*HEADER    GENE REGULATION                         25-MAY-04   1WEQ              
*TITLE     SOLUTION STRUCTURE OF PHD DOMAIN IN PHD FINGER PROTEIN 7              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PHD FINGER PROTEIN 7;                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: PHD DOMAIN;                                                
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   3 ORGANISM_COMMON: HOUSE MOUSE;                                        
*SOURCE   4 ORGANISM_TAXID: 10090;                                               
*SOURCE   5 GENE: RIKEN CDNA 1700010P14;                                         
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P030408-45;                               
*SOURCE   8 OTHER_DETAILS: CELL FREE PROTEIN SYNTHESIS                           
*KEYWDS    NMR, STRUCTURAL GENOMICS, PHD DOMAIN, PHD FINGER PROTEIN 7,           
*KEYWDS   2 RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI, GENE          
*KEYWDS   3 REGULATION                                                           
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    F.HE, Y.MUTO, M.INOUE, T.KIGAWA, M.SHIROUZU, T.TERADA,                
*AUTHOR   2 S.YOKOYAMA, RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE          
*AUTHOR   3 (RSGI)                                                               
*REVDAT   1   12-MAY-09 1WEQ    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.
**************************************************************

  20 ARG PHI -113.7 -53.7
  20 ARG PSI 104.3 164.3
  21  TYR PHI -116.4 -56.4
  21  TYR PSI  93.7 153.7
  23  HIS PHI -153.7 -93.7
  23  HIS PSI 106.9 166.9
  28  ILE PHI -145.0 -85.0
  28  ILE PSI 111.0 171.0
  29  CYSS PHI -129.0 -69.0
  29  CYSS PSI  95.0 155.0
  31  TYR PHI -113.1 -53.1
  31  TYR PSI 102.9 162.9
  37  SER PHI -146.4 -86.4
  37  SER PSI 112.6 172.6
  39 GLU PHI -143.9 -83.9
  39 GLU PSI 120.4 180.4
  46  LEU PHI -116.0 -56.0
  46  LEU PSI  97.0 157.0
  47  ILE PHI -137.0 -77.0
  47  ILE PSI  94.0 154.0
  48  LEU PHI -137.0 -77.0
  48  LEU PSI 121.0 181.0
  57  THR PHI -151.0 -91.0
  57  THR PSI 110.0 170.0
  59 ARG PHI -90.9 -30.9
  59 ARG PSI -70.7 -10.7
  60 ASP PHI -92.6 -32.6
  60 ASP PSI -73.6 -13.6
  61  CYSS PHI -91.9 -31.9
  61  CYSS PSI -64.8  -4.8
  70 LYS PHI -143.8 -83.8
  70 LYS PSI 101.3 161.3
  71  TRP PHI -124.9 -64.9
  71  TRP PSI  95.6 155.6
  73  CYSS PHI -115.0 -55.0
  73  CYSS PSI 117.0 177.0
  74  ASN PHI -92.0 -32.0
  74  ASN PSI -71.0 -11.0
  75 GLU PHI -95.0 -35.0
  75 GLU PSI -70.0 -10.0

24 CYSS SG   201 ZN   ZN   2.33  5.00E+00
29 CYSS SG   201 ZN   ZN   2.33  5.00E+00
58 HIST ND1  201 ZN   ZN   2.33  5.00E+00
61 CYSS SG   201 ZN   ZN   2.33  5.00E+00

24 CYSS CB   201 ZN   ZN   3.25  5.00E+00
29 CYSS CB   201 ZN   ZN   3.25  5.00E+00
58 HIST CG   201 ZN   ZN   3.25  5.00E+00
61 CYSS CB   201 ZN   ZN   3.25  5.00E+00

24 CYSS SG    29 CYSS SG   3.20  5.00E+00
24 CYSS SG    58 HIST ND1  3.20  5.00E+00
24 CYSS SG    61 CYSS SG   3.20  5.00E+00
29 CYSS SG    58 HIST ND1  3.20  5.00E+00
29 CYSS SG    61 CYSS SG   3.20  5.00E+00
58 HIST ND1   61 CYSS SG   3.20  5.00E+00


49 CYSS SG   401 ZN   ZN   2.33  5.00E+00
52 CYSS SG   401 ZN   ZN   2.33  5.00E+00
73 CYSS SG   401 ZN   ZN   2.33  5.00E+00
76 CYSS SG   401 ZN   ZN   2.33  5.00E+00

49 CYSS CB   401 ZN   ZN   3.25  5.00E+00
52 CYSS CB   401 ZN   ZN   3.25  5.00E+00
73 CYSS CB   401 ZN   ZN   3.25  5.00E+00
76 CYSS CB   401 ZN   ZN   3.25  5.00E+00

49 CYSS SG    52 CYSS SG   3.20  5.00E+00
49 CYSS SG    73 CYSS SG   3.20  5.00E+00
49 CYSS SG    76 CYSS SG   3.20  5.00E+00
52 CYSS SG    73 CYSS SG   3.20  5.00E+00
52 CYSS SG    76 CYSS SG   3.20  5.00E+00
73 CYSS SG    76 CYSS SG   3.20  5.00E+00

24 CYSS SG   201 ZN   ZN   2.37  5.00E+00
29 CYSS SG   201 ZN   ZN   2.37  5.00E+00
58 HIST ND1  201 ZN   ZN   2.37  5.00E+00
61 CYSS SG   201 ZN   ZN   2.37  5.00E+00

24 CYSS CB   201 ZN   ZN   3.51  5.00E+00
29 CYSS CB   201 ZN   ZN   3.51  5.00E+00
58 HIST CG   201 ZN   ZN   3.51  5.00E+00
61 CYSS CB   201 ZN   ZN   3.51  5.00E+00

24 CYSS SG    29 CYSS SG   4.00  5.00E+00
24 CYSS SG    58 HIST ND1  4.00  5.00E+00
24 CYSS SG    61 CYSS SG   4.00  5.00E+00
29 CYSS SG    58 HIST ND1  4.00  5.00E+00
29 CYSS SG    61 CYSS SG   4.00  5.00E+00
58 HIST ND1   61 CYSS SG   4.00  5.00E+00


49 CYSS SG   401 ZN   ZN   2.37  5.00E+00
52 CYSS SG   401 ZN   ZN   2.37  5.00E+00
73 CYSS SG   401 ZN   ZN   2.37  5.00E+00
76 CYSS SG   401 ZN   ZN   2.37  5.00E+00

49 CYSS CB   401 ZN   ZN   3.51  5.00E+00
52 CYSS CB   401 ZN   ZN   3.51  5.00E+00
73 CYSS CB   401 ZN   ZN   3.51  5.00E+00
76 CYSS CB   401 ZN   ZN   3.51  5.00E+00

49 CYSS SG    52 CYSS SG   4.00  5.00E+00
49 CYSS SG    73 CYSS SG   4.00  5.00E+00
49 CYSS SG    76 CYSS SG   4.00  5.00E+00
52 CYSS SG    73 CYSS SG   4.00  5.00E+00
52 CYSS SG    76 CYSS SG   4.00  5.00E+00
73 CYSS SG    76 CYSS SG   4.00  5.00E+00
 29 CYSS HA     30 LEU  HN      3.22 #SUP  0.82  #QF  0.82
 30 LEU  HN     30 LEU  HB2     3.84 #SUP  0.92  #QF  0.92
 30 LEU  HN     30 LEU  HG      3.40 #SUP  0.84  #QF  0.84
 50 ALA  HN     72 GLU  HN      5.50 #SUP  0.76  #QF  0.45
 50 ALA  HN     72 GLU  HA      3.89 #SUP  0.66  #QF  0.66
 49 CYSS HA     50 ALA  HN      2.99 #SUP  0.82  #QF  0.82
 50 ALA  HN     50 ALA  QB      3.13 #SUP  0.77  #QF  0.77
 32 GLU  HN     32 GLU  QB      3.91 #SUP  0.97  #QF  0.97
 64 LEU  QD2    71 TRP  HE1     4.47 #SUP  0.58  #QF  0.58
 47 ILE  HN     57 THR  HN      3.65 #SUP  0.91  #QF  0.91
 46 LEU  HA     47 ILE  HN      3.11 #SUP  0.77  #QF  0.77
 47 ILE  HN     47 ILE  HB      3.57 #SUP  0.95  #QF  0.95
 47 ILE  HN     47 ILE  QG1     3.64 #SUP  0.94  #QF  0.94
 47 ILE  HN     47 ILE  QG2     3.87 #SUP  0.97  #QF  0.97
 46 LEU  HB3    47 ILE  HN      4.94 #SUP  0.81  #QF  0.81
 28 ILE  HA     29 CYSS HN      2.95 #SUP  0.86  #QF  0.86
 29 CYSS HN     29 CYSS HB2     3.75 #SUP  0.94  #QF  0.94
 29 CYSS HN     29 CYSS HB3     3.75 #SUP  0.87  #QF  0.87
 28 ILE  QG2    29 CYSS HN      3.54 #SUP  0.85  #QF  0.85
 58 HIST HB3    59 ARG  HN      3.49 #SUP  0.73  #QF  0.73
 58 HIST HA     59 ARG  HN      3.14 #SUP  0.79  #QF  0.71
 59 ARG  HN     59 ARG  HB2     3.63 #SUP  0.94  #QF  0.94
 59 ARG  HN     59 ARG  HB3     3.63 #SUP  0.87  #QF  0.87
 25 ASP  HN     26 ALA  HN      3.51 #SUP  0.85  #QF  0.85
 24 CYSS HA     26 ALA  HN      3.93 #SUP  0.54  #QF  0.54
 26 ALA  HN     26 ALA  QB      2.99 #SUP  0.44  #QF  0.44
 23 HIS  HA     24 CYSS HN      3.40 #SUP  0.85  #QF  0.85
 24 CYSS HN     24 CYSS HB2     3.76 #SUP  0.90  #QF  0.90
 43 ARG  HD3    44 TRP  HE1     4.74 #SUP  0.64  #QF  0.64
 70 LYS  HA     71 TRP  HN      2.73 #SUP  0.59  #QF  0.59
 71 TRP  HN     71 TRP  HB2     3.54 #SUP  0.91  #QF  0.91
 70 LYS  HB2    71 TRP  HN      4.12 #SUP  0.93  #QF  0.93
 70 LYS  HB3    71 TRP  HN      4.12 #SUP  0.86  #QF  0.86
 70 LYS  QG     71 TRP  HN      4.31 #SUP  0.90  #QF  0.90
 71 TRP  HN     71 TRP  HB3     3.54 #SUP  0.85  #QF  0.85
 50 ALA  QB     71 TRP  HN      3.62 #SUP  0.37  #QF  0.37
 57 THR  HA     58 HIST HN      3.37 #SUP  0.91  #QF  0.91
 58 HIST HN     58 HIST HB2     3.70 #SUP  0.90  #QF  0.70
 24 CYSS HA     58 HIST HN      4.24 #SUP  0.68  #QF  0.68
 58 HIST HN     61 CYSS HB3     4.02 #SUP  0.78  #QF  0.78
 21 TYR  HA     22 ARG  HN      3.07 #SUP  0.66  #QF  0.66
 21 TYR  QB     22 ARG  HN      4.29 #SUP  0.90  #QF  0.87
 71 TRP  HD1    72 GLU  HN      3.84 #SUP  0.85  #QF  0.85
 71 TRP  HA     72 GLU  HN      2.87 #SUP  0.77  #QF  0.77
 71 TRP  HB2    72 GLU  HN      4.35 #SUP  0.96  #QF  0.96
 72 GLU  HN     72 GLU  HB3     3.95 #SUP  0.90  #QF  0.90
 72 GLU  HN     72 GLU  HB2     3.35 #SUP  0.98  #QF  0.98
 47 ILE  HA     48 LEU  HN      2.97 #SUP  0.76  #QF  0.76
 48 LEU  HN     48 LEU  HB2     3.42 #SUP  0.93  #QF  0.93
 48 LEU  HN     48 LEU  HG      3.59 #SUP  0.93  #QF  0.93
 48 LEU  HN     48 LEU  HB3     3.86 #SUP  0.90  #QF  0.90
 47 ILE  QG1    48 LEU  HN      4.26 #SUP  0.93  #QF  0.93
 48 LEU  HN     48 LEU  QD1     4.27 #SUP  0.97  #QF  0.85
 48 LEU  HN     48 LEU  QD2     4.63 #SUP  0.97  #QF  0.85
 47 ILE  QG2    48 LEU  HN      3.31 #SUP  0.66  #QF  0.66
 72 GLU  HA     73 CYSS HN      3.20 #SUP  0.81  #QF  0.81
 73 CYSS HN     73 CYSS HB2     3.71 #SUP  0.86  #QF  0.86
 49 CYSS HB2    73 CYSS HN      3.91 #SUP  0.64  #QF  0.27
 73 CYSS HN     76 CYSS HB2     4.26 #SUP  0.64  #QF  0.27
 73 CYSS HN     73 CYSS HB3     3.59 #SUP  0.85  #QF  0.85
 72 GLU  HB3    73 CYSS HN      3.86 #SUP  0.79  #QF  0.79
 45 ARG  HA     46 LEU  HN      3.17 #SUP  0.89  #QF  0.89
 46 LEU  HN     46 LEU  HB2     3.44 #SUP  0.91  #QF  0.91
 45 ARG  HB2    46 LEU  HN      3.71 #SUP  0.84  #QF  0.84
 46 LEU  HN     46 LEU  HB3     3.44 #SUP  0.81  #QF  0.81
 78 PRO  HA     79 ALA  HN      3.16 #SUP  0.85  #QF  0.85
 30 LEU  HB3    31 TYR  HN      4.18 #SUP  0.55  #QF  0.55
 79 ALA  HN     79 ALA  QB      3.25 #SUP  0.72  #QF  0.72
 30 LEU  HN     31 TYR  HN      3.54 #SUP  0.92  #QF  0.92
 31 TYR  HN     31 TYR  HB2     3.47 #SUP  0.94  #QF  0.72
 31 TYR  HN     31 TYR  HB3     3.47 #SUP  0.80  #QF  0.80
 13 ALA  HN     13 ALA  QB      3.59 #SUP  0.81  #QF  0.81
  9 LEU  HA     10 GLU  HN      3.10 #SUP  0.80  #QF  0.80
 10 GLU  HN     10 GLU  QG      3.93 #SUP  0.93  #QF  0.93
 10 GLU  HN     10 GLU  HB3     3.77 #SUP  0.86  #QF  0.86
  9 LEU  HB3    10 GLU  HN      4.03 #SUP  0.78  #QF  0.78
  8 GLU  HA      9 LEU  HN      3.14 #SUP  0.76  #QF  0.76
  8 GLU  HB2     9 LEU  HN      4.31 #SUP  0.87  #QF  0.87
  9 LEU  HN      9 LEU  HG      3.75 #SUP  0.93  #QF  0.78
 20 ARG  HA     21 TYR  HN      3.20 #SUP  0.99  #QF  0.77
 21 TYR  HN     21 TYR  QB      3.23 #SUP  0.80  #QF  0.80
 75 GLU  HN     76 CYSS HN      3.17 #SUP  0.93  #QF  0.93
 76 CYSS HN     76 CYSS HB3     3.76 #SUP  0.94  #QF  0.94
 76 CYSS HN     76 CYSS HB2     3.29 #SUP  0.86  #QF  0.86
 75 GLU  QB     76 CYSS HN      3.60 #SUP  0.87  #QF  0.87
 49 CYSS HN     71 TRP  HZ3     3.90 #SUP  0.83  #QF  0.83
 48 LEU  HA     49 CYSS HN      3.38 #SUP  0.84  #QF  0.84
 49 CYSS HN     49 CYSS HB3     3.48 #SUP  0.91  #QF  0.91
 48 LEU  QD2    49 CYSS HN      3.98 #SUP  0.74  #QF  0.74
 49 CYSS HN     49 CYSS HB2     3.56 #SUP  0.88  #QF  0.88
 48 LEU  HB3    49 CYSS HN      4.07 #SUP  0.85  #QF  0.85
 76 CYSS HB3    77 LEU  HN      3.77 #SUP  0.88  #QF  0.88
 76 CYSS HB2    77 LEU  HN      3.59 #SUP  0.81  #QF  0.81
 77 LEU  HN     77 LEU  HG      3.09 #SUP  0.75  #QF  0.75
 77 LEU  HN     77 LEU  HB2     3.26 #SUP  0.81  #QF  0.81
 77 LEU  HN     77 LEU  QD1     4.32 #SUP  0.99  #QF  0.89
 77 LEU  HN     77 LEU  QD2     4.78 #SUP  0.99  #QF  0.89
 45 ARG  HN     59 ARG  HN      3.91 #SUP  0.78  #QF  0.78
 44 TRP  HN     45 ARG  HN      3.38 #SUP  0.99  #QF  0.99
 45 ARG  HN     45 ARG  HG2     3.78 #SUP  0.86  #QF  0.86
 45 ARG  HN     45 ARG  HB2     4.00 #SUP  0.95  #QF  0.87
 45 ARG  HN     59 ARG  HB3     4.76 #SUP  0.95  #QF  0.87
 45 ARG  HN     45 ARG  HG3     3.78 #SUP  0.80  #QF  0.67
 45 ARG  HN     45 ARG  HB3     3.22 #SUP  0.91  #QF  0.91
 38 PHE  HN     38 PHE  QD      3.78 #SUP  0.59  #QF  0.59
 38 PHE  HN     38 PHE  HB2     4.12 #SUP  0.78  #QF  0.78
 38 PHE  HN     38 PHE  HB3     4.12 #SUP  0.81  #QF  0.81
 64 LEU  HB2    65 ARG  HN      3.54 #SUP  0.91  #QF  0.91
 64 LEU  HB3    65 ARG  HN      3.51 #SUP  0.92  #QF  0.92
 64 LEU  HA     65 ARG  HN      2.85 #SUP  0.74  #QF  0.74
 65 ARG  HN     65 ARG  HB3     3.72 #SUP  0.97  #QF  0.97
 65 ARG  HN     65 ARG  HB2     2.91 #SUP  0.86  #QF  0.86
 64 LEU  QD2    65 ARG  HN      3.94 #SUP  0.80  #QF  0.80
 20 ARG  HN     20 ARG  HB3     4.16 #SUP  0.91  #QF  0.91
 20 ARG  HN     20 ARG  QG      4.00 #SUP  0.95  #QF  0.50
 17 LEU  HN     17 LEU  HG      3.13 #SUP  0.85  #QF  0.28
 16 GLU  HA     17 LEU  HN      3.37 #SUP  1.00  #QF  0.61
 19 GLN  HN     19 GLN  QG      4.14 #SUP  0.96  #QF  0.65
 16 GLU  HB3    17 LEU  HN      4.23 #SUP  0.92  #QF  0.30
 16 GLU  HB2    17 LEU  HN      4.23 #SUP  0.73  #QF  0.41
 43 ARG  HN     43 ARG  HG2     3.84 #SUP  0.95  #QF  0.95
 43 ARG  HN     43 ARG  HG3     3.84 #SUP  0.90  #QF  0.90
 43 ARG  HN     43 ARG  QB      3.53 #SUP  0.89  #QF  0.89
 51 THR  HB     52 CYSS HN      3.40 #SUP  0.83  #QF  0.83
 52 CYSS HN     52 CYSS HB3     3.98 #SUP  0.75  #QF  0.75
 51 THR  QG2    52 CYSS HN      3.99 #SUP  0.85  #QF  0.85
 21 TYR  QD     23 HIS  HN      3.88 #SUP  0.25  #QF  0.25
 22 ARG  HA     23 HIS  HN      3.29 #SUP  0.78  #QF  0.78
 40 ASP  HN     40 ASP  HB3     3.74 #SUP  0.88  #QF  0.88
 40 ASP  HN     40 ASP  HB2     3.78 #SUP  0.96  #QF  0.96
 39 GLU  HG3    40 ASP  HN      5.30 #SUP  0.93  #QF  0.84
 75 GLU  HN     75 GLU  QB      3.35 #SUP  0.69  #QF  0.69
 74 ASN  HN     75 GLU  HN      3.83 #SUP  0.95  #QF  0.95
 75 GLU  HN     75 GLU  QG      4.12 #SUP  0.87  #QF  0.87
 60 ASP  HA     64 LEU  HN      3.48 #SUP  0.39  #QF  0.39
 63 SER  HA     64 LEU  HN      3.27 #SUP  0.82  #QF  0.82
 64 LEU  HN     64 LEU  HB2     3.04 #SUP  0.87  #QF  0.87
 64 LEU  HN     64 LEU  HG      3.01 #SUP  0.76  #QF  0.76
 64 LEU  HN     64 LEU  QD2     4.21 #SUP  0.91  #QF  0.91
 64 LEU  HN     64 LEU  QD1     4.25 #SUP  0.87  #QF  0.87
 60 ASP  HN     61 CYSS HN      3.78 #SUP  1.00  #QF  0.83
 38 PHE  HA     39 GLU  HN      3.26 #SUP  1.00  #QF  0.90
 39 GLU  HN     44 TRP  HB2     3.53 #SUP  0.23  #QF  0.23
 38 PHE  HB2    39 GLU  HN      4.01 #SUP  0.77  #QF  0.77
 38 PHE  HB3    39 GLU  HN      4.01 #SUP  0.90  #QF  0.81
 39 GLU  HN     44 TRP  HB3     4.55 #SUP  0.90  #QF  0.81
 61 CYSS HN     62 SER  HN      3.39 #SUP  1.00
 58 HIST HB2    61 CYSS HN      3.28 #SUP  0.79  #QF  0.79
 58 HIST HB3    61 CYSS HN      3.84 #SUP  0.90  #QF  0.90
 61 CYSS HN     61 CYSS HB2     3.83 #SUP  0.92  #QF  0.92
 61 CYSS HN     61 CYSS HB3     3.58 #SUP  0.90  #QF  0.90
 14 PHE  HN     14 PHE  HB2     3.74 #SUP  0.84  #QF  0.84
 14 PHE  HN     14 PHE  HB3     3.74 #SUP  0.92  #QF  0.92
 13 ALA  QB     14 PHE  HN      4.34 #SUP  0.85  #QF  0.85
 18 TYR  HN     18 TYR  QD      4.12 #SUP  0.75  #QF  0.75
 17 LEU  HA     18 TYR  HN      3.39 #SUP  0.91  #QF  0.91
 18 TYR  HN     18 TYR  HB2     3.74 #SUP  0.89  #QF  0.89
 18 TYR  HN     18 TYR  HB3     3.74 #SUP  0.88  #QF  0.88
 51 THR  HN     52 CYSS HN      3.36 #SUP  1.00
 50 ALA  QB     51 THR  HN      3.70 #SUP  0.60  #QF  0.60
 50 ALA  HN     51 THR  HN      3.40 #SUP  0.97  #QF  0.97
 51 THR  HN     51 THR  HB      3.23 #SUP  0.88  #QF  0.88
 51 THR  HN     51 THR  QG2     4.10 #SUP  0.90  #QF  0.90
 80 SER  QB     81 GLY  HN      4.43 #SUP  0.85  #QF  0.81
 60 ASP  HN     60 ASP  HB2     3.70 #SUP  0.87  #QF  0.87
 59 ARG  HB2    60 ASP  HN      3.72 #SUP  0.85  #QF  0.85
 60 ASP  HN     60 ASP  HB3     3.70 #SUP  0.83  #QF  0.83
 59 ARG  HB3    60 ASP  HN      3.72 #SUP  0.85  #QF  0.85
 44 TRP  HN     44 TRP  HB3     3.85 #SUP  0.91  #QF  0.91
 43 ARG  HN     44 TRP  HN      3.75 #SUP  0.98  #QF  0.98
 44 TRP  HN     44 TRP  HB2     3.44 #SUP  0.88  #QF  0.88
 43 ARG  QB     44 TRP  HN      3.96 #SUP  0.89  #QF  0.89
 36 ASP  HN     37 SER  HN      3.31 #SUP  0.84  #QF  0.84
 37 SER  HN     38 PHE  QD      4.52 #SUP  0.45  #QF  0.45
 37 SER  HN     37 SER  HB2     3.83 #SUP  0.82  #QF  0.82
 37 SER  HN     37 SER  HB3     3.83 #SUP  0.81  #QF  0.81
 54 SER  HN     55 HIS  HN      3.25 #SUP  0.95  #QF  0.95
 54 SER  HN     54 SER  QB      3.42 #SUP  0.68  #QF  0.68
 49 CYSS HB3    54 SER  HN      4.04 #SUP  0.91  #QF  0.91
 53 GLY  QA     54 SER  HN      3.38 #SUP  0.89  #QF  0.89
 27 PRO  HB3    28 ILE  HN      4.04 #SUP  0.84  #QF  0.84
 27 PRO  HB2    28 ILE  HN      3.14 #SUP  0.87  #QF  0.87
 28 ILE  HN     28 ILE  HB      3.13 #SUP  0.90  #QF  0.90
 28 ILE  HN     28 ILE  HG12    3.37 #SUP  0.89  #QF  0.89
 26 ALA  QB     28 ILE  HN      3.25 #SUP  0.41  #QF  0.41
 28 ILE  HN     28 ILE  HG13    4.47 #SUP  0.91  #QF  0.91
 28 ILE  HN     28 ILE  QD1     3.91 #SUP  0.88  #QF  0.88
 28 ILE  HN     28 ILE  QG2     4.11 #SUP  0.97  #QF  0.97
 73 CYSS HA     74 ASN  HN      3.32 #SUP  0.89  #QF  0.89
 73 CYSS HB2    74 ASN  HN      3.41 #SUP  0.84  #QF  0.84
 73 CYSS HB3    74 ASN  HN      3.88 #SUP  0.75  #QF  0.75
 40 ASP  HN     41 GLU  HN      3.56 #SUP  0.97  #QF  0.97
 40 ASP  HB3    41 GLU  HN      3.58 #SUP  0.83  #QF  0.83
 40 ASP  HB2    41 GLU  HN      3.71 #SUP  0.92  #QF  0.92
 39 GLU  HB2    41 GLU  HN      4.45 #SUP  0.44  #QF  0.21
 41 GLU  HN     41 GLU  HB2     4.15 #SUP  0.98  #QF  0.98
 41 GLU  HN     41 GLU  HB3     4.15 #SUP  0.91  #QF  0.91
 39 GLU  HB3    41 GLU  HN      4.45 #SUP  0.84  #QF  0.84
 41 GLU  HN     41 GLU  QG      3.69 #SUP  0.87  #QF  0.87
 53 GLY  QA     55 HIS  HN      4.15 #SUP  0.86  #QF  0.22
 54 SER  QB     55 HIS  HN      3.99 #SUP  0.99  #QF  0.66
 49 CYSS HB3    55 HIS  HN      3.99 #SUP  0.83  #QF  0.83
 55 HIS  HN     55 HIS  HB2     3.72 #SUP  0.83  #QF  0.83
 48 LEU  QD2    55 HIS  HN      4.54 #SUP  0.79  #QF  0.79
 35 ARG  HN     36 ASP  HN      4.56 #SUP  0.85  #QF  0.85
 36 ASP  HN     36 ASP  HB3     4.07 #SUP  0.92  #QF  0.92
 60 ASP  HA     63 SER  HN      4.11 #SUP  0.67  #QF  0.67
 53 GLY  HN     54 SER  HN      3.80 #SUP  0.98  #QF  0.98
 52 CYSS HN     53 GLY  HN      3.31 #SUP  0.98  #QF  0.98
 53 GLY  HN     53 GLY  QA      2.90 #SUP  0.92  #QF  0.92
 49 CYSS HB3    53 GLY  HN      3.73 #SUP  0.75  #QF  0.75
 49 CYSS HB2    53 GLY  HN      4.11 #SUP  0.84  #QF  0.84
 56 GLY  HA1    57 THR  HN      3.53 #SUP  0.88  #QF  0.88
 57 THR  HN     57 THR  QG2     3.66 #SUP  0.86  #QF  0.86
 35 ARG  HN     35 ARG  HG3     4.19 #SUP  0.68  #QF  0.68
 35 ARG  HN     35 ARG  HG2     3.49 #SUP  0.91  #QF  0.91
 55 HIS  HB3    56 GLY  HN      3.97 #SUP  0.85  #QF  0.85
 56 GLY  HN     71 TRP  HH2     3.51 #SUP  0.64  #QF  0.64
 62 SER  HN     63 SER  HN      3.46 #SUP  1.00
 62 SER  HN     62 SER  HG      4.35 #SUP  0.94  #QF  0.94
 58 HIST HB2    62 SER  HN      3.91 #SUP  0.60  #QF  0.60
 62 SER  HN     62 SER  HB2     3.69 #SUP  0.90  #QF  0.90
 62 SER  HN     62 SER  HB3     3.69 #SUP  0.85  #QF  0.85
 61 CYSS HB3    62 SER  HN      4.28 #SUP  0.88  #QF  0.88
 33 GLN  HN     34 GLY  HN      3.46 #SUP  0.77  #QF  0.77
  9 LEU  HN      9 LEU  QD1     5.50 #SUP  1.00  #QF  0.95
  9 LEU  HN      9 LEU  QD2     5.50 #SUP  1.00  #QF  0.95
  8 GLU  HB3     9 LEU  HN      4.31 #SUP  0.91  #QF  0.91
  9 LEU  QD1    10 GLU  HN      5.50 #SUP  0.88  #QF  0.62
  9 LEU  QD2    10 GLU  HN      5.50 #SUP  0.88  #QF  0.62
 12 GLY  HN     13 ALA  HN      5.04 #SUP  1.00
 11 PRO  QG     12 GLY  HN      4.76 #SUP  0.93  #QF  0.93
 11 PRO  HA     13 ALA  HN      4.78 #SUP  0.45  #QF  0.45
 14 PHE  HN     14 PHE  QD      4.66 #SUP  0.69  #QF  0.69
 13 ALA  HN     14 PHE  HN      4.19 #SUP  0.93  #QF  0.93
 14 PHE  HB2    15 SER  HN      4.79 #SUP  0.80  #QF  0.80
 14 PHE  HB3    15 SER  HN      4.79 #SUP  0.82  #QF  0.82
 15 SER  HN     16 GLU  HN      5.04 #SUP  0.99  #QF  0.56
 16 GLU  HN     16 GLU  QG      4.68 #SUP  0.99  #QF  0.99
 16 GLU  HN     16 GLU  HB2     4.02 #SUP  0.90  #QF  0.90
 16 GLU  HN     17 LEU  HN      4.85 #SUP  0.94  #QF  0.94
 18 TYR  HN     19 GLN  HN      3.20 #SUP  0.66  #QF  0.66
 17 LEU  HN     17 LEU  QD1     5.06 #SUP  0.95  #QF  0.79
 17 LEU  HN     17 LEU  QD2     5.06 #SUP  0.95  #QF  0.79
 18 TYR  QD     19 GLN  HN      4.84 #SUP  0.69  #QF  0.69
 18 TYR  HB2    19 GLN  HN      4.39 #SUP  0.84  #QF  0.84
 18 TYR  HB3    19 GLN  HN      4.39 #SUP  0.90  #QF  0.90
 20 ARG  QG     21 TYR  HN      4.24 #SUP  0.72  #QF  0.72
 22 ARG  HN     23 HIS  HN      4.46 #SUP  0.99  #QF  0.99
 22 ARG  HN     22 ARG  QD      4.92 #SUP  0.87  #QF  0.87
 22 ARG  HN     22 ARG  HG2     4.17 #SUP  0.96  #QF  0.96
 22 ARG  HN     22 ARG  HG3     4.17 #SUP  0.76  #QF  0.76
 23 HIS  HN     46 LEU  QD1     5.31 #SUP  0.63  #QF  0.63
 23 HIS  HN     24 CYSS HN      4.22 #SUP  0.46  #QF  0.46
 24 CYSS HN     36 ASP  HA      4.24 #SUP  0.22  #QF  0.22
 24 CYSS HN     35 ARG  HA      5.09 #SUP  0.32  #QF  0.32
 25 ASP  HN     57 THR  HB      3.90 #SUP  0.89  #QF  0.82
 26 ALA  HN     57 THR  HA      4.81 #SUP  0.91  #QF  0.91
 26 ALA  HN     57 THR  HB      4.04 #SUP  0.43  #QF  0.43
 28 ILE  HN     29 CYSS HN      4.49 #SUP  1.00
 26 ALA  HA     28 ILE  HN      4.96 #SUP  0.82  #QF  0.82
 28 ILE  QD1    29 CYSS HN      3.58 #SUP  0.69  #QF  0.69
 28 ILE  HG13   29 CYSS HN      5.31 #SUP  0.90  #QF  0.90
 26 ALA  QB     29 CYSS HN      5.13 #SUP  0.34  #QF  0.34
 28 ILE  HG12   29 CYSS HN      5.06 #SUP  0.89  #QF  0.89
 28 ILE  HB     29 CYSS HN      4.43 #SUP  0.90  #QF  0.90
 29 CYSS HN     30 LEU  HG      4.83 #SUP  0.63  #QF  0.63
 30 LEU  HN     61 CYSS HB2     5.32 #SUP  0.42  #QF  0.42
 30 LEU  HN     30 LEU  QD2     4.15 #SUP  0.88  #QF  0.88
 29 CYSS HA     31 TYR  HN      4.24 #SUP  0.68  #QF  0.68
 32 GLU  HN     32 GLU  HG2     4.83 #SUP  0.90  #QF  0.88
 32 GLU  HN     32 GLU  HG3     4.83 #SUP  0.92  #QF  0.92
 33 GLN  HB3    34 GLY  HN      4.93 #SUP  0.92  #QF  0.92
 32 GLU  QB     34 GLY  HN      5.50 #SUP  0.87  #QF  0.26
 34 GLY  HN     35 ARG  HG2     5.50 #SUP  0.87  #QF  0.26
 33 GLN  HB2    34 GLY  HN      4.93 #SUP  0.85  #QF  0.85
 31 TYR  HB2    34 GLY  HN      4.43 #SUP  0.67  #QF  0.67
 34 GLY  HN     35 ARG  HN      4.34 #SUP  0.99  #QF  0.99
 35 ARG  HA     37 SER  HN      5.23 #SUP  0.73  #QF  0.73
 37 SER  HN     38 PHE  HN      4.89 #SUP  0.95  #QF  0.95
 38 PHE  HN     39 GLU  HN      4.92 #SUP  0.97  #QF  0.90
 64 LEU  HN     65 ARG  HN      5.32 #SUP  0.97  #QF  0.90
 38 PHE  QD     39 GLU  HN      4.21 #SUP  0.72  #QF  0.72
 63 SER  HN     64 LEU  HN      3.71 #SUP  0.87  #QF  0.87
 39 GLU  HN     45 ARG  HA      3.95 #SUP  0.52  #QF  0.52
 39 GLU  HB3    40 ASP  HN      4.46 #SUP  0.96  #QF  0.96
 41 GLU  HN     45 ARG  HB3     4.70 #SUP  0.78  #QF  0.78
 44 TRP  HN     44 TRP  HD1     4.05 #SUP  0.80  #QF  0.80
 43 ARG  HG3    44 TRP  HN      5.24 #SUP  0.90  #QF  0.90
 43 ARG  HG2    44 TRP  HN      5.24 #SUP  0.92  #QF  0.92
 39 GLU  HN     45 ARG  HN      4.93 #SUP  0.64  #QF  0.64
 43 ARG  HN     45 ARG  HN      4.84 #SUP  0.83  #QF  0.83
 43 ARG  HA     45 ARG  HN      4.41 #SUP  0.75  #QF  0.63
 45 ARG  HN     45 ARG  HD2     5.08 #SUP  0.75  #QF  0.63
 45 ARG  HN     45 ARG  HD3     5.08 #SUP  0.91  #QF  0.91
 44 TRP  HB2    45 ARG  HN      4.69 #SUP  0.87  #QF  0.87
 45 ARG  HN     59 ARG  HB2     4.76 #SUP  0.77  #QF  0.77
 46 LEU  HN     46 LEU  QD2     4.97 #SUP  0.89  #QF  0.89
 46 LEU  HN     46 LEU  HG      4.72 #SUP  0.97  #QF  0.97
 45 ARG  HG2    46 LEU  HN      5.14 #SUP  0.86  #QF  0.86
 38 PHE  HB2    46 LEU  HN      4.77 #SUP  0.64  #QF  0.64
 38 PHE  QD     46 LEU  HN      4.25 #SUP  0.62  #QF  0.62
 45 ARG  HN     46 LEU  HN      4.89 #SUP  0.99  #QF  0.99
 39 GLU  HN     46 LEU  HN      5.26 #SUP  0.98  #QF  0.98
 46 LEU  HN     47 ILE  HN      4.79 #SUP  0.99  #QF  0.99
 47 ILE  HN     47 ILE  QD1     4.17 #SUP  0.88  #QF  0.88
 48 LEU  HG     49 CYSS HN      4.96 #SUP  0.93  #QF  0.93
 49 CYSS HN     56 GLY  HA2     5.17 #SUP  0.53  #QF  0.53
 49 CYSS HN     71 TRP  HE3     3.80 #SUP  0.72  #QF  0.72
 49 CYSS HN     50 ALA  HN      4.76 #SUP  0.97  #QF  0.97
 50 ALA  HN     71 TRP  HN      4.46 #SUP  0.92  #QF  0.92
 50 ALA  HN     73 CYSS HN      4.84 #SUP  0.96  #QF  0.96
 49 CYSS HB3    50 ALA  HN      4.75 #SUP  0.92  #QF  0.92
 50 ALA  HN     70 LYS  QE      5.50 #SUP  0.70  #QF  0.70
 49 CYSS HB2    50 ALA  HN      4.82 #SUP  0.83  #QF  0.83
 51 THR  HN     53 GLY  HN      4.31 #SUP  0.98  #QF  0.98
 51 THR  HN     72 GLU  HA      4.37 #SUP  0.50  #QF  0.50
 51 THR  HN     76 CYSS HB3     5.39 #SUP  0.40  #QF  0.40
 49 CYSS HB2    51 THR  HN      5.50 #SUP  0.77  #QF  0.52
 51 THR  HN     76 CYSS HB2     5.50 #SUP  0.77  #QF  0.52
 51 THR  HN     72 GLU  HG2     4.23 #SUP  0.63  #QF  0.63
 52 CYSS HN     52 CYSS HB2     3.98 #SUP  0.90  #QF  0.90
 49 CYSS HB3    52 CYSS HN      3.99 #SUP  0.66  #QF  0.66
 52 CYSS HN     53 GLY  QA      4.14 #SUP  0.77  #QF  0.77
 49 CYSS HA     53 GLY  HN      4.96 #SUP  0.94  #QF  0.55
 51 THR  HB     53 GLY  HN      5.21 #SUP  0.94  #QF  0.55
 50 ALA  HA     53 GLY  HN      4.60 #SUP  0.57  #QF  0.57
 52 CYSS HN     54 SER  HN      4.59 #SUP  0.93  #QF  0.93
 54 SER  HN     55 HIS  HB2     4.29 #SUP  0.70  #QF  0.70
 49 CYSS HB2    54 SER  HN      4.19 #SUP  0.93  #QF  0.93
 48 LEU  QD2    54 SER  HN      5.19 #SUP  0.77  #QF  0.77
 49 CYSS HB2    55 HIS  HN      4.33 #SUP  0.88  #QF  0.88
 49 CYSS HN     55 HIS  HN      4.07 #SUP  0.96  #QF  0.96
 55 HIS  HN     56 GLY  HN      5.35 #SUP  0.99  #QF  0.99
 56 GLY  HN     57 THR  HN      4.79 #SUP  0.97  #QF  0.97
 56 GLY  HN     57 THR  HB      4.38 #SUP  0.45  #QF  0.45
 55 HIS  HB2    56 GLY  HN      4.21 #SUP  0.74  #QF  0.74
 46 LEU  HA     57 THR  HN      4.51 #SUP  0.77  #QF  0.77
 46 LEU  HG     57 THR  HN      4.55 #SUP  0.91  #QF  0.91
 47 ILE  QG2    57 THR  HN      4.59 #SUP  0.60  #QF  0.60
 38 PHE  HZ     58 HIST HN      5.50 #SUP  1.00  #QF  0.59
 58 HIST HN     62 SER  HN      5.50 #SUP  1.00  #QF  0.59
 26 ALA  HN     58 HIST HN      5.50 #SUP  0.96  #QF  0.48
 57 THR  HN     58 HIST HN      5.50 #SUP  0.96  #QF  0.48
 58 HIST HN     61 CYSS HB2     4.03 #SUP  0.74  #QF  0.74
 57 THR  HB     58 HIST HN      4.08 #SUP  0.90  #QF  0.90
 24 CYSS HB2    58 HIST HN      4.39 #SUP  0.76  #QF  0.76
 24 CYSS HB3    58 HIST HN      5.50 #SUP  0.96  #QF  0.96
 26 ALA  QB     58 HIST HN      4.80 #SUP  0.55  #QF  0.55
 57 THR  QG2    58 HIST HN      4.39 #SUP  0.86  #QF  0.86
 47 ILE  QG1    59 ARG  HN      4.11 #SUP  0.94  #QF  0.94
 59 ARG  HN     59 ARG  HG2     4.47 #SUP  0.96  #QF  0.96
 57 THR  QG2    59 ARG  HN      5.22 #SUP  0.94  #QF  0.94
 59 ARG  HN     61 CYSS HN      5.03 #SUP  0.99  #QF  0.97
 58 HIST HN     59 ARG  HN      5.41 #SUP  1.00
 58 HIST HD2    59 ARG  HN      5.50 #SUP  0.84  #QF  0.84
 44 TRP  HA     60 ASP  HN      4.65 #SUP  0.79  #QF  0.21
 58 HIST HB2    60 ASP  HN      4.97 #SUP  0.79  #QF  0.21
 60 ASP  HN     62 SER  HN      5.10 #SUP  0.99  #QF  0.99
 58 HIST HB3    60 ASP  HN      4.22 #SUP  0.79  #QF  0.79
 59 ARG  HG2    60 ASP  HN      5.21 #SUP  0.99  #QF  0.99
 26 ALA  QB     61 CYSS HN      4.98 #SUP  0.66  #QF  0.66
 59 ARG  HA     61 CYSS HN      4.70 #SUP  0.73  #QF  0.73
 58 HIST HN     61 CYSS HN      4.84 #SUP  0.99  #QF  0.99
 59 ARG  HN     62 SER  HN      5.50 #SUP  1.00  #QF  0.87
 60 ASP  HA     62 SER  HN      4.69 #SUP  0.97  #QF  0.97
 61 CYSS HB2    62 SER  HN      4.36 #SUP  0.89  #QF  0.89
 62 SER  HN     64 LEU  HG      4.43 #SUP  0.49  #QF  0.49
 26 ALA  QB     62 SER  HN      4.34 #SUP  0.43  #QF  0.43
 57 THR  QG2    62 SER  HN      4.41 #SUP  0.86  #QF  0.86
 62 SER  HA     63 SER  HN      3.25 #SUP  0.72  #QF  0.72
 61 CYSS HN     63 SER  HN      4.96 #SUP  0.98  #QF  0.98
 62 SER  HN     64 LEU  HN      4.62 #SUP  0.99  #QF  0.99
 64 LEU  QD1    65 ARG  HN      5.30 #SUP  0.88  #QF  0.88
 71 TRP  HN     71 TRP  HE3     4.19 #SUP  0.59  #QF  0.59
 47 ILE  QD1    71 TRP  HN      5.02 #SUP  0.29  #QF  0.29
 72 GLU  HN     72 GLU  HG3     3.89 #SUP  0.90  #QF  0.90
 72 GLU  HN     72 GLU  HG2     4.51 #SUP  0.93  #QF  0.93
 71 TRP  HB3    72 GLU  HN      4.35 #SUP  0.87  #QF  0.87
 71 TRP  HN     72 GLU  HN      4.82 #SUP  0.99  #QF  0.99
 49 CYSS HA     73 CYSS HN      4.37 #SUP  0.67  #QF  0.67
 72 GLU  HN     73 CYSS HN      4.60 #SUP  0.99  #QF  0.99
 73 CYSS HN     74 ASN  HN      4.66 #SUP  0.99  #QF  0.99
 73 CYSS HN     76 CYSS HB3     4.46 #SUP  0.63  #QF  0.63
 72 GLU  HG3    73 CYSS HN      4.72 #SUP  0.93  #QF  0.93
 71 TRP  HH2    74 ASN  HN      5.50 #SUP  0.83  #QF  0.83
 74 ASN  HN     76 CYSS HN      5.49 #SUP  0.63  #QF  0.45
 74 ASN  HB2    75 GLU  HN      4.92 #SUP  0.92  #QF  0.54
 74 ASN  HB3    75 GLU  HN      4.92 #SUP  0.92  #QF  0.54
 73 CYSS HB2    75 GLU  HN      4.82 #SUP  0.46  #QF  0.46
 76 CYSS HN     77 LEU  HB2     4.81 #SUP  0.69  #QF  0.69
 76 CYSS HN     77 LEU  HG      4.89 #SUP  0.67  #QF  0.67
 74 ASN  HA     76 CYSS HN      4.26 #SUP  0.76  #QF  0.76
 75 GLU  HN     77 LEU  HN      4.69 #SUP  0.43  #QF  0.43
 77 LEU  HN     78 PRO  HD3     5.05 #SUP  0.97  #QF  0.97
 30 LEU  HG     31 TYR  HN      5.02 #SUP  0.99  #QF  0.33
 78 PRO  QG     79 ALA  HN      5.37 #SUP  0.99  #QF  0.33
 79 ALA  QB     80 SER  HN      4.62 #SUP  0.72  #QF  0.72
 57 THR  QG2    71 TRP  HE1     4.41 #SUP  0.27  #QF  0.27
 64 LEU  QD1    71 TRP  HE1     4.93 #SUP  0.65  #QF  0.65
 71 TRP  HE1    72 GLU  HN      4.33 #SUP  0.95  #QF  0.95
 43 ARG  QB     44 TRP  HE1     5.31 #SUP  0.71  #QF  0.71
 23 HIS  HN     46 LEU  QD2     5.31 #SUP  0.36  #QF  0.36
 44 TRP  HB2    44 TRP  HE1     4.97 #SUP  0.88  #QF  0.88
 32 GLU  HN     33 GLN  HN      4.61 #SUP  0.88  #QF  0.88
 31 TYR  QE     32 GLU  HN      5.05 #SUP  0.21  #QF  0.21
 32 GLU  QB     33 GLN  HN      5.04 #SUP  0.98  #QF  0.55
 45 ARG  HB2    45 ARG  HD2     3.81 #SUP  1.00
 45 ARG  HB3    45 ARG  HD2     3.71 #SUP  1.00
 45 ARG  HB2    45 ARG  HD3     3.81 #SUP  1.00
 45 ARG  HB3    45 ARG  HD3     3.71 #SUP  1.00
 38 PHE  HB3    46 LEU  HN      4.77 #SUP  1.00  #QF  0.99
 22 ARG  HB2    22 ARG  QD      3.60 #SUP  0.97  #QF  0.84
 22 ARG  HB3    22 ARG  QD      3.60 #SUP  0.97  #QF  0.84
 43 ARG  QB     43 ARG  HD2     3.65 #SUP  1.00
 43 ARG  QB     43 ARG  HD3     3.65 #SUP  1.00
 20 ARG  HB2    20 ARG  QD      3.82 #SUP  0.90  #QF  0.64
 20 ARG  HB3    20 ARG  QD      3.82 #SUP  0.90  #QF  0.64
 65 ARG  HA     65 ARG  QD      4.14 #SUP  1.00
 65 ARG  QD     66 PRO  HD2     3.87 #SUP  0.97  #QF  0.97
 65 ARG  HB3    65 ARG  QD      3.90 #SUP  1.00
 30 LEU  HB3    30 LEU  QD2     3.69 #SUP  1.00
 77 LEU  HB3    77 LEU  QD2     3.95 #SUP  1.00  #QF  0.70
 77 LEU  HN     77 LEU  HB3     3.64 #SUP  0.94  #QF  0.94
 70 LYS  QG     70 LYS  QE      3.47 #SUP  0.99  #QF  0.99
 28 ILE  HB     28 ILE  QD1     3.27 #SUP  1.00
 21 TYR  QB     48 LEU  QD2     3.78 #SUP  0.96  #QF  0.96
 70 LYS  HB2    70 LYS  QD      2.65 #SUP  0.87  #QF  0.87
 19 GLN  HA     19 GLN  QG      3.90 #SUP  0.99  #QF  0.99
 33 GLN  HA     33 GLN  HG3     3.90 #SUP  1.00
 72 GLU  HB2    77 LEU  QD2     4.13 #SUP  0.99  #QF  0.53
 20 ARG  HB2    20 ARG  QG      2.89 #SUP  1.00
 10 GLU  HN     10 GLU  HB2     3.77 #SUP  0.82  #QF  0.82
 75 GLU  QB     75 GLU  QG      2.53 #SUP  0.77  #QF  0.77
 65 ARG  HB2    65 ARG  QD      4.08 #SUP  1.00
 70 LYS  HB3    70 LYS  QD      2.65 #SUP  0.70  #QF  0.70
 33 GLN  HN     33 GLN  HB2     3.98 #SUP  1.00  #QF  0.24
 65 ARG  HA     65 ARG  HG2     4.08 #SUP  1.00
 28 ILE  HA     28 ILE  HG12    3.50 #SUP  1.00
 28 ILE  HB     28 ILE  HG12    2.79 #SUP  1.00
 47 ILE  HA     47 ILE  QG1     3.74 #SUP  1.00
 28 ILE  QG2    28 ILE  HG13    3.00 #SUP  0.99  #QF  0.99
 65 ARG  HA     65 ARG  HG3     4.08 #SUP  0.99  #QF  0.99
 20 ARG  HA     20 ARG  QG      3.86 #SUP  1.00  #QF  0.30
 20 ARG  HB3    20 ARG  QG      2.89 #SUP  0.90  #QF  0.90
 30 LEU  HA     30 LEU  HG      3.90 #SUP  1.00
 30 LEU  QD1    61 CYSS HA      3.49 #SUP  0.99  #QF  0.99
 30 LEU  HB2    30 LEU  QD1     3.38 #SUP  0.99  #QF  0.99
 30 LEU  HB3    30 LEU  QD1     3.14 #SUP  0.98  #QF  0.98
 59 ARG  HA     64 LEU  QD1     3.77 #SUP  0.96  #QF  0.96
 62 SER  HB3    64 LEU  QD1     4.27 #SUP  1.00  #QF  0.93
 64 LEU  HB2    64 LEU  QD1     3.18 #SUP  0.97  #QF  0.97
 64 LEU  HB3    64 LEU  QD1     3.41 #SUP  1.00  #QF  0.87
 47 ILE  QG1    64 LEU  QD1     4.12 #SUP  0.95  #QF  0.95
 47 ILE  QG2    64 LEU  QD1     3.16 #SUP  0.91  #QF  0.91
 57 THR  QG2    64 LEU  QD1     3.90 #SUP  0.99  #QF  0.99
 48 LEU  HB2    48 LEU  QD1     3.51 #SUP  0.98  #QF  0.98
 48 LEU  HB3    48 LEU  QD1     3.66 #SUP  0.99  #QF  0.99
 70 LYS  HA     70 LYS  QG      3.83 #SUP  1.00
 77 LEU  HB2    77 LEU  QD1     3.43 #SUP  1.00  #QF  0.94
 77 LEU  HA     77 LEU  QD2     3.20 #SUP  0.96  #QF  0.96
 72 GLU  HB3    77 LEU  QD2     3.53 #SUP  0.87  #QF  0.87
 48 LEU  HA     48 LEU  QD2     3.65 #SUP  0.99  #QF  0.99
 46 LEU  QD2    48 LEU  QD2     3.96 #SUP  0.94  #QF  0.94
 48 LEU  HB2    48 LEU  QD2     4.09 #SUP  1.00
 48 LEU  HB3    48 LEU  QD2     3.68 #SUP  1.00
 46 LEU  QD1    48 LEU  QD2     3.96 #SUP  0.82  #QF  0.82
  9 LEU  HA      9 LEU  QD2     4.31 #SUP  0.95  #QF  0.95
 51 THR  QG2    76 CYSS HB3     3.73 #SUP  0.99  #QF  0.99
 64 LEU  HA     64 LEU  QD2     3.23 #SUP  0.99  #QF  0.99
 64 LEU  QD2    68 SER  HB2     5.03 #SUP  0.89  #QF  0.80
 64 LEU  QD2    68 SER  HB3     5.03 #SUP  0.89  #QF  0.80
 62 SER  HB3    64 LEU  QD2     4.41 #SUP  1.00  #QF  0.68
 64 LEU  HB2    64 LEU  QD2     3.24 #SUP  0.98  #QF  0.98
 64 LEU  HB3    64 LEU  QD2     3.34 #SUP  1.00  #QF  0.90
 38 PHE  QE     46 LEU  QD2     4.96 #SUP  0.71  #QF  0.40
 46 LEU  HA     46 LEU  QD2     4.13 #SUP  0.99  #QF  0.99
 30 LEU  HA     30 LEU  QD2     2.87 #SUP  0.99  #QF  0.99
 30 LEU  HB2    30 LEU  QD2     3.69 #SUP  1.00
 50 ALA  QB     51 THR  HA      4.08 #SUP  0.42  #QF  0.42
 49 CYSS HA     50 ALA  QB      4.31 #SUP  0.94  #QF  0.72
 50 ALA  QB     70 LYS  QG      4.18 #SUP  0.98  #QF  0.98
 50 ALA  QB     70 LYS  QE      4.10 #SUP  0.91  #QF  0.91
 51 THR  HA     51 THR  QG2     3.29 #SUP  0.99  #QF  0.99
 33 GLN  HB2    37 SER  HB2     4.98 #SUP  1.00
 47 ILE  QG2    71 TRP  HE3     3.93 #SUP  0.98  #QF  0.98
 47 ILE  HA     47 ILE  QG2     3.46 #SUP  1.00
 47 ILE  QG2    71 TRP  HB2     3.47 #SUP  0.99  #QF  0.99
 47 ILE  QG2    71 TRP  HB3     3.47 #SUP  0.99  #QF  0.99
 47 ILE  QG2    47 ILE  QG1     3.29 #SUP  1.00
 47 ILE  QG2    57 THR  QG2     4.23 #SUP  1.00
 57 THR  QG2    62 SER  HG      4.89 #SUP  1.00
 57 THR  QG2    58 HIST HA      4.65 #SUP  0.89  #QF  0.72
 57 THR  QG2    58 HIST HB2     4.98 #SUP  0.89  #QF  0.72
 57 THR  QG2    62 SER  HB3     3.98 #SUP  0.98  #QF  0.98
 47 ILE  HB     57 THR  QG2     3.39 #SUP  0.98  #QF  0.98
 28 ILE  QG2    30 LEU  HA      4.39 #SUP  0.80  #QF  0.80
 28 ILE  HA     28 ILE  QG2     3.39 #SUP  1.00
 28 ILE  QG2    30 LEU  HG      4.12 #SUP  0.75  #QF  0.75
 28 ILE  QG2    28 ILE  HG12    3.64 #SUP  1.00
 30 LEU  HG     61 CYSS HA      3.92 #SUP  0.98  #QF  0.98
 59 ARG  HA     59 ARG  HG2     3.73 #SUP  1.00
 47 ILE  QG1    59 ARG  HA      3.84 #SUP  1.00
 47 ILE  QD1    59 ARG  HA      3.49 #SUP  1.00
 28 ILE  HA     28 ILE  HG13    3.81 #SUP  1.00
 28 ILE  HA     28 ILE  QD1     3.46 #SUP  1.00
 49 CYSS HA     71 TRP  HE3     3.74 #SUP  1.00
 24 CYSS HA     25 ASP  HN      3.47 #SUP  0.87  #QF  0.87
 32 GLU  HA     32 GLU  HG2     3.86 #SUP  1.00
 32 GLU  HA     32 GLU  HG3     3.86 #SUP  0.95  #QF  0.95
 32 GLU  HA     32 GLU  QB      2.94 #SUP  0.99  #QF  0.99
 25 ASP  HN     57 THR  HA      4.00 #SUP  0.73  #QF  0.73
 24 CYSS HA     57 THR  HA      3.61 #SUP  0.96  #QF  0.96
 35 ARG  HA     58 HIST HE1     4.89 #SUP  0.82  #QF  0.82
 75 GLU  HA     75 GLU  QG      3.28 #SUP  0.95  #QF  0.95
 47 ILE  HA     47 ILE  QD1     3.94 #SUP  1.00
 47 ILE  QD1    59 ARG  HG3     3.41 #SUP  0.94  #QF  0.24
 47 ILE  HB     47 ILE  QD1     3.38 #SUP  0.99  #QF  0.99
 47 ILE  QD1    59 ARG  HG2     3.37 #SUP  0.92  #QF  0.92
 16 GLU  HA     16 GLU  QG      3.65 #SUP  0.98  #QF  0.98
 17 LEU  HA     17 LEU  QD1     4.59 #SUP  1.00  #QF  0.75
 17 LEU  HA     17 LEU  QD2     4.59 #SUP  1.00  #QF  0.75
 74 ASN  HA     77 LEU  QD1     3.90 #SUP  0.67  #QF  0.67
  9 LEU  HA      9 LEU  HG      4.18 #SUP  1.00
  9 LEU  HA      9 LEU  QD1     4.31 #SUP  0.99  #QF  0.44
 22 ARG  HA     22 ARG  HG2     4.13 #SUP  1.00
 22 ARG  HA     46 LEU  QD1     4.05 #SUP  0.99  #QF  0.99
 22 ARG  HA     46 LEU  QD2     4.05 #SUP  0.95  #QF  0.95
 33 GLN  HA     33 GLN  HG2     3.90 #SUP  1.00
 32 GLU  QB     33 GLN  HA      4.37 #SUP  1.00  #QF  0.29
 23 HIS  HA     36 ASP  HA      4.17 #SUP  0.84  #QF  0.84
 44 TRP  HA     44 TRP  HZ3     4.56 #SUP  1.00
 10 GLU  HA     11 PRO  HD2     3.24 #SUP  0.83  #QF  0.72
 65 ARG  HA     66 PRO  HD3     3.33 #SUP  0.83  #QF  0.72
 10 GLU  QG     11 PRO  HD2     4.95 #SUP  1.00  #QF  0.54
 10 GLU  HA     11 PRO  HD3     3.24 #SUP  0.86  #QF  0.77
 65 ARG  HA     66 PRO  HD2     3.57 #SUP  0.86  #QF  0.77
 65 ARG  HB3    66 PRO  HD2     3.02 #SUP  0.53  #QF  0.53
 77 LEU  QD2    78 PRO  HD3     4.15 #SUP  0.79  #QF  0.79
 65 ARG  HB3    66 PRO  HD3     3.47 #SUP  0.91  #QF  0.91
 77 LEU  HA     78 PRO  HD2     3.25 #SUP  0.89  #QF  0.89
 77 LEU  HB3    78 PRO  HD2     4.02 #SUP  1.00
 77 LEU  HA     78 PRO  HD3     3.25 #SUP  0.90  #QF  0.90
 77 LEU  HB3    78 PRO  HD3     4.02 #SUP  1.00
  8 GLU  HA      9 LEU  HG      5.50 #SUP  0.93  #QF  0.81
  8 GLU  HN      8 GLU  QG      4.48 #SUP  0.99  #QF  0.76
  8 GLU  QG      9 LEU  HN      4.86 #SUP  0.99  #QF  0.76
  8 GLU  HA      8 GLU  QG      3.70 #SUP  0.95  #QF  0.95
  9 LEU  HB2    10 GLU  HN      4.03 #SUP  0.83  #QF  0.83
 48 LEU  QD2    54 SER  HA      4.83 #SUP  0.39  #QF  0.39
 10 GLU  QG     11 PRO  HD3     4.95 #SUP  0.88  #QF  0.88
 11 PRO  HB2    12 GLY  QA      4.27 #SUP  0.95  #QF  0.95
 12 GLY  QA     13 ALA  QB      4.27 #SUP  0.77  #QF  0.77
 10 GLU  HN     13 ALA  QB      4.77 #SUP  0.86  #QF  0.86
 13 ALA  QB     14 PHE  QD      4.81 #SUP  0.24  #QF  0.24
 10 GLU  HA     13 ALA  QB      5.50 #SUP  0.99  #QF  0.79
 13 ALA  QB     14 PHE  HA      5.50 #SUP  0.99  #QF  0.79
 11 PRO  HA     13 ALA  QB      4.34 #SUP  0.60  #QF  0.60
 10 GLU  QG     13 ALA  QB      4.98 #SUP  0.85  #QF  0.85
 10 GLU  HB2    13 ALA  QB      4.42 #SUP  0.94  #QF  0.94
 10 GLU  HB3    13 ALA  QB      4.42 #SUP  0.89  #QF  0.89
 14 PHE  HA     14 PHE  QD      4.18 #SUP  0.93  #QF  0.93
 14 PHE  HA     14 PHE  QE      4.74 #SUP  0.96  #QF  0.96
 14 PHE  HA     15 SER  HA      5.50 #SUP  0.95  #QF  0.95
 16 GLU  HA     17 LEU  HG      4.48 #SUP  0.42  #QF  0.42
 16 GLU  HN     16 GLU  HB3     4.02 #SUP  0.87  #QF  0.87
 16 GLU  QG     17 LEU  HA      4.69 #SUP  0.23  #QF  0.23
 77 LEU  QD2    78 PRO  QG      4.03 #SUP  0.67  #QF  0.67
 72 GLU  HG2    77 LEU  QD2     4.95 #SUP  0.95  #QF  0.95
 72 GLU  HN     77 LEU  QD1     4.96 #SUP  0.98  #QF  0.71
 72 GLU  HN     77 LEU  QD2     5.35 #SUP  0.98  #QF  0.71
 18 TYR  HA     18 TYR  QD      3.65 #SUP  0.93  #QF  0.93
 20 ARG  HA     21 TYR  QB      5.50 #SUP  0.93  #QF  0.21
 20 ARG  HN     20 ARG  HB2     4.16 #SUP  0.98  #QF  0.95
 20 ARG  HN     20 ARG  QD      5.24 #SUP  0.99  #QF  0.94
 20 ARG  QD     21 TYR  HN      5.50 #SUP  0.99  #QF  0.94
 20 ARG  HA     20 ARG  QD      3.87 #SUP  0.99  #QF  0.99
 21 TYR  QD     48 LEU  QD2     3.67 #SUP  0.97  #QF  0.97
 21 TYR  QD     22 ARG  HA      4.54 #SUP  0.99  #QF  0.93
 21 TYR  HA     21 TYR  QD      3.57 #SUP  0.97  #QF  0.97
 21 TYR  QD     55 HIS  HA      4.06 #SUP  0.75  #QF  0.75
 21 TYR  QD     22 ARG  HN      4.19 #SUP  0.87  #QF  0.87
 21 TYR  HN     21 TYR  QD      4.22 #SUP  0.94  #QF  0.94
 21 TYR  QD     56 GLY  HN      5.02 #SUP  0.90  #QF  0.90
 22 ARG  HA     22 ARG  QD      4.65 #SUP  1.00
 21 TYR  QB     22 ARG  HA      5.37 #SUP  0.99  #QF  0.96
 22 ARG  HA     22 ARG  HG3     4.13 #SUP  0.94  #QF  0.94
 22 ARG  HA     48 LEU  QD2     4.75 #SUP  0.98  #QF  0.48
 27 PRO  HB2    28 ILE  HG12    4.01 #SUP  0.89  #QF  0.89
 47 ILE  QG1    57 THR  QG2     4.71 #SUP  0.90  #QF  0.90
 23 HIS  HB2    24 CYSS HN      5.50 #SUP  0.69  #QF  0.29
 23 HIS  HB3    24 CYSS HN      5.50 #SUP  0.69  #QF  0.29
 21 TYR  QE     23 HIS  HB3     4.76 #SUP  0.20  #QF  0.20
 24 CYSS HA     57 THR  HB      4.34 #SUP  0.84  #QF  0.84
 24 CYSS HN     24 CYSS HB3     4.04 #SUP  0.89  #QF  0.89
 24 CYSS HB3    38 PHE  HZ      4.44 #SUP  0.66  #QF  0.66
 24 CYSS HB3    38 PHE  QE      5.38 #SUP  0.93  #QF  0.93
 25 ASP  HN     25 ASP  HB2     4.09 #SUP  0.88  #QF  0.88
 25 ASP  HB2    56 GLY  HN      5.13 #SUP  0.79  #QF  0.79
 25 ASP  HN     25 ASP  HB3     4.09 #SUP  0.86  #QF  0.86
 25 ASP  HB3    56 GLY  HN      5.13 #SUP  0.71  #QF  0.71
 26 ALA  QB     28 ILE  HB      5.10 #SUP  0.66  #QF  0.66
 26 ALA  QB     27 PRO  HG3     4.94 #SUP  0.96  #QF  0.96
 26 ALA  QB     27 PRO  HB2     4.83 #SUP  0.94  #QF  0.94
 26 ALA  QB     57 THR  HB      3.67 #SUP  0.64  #QF  0.64
 26 ALA  QB     58 HIST HB2     4.72 #SUP  0.89  #QF  0.89
 26 ALA  QB     29 CYSS HA      4.18 #SUP  0.94  #QF  0.94
 26 ALA  QB     57 THR  HG1     4.36 #SUP  0.87  #QF  0.87
 26 ALA  HA     27 PRO  HA      4.54 #SUP  0.99  #QF  0.99
 27 PRO  HB3    28 ILE  HG12    5.50 #SUP  0.99  #QF  0.99
 26 ALA  QB     27 PRO  HG2     4.94 #SUP  1.00
 26 ALA  HA     27 PRO  HG2     4.94 #SUP  1.00
 26 ALA  HA     27 PRO  HG3     4.94 #SUP  1.00
 27 PRO  HB2    28 ILE  HB      4.70 #SUP  0.99  #QF  0.99
 62 SER  HB3    64 LEU  HG      4.02 #SUP  0.99  #QF  0.99
 64 LEU  HA     64 LEU  HG      3.91 #SUP  0.99  #QF  0.99
 28 ILE  QG2    30 LEU  HN      4.82 #SUP  0.78  #QF  0.78
 27 PRO  HB3    28 ILE  QD1     5.00 #SUP  0.99  #QF  0.99
 27 PRO  HB2    28 ILE  QD1     4.56 #SUP  0.97  #QF  0.97
 28 ILE  QG2    28 ILE  QD1     2.40 #SUP  0.76  #QF  0.76
 29 CYSS HA     61 CYSS HA      4.40 #SUP  1.00  #QF  0.99
 29 CYSS HA     61 CYSS HB2     4.12 #SUP  0.96  #QF  0.96
 29 CYSS HA     30 LEU  HB2     4.96 #SUP  1.00
 29 CYSS HA     30 LEU  HG      3.94 #SUP  0.98  #QF  0.98
 28 ILE  QG2    29 CYSS HA      4.66 #SUP  1.00
 30 LEU  HA     30 LEU  QD1     4.20 #SUP  0.98  #QF  0.98
 29 CYSS HA     30 LEU  HA      4.65 #SUP  1.00
 30 LEU  QD1    61 CYSS HN      4.61 #SUP  0.68  #QF  0.68
 30 LEU  HN     30 LEU  QD1     4.35 #SUP  0.95  #QF  0.95
 28 ILE  HB     30 LEU  QD2     4.57 #SUP  0.61  #QF  0.61
 29 CYSS HA     30 LEU  QD2     4.93 #SUP  1.00
 31 TYR  HA     31 TYR  QE      4.44 #SUP  0.74  #QF  0.74
 75 GLU  QG     76 CYSS HN      4.30 #SUP  0.73  #QF  0.73
 31 TYR  HB3    34 GLY  HN      4.43 #SUP  0.64  #QF  0.45
 33 GLN  HN     33 GLN  HB3     3.98 #SUP  0.74  #QF  0.74
 24 CYSS HB2    35 ARG  HA      4.87 #SUP  0.99  #QF  0.99
 24 CYSS HB3    35 ARG  HA      4.26 #SUP  0.99  #QF  0.99
 35 ARG  HG3    37 SER  HA      4.26 #SUP  0.56  #QF  0.56
 35 ARG  HG2    37 SER  HA      4.71 #SUP  0.71  #QF  0.71
 65 ARG  HG3    66 PRO  HD3     5.24 #SUP  0.99  #QF  0.99
 65 ARG  HG2    66 PRO  HD3     5.24 #SUP  0.99  #QF  0.99
 65 ARG  HN     65 ARG  QD      4.42 #SUP  0.51  #QF  0.51
 36 ASP  HA     38 PHE  QE      4.11 #SUP  0.55  #QF  0.55
 36 ASP  HN     36 ASP  HB2     4.07 #SUP  0.87  #QF  0.87
 33 GLN  HB3    37 SER  HB2     4.98 #SUP  1.00
 33 GLN  HB2    37 SER  HB3     4.98 #SUP  1.00
 33 GLN  HB3    37 SER  HB3     4.98 #SUP  0.98  #QF  0.98
 38 PHE  QD     46 LEU  HB3     4.49 #SUP  0.97  #QF  0.59
 38 PHE  QD     46 LEU  QD1     4.71 #SUP  0.97  #QF  0.59
 38 PHE  QD     46 LEU  HB2     4.49 #SUP  0.98  #QF  0.98
 38 PHE  QD     46 LEU  HA      3.93 #SUP  0.99  #QF  0.99
 38 PHE  QD     58 HIST HA      4.38 #SUP  1.00  #QF  0.83
 38 PHE  QD     58 HIST HD2     3.41 #SUP  0.85  #QF  0.85
 24 CYSS HA     38 PHE  QE      5.49 #SUP  1.00  #QF  0.85
 38 PHE  QE     58 HIST HD2     5.10 #SUP  0.97  #QF  0.97
 39 GLU  HB2    40 ASP  HN      4.46 #SUP  0.95  #QF  0.95
 39 GLU  HG2    40 ASP  HN      5.30 #SUP  0.98  #QF  0.98
 39 GLU  HN     39 GLU  HG2     4.98 #SUP  0.90  #QF  0.90
 39 GLU  HN     39 GLU  HG3     4.98 #SUP  0.87  #QF  0.87
 40 ASP  HB3    41 GLU  QG      4.89 #SUP  0.89  #QF  0.89
 40 ASP  HB2    41 GLU  QG      5.00 #SUP  0.93  #QF  0.93
 39 GLU  HA     40 ASP  HB3     5.43 #SUP  0.70  #QF  0.70
 39 GLU  HA     40 ASP  HB2     4.62 #SUP  0.72  #QF  0.72
 41 GLU  HB2    42 GLY  HN      4.86 #SUP  0.84  #QF  0.84
 41 GLU  HB3    42 GLY  HN      4.86 #SUP  0.86  #QF  0.86
 41 GLU  HA     41 GLU  QG      4.04 #SUP  1.00
 43 ARG  HA     60 ASP  HN      4.05 #SUP  0.50  #QF  0.50
 43 ARG  HA     59 ARG  HB2     4.15 #SUP  0.98  #QF  0.98
 43 ARG  HA     59 ARG  HB3     4.15 #SUP  1.00  #QF  0.97
 43 ARG  HA     45 ARG  HB3     5.50 #SUP  1.00  #QF  0.79
 43 ARG  HA     59 ARG  HG2     5.50 #SUP  1.00  #QF  0.79
 43 ARG  HA     43 ARG  HG3     4.16 #SUP  1.00
 43 ARG  HA     43 ARG  HG2     4.16 #SUP  1.00
 43 ARG  HD2    44 TRP  HE1     4.74 #SUP  0.86  #QF  0.86
 44 TRP  HA     58 HIST HB3     3.92 #SUP  0.74  #QF  0.74
 44 TRP  HA     59 ARG  HN      4.75 #SUP  0.43  #QF  0.23
 44 TRP  HB3    44 TRP  HZ3     5.43 #SUP  1.00
 41 GLU  HA     45 ARG  HB2     4.68 #SUP  0.98  #QF  0.98
 41 GLU  HA     45 ARG  HB3     4.51 #SUP  0.97  #QF  0.97
 44 TRP  HN     45 ARG  HB3     4.86 #SUP  0.95  #QF  0.45
 45 ARG  HB3    46 LEU  HN      5.17 #SUP  0.95  #QF  0.45
 45 ARG  HG3    47 ILE  QD1     4.43 #SUP  0.97  #QF  0.97
 45 ARG  HG3    46 LEU  HN      5.14 #SUP  0.92  #QF  0.92
 45 ARG  HD3    47 ILE  QD1     4.63 #SUP  1.00
 45 ARG  HD2    47 ILE  QD1     4.63 #SUP  0.99  #QF  0.99
 46 LEU  HA     47 ILE  QG1     3.98 #SUP  0.80  #QF  0.80
 46 LEU  HA     58 HIST HA      4.07 #SUP  0.95  #QF  0.95
 38 PHE  QE     46 LEU  HA      4.52 #SUP  0.91  #QF  0.91
 46 LEU  HB2    47 ILE  HN      4.94 #SUP  0.92  #QF  0.92
 46 LEU  HG     47 ILE  HN      4.81 #SUP  0.93  #QF  0.93
 46 LEU  HA     46 LEU  QD1     4.13 #SUP  1.00
 46 LEU  HN     46 LEU  QD1     4.97 #SUP  0.98  #QF  0.98
 38 PHE  QD     46 LEU  QD2     4.71 #SUP  0.98  #QF  0.98
 46 LEU  QD2    48 LEU  HG      4.88 #SUP  0.89  #QF  0.64
 47 ILE  HB     57 THR  HN      4.38 #SUP  0.61  #QF  0.61
 47 ILE  HB     48 LEU  HN      4.42 #SUP  0.98  #QF  0.98
 46 LEU  HA     47 ILE  HB      4.85 #SUP  0.99  #QF  0.99
 47 ILE  QG2    71 TRP  HN      4.15 #SUP  0.80  #QF  0.80
 47 ILE  QG2    71 TRP  HD1     5.22 #SUP  0.98  #QF  0.98
 47 ILE  QG2    48 LEU  HA      5.27 #SUP  1.00
 47 ILE  QG2    71 TRP  HA      4.67 #SUP  1.00
 47 ILE  QG2    49 CYSS HA      4.50 #SUP  0.90  #QF  0.64
 47 ILE  QG2    70 LYS  HA      4.79 #SUP  0.90  #QF  0.64
 47 ILE  QG2    48 LEU  HB2     4.55 #SUP  0.84  #QF  0.84
 47 ILE  QG2    47 ILE  QD1     2.91 #SUP  0.99  #QF  0.98
 47 ILE  QD1    57 THR  QG2     4.39 #SUP  0.98  #QF  0.98
 47 ILE  QD1    64 LEU  QD2     4.59 #SUP  0.70  #QF  0.70
 45 ARG  HG2    47 ILE  QD1     4.43 #SUP  0.98  #QF  0.98
 47 ILE  QD1    59 ARG  HB2     4.56 #SUP  0.99  #QF  0.99
 47 ILE  QD1    59 ARG  HD3     4.90 #SUP  1.00  #QF  0.91
 47 ILE  QD1    70 LYS  HA      5.02 #SUP  0.66  #QF  0.66
 47 ILE  QD1    48 LEU  HN      5.11 #SUP  0.92  #QF  0.92
 47 ILE  QD1    59 ARG  HN      4.29 #SUP  0.91  #QF  0.91
 48 LEU  HA     56 GLY  HA2     5.20 #SUP  0.99  #QF  0.99
 48 LEU  HB2    49 CYSS HN      4.26 #SUP  0.73  #QF  0.73
 48 LEU  HB3    53 GLY  QA      4.12 #SUP  0.88  #QF  0.88
 46 LEU  QD1    48 LEU  HG      4.88 #SUP  0.82  #QF  0.82
 48 LEU  QD1    49 CYSS HN      5.14 #SUP  0.88  #QF  0.88
 21 TYR  QD     48 LEU  QD1     5.20 #SUP  0.93  #QF  0.93
 48 LEU  HA     48 LEU  QD1     4.77 #SUP  1.00
 48 LEU  QD1    53 GLY  QA      4.48 #SUP  0.87  #QF  0.87
 21 TYR  QB     48 LEU  QD1     4.51 #SUP  0.79  #QF  0.79
 49 CYSS HA     72 GLU  HA      4.25 #SUP  0.99  #QF  0.71
 49 CYSS HB3    73 CYSS HB3     4.19 #SUP  0.96  #QF  0.96
 49 CYSS HB3    55 HIS  HB2     4.12 #SUP  0.76  #QF  0.76
 49 CYSS HB3    53 GLY  QA      4.59 #SUP  0.98  #QF  0.98
 48 LEU  HA     49 CYSS HB3     5.13 #SUP  0.99  #QF  0.88
 49 CYSS HB3    72 GLU  HA      5.44 #SUP  0.99  #QF  0.88
 49 CYSS HB3    73 CYSS HN      4.25 #SUP  0.79  #QF  0.79
 49 CYSS HB3    51 THR  HN      4.91 #SUP  0.42  #QF  0.42
 49 CYSS HB2    71 TRP  HE3     4.64 #SUP  1.00
 49 CYSS HB2    71 TRP  HZ3     4.54 #SUP  1.00
 49 CYSS HB2    72 GLU  HA      4.73 #SUP  1.00  #QF  0.91
 49 CYSS HB2    55 HIS  HB2     3.78 #SUP  0.65  #QF  0.65
 49 CYSS HB2    73 CYSS HB3     3.95 #SUP  0.99  #QF  0.99
 50 ALA  QB     72 GLU  HA      4.61 #SUP  0.97  #QF  0.97
 50 ALA  QB     72 GLU  HG2     4.22 #SUP  0.98  #QF  0.98
 50 ALA  QB     72 GLU  HG3     3.64 #SUP  0.91  #QF  0.91
 50 ALA  QB     51 THR  QG2     5.43 #SUP  0.95  #QF  0.87
 51 THR  QG2    72 GLU  HG3     5.50 #SUP  0.97  #QF  0.97
 51 THR  QG2    72 GLU  HG2     4.85 #SUP  0.87  #QF  0.87
 51 THR  QG2    76 CYSS HB2     4.29 #SUP  1.00
 48 LEU  QD2    53 GLY  QA      4.95 #SUP  0.93  #QF  0.59
 48 LEU  HB2    53 GLY  QA      4.96 #SUP  0.99  #QF  0.99
 21 TYR  QB     54 SER  HA      4.29 #SUP  0.74  #QF  0.74
 21 TYR  QD     54 SER  HA      4.60 #SUP  0.93  #QF  0.93
 54 SER  QB     55 HIS  HD2     5.49 #SUP  0.30  #QF  0.30
 21 TYR  QD     54 SER  QB      5.21 #SUP  0.70  #QF  0.70
 55 HIS  HB2    73 CYSS HA      4.08 #SUP  0.95  #QF  0.95
 55 HIS  HB2    73 CYSS HB2     3.92 #SUP  0.99  #QF  0.99
 48 LEU  QD2    56 GLY  HA1     4.08 #SUP  0.98  #QF  0.98
 48 LEU  HA     56 GLY  HA1     4.05 #SUP  0.98  #QF  0.98
 56 GLY  HA1    71 TRP  HZ3     4.26 #SUP  0.99  #QF  0.99
 56 GLY  HA1    71 TRP  HH2     4.41 #SUP  0.96  #QF  0.23
 49 CYSS HN     56 GLY  HA1     3.93 #SUP  0.77  #QF  0.77
 21 TYR  QD     56 GLY  HA2     4.59 #SUP  0.99  #QF  0.92
 21 TYR  QE     56 GLY  HA2     5.18 #SUP  0.99  #QF  0.92
 56 GLY  HA2    71 TRP  HZ3     4.70 #SUP  0.99  #QF  0.99
 48 LEU  QD2    56 GLY  HA2     3.84 #SUP  0.95  #QF  0.26
 57 THR  HA     57 THR  QG2     4.22 #SUP  1.00
 26 ALA  QB     57 THR  HA      4.97 #SUP  0.96  #QF  0.96
 24 CYSS HB3    57 THR  HA      5.01 #SUP  1.00
 57 THR  HA     58 HIST HA      4.39 #SUP  0.79  #QF  0.79
 57 THR  HB     71 TRP  HZ2     4.93 #SUP  0.95  #QF  0.95
 57 THR  HB     71 TRP  HH2     4.58 #SUP  0.95  #QF  0.95
 26 ALA  QB     57 THR  QG2     3.95 #SUP  0.91  #QF  0.91
 24 CYSS HB2    57 THR  QG2     5.50 #SUP  0.87  #QF  0.65
 27 PRO  QD     57 THR  QG2     5.46 #SUP  1.00  #QF  0.46
 57 THR  QG2    62 SER  HB2     3.98 #SUP  0.98  #QF  0.98
 47 ILE  HN     57 THR  QG2     4.77 #SUP  0.92  #QF  0.92
 47 ILE  HN     58 HIST HA      4.55 #SUP  0.70  #QF  0.70
 45 ARG  HN     58 HIST HA      5.38 #SUP  0.98  #QF  0.80
 58 HIST HA     61 CYSS HN      5.50 #SUP  0.98  #QF  0.80
 38 PHE  HZ     58 HIST HA      5.50 #SUP  0.91  #QF  0.82
 58 HIST HA     62 SER  HN      5.50 #SUP  0.91  #QF  0.82
 38 PHE  QE     58 HIST HA      4.66 #SUP  0.96  #QF  0.96
 58 HIST HA     59 ARG  HA      4.37 #SUP  0.98  #QF  0.98
 58 HIST HA     61 CYSS HB3     5.13 #SUP  0.99  #QF  0.99
 58 HIST HB2    59 ARG  HN      4.32 #SUP  0.93  #QF  0.89
 44 TRP  HZ3    58 HIST HB3     4.31 #SUP  1.00
 57 THR  QG2    59 ARG  HA      4.59 #SUP  0.95  #QF  0.95
 47 ILE  QG2    59 ARG  HA      4.80 #SUP  0.91  #QF  0.91
 59 ARG  HA     64 LEU  QD2     5.50 #SUP  0.95  #QF  0.95
 47 ILE  HB     59 ARG  HA      3.91 #SUP  0.87  #QF  0.87
 47 ILE  QD1    59 ARG  HB3     4.56 #SUP  0.99  #QF  0.99
 47 ILE  QD1    59 ARG  HD2     4.90 #SUP  1.00  #QF  0.99
 59 ARG  HD2    64 LEU  QD1     5.50 #SUP  1.00  #QF  0.99
 59 ARG  HD3    64 LEU  QD1     5.50 #SUP  1.00  #QF  0.99
 60 ASP  HA     63 SER  HA      4.72 #SUP  0.80  #QF  0.80
 60 ASP  HB2    61 CYSS HN      4.28 #SUP  0.62  #QF  0.62
 43 ARG  QB     60 ASP  HB2     4.37 #SUP  0.74  #QF  0.74
 43 ARG  QB     60 ASP  HB3     4.37 #SUP  0.97  #QF  0.97
 60 ASP  HB3    61 CYSS HN      4.28 #SUP  0.70  #QF  0.70
 30 LEU  HN     61 CYSS HA      4.83 #SUP  0.91  #QF  0.91
 58 HIST HB2    61 CYSS HA      4.86 #SUP  0.99  #QF  0.99
 30 LEU  HB2    61 CYSS HA      5.43 #SUP  1.00
 26 ALA  QB     61 CYSS HA      4.25 #SUP  0.93  #QF  0.93
 30 LEU  QD2    61 CYSS HA      5.42 #SUP  0.99  #QF  0.99
 30 LEU  QD1    61 CYSS HB2     4.94 #SUP  0.98  #QF  0.98
 26 ALA  QB     61 CYSS HB2     3.90 #SUP  0.99  #QF  0.99
 58 HIST HB2    61 CYSS HB2     3.94 #SUP  0.92  #QF  0.92
 44 TRP  HZ3    61 CYSS HB2     5.12 #SUP  0.87  #QF  0.26
 58 HIST HB2    61 CYSS HB3     3.67 #SUP  0.91  #QF  0.91
 26 ALA  QB     61 CYSS HB3     3.51 #SUP  0.99  #QF  0.99
 62 SER  HB2    64 LEU  HG      4.02 #SUP  0.99  #QF  0.99
 62 SER  HB2    64 LEU  QD1     4.27 #SUP  1.00
 63 SER  HB2    64 LEU  HN      5.50 #SUP  0.88  #QF  0.88
 63 SER  HB3    64 LEU  HN      5.50 #SUP  0.95  #QF  0.95
 59 ARG  HG2    64 LEU  HB2     3.56 #SUP  0.43  #QF  0.43
 59 ARG  HA     64 LEU  HB2     4.54 #SUP  0.93  #QF  0.93
 64 LEU  HN     64 LEU  HB3     4.14 #SUP  0.94  #QF  0.90
 57 THR  QG2    64 LEU  QD2     5.20 #SUP  0.99  #QF  0.99
 64 LEU  QD2    71 TRP  HB3     4.22 #SUP  0.98  #QF  0.98
 62 SER  HB2    64 LEU  QD2     4.41 #SUP  1.00
 64 LEU  QD2    71 TRP  HA      4.17 #SUP  0.87  #QF  0.87
 65 ARG  HB2    68 SER  HA      5.14 #SUP  0.92  #QF  0.63
 69 LYS  HA     69 LYS  QD      4.74 #SUP  0.92  #QF  0.63
 65 ARG  HB2    66 PRO  HD3     4.93 #SUP  1.00
 65 ARG  HB2    66 PRO  HD2     3.99 #SUP  1.00
 59 ARG  HD2    66 PRO  HA      4.96 #SUP  0.86  #QF  0.86
 59 ARG  HD3    66 PRO  HA      4.96 #SUP  0.72  #QF  0.72
 64 LEU  HB3    68 SER  HB2     3.96 #SUP  0.63  #QF  0.53
 64 LEU  HB3    68 SER  HB3     3.96 #SUP  0.37  #QF  0.37
 64 LEU  QD1    70 LYS  HA      5.50 #SUP  0.74  #QF  0.60
 50 ALA  QB     70 LYS  HA      4.60 #SUP  1.00  #QF  0.99
 70 LYS  HB2    70 LYS  QE      5.22 #SUP  1.00
 70 LYS  HB3    70 LYS  QE      5.22 #SUP  1.00
 70 LYS  HA     70 LYS  QD      4.66 #SUP  0.99  #QF  0.99
 64 LEU  QD1    71 TRP  HB2     4.21 #SUP  1.00  #QF  0.98
 64 LEU  QD2    71 TRP  HB2     4.22 #SUP  0.98  #QF  0.98
 72 GLU  HA     72 GLU  HG2     3.98 #SUP  1.00
 72 GLU  HB2    73 CYSS HN      4.65 #SUP  0.88  #QF  0.88
 72 GLU  HB3    76 CYSS HB3     4.81 #SUP  0.99  #QF  0.99
 72 GLU  HB2    76 CYSS HB3     4.67 #SUP  0.99  #QF  0.99
 72 GLU  HB2    77 LEU  HB2     5.50 #SUP  0.69  #QF  0.69
 51 THR  QG2    72 GLU  HB3     5.50 #SUP  0.96  #QF  0.86
 72 GLU  HB3    77 LEU  HB2     5.50 #SUP  0.96  #QF  0.86
 72 GLU  HB3    77 LEU  QD1     4.71 #SUP  0.99  #QF  0.50
 72 GLU  HG3    77 LEU  QD2     4.82 #SUP  0.96  #QF  0.96
 72 GLU  HG2    76 CYSS HB3     4.72 #SUP  0.61  #QF  0.61
 70 LYS  QE     72 GLU  HG3     4.68 #SUP  0.65  #QF  0.65
 72 GLU  HA     72 GLU  HG3     3.94 #SUP  1.00
 72 GLU  HG2    73 CYSS HN      5.12 #SUP  0.89  #QF  0.89
 51 THR  HN     72 GLU  HG3     4.88 #SUP  0.77  #QF  0.77
 50 ALA  HN     72 GLU  HG3     4.93 #SUP  0.88  #QF  0.88
 50 ALA  HN     72 GLU  HG2     4.79 #SUP  0.87  #QF  0.87
 73 CYSS HA     74 ASN  HA      5.02 #SUP  0.99  #QF  0.99
 73 CYSS HA     74 ASN  HB2     5.50 #SUP  0.75  #QF  0.39
 73 CYSS HA     74 ASN  HB3     5.50 #SUP  0.75  #QF  0.39
 49 CYSS HB2    73 CYSS HB2     4.35 #SUP  0.97  #QF  0.97
 55 HIS  HB3    73 CYSS HB2     3.69 #SUP  0.99  #QF  0.99
 71 TRP  HH2    73 CYSS HB2     4.53 #SUP  0.99  #QF  0.99
 71 TRP  HH2    73 CYSS HB3     4.56 #SUP  0.98  #QF  0.98
 55 HIS  HB3    73 CYSS HB3     3.87 #SUP  0.99  #QF  0.99
 55 HIS  HB2    73 CYSS HB3     4.09 #SUP  1.00
 74 ASN  HA     77 LEU  HB2     4.35 #SUP  0.83  #QF  0.83
 74 ASN  HA     77 LEU  HB3     4.62 #SUP  0.93  #QF  0.71
 74 ASN  HA     77 LEU  HG      4.89 #SUP  0.93  #QF  0.71
 74 ASN  HA     77 LEU  HN      4.90 #SUP  0.82  #QF  0.47
 51 THR  QG2    76 CYSS HA      4.55 #SUP  0.99  #QF  0.99
 51 THR  HB     76 CYSS HB3     4.05 #SUP  0.99  #QF  0.99
 51 THR  HB     76 CYSS HB2     4.30 #SUP  0.99  #QF  0.99
 72 GLU  HB3    76 CYSS HB2     4.02 #SUP  0.92  #QF  0.92
 72 GLU  HB2    76 CYSS HB2     4.20 #SUP  0.52  #QF  0.52
 77 LEU  HA     78 PRO  QG      4.59 #SUP  0.90  #QF  0.90
 77 LEU  HA     77 LEU  HG      3.83 #SUP  0.98  #QF  0.98
 78 PRO  HA     79 ALA  QB      4.87 #SUP  0.93  #QF  0.93
 77 LEU  HN     78 PRO  HD2     5.05 #SUP  0.87  #QF  0.87
 77 LEU  QD2    78 PRO  HD2     4.15 #SUP  0.94  #QF  0.70
 77 LEU  HB2    78 PRO  HD2     4.82 #SUP  0.99  #QF  0.99
 77 LEU  HB2    78 PRO  HD3     4.82 #SUP  1.00
 79 ALA  QB     80 SER  HA      5.18 #SUP  0.74  #QF  0.56
 57 THR  QG2    71 TRP  HD1     5.30 #SUP  0.96  #QF  0.96
 64 LEU  QD1    71 TRP  HD1     4.17 #SUP  0.99  #QF  0.99
 64 LEU  QD2    71 TRP  HD1     3.60 #SUP  0.98  #QF  0.98
 64 LEU  HG     71 TRP  HD1     4.74 #SUP  0.99  #QF  0.99
 43 ARG  QB     44 TRP  HD1     5.50 #SUP  0.84  #QF  0.84
 44 TRP  HB2    44 TRP  HD1     3.56 #SUP  0.94  #QF  0.94
 44 TRP  HB3    44 TRP  HD1     3.61 #SUP  0.96  #QF  0.96
 55 HIS  HD2    73 CYSS HB3     5.32 #SUP  0.95  #QF  0.95
 55 HIS  HD2    73 CYSS HB2     4.81 #SUP  0.37  #QF  0.37
 55 HIS  HA     55 HIS  HD2     3.80 #SUP  0.73  #QF  0.73
 44 TRP  HB2    58 HIST HD2     4.47 #SUP  0.99  #QF  0.99
 44 TRP  HB3    58 HIST HD2     3.87 #SUP  0.93  #QF  0.93
 38 PHE  HA     58 HIST HD2     4.15 #SUP  0.35  #QF  0.35
 44 TRP  HA     58 HIST HD2     3.63 #SUP  0.94  #QF  0.94
 58 HIST HA     58 HIST HD2     3.70 #SUP  0.93  #QF  0.93
 38 PHE  HZ     58 HIST HD2     5.50 #SUP  1.00  #QF  0.43
 64 LEU  QD1    71 TRP  HB3     4.21 #SUP  0.98  #QF  0.21
 64 LEU  HA     64 LEU  QD1     4.42 #SUP  1.00
 64 LEU  QD1    71 TRP  HN      4.86 #SUP  0.63  #QF  0.63
 30 LEU  HB3    44 TRP  HZ2     5.10 #SUP  0.99  #QF  0.99
 43 ARG  HD3    44 TRP  HZ2     4.52 #SUP  0.97  #QF  0.97
 43 ARG  HD2    44 TRP  HZ2     4.52 #SUP  0.96  #QF  0.94
 30 LEU  QD2    44 TRP  HH2     4.67 #SUP  0.97  #QF  0.97
 30 LEU  QD1    44 TRP  HH2     4.25 #SUP  0.99  #QF  0.99
 30 LEU  HB3    44 TRP  HH2     3.58 #SUP  0.95  #QF  0.95
 30 LEU  HB2    44 TRP  HH2     3.44 #SUP  0.96  #QF  0.94
 30 LEU  HA     44 TRP  HH2     4.95 #SUP  0.99  #QF  0.99
 57 THR  QG2    71 TRP  HZ2     4.30 #SUP  1.00
 30 LEU  HB2    44 TRP  HZ2     5.21 #SUP  0.99  #QF  0.70
 71 TRP  HZ2    73 CYSS HB3     5.49 #SUP  0.99  #QF  0.70
 71 TRP  HZ2    73 CYSS HB2     4.15 #SUP  0.72  #QF  0.72
 71 TRP  HZ2    73 CYSS HA      3.85 #SUP  0.98  #QF  0.98
 71 TRP  HZ2    74 ASN  HN      4.65 #SUP  0.87  #QF  0.87
 57 THR  QG2    71 TRP  HH2     4.55 #SUP  0.99  #QF  0.99
 55 HIS  HB2    71 TRP  HH2     4.55 #SUP  0.95  #QF  0.28
 31 TYR  HA     44 TRP  HH2     4.78 #SUP  1.00  #QF  0.26
 55 HIS  HB3    71 TRP  HH2     4.24 #SUP  0.91  #QF  0.91
 71 TRP  HH2    73 CYSS HA      4.08 #SUP  0.99  #QF  0.99
 49 CYSS HN     71 TRP  HH2     4.54 #SUP  0.80  #QF  0.80
 49 CYSS HB3    71 TRP  HE3     5.43 #SUP  1.00
 48 LEU  HA     71 TRP  HE3     5.14 #SUP  0.99  #QF  0.88
 56 GLY  HA1    71 TRP  HE3     5.16 #SUP  1.00
 50 ALA  HN     71 TRP  HE3     4.88 #SUP  0.80  #QF  0.80
 57 THR  QG2    71 TRP  HZ3     5.31 #SUP  1.00
 55 HIS  HB2    71 TRP  HZ3     4.71 #SUP  0.70  #QF  0.70
 49 CYSS HB3    71 TRP  HZ3     4.47 #SUP  0.99  #QF  0.99
 49 CYSS HA     71 TRP  HZ3     4.59 #SUP  1.00
 48 LEU  HA     71 TRP  HZ3     4.89 #SUP  0.98  #QF  0.98
 44 TRP  HZ3    58 HIST HB2     4.36 #SUP  0.97  #QF  0.97
 44 TRP  HZ3    58 HIST HD2     5.41 #SUP  0.99  #QF  0.99
 30 LEU  QD1    44 TRP  HE3     5.38 #SUP  0.78  #QF  0.78
 44 TRP  HE3    58 HIST HB3     4.95 #SUP  0.98  #QF  0.98
 44 TRP  HA     44 TRP  HE3     4.43 #SUP  0.98  #QF  0.98
 21 TYR  QE     48 LEU  QD2     4.63 #SUP  0.84  #QF  0.84
 21 TYR  QE     23 HIS  HB2     4.76 #SUP  0.95  #QF  0.91
 21 TYR  QE     55 HIS  HB3     4.62 #SUP  0.85  #QF  0.85
 21 TYR  QE     22 ARG  HA      5.02 #SUP  0.99  #QF  0.64
 21 TYR  HA     21 TYR  QE      4.84 #SUP  0.89  #QF  0.89
 21 TYR  QE     55 HIS  HA      3.47 #SUP  0.75  #QF  0.75
 21 TYR  QE     56 GLY  HN      3.90 #SUP  0.84  #QF  0.84
 31 TYR  QE     33 GLN  HB3     4.15 #SUP  0.99  #QF  0.99
 31 TYR  QE     33 GLN  HG3     4.58 #SUP  0.97  #QF  0.97
 31 TYR  QE     33 GLN  HG2     4.58 #SUP  0.92  #QF  0.92
 31 TYR  QE     33 GLN  HB2     4.15 #SUP  0.99  #QF  0.99
 31 TYR  QE     44 TRP  HB2     4.78 #SUP  0.87  #QF  0.87
 31 TYR  QE     44 TRP  HB3     4.30 #SUP  0.60  #QF  0.60
 31 TYR  QE     37 SER  HB3     4.16 #SUP  0.99  #QF  0.99
 31 TYR  QE     37 SER  HB2     4.16 #SUP  0.98  #QF  0.98
 31 TYR  QE     44 TRP  HD1     4.11 #SUP  0.94  #QF  0.94
 31 TYR  QE     44 TRP  HE1     4.70 #SUP  0.82  #QF  0.82
 23 HIS  HA     23 HIS  HD2     4.66 #SUP  0.77  #QF  0.77
 59 ARG  HA     59 ARG  HG3     4.09 #SUP  0.99  #QF  0.99
 59 ARG  HN     59 ARG  HG3     5.14 #SUP  0.98  #QF  0.92
 59 ARG  HG3    60 ASP  HN      5.50 #SUP  0.98  #QF  0.92
 38 PHE  QE     46 LEU  QD1     4.96 #SUP  0.76  #QF  0.56
 57 THR  QG2    71 TRP  HE3     4.77 #SUP  0.99  #QF  0.99
 23 HIS  HA     38 PHE  HZ      4.72 #SUP  0.27  #QF  0.27
 24 CYSS HB3    25 ASP  HN      4.80 #SUP  0.87  #QF  0.87
 32 GLU  HA     34 GLY  HN      4.96 #SUP  0.57  #QF  0.57
 47 ILE  HA     48 LEU  HB2     4.93 #SUP  0.92  #QF  0.92
 24 CYSS HB3    58 HIST HE1     3.95 #SUP  0.87  #QF  0.87
 24 CYSS HB2    58 HIST HE1     4.71 #SUP  0.96  #QF  0.96
  8 GLU  HN      8 GLU  QB      3.56 
  8 GLU  HA      9 LEU  QB      5.34 
  9 LEU  HN      9 LEU  QB      3.31 
  9 LEU  HA      9 LEU  QQD     3.64 
 10 GLU  HN     10 GLU  QB      3.18 
 10 GLU  HN     11 PRO  QD      5.26 
 10 GLU  HA     11 PRO  QD      2.76 
 10 GLU  QB     13 ALA  QB      3.85 
 10 GLU  QG     11 PRO  QD      4.15 
 14 PHE  QB     15 SER  HN      4.18 
 15 SER  HA     16 GLU  QB      4.38 
 16 GLU  HA     17 LEU  QQD     4.71 
 16 GLU  QB     17 LEU  HN      3.46 
 16 GLU  QB     17 LEU  HG      4.71 
 16 GLU  QG     17 LEU  QQD     5.44 
 17 LEU  HN     17 LEU  QB      3.60 
 17 LEU  HN     17 LEU  QQD     4.40 
 17 LEU  HA     17 LEU  QQD     3.97 
 17 LEU  QB     18 TYR  HN      3.56 
 17 LEU  QB     19 GLN  HN      4.64 
 18 TYR  HN     18 TYR  QB      3.08 
 18 TYR  QB     19 GLN  HN      3.75 
 18 TYR  QB     19 GLN  HA      5.34 
 18 TYR  QB     19 GLN  QG      4.49 
 19 GLN  HN     19 GLN  QB      3.63 
 19 GLN  QB     20 ARG  HN      4.20 
 20 ARG  HN     20 ARG  QB      3.42 
 20 ARG  QB     20 ARG  QG      2.29 
 20 ARG  QB     20 ARG  QD      3.16 
 20 ARG  QB     21 TYR  HN      3.77 
 21 TYR  QE     23 HIS  QB      3.90 
 21 TYR  QE     25 ASP  QB      4.78 
 22 ARG  HN     22 ARG  QB      3.37 
 22 ARG  HN     22 ARG  QG      3.61 
 22 ARG  HN     23 HIS  QB      4.69 
 22 ARG  HA     22 ARG  QG      3.53 
 22 ARG  HA     23 HIS  QB      5.34 
 22 ARG  HA     46 LEU  QQD     3.36 
 22 ARG  QB     22 ARG  QG      2.34 
 22 ARG  QB     22 ARG  QD      3.10 
 22 ARG  QB     23 HIS  HN      4.25 
 22 ARG  QB     46 LEU  QQD     3.46 
 22 ARG  QG     46 LEU  QQD     3.83 
 22 ARG  QD     46 LEU  QQD     4.17 
 23 HIS  HN     23 HIS  QB      3.68 
 23 HIS  HN     46 LEU  QQD     4.25 
 25 ASP  HN     25 ASP  QB      3.50 
 25 ASP  QB     26 ALA  HN      4.13 
 25 ASP  QB     56 GLY  HN      4.37 
 26 ALA  QB     27 PRO  QG      4.20 
 27 PRO  HB2    63 SER  QB      4.71 
 27 PRO  QG     28 ILE  HN      3.53 
 27 PRO  QG     63 SER  QB      2.89 
 29 CYSS HN     29 CYSS QB      3.22 
 29 CYSS QB     30 LEU  HG      5.34 
 30 LEU  QD1    60 ASP  QB      4.06 
 31 TYR  QB     44 TRP  HE3     3.90 
 31 TYR  QB     44 TRP  HZ3     4.94 
 31 TYR  QB     58 HIST HE1     4.39 
 31 TYR  QE     33 GLN  QB      3.60 
 31 TYR  QE     33 GLN  QG      4.01 
 31 TYR  QE     37 SER  QB      3.61 
 32 GLU  HN     32 GLU  QG      4.10 
 33 GLN  HN     33 GLN  QB      3.47 
 33 GLN  HA     33 GLN  QG      3.39 
 33 GLN  QB     34 GLY  HN      4.15 
 33 GLN  QB     35 ARG  HG2     4.31 
 33 GLN  QB     37 SER  QB      3.53 
 33 GLN  QG     34 GLY  HN      5.34 
 33 GLN  QG     35 ARG  QB      3.97 
 33 GLN  QG     35 ARG  QD      3.46 
 34 GLY  QA     35 ARG  HN      2.96 
 35 ARG  HN     35 ARG  QB      3.20 
 35 ARG  HN     35 ARG  QD      4.31 
 35 ARG  QB     35 ARG  QD      3.31 
 35 ARG  HG2    37 SER  QB      4.70 
 35 ARG  QD     36 ASP  HN      5.25 
 36 ASP  HN     36 ASP  QB      3.53 
 36 ASP  HN     37 SER  QB      5.34 
 36 ASP  HA     46 LEU  QQD     5.42 
 37 SER  HN     37 SER  QB      3.31 
 37 SER  QB     38 PHE  HN      3.82 
 38 PHE  HN     38 PHE  QB      3.52 
 38 PHE  QB     39 GLU  HN      3.44 
 38 PHE  QB     45 ARG  HA      4.50 
 38 PHE  QB     46 LEU  HN      3.98 
 38 PHE  QB     46 LEU  QB      4.31 
 38 PHE  QB     46 LEU  QQD     4.78 
 38 PHE  QD     46 LEU  QB      3.79 
 38 PHE  QD     46 LEU  QQD     4.00 
 38 PHE  QE     46 LEU  QQD     3.92 
 38 PHE  HZ     46 LEU  QQD     4.41 
 39 GLU  HN     39 GLU  QB      3.43 
 39 GLU  HN     39 GLU  QG      4.17 
 39 GLU  QB     39 GLU  QG      2.35 
 39 GLU  QB     41 GLU  HN      3.74 
 39 GLU  QB     44 TRP  HB2     4.33 
 39 GLU  QB     44 TRP  HB3     4.70 
 39 GLU  QB     44 TRP  HD1     5.08 
 39 GLU  QG     40 ASP  HN      4.46 
 39 GLU  QG     41 GLU  HN      4.12 
 41 GLU  HN     41 GLU  QB      3.43 
 41 GLU  HA     45 ARG  QD      3.89 
 42 GLY  QA     43 ARG  HN      3.04 
 42 GLY  QA     43 ARG  HA      4.56 
 42 GLY  QA     44 TRP  HN      4.88 
 43 ARG  HN     43 ARG  QG      3.31 
 43 ARG  HN     43 ARG  QD      4.43 
 43 ARG  HA     43 ARG  QD      4.84 
 43 ARG  HA     45 ARG  QG      5.34 
 43 ARG  HA     59 ARG  QD      4.50 
 43 ARG  HA     60 ASP  QB      5.34 
 43 ARG  QB     60 ASP  QB      3.75 
 43 ARG  QG     44 TRP  HN      4.42 
 43 ARG  QG     44 TRP  HE1     5.09 
 43 ARG  QD     44 TRP  HE1     3.97 
 43 ARG  QD     44 TRP  HZ2     3.96 
 44 TRP  HN     59 ARG  QB      4.71 
 44 TRP  HH2    60 ASP  QB      5.14 
 45 ARG  HN     45 ARG  QG      3.19 
 45 ARG  HN     45 ARG  QD      4.30 
 45 ARG  HN     59 ARG  QB      4.00 
 45 ARG  QG     46 LEU  HN      4.40 
 45 ARG  QG     47 ILE  QD1     3.75 
 45 ARG  QG     59 ARG  HG2     4.85 
 45 ARG  QD     47 ILE  QD1     4.03 
 46 LEU  HN     46 LEU  QB      2.93 
 46 LEU  HN     46 LEU  QQD     4.27 
 46 LEU  HA     46 LEU  QQD     3.14 
 46 LEU  QB     46 LEU  QQD     2.76 
 46 LEU  QB     47 ILE  HN      4.13 
 46 LEU  QQD    47 ILE  HN      3.40 
 46 LEU  QQD    47 ILE  QG1     5.44 
 46 LEU  QQD    48 LEU  HA      5.21 
 46 LEU  QQD    48 LEU  HG      4.19 
 46 LEU  QQD    56 GLY  HA1     4.30 
 46 LEU  QQD    56 GLY  HA2     3.59 
 46 LEU  QQD    57 THR  HN      3.66 
 46 LEU  QQD    57 THR  HA      5.44 
 46 LEU  QQD    58 HIST HA      5.44 
 47 ILE  QD1    59 ARG  QB      3.91 
 47 ILE  QD1    59 ARG  QD      4.26 
 47 ILE  QD1    71 TRP  QB      4.01 
 50 ALA  QB     70 LYS  QB      2.50 
 51 THR  QG2    52 CYSS QB      3.65 
 52 CYSS HN     52 CYSS QB      3.43 
 52 CYSS QB     54 SER  HN      4.35 
 52 CYSS QB     54 SER  QB      4.39 
 57 THR  QG2    62 SER  QB      3.38 
 57 THR  QG2    71 TRP  QB      5.34 
 58 HIST HA     59 ARG  QB      5.25 
 59 ARG  HN     59 ARG  QB      3.03 
 59 ARG  QB     59 ARG  QD      3.13 
 59 ARG  QB     60 ASP  HN      3.18 
 59 ARG  QD     64 LEU  HB2     3.46 
 59 ARG  QD     66 PRO  HA      4.28 
 60 ASP  HN     60 ASP  QB      3.15 
 62 SER  QB     64 LEU  HG      3.45 
 62 SER  QB     64 LEU  QD1     3.64 
 62 SER  QB     71 TRP  HD1     4.45 
 62 SER  QB     71 TRP  HE1     3.69 
 63 SER  HN     63 SER  QB      3.20 
 64 LEU  HB3    68 SER  QB      3.31 
 64 LEU  QD1    68 SER  QB      3.80 
 64 LEU  QD1    71 TRP  QB      3.59 
 64 LEU  QD2    68 SER  QB      4.31 
 64 LEU  QD2    71 TRP  QB      3.66 
 65 ARG  HN     65 ARG  QG      3.94 
 65 ARG  HN     68 SER  QB      3.70 
 65 ARG  HB2    68 SER  QB      3.54 
 65 ARG  HB3    65 ARG  QG      2.42 
 65 ARG  HB3    68 SER  QB      4.35 
 65 ARG  QG     66 PRO  HD2     2.98 
 65 ARG  QG     66 PRO  HD3     4.47 
 68 SER  HN     68 SER  QB      3.49 
 69 LYS  QB     69 LYS  QD      2.82 
 70 LYS  HA     71 TRP  QB      4.08 
 70 LYS  QB     70 LYS  QD      2.23 
 70 LYS  QB     70 LYS  QE      4.47 
 70 LYS  QB     71 TRP  HN      3.41 
 71 TRP  HN     71 TRP  QB      3.10 
 71 TRP  QB     71 TRP  HE3     3.57 
 71 TRP  QB     72 GLU  HN      3.79 
 73 CYSS HB2    74 ASN  QB      4.27 
 74 ASN  HN     74 ASN  QB      3.13 
 74 ASN  HN     74 ASN  QD2     5.03 
 74 ASN  HA     74 ASN  QD2     4.54 
 74 ASN  QB     75 GLU  HN      4.31 
 77 LEU  HN     78 PRO  QD      4.39 
 77 LEU  HB2    78 PRO  QD      4.16 
 77 LEU  HB3    78 PRO  QD      3.53 
 77 LEU  QD2    78 PRO  QD      3.59 
 78 PRO  QD     79 ALA  HN      4.91 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1 -32.992 -28.480   7.906
    2    HA2  GLY   1           1HA      GLY   1 -30.854 -27.695   6.193
    3    HA3  GLY   1           2HA      GLY   1 -32.280 -28.125   5.260
    4    H    SER   2           H        SER   2 -30.972 -25.533   5.518
    5    HA   SER   2           HA       SER   2 -33.333 -23.969   6.060
    6    HB2  SER   2           1HB      SER   2 -32.073 -24.275   8.290
    7    HB3  SER   2           2HB      SER   2 -30.855 -23.205   7.595
    8    HG   SER   2           HG       SER   2 -33.562 -22.452   7.559
    9    H    SER   3           H        SER   3 -32.982 -21.647   5.527
   10    HA   SER   3           HA       SER   3 -30.650 -21.052   3.902
   11    HB2  SER   3           1HB      SER   3 -32.044 -22.104   2.242
   12    HB3  SER   3           2HB      SER   3 -33.445 -21.161   2.749
   13    HG   SER   3           HG       SER   3 -31.257 -20.415   1.201
   14    H    GLY   4           H        GLY   4 -30.378 -18.825   3.475
   15    HA2  GLY   4           1HA      GLY   4 -31.759 -16.637   3.612
   16    HA3  GLY   4           2HA      GLY   4 -31.941 -17.121   5.291
   17    H    SER   5           H        SER   5 -30.082 -15.381   3.112
   18    HA   SER   5           HA       SER   5 -27.860 -15.223   5.044
   19    HB2  SER   5           1HB      SER   5 -26.976 -16.195   3.051
   20    HB3  SER   5           2HB      SER   5 -27.814 -15.028   2.029
   21    HG   SER   5           HG       SER   5 -25.438 -14.793   3.396
   22    H    SER   6           H        SER   6 -26.842 -13.149   5.275
   23    HA   SER   6           HA       SER   6 -28.475 -10.874   4.379
   24    HB2  SER   6           1HB      SER   6 -28.912 -11.585   6.806
   25    HB3  SER   6           2HB      SER   6 -27.284 -10.999   7.147
   26    HG   SER   6           HG       SER   6 -29.521  -9.592   6.951
   27    H    GLY   7           H        GLY   7 -27.126  -9.906   2.982
   28    HA2  GLY   7           1HA      GLY   7 -24.798  -8.585   3.963
   29    HA3  GLY   7           2HA      GLY   7 -24.365  -9.953   2.949
   30    H    GLU   8           H        GLU   8 -25.083  -6.694   2.980
   31    HA   GLU   8           HA       GLU   8 -25.523  -6.712   0.067
   32    HB2  GLU   8           1HB      GLU   8 -26.722  -4.842   2.115
   33    HB3  GLU   8           2HB      GLU   8 -26.803  -4.582   0.378
   34    HG2  GLU   8           1HG      GLU   8 -28.859  -5.557   1.265
   35    HG3  GLU   8           2HG      GLU   8 -28.074  -6.616   0.095
   36    H    LEU   9           H        LEU   9 -24.885  -4.587  -0.954
   37    HA   LEU   9           HA       LEU   9 -22.701  -3.240   0.449
   38    HB2  LEU   9           1HB      LEU   9 -21.305  -3.409  -1.624
   39    HB3  LEU   9           2HB      LEU   9 -21.519  -4.913  -0.730
   40    HG   LEU   9           HG       LEU   9 -23.459  -5.283  -2.476
   41   HD11  LEU   9          1HD1      LEU   9 -23.501  -3.365  -3.745
   42   HD12  LEU   9          2HD1      LEU   9 -22.458  -4.402  -4.717
   43   HD13  LEU   9          3HD1      LEU   9 -21.750  -3.158  -3.688
   44   HD21  LEU   9          1HD2      LEU   9 -21.120  -6.434  -2.074
   45   HD22  LEU   9          2HD2      LEU   9 -20.732  -5.650  -3.606
   46   HD23  LEU   9          3HD2      LEU   9 -22.082  -6.783  -3.511
   47    H    GLU  10           H        GLU  10 -21.951  -1.283  -0.750
   48    HA   GLU  10           HA       GLU  10 -24.260   0.020  -2.008
   49    HB2  GLU  10           1HB      GLU  10 -21.870   1.077  -0.517
   50    HB3  GLU  10           2HB      GLU  10 -22.867   2.128  -1.512
   51    HG2  GLU  10           1HG      GLU  10 -24.809   1.057  -0.086
   52    HG3  GLU  10           2HG      GLU  10 -23.496   0.792   1.060
   53    HA   PRO  11           HA       PRO  11 -21.696  -0.569  -5.710
   54    HB2  PRO  11           1HB      PRO  11 -23.770  -0.292  -7.440
   55    HB3  PRO  11           2HB      PRO  11 -23.409  -1.810  -6.608
   56    HG2  PRO  11           1HG      PRO  11 -25.447   0.279  -5.939
   57    HG3  PRO  11           2HG      PRO  11 -25.609  -1.487  -5.926
   58    HD2  PRO  11           1HD      PRO  11 -25.211  -0.044  -3.670
   59    HD3  PRO  11           2HD      PRO  11 -24.583  -1.692  -3.872
   60    H    GLY  12           H        GLY  12 -20.870   0.901  -7.163
   61    HA2  GLY  12           1HA      GLY  12 -20.299   2.977  -7.961
   62    HA3  GLY  12           2HA      GLY  12 -22.031   3.260  -8.046
   63    H    ALA  13           H        ALA  13 -19.810   2.836  -5.296
   64    HA   ALA  13           HA       ALA  13 -20.749   5.440  -4.281
   65    HB1  ALA  13           1HB      ALA  13 -20.894   4.627  -2.156
   66    HB2  ALA  13           2HB      ALA  13 -21.260   3.154  -3.054
   67    HB3  ALA  13           3HB      ALA  13 -19.638   3.416  -2.412
   68    H    PHE  14           H        PHE  14 -19.004   6.435  -5.480
   69    HA   PHE  14           HA       PHE  14 -16.372   6.039  -4.215
   70    HB2  PHE  14           1HB      PHE  14 -17.171   6.584  -7.033
   71    HB3  PHE  14           2HB      PHE  14 -15.671   7.301  -6.454
   72    HD1  PHE  14           1HD      PHE  14 -17.429   4.009  -6.384
   73    HD2  PHE  14           2HD      PHE  14 -13.744   6.104  -6.768
   74    HE1  PHE  14           1HE      PHE  14 -16.263   1.879  -6.783
   75    HE2  PHE  14           2HE      PHE  14 -12.573   3.978  -7.169
   76    HZ   PHE  14           HZ       PHE  14 -13.832   1.862  -7.178
   77    H    SER  15           H        SER  15 -16.891   7.512  -2.535
   78    HA   SER  15           HA       SER  15 -17.879  10.081  -2.805
   79    HB2  SER  15           1HB      SER  15 -17.662   9.250  -0.605
   80    HB3  SER  15           2HB      SER  15 -15.954   8.874  -0.825
   81    HG   SER  15           HG       SER  15 -17.191  11.307  -0.270
   82    H    GLU  16           H        GLU  16 -17.180  11.638  -4.103
   83    HA   GLU  16           HA       GLU  16 -14.723  11.788  -5.363
   84    HB2  GLU  16           1HB      GLU  16 -16.840  13.095  -5.886
   85    HB3  GLU  16           2HB      GLU  16 -16.362  14.205  -4.609
   86    HG2  GLU  16           1HG      GLU  16 -15.568  15.237  -6.510
   87    HG3  GLU  16           2HG      GLU  16 -14.144  14.393  -5.903
   88    H    LEU  17           H        LEU  17 -12.866  13.071  -5.041
   89    HA   LEU  17           HA       LEU  17 -12.504  14.240  -2.383
   90    HB2  LEU  17           1HB      LEU  17 -10.502  12.346  -3.594
   91    HB3  LEU  17           2HB      LEU  17 -10.436  13.097  -2.002
   92    HG   LEU  17           HG       LEU  17 -12.726  11.298  -2.625
   93   HD11  LEU  17          1HD1      LEU  17  -9.991  10.294  -1.855
   94   HD12  LEU  17          2HD1      LEU  17 -10.736  10.092  -3.440
   95   HD13  LEU  17          3HD1      LEU  17 -11.461   9.333  -2.023
   96   HD21  LEU  17          1HD2      LEU  17 -12.973  11.236  -0.391
   97   HD22  LEU  17          2HD2      LEU  17 -12.003  12.708  -0.434
   98   HD23  LEU  17          3HD2      LEU  17 -11.236  11.156  -0.094
   99    H    TYR  18           H        TYR  18 -11.996  16.282  -2.809
  100    HA   TYR  18           HA       TYR  18 -10.944  17.241  -5.218
  101    HB2  TYR  18           1HB      TYR  18 -10.773  18.540  -2.492
  102    HB3  TYR  18           2HB      TYR  18 -10.609  19.354  -4.044
  103    HD1  TYR  18           2HD      TYR  18 -12.761  18.531  -5.661
  104    HD2  TYR  18           1HD      TYR  18 -12.745  19.091  -1.444
  105    HE1  TYR  18           2HE      TYR  18 -15.188  18.930  -5.711
  106    HE2  TYR  18           1HE      TYR  18 -15.171  19.491  -1.481
  107    HH   TYR  18           HH       TYR  18 -16.852  20.397  -3.735
  108    H    GLN  19           H        GLN  19  -9.314  16.814  -2.076
  109    HA   GLN  19           HA       GLN  19  -6.726  17.332  -3.217
  110    HB2  GLN  19           1HB      GLN  19  -7.777  16.663  -0.509
  111    HB3  GLN  19           2HB      GLN  19  -6.075  16.364  -0.832
  112    HG2  GLN  19           1HG      GLN  19  -7.289  19.020  -1.460
  113    HG3  GLN  19           2HG      GLN  19  -6.799  18.622   0.186
  114   HE21  GLN  19          1HE2      GLN  19  -5.424  20.561  -0.350
  115   HE22  GLN  19          2HE2      GLN  19  -3.866  20.245  -1.027
  116    H    ARG  20           H        ARG  20  -5.062  15.877  -3.569
  117    HA   ARG  20           HA       ARG  20  -5.870  13.241  -4.338
  118    HB2  ARG  20           1HB      ARG  20  -3.235  14.697  -4.336
  119    HB3  ARG  20           2HB      ARG  20  -3.349  12.998  -4.777
  120    HG2  ARG  20           1HG      ARG  20  -3.417  14.125  -6.810
  121    HG3  ARG  20           2HG      ARG  20  -5.108  13.745  -6.475
  122    HD2  ARG  20           1HD      ARG  20  -5.658  15.927  -6.056
  123    HD3  ARG  20           2HD      ARG  20  -4.032  16.345  -5.515
  124    HE   ARG  20           HE       ARG  20  -4.127  15.720  -8.301
  125   HH11  ARG  20          2HH1      ARG  20  -4.713  18.223  -5.954
  126   HH12  ARG  20          1HH1      ARG  20  -4.472  19.516  -7.080
  127   HH21  ARG  20          2HH2      ARG  20  -3.809  17.414  -9.794
  128   HH22  ARG  20          1HH2      ARG  20  -3.959  19.056  -9.265
  129    H    TYR  21           H        TYR  21  -5.689  11.378  -3.253
  130    HA   TYR  21           HA       TYR  21  -4.947  11.436  -0.484
  131    HB2  TYR  21           1HB      TYR  21  -6.810  10.052  -1.209
  132    HB3  TYR  21           2HB      TYR  21  -5.754   9.141  -2.283
  133    HD1  TYR  21           1HD      TYR  21  -6.499   9.854   1.273
  134    HD2  TYR  21           2HD      TYR  21  -4.480   7.314  -1.480
  135    HE1  TYR  21           1HE      TYR  21  -6.038   8.261   3.090
  136    HE2  TYR  21           2HE      TYR  21  -4.014   5.714   0.329
  137    HH   TYR  21           HH       TYR  21  -4.444   6.476   3.612
  138    H    ARG  22           H        ARG  22  -2.864  11.519   0.057
  139    HA   ARG  22           HA       ARG  22  -1.027   9.612  -1.232
  140    HB2  ARG  22           1HB      ARG  22   0.772  11.248  -1.067
  141    HB3  ARG  22           2HB      ARG  22  -0.557  11.893  -2.020
  142    HG2  ARG  22           1HG      ARG  22  -1.086  13.476  -0.473
  143    HG3  ARG  22           2HG      ARG  22  -0.516  12.500   0.883
  144    HD2  ARG  22           1HD      ARG  22   1.825  12.863  -0.181
  145    HD3  ARG  22           2HD      ARG  22   1.045  14.207  -1.014
  146    HE   ARG  22           HE       ARG  22   1.734  14.056   1.778
  147   HH11  ARG  22          2HH1      ARG  22  -0.285  15.583  -0.612
  148   HH12  ARG  22          1HH1      ARG  22  -0.556  17.007   0.337
  149   HH21  ARG  22          2HH2      ARG  22   1.384  15.925   3.038
  150   HH22  ARG  22          1HH2      ARG  22   0.395  17.201   2.413
  151    H    HIS  23           H        HIS  23  -2.266   8.727   0.925
  152    HA   HIS  23           HA       HIS  23  -0.458   9.214   3.195
  153    HB2  HIS  23           1HB      HIS  23  -3.297   8.206   3.067
  154    HB3  HIS  23           2HB      HIS  23  -2.309   8.048   4.516
  155    HD1  HIS  23           1HD      HIS  23  -1.277  10.500   5.337
  156    HD2  HIS  23           2HD      HIS  23  -4.719  10.499   3.010
  157    HE1  HIS  23           1HE      HIS  23  -2.342  12.747   5.712
  158    HE2  HIS  23           2HE      HIS  23  -4.466  12.691   4.360
  159    H    CYS  24           H        CYS  24   1.144   7.778   3.233
  160    HA   CYS  24           HA       CYS  24   1.362   5.384   1.943
  161    HB2  CYS  24           1HB      CYS  24   3.290   6.302   3.002
  162    HB3  CYS  24           2HB      CYS  24   2.528   6.250   4.588
  163    H    ASP  25           H        ASP  25   0.134   3.633   1.975
  164    HA   ASP  25           HA       ASP  25  -0.961   2.727   4.555
  165    HB2  ASP  25           1HB      ASP  25  -2.626   3.760   2.857
  166    HB3  ASP  25           2HB      ASP  25  -2.399   2.264   1.956
  167    H    ALA  26           H        ALA  26   1.411   2.031   2.720
  168    HA   ALA  26           HA       ALA  26   0.962  -0.582   1.723
  169    HB1  ALA  26           1HB      ALA  26   3.140   1.272   1.859
  170    HB2  ALA  26           2HB      ALA  26   3.693  -0.334   2.337
  171    HB3  ALA  26           3HB      ALA  26   2.909  -0.099   0.775
  172    HA   PRO  27           HA       PRO  27   1.449  -3.242   5.179
  173    HB2  PRO  27           1HB      PRO  27   3.226  -5.113   4.336
  174    HB3  PRO  27           2HB      PRO  27   1.569  -5.019   3.728
  175    HG2  PRO  27           1HG      PRO  27   4.101  -4.007   2.492
  176    HG3  PRO  27           2HG      PRO  27   2.745  -4.857   1.728
  177    HD2  PRO  27           1HD      PRO  27   3.059  -2.172   1.565
  178    HD3  PRO  27           2HD      PRO  27   1.462  -2.947   1.590
  179    H    ILE  28           H        ILE  28   4.624  -2.495   3.744
  180    HA   ILE  28           HA       ILE  28   5.638  -1.940   6.439
  181    HB   ILE  28           HB       ILE  28   7.183  -3.558   4.412
  182   HG12  ILE  28          1HG1      ILE  28   5.222  -4.755   5.455
  183   HG13  ILE  28          2HG1      ILE  28   6.791  -5.490   5.766
  184   HG21  ILE  28          1HG2      ILE  28   8.782  -2.467   5.670
  185   HG22  ILE  28          2HG2      ILE  28   7.791  -2.477   7.129
  186   HG23  ILE  28          3HG2      ILE  28   8.565  -3.963   6.578
  187   HD11  ILE  28          1HD1      ILE  28   5.761  -3.555   7.757
  188   HD12  ILE  28          2HD1      ILE  28   4.997  -5.142   7.669
  189   HD13  ILE  28          3HD1      ILE  28   6.728  -5.012   7.982
  190    H    CYS  29           H        CYS  29   7.054  -0.259   6.570
  191    HA   CYS  29           HA       CYS  29   7.711   1.103   4.040
  192    HB2  CYS  29           1HB      CYS  29   6.098   2.159   5.845
  193    HB3  CYS  29           2HB      CYS  29   7.613   2.579   6.638
  194    H    LEU  30           H        LEU  30   9.764   1.931   3.758
  195    HA   LEU  30           HA       LEU  30  11.757   1.070   5.749
  196    HB2  LEU  30           1HB      LEU  30  12.247   1.512   2.814
  197    HB3  LEU  30           2HB      LEU  30  13.324   0.752   3.984
  198    HG   LEU  30           HG       LEU  30  10.681  -0.517   3.466
  199   HD11  LEU  30          1HD1      LEU  30  13.026  -1.010   1.657
  200   HD12  LEU  30          2HD1      LEU  30  11.735   0.118   1.244
  201   HD13  LEU  30          3HD1      LEU  30  11.368  -1.588   1.493
  202   HD21  LEU  30          1HD2      LEU  30  11.614  -2.117   4.682
  203   HD22  LEU  30          2HD2      LEU  30  13.072  -1.138   4.846
  204   HD23  LEU  30          3HD2      LEU  30  12.918  -2.275   3.505
  205    H    TYR  31           H        TYR  31  10.622   3.669   3.724
  206    HA   TYR  31           HA       TYR  31  12.764   5.437   3.884
  207    HB2  TYR  31           1HB      TYR  31  10.471   5.589   2.615
  208    HB3  TYR  31           2HB      TYR  31   9.953   6.457   4.056
  209    HD1  TYR  31           2HD      TYR  31  13.011   6.455   1.894
  210    HD2  TYR  31           1HD      TYR  31   9.966   8.740   3.793
  211    HE1  TYR  31           2HE      TYR  31  14.012   8.518   1.004
  212    HE2  TYR  31           1HE      TYR  31  10.958  10.809   2.907
  213    HH   TYR  31           HH       TYR  31  12.425  11.621   1.333
  214    H    GLU  32           H        GLU  32  13.759   6.199   5.618
  215    HA   GLU  32           HA       GLU  32  13.173   5.945   8.227
  216    HB2  GLU  32           1HB      GLU  32  15.256   6.938   7.454
  217    HB3  GLU  32           2HB      GLU  32  14.403   8.387   6.939
  218    HG2  GLU  32           1HG      GLU  32  15.241   9.092   8.934
  219    HG3  GLU  32           2HG      GLU  32  13.674   8.474   9.454
  220    H    GLN  33           H        GLN  33  11.978   8.555   6.149
  221    HA   GLN  33           HA       GLN  33  10.576   9.936   8.182
  222    HB2  GLN  33           1HB      GLN  33  10.629   9.985   5.210
  223    HB3  GLN  33           2HB      GLN  33   9.227  10.695   6.002
  224    HG2  GLN  33           1HG      GLN  33  11.004  12.326   5.483
  225    HG3  GLN  33           2HG      GLN  33  10.605  12.241   7.198
  226   HE21  GLN  33          1HE2      GLN  33  12.335  12.447   8.405
  227   HE22  GLN  33          2HE2      GLN  33  13.899  11.789   8.076
  228    H    GLY  34           H        GLY  34   9.626   7.423   5.881
  229    HA2  GLY  34           1HA      GLY  34   7.698   6.178   5.697
  230    HA3  GLY  34           2HA      GLY  34   7.763   6.168   7.453
  231    H    ARG  35           H        ARG  35   7.337   9.096   5.584
  232    HA   ARG  35           HA       ARG  35   4.590   9.279   6.631
  233    HB2  ARG  35           1HB      ARG  35   4.866  11.533   7.021
  234    HB3  ARG  35           2HB      ARG  35   6.490  10.942   7.345
  235    HG2  ARG  35           1HG      ARG  35   7.036  11.521   4.944
  236    HG3  ARG  35           2HG      ARG  35   5.492  12.374   4.904
  237    HD2  ARG  35           1HD      ARG  35   7.719  13.625   5.528
  238    HD3  ARG  35           2HD      ARG  35   6.201  14.010   6.337
  239    HE   ARG  35           HE       ARG  35   8.506  12.681   7.485
  240   HH11  ARG  35          2HH1      ARG  35   5.131  13.480   7.793
  241   HH12  ARG  35          1HH1      ARG  35   5.099  13.249   9.510
  242   HH21  ARG  35          2HH2      ARG  35   8.476  12.374   9.745
  243   HH22  ARG  35          1HH2      ARG  35   7.003  12.621  10.619
  244    H    ASP  36           H        ASP  36   3.522  11.266   5.216
  245    HA   ASP  36           HA       ASP  36   3.093  10.060   2.647
  246    HB2  ASP  36           1HB      ASP  36   1.528  12.029   2.334
  247    HB3  ASP  36           2HB      ASP  36   1.172  10.983   3.706
  248    H    SER  37           H        SER  37   5.727  10.750   2.757
  249    HA   SER  37           HA       SER  37   5.910  13.138   1.039
  250    HB2  SER  37           1HB      SER  37   7.727  12.006   3.119
  251    HB3  SER  37           2HB      SER  37   8.457  12.831   1.741
  252    HG   SER  37           HG       SER  37   6.324  14.105   2.993
  253    H    PHE  38           H        PHE  38   6.707  12.943  -0.972
  254    HA   PHE  38           HA       PHE  38   8.228  10.589  -1.740
  255    HB2  PHE  38           1HB      PHE  38   5.776  11.281  -3.345
  256    HB3  PHE  38           2HB      PHE  38   6.758   9.822  -3.419
  257    HD1  PHE  38           1HD      PHE  38   4.229  11.642  -1.466
  258    HD2  PHE  38           2HD      PHE  38   6.375   7.997  -1.944
  259    HE1  PHE  38           1HE      PHE  38   2.684  10.531   0.095
  260    HE2  PHE  38           2HE      PHE  38   4.833   6.881  -0.385
  261    HZ   PHE  38           HZ       PHE  38   2.984   8.147   0.636
  262    H    GLU  39           H        GLU  39   9.070  10.766  -3.973
  263    HA   GLU  39           HA       GLU  39   9.566  13.587  -4.637
  264    HB2  GLU  39           1HB      GLU  39  11.213  11.113  -4.798
  265    HB3  GLU  39           2HB      GLU  39  11.480  12.348  -6.020
  266    HG2  GLU  39           1HG      GLU  39  13.003  12.976  -4.446
  267    HG3  GLU  39           2HG      GLU  39  11.614  13.942  -3.952
  268    H    ASP  40           H        ASP  40  10.248  13.772  -7.084
  269    HA   ASP  40           HA       ASP  40   7.904  13.077  -8.590
  270    HB2  ASP  40           1HB      ASP  40   9.482  15.202  -8.724
  271    HB3  ASP  40           2HB      ASP  40  10.335  14.209  -9.902
  272    H    GLU  41           H        GLU  41  11.209  11.945  -8.378
  273    HA   GLU  41           HA       GLU  41  10.491   9.638 -10.010
  274    HB2  GLU  41           1HB      GLU  41  12.708  11.565 -10.651
  275    HB3  GLU  41           2HB      GLU  41  12.786   9.886 -11.165
  276    HG2  GLU  41           1HG      GLU  41  11.018  10.112 -12.631
  277    HG3  GLU  41           2HG      GLU  41  10.379  11.531 -11.803
  278    H    GLY  42           H        GLY  42  11.052   7.876  -8.927
  279    HA2  GLY  42           1HA      GLY  42  13.364   6.918  -8.093
  280    HA3  GLY  42           2HA      GLY  42  13.062   8.084  -6.813
  281    H    ARG  43           H        ARG  43  13.358   5.539  -6.056
  282    HA   ARG  43           HA       ARG  43  11.139   3.865  -6.066
  283    HB2  ARG  43           1HB      ARG  43  12.103   2.816  -4.086
  284    HB3  ARG  43           2HB      ARG  43  13.358   3.182  -5.262
  285    HG2  ARG  43           1HG      ARG  43  13.856   5.257  -3.953
  286    HG3  ARG  43           2HG      ARG  43  12.745   4.661  -2.718
  287    HD2  ARG  43           1HD      ARG  43  14.115   2.860  -2.178
  288    HD3  ARG  43           2HD      ARG  43  14.989   2.945  -3.707
  289    HE   ARG  43           HE       ARG  43  15.351   5.276  -2.084
  290   HH11  ARG  43          2HH1      ARG  43  16.435   2.017  -2.647
  291   HH12  ARG  43          1HH1      ARG  43  18.008   2.284  -1.970
  292   HH21  ARG  43          2HH2      ARG  43  17.418   5.641  -1.190
  293   HH22  ARG  43          1HH2      ARG  43  18.565   4.345  -1.141
  294    H    TRP  44           H        TRP  44  11.835   6.688  -4.118
  295    HA   TRP  44           HA       TRP  44   9.553   6.233  -2.383
  296    HB2  TRP  44           1HB      TRP  44  11.260   8.718  -2.501
  297    HB3  TRP  44           2HB      TRP  44  10.281   8.136  -1.157
  298    HD1  TRP  44           HD       TRP  44  13.743   8.410  -2.026
  299    HE1  TRP  44           1HE      TRP  44  15.198   6.669  -0.809
  300    HE3  TRP  44           3HE      TRP  44  10.063   5.216  -0.477
  301    HZ2  TRP  44           2HZ      TRP  44  14.833   4.261   0.618
  302    HZ3  TRP  44           3HZ      TRP  44  10.700   3.217   0.808
  303    HH2  TRP  44           HH       TRP  44  13.036   2.751   1.343
  304    H    ARG  45           H        ARG  45   8.875   6.439  -5.103
  305    HA   ARG  45           HA       ARG  45   7.740   9.115  -5.415
  306    HB2  ARG  45           1HB      ARG  45   7.216   8.439  -7.694
  307    HB3  ARG  45           2HB      ARG  45   8.908   8.118  -7.337
  308    HG2  ARG  45           1HG      ARG  45   8.393   5.758  -6.986
  309    HG3  ARG  45           2HG      ARG  45   6.693   6.078  -7.335
  310    HD2  ARG  45           1HD      ARG  45   8.968   6.579  -9.249
  311    HD3  ARG  45           2HD      ARG  45   7.941   5.147  -9.264
  312    HE   ARG  45           HE       ARG  45   6.477   7.613  -9.428
  313   HH11  ARG  45          2HH1      ARG  45   8.190   5.179 -11.234
  314   HH12  ARG  45          1HH1      ARG  45   7.354   5.504 -12.716
  315   HH21  ARG  45          2HH2      ARG  45   5.369   8.050 -11.374
  316   HH22  ARG  45          1HH2      ARG  45   5.751   7.139 -12.795
  317    H    LEU  46           H        LEU  46   5.667   9.555  -5.028
  318    HA   LEU  46           HA       LEU  46   3.947   7.771  -3.756
  319    HB2  LEU  46           1HB      LEU  46   3.667  10.148  -3.541
  320    HB3  LEU  46           2HB      LEU  46   3.353  10.308  -5.268
  321    HG   LEU  46           HG       LEU  46   1.270   8.933  -4.899
  322   HD11  LEU  46          1HD1      LEU  46   1.875   9.526  -2.005
  323   HD12  LEU  46          2HD1      LEU  46   1.925   7.935  -2.763
  324   HD13  LEU  46          3HD1      LEU  46   0.395   8.802  -2.634
  325   HD21  LEU  46          1HD2      LEU  46   1.665  11.594  -4.795
  326   HD22  LEU  46          2HD2      LEU  46   0.945  11.326  -3.207
  327   HD23  LEU  46          3HD2      LEU  46   0.079  10.834  -4.664
  328    H    ILE  47           H        ILE  47   3.051   6.001  -4.564
  329    HA   ILE  47           HA       ILE  47   2.261   5.979  -7.400
  330    HB   ILE  47           HB       ILE  47   2.750   3.614  -5.586
  331   HG12  ILE  47          1HG1      ILE  47   4.479   4.985  -7.640
  332   HG13  ILE  47          2HG1      ILE  47   4.865   4.618  -5.962
  333   HG21  ILE  47          1HG2      ILE  47   1.152   3.596  -7.709
  334   HG22  ILE  47          2HG2      ILE  47   2.693   3.392  -8.541
  335   HG23  ILE  47          3HG2      ILE  47   2.198   2.234  -7.306
  336   HD11  ILE  47          1HD1      ILE  47   4.511   2.590  -8.156
  337   HD12  ILE  47          2HD1      ILE  47   6.051   3.161  -7.514
  338   HD13  ILE  47          3HD1      ILE  47   4.949   2.250  -6.482
  339    H    LEU  48           H        LEU  48   0.171   5.900  -7.901
  340    HA   LEU  48           HA       LEU  48  -1.758   5.403  -5.745
  341    HB2  LEU  48           1HB      LEU  48  -1.898   6.915  -8.329
  342    HB3  LEU  48           2HB      LEU  48  -3.364   6.410  -7.492
  343    HG   LEU  48           HG       LEU  48  -1.242   8.266  -6.417
  344   HD11  LEU  48          1HD1      LEU  48  -2.369   9.828  -7.520
  345   HD12  LEU  48          2HD1      LEU  48  -3.733   9.505  -6.450
  346   HD13  LEU  48          3HD1      LEU  48  -3.616   8.678  -8.003
  347   HD21  LEU  48          1HD2      LEU  48  -3.772   7.191  -5.186
  348   HD22  LEU  48          2HD2      LEU  48  -2.904   8.599  -4.573
  349   HD23  LEU  48          3HD2      LEU  48  -2.122   7.018  -4.588
  350    H    CYS  49           H        CYS  49  -3.339   3.867  -5.910
  351    HA   CYS  49           HA       CYS  49  -2.910   1.505  -7.188
  352    HB2  CYS  49           1HB      CYS  49  -4.590   1.596  -5.508
  353    HB3  CYS  49           2HB      CYS  49  -5.512   2.807  -6.394
  354    H    ALA  50           H        ALA  50  -3.899   0.456  -9.018
  355    HA   ALA  50           HA       ALA  50  -4.206   2.295 -11.278
  356    HB1  ALA  50           1HB      ALA  50  -3.963  -0.666 -11.585
  357    HB2  ALA  50           2HB      ALA  50  -3.439   0.622 -12.670
  358    HB3  ALA  50           3HB      ALA  50  -2.542   0.299 -11.186
  359    H    THR  51           H        THR  51  -5.809  -0.408  -9.665
  360    HA   THR  51           HA       THR  51  -7.948  -0.729 -11.447
  361    HB   THR  51           HB       THR  51  -7.878  -1.223  -8.464
  362    HG1  THR  51           1HG      THR  51  -7.708  -3.474  -9.433
  363   HG21  THR  51          1HG2      THR  51  -9.861  -2.433  -8.643
  364   HG22  THR  51          2HG2      THR  51  -9.738  -2.562 -10.398
  365   HG23  THR  51          3HG2      THR  51 -10.167  -1.022  -9.655
  366    H    CYS  52           H        CYS  52  -8.300   0.673  -8.195
  367    HA   CYS  52           HA       CYS  52 -10.487   2.329  -9.185
  368    HB2  CYS  52           1HB      CYS  52 -11.011   2.734  -6.854
  369    HB3  CYS  52           2HB      CYS  52 -10.773   1.007  -7.102
  370    H    GLY  53           H        GLY  53  -7.255   2.623  -7.845
  371    HA2  GLY  53           1HA      GLY  53  -5.781   4.392  -7.922
  372    HA3  GLY  53           2HA      GLY  53  -6.937   5.240  -8.939
  373    H    SER  54           H        SER  54  -7.044   4.055  -5.580
  374    HA   SER  54           HA       SER  54  -7.774   6.791  -4.760
  375    HB2  SER  54           1HB      SER  54  -8.756   4.120  -3.758
  376    HB3  SER  54           2HB      SER  54  -8.946   5.599  -2.817
  377    HG   SER  54           HG       SER  54 -10.698   5.801  -3.969
  378    H    HIS  55           H        HIS  55  -6.189   3.792  -3.717
  379    HA   HIS  55           HA       HIS  55  -5.011   4.940  -1.392
  380    HB2  HIS  55           1HB      HIS  55  -4.292   2.435  -2.929
  381    HB3  HIS  55           2HB      HIS  55  -3.645   2.867  -1.348
  382    HD1  HIS  55           1HD      HIS  55  -4.663   0.988  -0.011
  383    HD2  HIS  55           2HD      HIS  55  -7.473   3.099  -2.226
  384    HE1  HIS  55           1HE      HIS  55  -6.902   0.157   0.777
  385    HE2  HIS  55           2HE      HIS  55  -8.585   1.386  -0.638
  386    H    GLY  56           H        GLY  56  -2.728   5.285  -1.025
  387    HA2  GLY  56           1HA      GLY  56  -1.051   5.663  -3.379
  388    HA3  GLY  56           2HA      GLY  56  -1.462   7.116  -2.480
  389    H    THR  57           H        THR  57   0.869   4.866  -2.884
  390    HA   THR  57           HA       THR  57   2.141   5.585  -0.373
  391    HB   THR  57           HB       THR  57   0.859   3.441   0.045
  392    HG1  THR  57           1HG      THR  57   3.647   3.019   0.285
  393   HG21  THR  57          1HG2      THR  57   1.065   1.727  -1.361
  394   HG22  THR  57          2HG2      THR  57   2.801   1.668  -1.053
  395   HG23  THR  57          3HG2      THR  57   2.169   2.680  -2.352
  396    H    HIS  58           H        HIS  58   4.427   4.646  -0.304
  397    HA   HIS  58           HA       HIS  58   5.842   5.495  -2.559
  398    HB2  HIS  58           1HB      HIS  58   6.896   3.548  -0.508
  399    HB3  HIS  58           2HB      HIS  58   7.812   4.714  -1.458
  400    HD2  HIS  58           2HD      HIS  58   8.131   7.157  -0.278
  401    HE1  HIS  58           1HE      HIS  58   5.441   6.555   2.948
  402    HE2  HIS  58           2HE      HIS  58   7.106   8.123   1.892
  403    H    ARG  59           H        ARG  59   7.684   3.821  -3.387
  404    HA   ARG  59           HA       ARG  59   6.170   1.842  -4.886
  405    HB2  ARG  59           1HB      ARG  59   7.884   3.474  -5.886
  406    HB3  ARG  59           2HB      ARG  59   9.108   2.422  -5.186
  407    HG2  ARG  59           1HG      ARG  59   6.991   1.252  -6.929
  408    HG3  ARG  59           2HG      ARG  59   8.354   2.105  -7.656
  409    HD2  ARG  59           1HD      ARG  59   8.613  -0.168  -5.692
  410    HD3  ARG  59           2HD      ARG  59   8.689  -0.353  -7.444
  411    HE   ARG  59           HE       ARG  59  10.772   0.555  -5.735
  412   HH11  ARG  59          2HH1      ARG  59   9.407   0.961  -8.911
  413   HH12  ARG  59          1HH1      ARG  59  10.899   1.470  -9.630
  414   HH21  ARG  59          2HH2      ARG  59  12.742   1.224  -6.669
  415   HH22  ARG  59          1HH2      ARG  59  12.795   1.619  -8.354
  416    H    ASP  60           H        ASP  60   9.330   1.819  -3.226
  417    HA   ASP  60           HA       ASP  60   9.456  -1.000  -3.051
  418    HB2  ASP  60           1HB      ASP  60  11.344   0.787  -2.846
  419    HB3  ASP  60           2HB      ASP  60  10.908   0.802  -1.140
  420    H    CYS  61           H        CYS  61   7.900   1.400  -1.129
  421    HA   CYS  61           HA       CYS  61   7.746  -0.015   1.316
  422    HB2  CYS  61           1HB      CYS  61   7.319   2.424   1.074
  423    HB3  CYS  61           2HB      CYS  61   5.819   2.049   0.231
  424    H    SER  62           H        SER  62   5.730   0.041  -1.568
  425    HA   SER  62           HA       SER  62   3.684  -1.617  -0.398
  426    HB2  SER  62           1HB      SER  62   3.239   0.088  -2.190
  427    HB3  SER  62           2HB      SER  62   4.102  -0.954  -3.321
  428    HG   SER  62           HG       SER  62   2.260  -2.375  -1.975
  429    H    SER  63           H        SER  63   6.638  -2.446  -0.836
  430    HA   SER  63           HA       SER  63   7.817  -4.312  -1.413
  431    HB2  SER  63           1HB      SER  63   6.096  -5.160   0.281
  432    HB3  SER  63           2HB      SER  63   5.212  -5.804  -1.102
  433    HG   SER  63           HG       SER  63   7.903  -6.416  -0.430
  434    H    LEU  64           H        LEU  64   7.327  -3.002  -3.641
  435    HA   LEU  64           HA       LEU  64   6.177  -4.913  -5.554
  436    HB2  LEU  64           1HB      LEU  64   6.888  -2.009  -5.942
  437    HB3  LEU  64           2HB      LEU  64   6.099  -3.051  -7.124
  438    HG   LEU  64           HG       LEU  64   4.861  -2.411  -4.458
  439   HD11  LEU  64          1HD1      LEU  64   3.672  -0.613  -5.430
  440   HD12  LEU  64          2HD1      LEU  64   4.280  -0.987  -7.042
  441   HD13  LEU  64          3HD1      LEU  64   5.373  -0.348  -5.814
  442   HD21  LEU  64          1HD2      LEU  64   4.192  -4.111  -6.649
  443   HD22  LEU  64          2HD2      LEU  64   2.993  -2.823  -6.533
  444   HD23  LEU  64          3HD2      LEU  64   3.320  -3.852  -5.138
  445    H    ARG  65           H        ARG  65   7.369  -4.398  -7.854
  446    HA   ARG  65           HA       ARG  65  10.159  -5.158  -7.360
  447    HB2  ARG  65           1HB      ARG  65   8.258  -5.642  -9.636
  448    HB3  ARG  65           2HB      ARG  65   9.994  -5.813  -9.862
  449    HG2  ARG  65           1HG      ARG  65  10.112  -7.560  -8.253
  450    HG3  ARG  65           2HG      ARG  65   8.446  -7.281  -7.744
  451    HD2  ARG  65           1HD      ARG  65   7.964  -7.749 -10.299
  452    HD3  ARG  65           2HD      ARG  65   9.496  -8.615 -10.187
  453    HE   ARG  65           HE       ARG  65   8.065  -9.538  -8.068
  454   HH11  ARG  65          2HH1      ARG  65   7.471  -9.310 -11.491
  455   HH12  ARG  65          1HH1      ARG  65   6.451 -10.709 -11.539
  456   HH21  ARG  65          2HH2      ARG  65   6.723 -11.381  -8.119
  457   HH22  ARG  65          1HH2      ARG  65   6.025 -11.886  -9.620
  458    HA   PRO  66           HA       PRO  66  11.813  -1.471  -9.069
  459    HB2  PRO  66           1HB      PRO  66  14.004  -2.401 -10.374
  460    HB3  PRO  66           2HB      PRO  66  13.897  -2.324  -8.612
  461    HG2  PRO  66           1HG      PRO  66  13.484  -4.662 -10.434
  462    HG3  PRO  66           2HG      PRO  66  14.355  -4.586  -8.891
  463    HD2  PRO  66           1HD      PRO  66  11.841  -5.569  -9.097
  464    HD3  PRO  66           2HD      PRO  66  12.420  -4.724  -7.647
  465    H    ASN  67           H        ASN  67  10.494  -3.866 -11.018
  466    HA   ASN  67           HA       ASN  67  10.581  -2.079 -13.351
  467    HB2  ASN  67           1HB      ASN  67  12.047  -4.271 -13.414
  468    HB3  ASN  67           2HB      ASN  67  10.502  -5.041 -13.764
  469   HD21  ASN  67          1HD2      ASN  67   9.537  -4.723 -15.723
  470   HD22  ASN  67          2HD2      ASN  67  10.305  -3.908 -17.038
  471    H    SER  68           H        SER  68   8.559  -2.204 -11.380
  472    HA   SER  68           HA       SER  68   6.385  -3.750 -12.548
  473    HB2  SER  68           1HB      SER  68   6.645  -3.683 -10.089
  474    HB3  SER  68           2HB      SER  68   6.392  -1.938 -10.120
  475    HG   SER  68           HG       SER  68   4.316  -2.427 -11.111
  476    H    LYS  69           H        LYS  69   4.807  -2.935 -13.785
  477    HA   LYS  69           HA       LYS  69   5.060  -0.301 -14.845
  478    HB2  LYS  69           1HB      LYS  69   3.159  -2.578 -15.235
  479    HB3  LYS  69           2HB      LYS  69   2.725  -0.987 -15.848
  480    HG2  LYS  69           1HG      LYS  69   5.150  -1.116 -16.886
  481    HG3  LYS  69           2HG      LYS  69   4.857  -2.850 -16.736
  482    HD2  LYS  69           1HD      LYS  69   2.786  -2.612 -18.016
  483    HD3  LYS  69           2HD      LYS  69   3.069  -0.875 -18.157
  484    HE2  LYS  69           1HE      LYS  69   5.079  -1.266 -19.435
  485    HE3  LYS  69           2HE      LYS  69   4.934  -3.006 -19.197
  486    HZ1  LYS  69           1HZ      LYS  69   2.713  -1.569 -20.462
  487    HZ2  LYS  69           2HZ      LYS  69   3.229  -3.163 -20.687
  488    HZ3  LYS  69           3HZ      LYS  69   4.096  -1.888 -21.382
  489    H    LYS  70           H        LYS  70   2.287  -1.828 -13.196
  490    HA   LYS  70           HA       LYS  70   1.790   0.724 -11.828
  491    HB2  LYS  70           1HB      LYS  70  -0.066  -0.820 -13.582
  492    HB3  LYS  70           2HB      LYS  70  -0.736  -0.012 -12.171
  493    HG2  LYS  70           1HG      LYS  70   0.501   2.071 -13.062
  494    HG3  LYS  70           2HG      LYS  70   0.570   1.177 -14.583
  495    HD2  LYS  70           1HD      LYS  70  -1.403   2.313 -14.860
  496    HD3  LYS  70           2HD      LYS  70  -1.997   0.829 -14.112
  497    HE2  LYS  70           1HE      LYS  70  -3.061   2.615 -12.984
  498    HE3  LYS  70           2HE      LYS  70  -1.810   2.017 -11.894
  499    HZ1  LYS  70           1HZ      LYS  70  -0.699   4.020 -13.505
  500    HZ2  LYS  70           2HZ      LYS  70  -0.946   4.038 -11.832
  501    HZ3  LYS  70           3HZ      LYS  70  -2.151   4.614 -12.870
  502    H    TRP  71           H        TRP  71   0.469   0.524  -9.896
  503    HA   TRP  71           HA       TRP  71   0.521  -2.187  -8.745
  504    HB2  TRP  71           1HB      TRP  71   2.195  -1.259  -7.485
  505    HB3  TRP  71           2HB      TRP  71   1.573   0.379  -7.671
  506    HD1  TRP  71           HD       TRP  71   1.261  -2.710  -5.454
  507    HE1  TRP  71           1HE      TRP  71  -0.009  -2.067  -3.310
  508    HE3  TRP  71           3HE      TRP  71  -0.188   2.016  -6.757
  509    HZ2  TRP  71           2HZ      TRP  71  -1.437   0.150  -2.304
  510    HZ3  TRP  71           3HZ      TRP  71  -1.504   3.332  -5.147
  511    HH2  TRP  71           HH       TRP  71  -2.115   2.416  -2.968
  512    H    GLU  72           H        GLU  72  -1.165  -2.750  -7.366
  513    HA   GLU  72           HA       GLU  72  -3.445  -0.882  -7.360
  514    HB2  GLU  72           1HB      GLU  72  -3.381  -3.882  -7.647
  515    HB3  GLU  72           2HB      GLU  72  -4.846  -3.010  -7.217
  516    HG2  GLU  72           1HG      GLU  72  -5.104  -2.128  -9.292
  517    HG3  GLU  72           2HG      GLU  72  -3.372  -2.098  -9.617
  518    H    CYS  73           H        CYS  73  -4.651  -0.671  -5.495
  519    HA   CYS  73           HA       CYS  73  -3.332  -0.950  -3.049
  520    HB2  CYS  73           1HB      CYS  73  -5.424  -0.284  -2.014
  521    HB3  CYS  73           2HB      CYS  73  -5.172   0.656  -3.481
  522    H    ASN  74           H        ASN  74  -4.574  -2.080  -1.125
  523    HA   ASN  74           HA       ASN  74  -4.275  -4.869  -1.531
  524    HB2  ASN  74           1HB      ASN  74  -3.768  -4.153   0.639
  525    HB3  ASN  74           2HB      ASN  74  -5.228  -3.174   0.760
  526   HD21  ASN  74          1HD2      ASN  74  -6.315  -3.989   2.412
  527   HD22  ASN  74          2HD2      ASN  74  -6.737  -5.652   2.615
  528    H    GLU  75           H        GLU  75  -7.174  -3.126  -0.392
  529    HA   GLU  75           HA       GLU  75  -9.062  -5.030  -0.578
  530    HB2  GLU  75           1HB      GLU  75 -10.703  -3.342  -0.891
  531    HB3  GLU  75           2HB      GLU  75  -9.396  -2.597   0.019
  532    HG2  GLU  75           1HG      GLU  75  -8.726  -1.287  -1.748
  533    HG3  GLU  75           2HG      GLU  75  -9.430  -2.365  -2.952
  534    H    CYS  76           H        CYS  76  -7.485  -3.465  -3.273
  535    HA   CYS  76           HA       CYS  76  -9.273  -4.575  -5.246
  536    HB2  CYS  76           1HB      CYS  76  -6.761  -2.939  -5.338
  537    HB3  CYS  76           2HB      CYS  76  -7.347  -3.729  -6.798
  538    H    LEU  77           H        LEU  77  -5.892  -5.119  -4.280
  539    HA   LEU  77           HA       LEU  77  -5.389  -7.239  -6.052
  540    HB2  LEU  77           1HB      LEU  77  -4.165  -6.464  -3.419
  541    HB3  LEU  77           2HB      LEU  77  -3.582  -7.832  -4.366
  542    HG   LEU  77           HG       LEU  77  -3.672  -5.007  -5.412
  543   HD11  LEU  77          1HD1      LEU  77  -1.191  -5.075  -5.017
  544   HD12  LEU  77          2HD1      LEU  77  -1.467  -6.487  -3.999
  545   HD13  LEU  77          3HD1      LEU  77  -2.186  -4.936  -3.567
  546   HD21  LEU  77          1HD2      LEU  77  -1.719  -6.879  -6.484
  547   HD22  LEU  77          2HD2      LEU  77  -2.864  -5.830  -7.322
  548   HD23  LEU  77          3HD2      LEU  77  -3.384  -7.408  -6.728
  549    HA   PRO  78           HA       PRO  78  -7.517 -10.662  -4.301
  550    HB2  PRO  78           1HB      PRO  78  -5.884 -12.691  -5.066
  551    HB3  PRO  78           2HB      PRO  78  -6.930 -11.823  -6.195
  552    HG2  PRO  78           1HG      PRO  78  -4.006 -11.466  -5.666
  553    HG3  PRO  78           2HG      PRO  78  -4.868 -11.490  -7.216
  554    HD2  PRO  78           1HD      PRO  78  -4.096  -9.190  -6.013
  555    HD3  PRO  78           2HD      PRO  78  -5.564  -9.303  -7.005
  556    H    ALA  79           H        ALA  79  -7.140 -10.032  -2.078
  557    HA   ALA  79           HA       ALA  79  -4.861 -11.333  -0.770
  558    HB1  ALA  79           1HB      ALA  79  -6.806  -9.272   0.257
  559    HB2  ALA  79           2HB      ALA  79  -5.486  -9.971   1.195
  560    HB3  ALA  79           3HB      ALA  79  -5.134  -8.997  -0.232
  561    H    SER  80           H        SER  80  -5.299 -13.401  -0.301
  562    HA   SER  80           HA       SER  80  -7.790 -14.557   0.078
  563    HB2  SER  80           1HB      SER  80  -5.047 -15.357   1.047
  564    HB3  SER  80           2HB      SER  80  -6.471 -16.352   1.350
  565    HG   SER  80           HG       SER  80  -6.450 -16.971  -0.660
  566    H    GLY  81           H        GLY  81  -9.262 -13.912   1.514
  567    HA2  GLY  81           1HA      GLY  81 -10.219 -13.782   3.631
  568    HA3  GLY  81           2HA      GLY  81  -8.631 -14.049   4.335
  569    HA   PRO  82           HA       PRO  82 -10.026  -9.477   4.420
  570    HB2  PRO  82           1HB      PRO  82 -10.906  -9.340   6.985
  571    HB3  PRO  82           2HB      PRO  82 -11.968  -9.718   5.623
  572    HG2  PRO  82           1HG      PRO  82 -10.676 -11.570   7.589
  573    HG3  PRO  82           2HG      PRO  82 -12.331 -11.591   6.953
  574    HD2  PRO  82           1HD      PRO  82 -10.391 -13.233   6.019
  575    HD3  PRO  82           2HD      PRO  82 -11.698 -12.616   4.988
  576    H    SER  83           H        SER  83  -8.648  -7.930   5.172
  577    HA   SER  83           HA       SER  83  -6.106  -8.421   5.917
  578    HB2  SER  83           1HB      SER  83  -6.859  -6.179   5.346
  579    HB3  SER  83           2HB      SER  83  -7.801  -6.085   6.834
  580    HG   SER  83           HG       SER  83  -5.045  -6.601   6.968
  581    H    SER  84           H        SER  84  -8.747  -7.786   8.222
  582    HA   SER  84           HA       SER  84  -7.128  -8.318  10.512
  583    HB2  SER  84           1HB      SER  84 -10.101  -7.996  10.108
  584    HB3  SER  84           2HB      SER  84  -9.405  -8.376  11.683
  585    HG   SER  84           HG       SER  84  -7.993  -6.427  11.083
  586    H    GLY  85           H        GLY  85  -6.215 -10.362  10.207
  587    HA2  GLY  85           1HA      GLY  85  -7.497 -12.705   9.476
  588    HA3  GLY  85           2HA      GLY  85  -6.095 -12.633  10.533
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1  -6.314  21.438  35.731
    2    HA2  GLY   1           1HA      GLY   1  -6.974  22.641  33.254
    3    HA3  GLY   1           2HA      GLY   1  -6.038  21.180  32.973
    4    H    SER   2           H        SER   2  -8.100  20.604  31.850
    5    HA   SER   2           HA       SER   2  -9.847  19.198  33.744
    6    HB2  SER   2           1HB      SER   2 -10.797  21.433  32.738
    7    HB3  SER   2           2HB      SER   2 -11.054  20.446  31.300
    8    HG   SER   2           HG       SER   2 -12.889  20.312  32.542
    9    H    SER   3           H        SER   3 -10.858  17.319  32.910
   10    HA   SER   3           HA       SER   3  -9.278  15.990  30.895
   11    HB2  SER   3           1HB      SER   3 -10.025  14.828  32.962
   12    HB3  SER   3           2HB      SER   3 -11.694  14.972  32.411
   13    HG   SER   3           HG       SER   3  -9.810  13.808  30.699
   14    H    GLY   4           H        GLY   4 -12.672  16.969  31.275
   15    HA2  GLY   4           1HA      GLY   4 -14.090  17.715  29.569
   16    HA3  GLY   4           2HA      GLY   4 -12.914  17.168  28.383
   17    H    SER   5           H        SER   5 -15.202  16.532  27.534
   18    HA   SER   5           HA       SER   5 -16.079  13.966  28.621
   19    HB2  SER   5           1HB      SER   5 -17.625  15.940  27.861
   20    HB3  SER   5           2HB      SER   5 -17.347  15.290  26.245
   21    HG   SER   5           HG       SER   5 -19.091  14.203  26.943
   22    H    SER   6           H        SER   6 -14.910  15.369  25.580
   23    HA   SER   6           HA       SER   6 -14.167  14.400  23.645
   24    HB2  SER   6           1HB      SER   6 -12.836  12.859  25.854
   25    HB3  SER   6           2HB      SER   6 -12.526  12.441  24.169
   26    HG   SER   6           HG       SER   6 -11.597  14.379  23.842
   27    H    GLY   7           H        GLY   7 -16.759  13.586  24.225
   28    HA2  GLY   7           1HA      GLY   7 -17.164  10.804  24.243
   29    HA3  GLY   7           2HA      GLY   7 -18.313  11.997  23.656
   30    H    GLU   8           H        GLU   8 -17.894   9.414  22.538
   31    HA   GLU   8           HA       GLU   8 -16.275   9.647  20.187
   32    HB2  GLU   8           1HB      GLU   8 -16.916   7.497  21.420
   33    HB3  GLU   8           2HB      GLU   8 -18.474   7.634  20.618
   34    HG2  GLU   8           1HG      GLU   8 -17.061   6.126  19.395
   35    HG3  GLU   8           2HG      GLU   8 -17.339   7.582  18.441
   36    H    LEU   9           H        LEU   9 -17.114   9.486  17.988
   37    HA   LEU   9           HA       LEU   9 -19.607  11.021  17.685
   38    HB2  LEU   9           1HB      LEU   9 -18.730  11.812  15.574
   39    HB3  LEU   9           2HB      LEU   9 -17.600  12.158  16.882
   40    HG   LEU   9           HG       LEU   9 -16.482   9.917  16.058
   41   HD11  LEU   9          1HD1      LEU   9 -17.643   9.074  14.324
   42   HD12  LEU   9          2HD1      LEU   9 -16.723  10.258  13.395
   43   HD13  LEU   9          3HD1      LEU   9 -18.368  10.628  13.913
   44   HD21  LEU   9          1HD2      LEU   9 -14.885  11.394  15.630
   45   HD22  LEU   9          2HD2      LEU   9 -16.081  12.690  15.592
   46   HD23  LEU   9          3HD2      LEU   9 -15.678  11.818  14.112
   47    H    GLU  10           H        GLU  10 -20.883  10.567  15.730
   48    HA   GLU  10           HA       GLU  10 -21.765   7.987  15.549
   49    HB2  GLU  10           1HB      GLU  10 -21.811  10.206  13.513
   50    HB3  GLU  10           2HB      GLU  10 -22.587   8.657  13.214
   51    HG2  GLU  10           1HG      GLU  10 -23.215  10.531  15.484
   52    HG3  GLU  10           2HG      GLU  10 -24.173  10.316  14.020
   53    HA   PRO  11           HA       PRO  11 -18.389   5.894  13.552
   54    HB2  PRO  11           1HB      PRO  11 -19.617   3.480  13.363
   55    HB3  PRO  11           2HB      PRO  11 -18.934   4.095  14.873
   56    HG2  PRO  11           1HG      PRO  11 -21.778   4.103  13.939
   57    HG3  PRO  11           2HG      PRO  11 -21.128   3.720  15.544
   58    HD2  PRO  11           1HD      PRO  11 -22.233   6.121  14.955
   59    HD3  PRO  11           2HD      PRO  11 -20.910   5.940  16.124
   60    H    GLY  12           H        GLY  12 -21.549   6.429  12.308
   61    HA2  GLY  12           1HA      GLY  12 -20.855   5.280   9.698
   62    HA3  GLY  12           2HA      GLY  12 -22.453   5.814  10.197
   63    H    ALA  13           H        ALA  13 -19.373   7.553  10.401
   64    HA   ALA  13           HA       ALA  13 -20.579   9.689   8.780
   65    HB1  ALA  13           1HB      ALA  13 -18.799   9.659  11.109
   66    HB2  ALA  13           2HB      ALA  13 -18.342  10.807   9.850
   67    HB3  ALA  13           3HB      ALA  13 -19.950  10.883  10.571
   68    H    PHE  14           H        PHE  14 -20.104   8.794   6.746
   69    HA   PHE  14           HA       PHE  14 -17.239   8.649   6.078
   70    HB2  PHE  14           1HB      PHE  14 -19.634   7.187   5.023
   71    HB3  PHE  14           2HB      PHE  14 -18.216   7.395   4.000
   72    HD1  PHE  14           1HD      PHE  14 -19.173   6.224   7.404
   73    HD2  PHE  14           2HD      PHE  14 -16.529   5.830   4.091
   74    HE1  PHE  14           1HE      PHE  14 -18.119   4.278   8.480
   75    HE2  PHE  14           2HE      PHE  14 -15.472   3.883   5.162
   76    HZ   PHE  14           HZ       PHE  14 -16.268   3.104   7.358
   77    H    SER  15           H        SER  15 -16.510  10.378   5.050
   78    HA   SER  15           HA       SER  15 -18.340  11.820   3.245
   79    HB2  SER  15           1HB      SER  15 -16.059  12.859   4.936
   80    HB3  SER  15           2HB      SER  15 -16.851  13.813   3.683
   81    HG   SER  15           HG       SER  15 -18.063  12.698   5.995
   82    H    GLU  16           H        GLU  16 -17.378  12.807   1.354
   83    HA   GLU  16           HA       GLU  16 -15.241  11.134   0.263
   84    HB2  GLU  16           1HB      GLU  16 -15.958  11.913  -1.917
   85    HB3  GLU  16           2HB      GLU  16 -17.349  11.337  -1.010
   86    HG2  GLU  16           1HG      GLU  16 -16.615  14.240  -1.079
   87    HG3  GLU  16           2HG      GLU  16 -17.596  13.498  -2.342
   88    H    LEU  17           H        LEU  17 -13.335  11.939  -0.527
   89    HA   LEU  17           HA       LEU  17 -12.741  14.729   0.188
   90    HB2  LEU  17           1HB      LEU  17 -10.399  14.049   0.258
   91    HB3  LEU  17           2HB      LEU  17 -11.391  13.090   1.355
   92    HG   LEU  17           HG       LEU  17 -11.405  11.416  -0.695
   93   HD11  LEU  17          1HD1      LEU  17  -9.206  13.308  -1.269
   94   HD12  LEU  17          2HD1      LEU  17 -10.185  12.334  -2.365
   95   HD13  LEU  17          3HD1      LEU  17  -8.859  11.591  -1.471
   96   HD21  LEU  17          1HD2      LEU  17 -10.306  10.181   0.786
   97   HD22  LEU  17          2HD2      LEU  17 -10.029  11.639   1.739
   98   HD23  LEU  17          3HD2      LEU  17  -8.834  11.124   0.547
   99    H    TYR  18           H        TYR  18 -11.617  16.064  -1.248
  100    HA   TYR  18           HA       TYR  18 -11.886  15.273  -4.058
  101    HB2  TYR  18           1HB      TYR  18 -11.866  17.894  -2.619
  102    HB3  TYR  18           2HB      TYR  18 -11.370  17.850  -4.307
  103    HD1  TYR  18           1HD      TYR  18 -14.170  17.330  -1.982
  104    HD2  TYR  18           2HD      TYR  18 -12.968  17.450  -6.062
  105    HE1  TYR  18           1HE      TYR  18 -16.531  17.390  -2.670
  106    HE2  TYR  18           2HE      TYR  18 -15.325  17.511  -6.761
  107    HH   TYR  18           HH       TYR  18 -17.681  16.599  -5.364
  108    H    GLN  19           H        GLN  19  -9.569  16.761  -1.818
  109    HA   GLN  19           HA       GLN  19  -7.438  17.175  -3.508
  110    HB2  GLN  19           1HB      GLN  19  -7.616  16.452  -0.605
  111    HB3  GLN  19           2HB      GLN  19  -6.042  16.560  -1.383
  112    HG2  GLN  19           1HG      GLN  19  -8.093  18.759  -1.239
  113    HG3  GLN  19           2HG      GLN  19  -6.633  18.634  -0.259
  114   HE21  GLN  19          1HE2      GLN  19  -7.969  19.929  -3.012
  115   HE22  GLN  19          2HE2      GLN  19  -6.517  20.376  -3.835
  116    H    ARG  20           H        ARG  20  -5.328  15.889  -3.461
  117    HA   ARG  20           HA       ARG  20  -5.836  13.334  -4.615
  118    HB2  ARG  20           1HB      ARG  20  -3.287  14.776  -3.890
  119    HB3  ARG  20           2HB      ARG  20  -3.305  13.192  -4.654
  120    HG2  ARG  20           1HG      ARG  20  -4.659  14.222  -6.507
  121    HG3  ARG  20           2HG      ARG  20  -4.312  15.791  -5.776
  122    HD2  ARG  20           1HD      ARG  20  -1.929  15.414  -6.038
  123    HD3  ARG  20           2HD      ARG  20  -2.235  13.804  -6.688
  124    HE   ARG  20           HE       ARG  20  -2.342  16.265  -8.111
  125   HH11  ARG  20          2HH1      ARG  20  -3.783  13.103  -7.904
  126   HH12  ARG  20          1HH1      ARG  20  -4.262  13.069  -9.569
  127   HH21  ARG  20          2HH2      ARG  20  -2.967  16.233 -10.304
  128   HH22  ARG  20          1HH2      ARG  20  -3.797  14.850 -10.933
  129    H    TYR  21           H        TYR  21  -6.060  11.455  -3.613
  130    HA   TYR  21           HA       TYR  21  -5.741  11.189  -0.803
  131    HB2  TYR  21           1HB      TYR  21  -7.425   9.910  -2.039
  132    HB3  TYR  21           2HB      TYR  21  -6.156   9.068  -2.921
  133    HD1  TYR  21           2HD      TYR  21  -4.709   7.437  -1.750
  134    HD2  TYR  21           1HD      TYR  21  -8.027   9.268   0.185
  135    HE1  TYR  21           2HE      TYR  21  -4.638   5.707  -0.004
  136    HE2  TYR  21           1HE      TYR  21  -7.964   7.543   1.938
  137    HH   TYR  21           HH       TYR  21  -6.606   4.731   1.702
  138    H    ARG  22           H        ARG  22  -3.826  11.115   0.162
  139    HA   ARG  22           HA       ARG  22  -1.764   9.348  -0.965
  140    HB2  ARG  22           1HB      ARG  22  -0.157  11.131   0.141
  141    HB3  ARG  22           2HB      ARG  22  -0.756  11.337  -1.499
  142    HG2  ARG  22           1HG      ARG  22  -2.208  13.024  -0.903
  143    HG3  ARG  22           2HG      ARG  22  -2.273  12.512   0.785
  144    HD2  ARG  22           1HD      ARG  22  -0.969  14.418   0.901
  145    HD3  ARG  22           2HD      ARG  22   0.244  13.141   0.806
  146    HE   ARG  22           HE       ARG  22  -0.526  14.280  -1.734
  147   HH11  ARG  22          2HH1      ARG  22   1.659  14.427   0.972
  148   HH12  ARG  22          1HH1      ARG  22   2.898  15.260   0.093
  149   HH21  ARG  22          2HH2      ARG  22   1.098  15.376  -2.902
  150   HH22  ARG  22          1HH2      ARG  22   2.578  15.800  -2.110
  151    H    HIS  23           H        HIS  23  -2.272   7.724   0.506
  152    HA   HIS  23           HA       HIS  23  -1.310   8.221   3.223
  153    HB2  HIS  23           1HB      HIS  23  -3.954   6.907   2.565
  154    HB3  HIS  23           2HB      HIS  23  -3.207   6.898   4.159
  155    HD1  HIS  23           1HD      HIS  23  -5.139   9.039   1.824
  156    HD2  HIS  23           2HD      HIS  23  -3.249   9.391   5.506
  157    HE1  HIS  23           1HE      HIS  23  -5.969  11.203   2.801
  158    HE2  HIS  23           2HE      HIS  23  -4.746  11.436   4.991
  159    H    CYS  24           H        CYS  24   0.379   6.898   3.367
  160    HA   CYS  24           HA       CYS  24   0.935   4.679   1.833
  161    HB2  CYS  24           1HB      CYS  24   2.704   5.583   3.111
  162    HB3  CYS  24           2HB      CYS  24   1.800   5.442   4.615
  163    H    ASP  25           H        ASP  25  -0.506   3.082   1.539
  164    HA   ASP  25           HA       ASP  25  -1.626   1.783   3.935
  165    HB2  ASP  25           1HB      ASP  25  -3.311   2.792   2.418
  166    HB3  ASP  25           2HB      ASP  25  -2.730   1.756   1.118
  167    H    ALA  26           H        ALA  26   0.986   1.342   2.530
  168    HA   ALA  26           HA       ALA  26   0.779  -1.206   1.229
  169    HB1  ALA  26           1HB      ALA  26   2.783   0.790   1.584
  170    HB2  ALA  26           2HB      ALA  26   3.436  -0.772   2.082
  171    HB3  ALA  26           3HB      ALA  26   2.762  -0.574   0.465
  172    HA   PRO  27           HA       PRO  27   1.217  -4.028   4.561
  173    HB2  PRO  27           1HB      PRO  27   3.176  -5.721   3.745
  174    HB3  PRO  27           2HB      PRO  27   1.561  -5.703   3.026
  175    HG2  PRO  27           1HG      PRO  27   4.092  -4.451   2.032
  176    HG3  PRO  27           2HG      PRO  27   2.855  -5.343   1.128
  177    HD2  PRO  27           1HD      PRO  27   2.987  -2.638   1.135
  178    HD3  PRO  27           2HD      PRO  27   1.451  -3.519   1.003
  179    H    ILE  28           H        ILE  28   4.473  -3.139   3.394
  180    HA   ILE  28           HA       ILE  28   5.241  -2.601   6.178
  181    HB   ILE  28           HB       ILE  28   6.972  -4.097   4.205
  182   HG12  ILE  28          1HG1      ILE  28   5.071  -5.428   5.132
  183   HG13  ILE  28          2HG1      ILE  28   6.653  -6.041   5.601
  184   HG21  ILE  28          1HG2      ILE  28   8.141  -2.571   5.806
  185   HG22  ILE  28          2HG2      ILE  28   7.478  -3.540   7.121
  186   HG23  ILE  28          3HG2      ILE  28   8.582  -4.272   5.957
  187   HD11  ILE  28          1HD1      ILE  28   5.086  -4.207   7.375
  188   HD12  ILE  28          2HD1      ILE  28   4.844  -5.954   7.383
  189   HD13  ILE  28          3HD1      ILE  28   6.421  -5.280   7.795
  190    H    CYS  29           H        CYS  29   6.503  -0.834   6.475
  191    HA   CYS  29           HA       CYS  29   7.208   0.697   4.062
  192    HB2  CYS  29           1HB      CYS  29   5.591   1.548   5.989
  193    HB3  CYS  29           2HB      CYS  29   7.117   1.973   6.758
  194    H    LEU  30           H        LEU  30   9.216   1.765   3.954
  195    HA   LEU  30           HA       LEU  30  11.251   0.717   5.810
  196    HB2  LEU  30           1HB      LEU  30  11.649   1.432   2.911
  197    HB3  LEU  30           2HB      LEU  30  12.837   0.712   3.995
  198    HG   LEU  30           HG       LEU  30  10.312  -0.779   3.490
  199   HD11  LEU  30          1HD1      LEU  30  12.463  -1.349   1.585
  200   HD12  LEU  30          2HD1      LEU  30  11.640   0.188   1.325
  201   HD13  LEU  30          3HD1      LEU  30  10.715  -1.312   1.352
  202   HD21  LEU  30          1HD2      LEU  30  11.450  -2.384   4.513
  203   HD22  LEU  30          2HD2      LEU  30  12.772  -1.244   4.770
  204   HD23  LEU  30          3HD2      LEU  30  12.754  -2.266   3.331
  205    H    TYR  31           H        TYR  31  10.028   3.468   4.051
  206    HA   TYR  31           HA       TYR  31  12.105   5.283   4.392
  207    HB2  TYR  31           1HB      TYR  31   9.781   5.475   3.163
  208    HB3  TYR  31           2HB      TYR  31   9.272   6.202   4.683
  209    HD1  TYR  31           2HD      TYR  31  12.306   6.458   2.502
  210    HD2  TYR  31           1HD      TYR  31   9.214   8.499   4.595
  211    HE1  TYR  31           2HE      TYR  31  13.246   8.612   1.779
  212    HE2  TYR  31           1HE      TYR  31  10.145  10.659   3.877
  213    HH   TYR  31           HH       TYR  31  13.110  10.824   1.928
  214    H    GLU  32           H        GLU  32  13.116   5.697   6.243
  215    HA   GLU  32           HA       GLU  32  12.441   5.222   8.797
  216    HB2  GLU  32           1HB      GLU  32  13.945   7.567   7.658
  217    HB3  GLU  32           2HB      GLU  32  13.771   7.338   9.392
  218    HG2  GLU  32           1HG      GLU  32  15.869   6.438   8.756
  219    HG3  GLU  32           2HG      GLU  32  14.801   5.084   9.125
  220    H    GLN  33           H        GLN  33  11.526   8.155   7.017
  221    HA   GLN  33           HA       GLN  33  10.307   9.659   8.906
  222    HB2  GLN  33           1HB      GLN  33  10.411   9.844   6.259
  223    HB3  GLN  33           2HB      GLN  33   8.765   9.240   6.390
  224    HG2  GLN  33           1HG      GLN  33   8.339  11.460   6.458
  225    HG3  GLN  33           2HG      GLN  33   8.583  11.174   8.180
  226   HE21  GLN  33          1HE2      GLN  33   8.909  13.629   6.681
  227   HE22  GLN  33          2HE2      GLN  33  10.550  14.123   6.900
  228    H    GLY  34           H        GLY  34   8.549   7.187   7.017
  229    HA2  GLY  34           1HA      GLY  34   6.929   5.690   7.736
  230    HA3  GLY  34           2HA      GLY  34   7.128   6.309   9.369
  231    H    ARG  35           H        ARG  35   6.121   7.761   6.271
  232    HA   ARG  35           HA       ARG  35   3.436   8.165   7.169
  233    HB2  ARG  35           1HB      ARG  35   3.398  10.462   7.539
  234    HB3  ARG  35           2HB      ARG  35   4.891   9.969   8.327
  235    HG2  ARG  35           1HG      ARG  35   5.997  10.564   6.065
  236    HG3  ARG  35           2HG      ARG  35   4.510  11.469   5.773
  237    HD2  ARG  35           1HD      ARG  35   4.922  12.538   8.055
  238    HD3  ARG  35           2HD      ARG  35   6.546  11.861   7.947
  239    HE   ARG  35           HE       ARG  35   7.072  13.572   6.546
  240   HH11  ARG  35          2HH1      ARG  35   3.633  13.048   6.386
  241   HH12  ARG  35          1HH1      ARG  35   3.350  14.372   5.305
  242   HH21  ARG  35          2HH2      ARG  35   6.712  15.317   5.122
  243   HH22  ARG  35          1HH2      ARG  35   5.102  15.661   4.586
  244    H    ASP  36           H        ASP  36   2.489  10.052   5.565
  245    HA   ASP  36           HA       ASP  36   2.771   8.887   2.955
  246    HB2  ASP  36           1HB      ASP  36   1.071  10.618   2.308
  247    HB3  ASP  36           2HB      ASP  36   0.572   9.568   3.631
  248    H    SER  37           H        SER  37   5.217   9.874   3.652
  249    HA   SER  37           HA       SER  37   5.511  12.438   2.271
  250    HB2  SER  37           1HB      SER  37   7.666  12.605   3.268
  251    HB3  SER  37           2HB      SER  37   6.597  11.993   4.530
  252    HG   SER  37           HG       SER  37   8.250  10.621   4.639
  253    H    PHE  38           H        PHE  38   5.937  12.419   0.175
  254    HA   PHE  38           HA       PHE  38   7.701  10.327  -0.894
  255    HB2  PHE  38           1HB      PHE  38   5.315  11.332  -2.435
  256    HB3  PHE  38           2HB      PHE  38   6.312   9.918  -2.764
  257    HD1  PHE  38           1HD      PHE  38   3.697  11.306  -0.580
  258    HD2  PHE  38           2HD      PHE  38   5.886   7.833  -1.705
  259    HE1  PHE  38           1HE      PHE  38   2.105   9.903   0.664
  260    HE2  PHE  38           2HE      PHE  38   4.296   6.425  -0.463
  261    HZ   PHE  38           HZ       PHE  38   2.402   7.459   0.723
  262    H    GLU  39           H        GLU  39   8.745  10.910  -2.922
  263    HA   GLU  39           HA       GLU  39   9.224  13.804  -3.060
  264    HB2  GLU  39           1HB      GLU  39  11.068  11.949  -2.682
  265    HB3  GLU  39           2HB      GLU  39  10.982  11.819  -4.433
  266    HG2  GLU  39           1HG      GLU  39  12.714  13.325  -4.029
  267    HG3  GLU  39           2HG      GLU  39  11.342  14.333  -4.484
  268    H    ASP  40           H        ASP  40   9.625  14.746  -5.194
  269    HA   ASP  40           HA       ASP  40   7.596  14.648  -6.942
  270    HB2  ASP  40           1HB      ASP  40   9.863  16.021  -6.947
  271    HB3  ASP  40           2HB      ASP  40  10.308  14.840  -8.176
  272    H    GLU  41           H        GLU  41  10.352  12.444  -6.940
  273    HA   GLU  41           HA       GLU  41   8.844  10.398  -8.233
  274    HB2  GLU  41           1HB      GLU  41  10.283  10.190 -10.240
  275    HB3  GLU  41           2HB      GLU  41   9.334  11.670 -10.228
  276    HG2  GLU  41           1HG      GLU  41  12.085  11.768  -9.122
  277    HG3  GLU  41           2HG      GLU  41  11.891  11.653 -10.870
  278    H    GLY  42           H        GLY  42  10.205   8.428  -8.635
  279    HA2  GLY  42           1HA      GLY  42  12.399   7.382  -8.225
  280    HA3  GLY  42           2HA      GLY  42  12.506   8.378  -6.781
  281    H    ARG  43           H        ARG  43  12.967   6.058  -6.011
  282    HA   ARG  43           HA       ARG  43  11.050   4.088  -5.802
  283    HB2  ARG  43           1HB      ARG  43  12.261   3.272  -3.870
  284    HB3  ARG  43           2HB      ARG  43  13.403   3.851  -5.076
  285    HG2  ARG  43           1HG      ARG  43  13.568   5.982  -3.802
  286    HG3  ARG  43           2HG      ARG  43  12.563   5.251  -2.549
  287    HD2  ARG  43           1HD      ARG  43  14.798   4.970  -1.840
  288    HD3  ARG  43           2HD      ARG  43  14.274   3.396  -2.437
  289    HE   ARG  43           HE       ARG  43  15.446   4.531  -4.599
  290   HH11  ARG  43          2HH1      ARG  43  16.464   3.997  -1.313
  291   HH12  ARG  43          1HH1      ARG  43  18.141   3.843  -1.720
  292   HH21  ARG  43          2HH2      ARG  43  17.651   4.331  -5.148
  293   HH22  ARG  43          1HH2      ARG  43  18.815   4.034  -3.901
  294    H    TRP  44           H        TRP  44  11.529   6.916  -3.726
  295    HA   TRP  44           HA       TRP  44   9.245   6.208  -2.082
  296    HB2  TRP  44           1HB      TRP  44  10.835   8.773  -1.981
  297    HB3  TRP  44           2HB      TRP  44   9.841   8.066  -0.710
  298    HD1  TRP  44           HD       TRP  44  13.312   8.532  -1.440
  299    HE1  TRP  44           1HE      TRP  44  14.799   6.771  -0.295
  300    HE3  TRP  44           3HE      TRP  44   9.722   5.097  -0.238
  301    HZ2  TRP  44           2HZ      TRP  44  14.491   4.257   0.953
  302    HZ3  TRP  44           3HZ      TRP  44  10.401   3.041   0.930
  303    HH2  TRP  44           HH       TRP  44  12.736   2.631   1.512
  304    H    ARG  45           H        ARG  45   8.641   6.615  -4.817
  305    HA   ARG  45           HA       ARG  45   7.376   9.239  -4.960
  306    HB2  ARG  45           1HB      ARG  45   6.929   8.724  -7.273
  307    HB3  ARG  45           2HB      ARG  45   8.606   8.329  -6.920
  308    HG2  ARG  45           1HG      ARG  45   7.831   5.942  -6.589
  309    HG3  ARG  45           2HG      ARG  45   6.298   6.449  -7.301
  310    HD2  ARG  45           1HD      ARG  45   7.817   7.393  -9.199
  311    HD3  ARG  45           2HD      ARG  45   9.004   6.261  -8.553
  312    HE   ARG  45           HE       ARG  45   6.526   4.962  -8.978
  313   HH11  ARG  45          2HH1      ARG  45   9.275   6.249 -10.683
  314   HH12  ARG  45          1HH1      ARG  45   9.113   5.167 -12.026
  315   HH21  ARG  45          2HH2      ARG  45   6.303   3.532 -10.741
  316   HH22  ARG  45          1HH2      ARG  45   7.422   3.623 -12.059
  317    H    LEU  46           H        LEU  46   5.256   9.594  -4.687
  318    HA   LEU  46           HA       LEU  46   3.603   7.654  -3.501
  319    HB2  LEU  46           1HB      LEU  46   3.214   9.961  -3.057
  320    HB3  LEU  46           2HB      LEU  46   2.992  10.314  -4.769
  321    HG   LEU  46           HG       LEU  46   0.921   8.868  -4.671
  322   HD11  LEU  46          1HD1      LEU  46   1.170   7.583  -2.742
  323   HD12  LEU  46          2HD1      LEU  46  -0.045   8.782  -2.299
  324   HD13  LEU  46          3HD1      LEU  46   1.622   8.975  -1.758
  325   HD21  LEU  46          1HD2      LEU  46  -0.370  10.671  -3.388
  326   HD22  LEU  46          2HD2      LEU  46   0.560  11.172  -4.800
  327   HD23  LEU  46          3HD2      LEU  46   1.195  11.456  -3.179
  328    H    ILE  47           H        ILE  47   3.066   5.856  -4.587
  329    HA   ILE  47           HA       ILE  47   2.215   6.063  -7.380
  330    HB   ILE  47           HB       ILE  47   2.813   3.640  -5.681
  331   HG12  ILE  47          1HG1      ILE  47   4.298   4.956  -7.963
  332   HG13  ILE  47          2HG1      ILE  47   4.818   4.861  -6.284
  333   HG21  ILE  47          1HG2      ILE  47   2.774   2.672  -8.174
  334   HG22  ILE  47          2HG2      ILE  47   1.359   2.677  -7.123
  335   HG23  ILE  47          3HG2      ILE  47   1.558   3.939  -8.340
  336   HD11  ILE  47          1HD1      ILE  47   6.063   3.195  -7.216
  337   HD12  ILE  47          2HD1      ILE  47   4.641   2.282  -6.712
  338   HD13  ILE  47          3HD1      ILE  47   4.822   2.773  -8.396
  339    H    LEU  48           H        LEU  48   0.131   6.222  -7.839
  340    HA   LEU  48           HA       LEU  48  -1.854   5.515  -5.824
  341    HB2  LEU  48           1HB      LEU  48  -1.938   7.064  -8.390
  342    HB3  LEU  48           2HB      LEU  48  -3.418   6.538  -7.590
  343    HG   LEU  48           HG       LEU  48  -1.332   8.363  -6.396
  344   HD11  LEU  48          1HD1      LEU  48  -3.189   8.984  -8.314
  345   HD12  LEU  48          2HD1      LEU  48  -2.467  10.119  -7.173
  346   HD13  LEU  48          3HD1      LEU  48  -4.030   9.384  -6.815
  347   HD21  LEU  48          1HD2      LEU  48  -3.936   7.274  -5.362
  348   HD22  LEU  48          2HD2      LEU  48  -3.187   8.731  -4.707
  349   HD23  LEU  48          3HD2      LEU  48  -2.339   7.186  -4.619
  350    H    CYS  49           H        CYS  49  -3.450   3.995  -6.100
  351    HA   CYS  49           HA       CYS  49  -2.895   1.678  -7.497
  352    HB2  CYS  49           1HB      CYS  49  -4.488   1.679  -5.684
  353    HB3  CYS  49           2HB      CYS  49  -5.560   2.762  -6.568
  354    H    ALA  50           H        ALA  50  -3.866   0.705  -9.353
  355    HA   ALA  50           HA       ALA  50  -4.503   2.672 -11.436
  356    HB1  ALA  50           1HB      ALA  50  -4.146   0.277 -12.728
  357    HB2  ALA  50           2HB      ALA  50  -2.916   1.522 -12.508
  358    HB3  ALA  50           3HB      ALA  50  -3.011   0.169 -11.382
  359    H    THR  51           H        THR  51  -5.582  -0.452 -10.141
  360    HA   THR  51           HA       THR  51  -7.745  -0.936 -11.786
  361    HB   THR  51           HB       THR  51  -7.924  -1.465  -8.832
  362    HG1  THR  51           1HG      THR  51  -5.972  -2.312  -9.096
  363   HG21  THR  51          1HG2      THR  51  -8.688  -3.115 -11.244
  364   HG22  THR  51          2HG2      THR  51  -9.798  -2.121 -10.302
  365   HG23  THR  51          3HG2      THR  51  -9.011  -3.512  -9.557
  366    H    CYS  52           H        CYS  52  -8.053   0.480  -8.524
  367    HA   CYS  52           HA       CYS  52 -10.489   1.843  -9.431
  368    HB2  CYS  52           1HB      CYS  52 -11.131   1.990  -7.120
  369    HB3  CYS  52           2HB      CYS  52 -10.609   0.338  -7.431
  370    H    GLY  53           H        GLY  53  -7.374   2.396  -7.869
  371    HA2  GLY  53           1HA      GLY  53  -6.086   4.312  -7.827
  372    HA3  GLY  53           2HA      GLY  53  -7.301   5.099  -8.823
  373    H    SER  54           H        SER  54  -7.770   3.589  -5.663
  374    HA   SER  54           HA       SER  54  -8.474   6.247  -4.600
  375    HB2  SER  54           1HB      SER  54  -9.747   3.554  -4.135
  376    HB3  SER  54           2HB      SER  54  -9.990   4.901  -3.023
  377    HG   SER  54           HG       SER  54 -11.044   4.470  -5.515
  378    H    HIS  55           H        HIS  55  -5.922   4.622  -4.564
  379    HA   HIS  55           HA       HIS  55  -5.449   4.886  -1.685
  380    HB2  HIS  55           1HB      HIS  55  -4.944   2.446  -3.362
  381    HB3  HIS  55           2HB      HIS  55  -3.944   2.781  -1.951
  382    HD1  HIS  55           1HD      HIS  55  -4.835   2.011   0.242
  383    HD2  HIS  55           2HD      HIS  55  -7.785   2.178  -2.679
  384    HE1  HIS  55           1HE      HIS  55  -6.885   1.011   1.300
  385    HE2  HIS  55           2HE      HIS  55  -8.633   1.045  -0.514
  386    H    GLY  56           H        GLY  56  -3.113   4.975  -1.153
  387    HA2  GLY  56           1HA      GLY  56  -1.329   5.631  -3.359
  388    HA3  GLY  56           2HA      GLY  56  -1.721   6.955  -2.272
  389    H    THR  57           H        THR  57   0.582   4.777  -2.925
  390    HA   THR  57           HA       THR  57   1.722   5.005  -0.264
  391    HB   THR  57           HB       THR  57   0.363   2.782  -0.516
  392    HG1  THR  57           1HG      THR  57   1.510   2.705   1.273
  393   HG21  THR  57          1HG2      THR  57   2.848   1.545  -1.477
  394   HG22  THR  57          2HG2      THR  57   1.958   2.453  -2.700
  395   HG23  THR  57          3HG2      THR  57   1.169   1.138  -1.829
  396    H    HIS  58           H        HIS  58   4.003   4.159  -0.229
  397    HA   HIS  58           HA       HIS  58   5.468   5.284  -2.362
  398    HB2  HIS  58           1HB      HIS  58   6.570   3.328  -0.347
  399    HB3  HIS  58           2HB      HIS  58   7.425   4.622  -1.181
  400    HD2  HIS  58           2HD      HIS  58   7.415   7.040   0.110
  401    HE1  HIS  58           1HE      HIS  58   4.717   5.971   3.205
  402    HE2  HIS  58           2HE      HIS  58   6.225   7.768   2.288
  403    H    ARG  59           H        ARG  59   7.445   3.810  -3.196
  404    HA   ARG  59           HA       ARG  59   6.165   1.798  -4.847
  405    HB2  ARG  59           1HB      ARG  59   7.911   3.597  -5.575
  406    HB3  ARG  59           2HB      ARG  59   9.089   2.450  -4.950
  407    HG2  ARG  59           1HG      ARG  59   7.042   1.447  -6.850
  408    HG3  ARG  59           2HG      ARG  59   8.350   2.451  -7.480
  409    HD2  ARG  59           1HD      ARG  59   8.957   0.147  -5.673
  410    HD3  ARG  59           2HD      ARG  59   8.633  -0.133  -7.383
  411    HE   ARG  59           HE       ARG  59  10.977   1.092  -6.232
  412   HH11  ARG  59          2HH1      ARG  59   9.039   0.677  -9.094
  413   HH12  ARG  59          1HH1      ARG  59  10.335   1.046 -10.184
  414   HH21  ARG  59          2HH2      ARG  59  12.691   1.580  -7.656
  415   HH22  ARG  59          1HH2      ARG  59  12.412   1.559  -9.365
  416    H    ASP  60           H        ASP  60   9.287   1.815  -3.123
  417    HA   ASP  60           HA       ASP  60   9.530  -0.976  -3.015
  418    HB2  ASP  60           1HB      ASP  60  11.261   0.963  -2.557
  419    HB3  ASP  60           2HB      ASP  60  10.755   0.729  -0.886
  420    H    CYS  61           H        CYS  61   7.685   1.212  -1.110
  421    HA   CYS  61           HA       CYS  61   7.465  -0.358   1.246
  422    HB2  CYS  61           1HB      CYS  61   6.955   2.073   1.145
  423    HB3  CYS  61           2HB      CYS  61   5.533   1.708   0.172
  424    H    SER  62           H        SER  62   5.640  -0.187  -1.756
  425    HA   SER  62           HA       SER  62   3.615  -2.025  -0.820
  426    HB2  SER  62           1HB      SER  62   2.951  -0.293  -2.386
  427    HB3  SER  62           2HB      SER  62   4.148  -0.846  -3.558
  428    HG   SER  62           HG       SER  62   2.983  -2.833  -3.654
  429    H    SER  63           H        SER  63   6.532  -2.777  -1.023
  430    HA   SER  63           HA       SER  63   7.858  -4.483  -1.787
  431    HB2  SER  63           1HB      SER  63   5.898  -5.500  -0.325
  432    HB3  SER  63           2HB      SER  63   5.443  -6.246  -1.857
  433    HG   SER  63           HG       SER  63   7.922  -6.723  -1.791
  434    H    LEU  64           H        LEU  64   6.955  -2.886  -3.897
  435    HA   LEU  64           HA       LEU  64   6.078  -4.667  -6.018
  436    HB2  LEU  64           1HB      LEU  64   6.776  -1.735  -6.042
  437    HB3  LEU  64           2HB      LEU  64   6.142  -2.635  -7.418
  438    HG   LEU  64           HG       LEU  64   4.608  -2.427  -4.845
  439   HD11  LEU  64          1HD1      LEU  64   4.642  -0.472  -7.136
  440   HD12  LEU  64          2HD1      LEU  64   5.037  -0.151  -5.448
  441   HD13  LEU  64          3HD1      LEU  64   3.380  -0.543  -5.906
  442   HD21  LEU  64          1HD2      LEU  64   4.232  -3.775  -7.284
  443   HD22  LEU  64          2HD2      LEU  64   3.080  -2.439  -7.267
  444   HD23  LEU  64          3HD2      LEU  64   3.091  -3.612  -5.949
  445    H    ARG  65           H        ARG  65   7.293  -4.256  -8.206
  446    HA   ARG  65           HA       ARG  65  10.123  -4.828  -7.677
  447    HB2  ARG  65           1HB      ARG  65   8.190  -5.658  -9.789
  448    HB3  ARG  65           2HB      ARG  65   9.889  -5.540 -10.227
  449    HG2  ARG  65           1HG      ARG  65  10.378  -7.041  -8.261
  450    HG3  ARG  65           2HG      ARG  65   8.637  -7.306  -8.146
  451    HD2  ARG  65           1HD      ARG  65   9.364  -9.092  -9.445
  452    HD3  ARG  65           2HD      ARG  65   8.788  -7.930 -10.640
  453    HE   ARG  65           HE       ARG  65  11.435  -7.363 -10.401
  454   HH11  ARG  65          2HH1      ARG  65   9.619 -10.254 -11.082
  455   HH12  ARG  65          1HH1      ARG  65  10.860 -10.958 -12.065
  456   HH21  ARG  65          2HH2      ARG  65  13.076  -8.279 -11.693
  457   HH22  ARG  65          1HH2      ARG  65  12.826  -9.834 -12.412
  458    HA   PRO  66           HA       PRO  66  11.584  -1.193  -9.651
  459    HB2  PRO  66           1HB      PRO  66  13.734  -2.101 -11.037
  460    HB3  PRO  66           2HB      PRO  66  13.717  -1.959  -9.276
  461    HG2  PRO  66           1HG      PRO  66  13.290  -4.379 -10.985
  462    HG3  PRO  66           2HG      PRO  66  14.238  -4.214  -9.495
  463    HD2  PRO  66           1HD      PRO  66  11.752  -5.286  -9.529
  464    HD3  PRO  66           2HD      PRO  66  12.376  -4.367  -8.145
  465    H    ASN  67           H        ASN  67  10.149  -3.634 -11.398
  466    HA   ASN  67           HA       ASN  67  10.398  -2.153 -13.932
  467    HB2  ASN  67           1HB      ASN  67   9.562  -4.351 -14.949
  468    HB3  ASN  67           2HB      ASN  67  11.210  -4.334 -14.328
  469   HD21  ASN  67          1HD2      ASN  67   7.921  -5.345 -13.674
  470   HD22  ASN  67          2HD2      ASN  67   8.328  -6.594 -12.551
  471    H    SER  68           H        SER  68   8.240  -3.345 -11.508
  472    HA   SER  68           HA       SER  68   5.815  -3.284 -12.912
  473    HB2  SER  68           1HB      SER  68   6.341  -4.156 -10.521
  474    HB3  SER  68           2HB      SER  68   6.008  -2.499 -10.015
  475    HG   SER  68           HG       SER  68   4.003  -2.943 -11.449
  476    H    LYS  69           H        LYS  69   4.990  -1.620 -13.976
  477    HA   LYS  69           HA       LYS  69   5.639   1.105 -13.207
  478    HB2  LYS  69           1HB      LYS  69   4.725   1.768 -15.293
  479    HB3  LYS  69           2HB      LYS  69   5.619   0.285 -15.602
  480    HG2  LYS  69           1HG      LYS  69   3.723  -0.180 -16.757
  481    HG3  LYS  69           2HG      LYS  69   3.246  -0.804 -15.176
  482    HD2  LYS  69           1HD      LYS  69   2.053   1.233 -14.682
  483    HD3  LYS  69           2HD      LYS  69   2.633   1.977 -16.175
  484    HE2  LYS  69           1HE      LYS  69   1.033  -0.562 -16.204
  485    HE3  LYS  69           2HE      LYS  69   0.250   1.016 -16.140
  486    HZ1  LYS  69           1HZ      LYS  69   1.678   1.551 -18.164
  487    HZ2  LYS  69           2HZ      LYS  69   0.360   0.515 -18.393
  488    HZ3  LYS  69           3HZ      LYS  69   1.926  -0.118 -18.291
  489    H    LYS  70           H        LYS  70   2.869  -1.056 -13.275
  490    HA   LYS  70           HA       LYS  70   1.251   1.039 -11.983
  491    HB2  LYS  70           1HB      LYS  70  -0.723  -0.192 -12.749
  492    HB3  LYS  70           2HB      LYS  70   0.310   0.253 -14.100
  493    HG2  LYS  70           1HG      LYS  70   1.155  -1.984 -14.269
  494    HG3  LYS  70           2HG      LYS  70   0.303  -2.461 -12.798
  495    HD2  LYS  70           1HD      LYS  70  -1.270  -1.318 -15.056
  496    HD3  LYS  70           2HD      LYS  70  -0.690  -2.980 -15.185
  497    HE2  LYS  70           1HE      LYS  70  -2.155  -2.018 -12.750
  498    HE3  LYS  70           2HE      LYS  70  -3.022  -2.574 -14.181
  499    HZ1  LYS  70           1HZ      LYS  70  -2.172  -4.158 -12.172
  500    HZ2  LYS  70           2HZ      LYS  70  -0.936  -4.359 -13.309
  501    HZ3  LYS  70           3HZ      LYS  70  -2.539  -4.694 -13.734
  502    H    TRP  71           H        TRP  71   0.209   0.612 -10.070
  503    HA   TRP  71           HA       TRP  71   0.788  -1.991  -8.816
  504    HB2  TRP  71           1HB      TRP  71   2.200  -0.583  -7.621
  505    HB3  TRP  71           2HB      TRP  71   1.098   0.786  -7.736
  506    HD1  TRP  71           HD       TRP  71   1.345  -2.610  -5.884
  507    HE1  TRP  71           1HE      TRP  71   0.156  -2.363  -3.614
  508    HE3  TRP  71           3HE      TRP  71  -0.435   2.153  -6.414
  509    HZ2  TRP  71           2HZ      TRP  71  -1.340  -0.408  -2.232
  510    HZ3  TRP  71           3HZ      TRP  71  -1.736   3.138  -4.572
  511    HH2  TRP  71           HH       TRP  71  -2.178   1.882  -2.526
  512    H    GLU  72           H        GLU  72  -0.744  -2.721  -7.240
  513    HA   GLU  72           HA       GLU  72  -3.411  -1.510  -7.570
  514    HB2  GLU  72           1HB      GLU  72  -2.679  -4.425  -7.244
  515    HB3  GLU  72           2HB      GLU  72  -4.324  -3.804  -7.227
  516    HG2  GLU  72           1HG      GLU  72  -4.358  -3.427  -9.469
  517    HG3  GLU  72           2HG      GLU  72  -2.622  -3.136  -9.560
  518    H    CYS  73           H        CYS  73  -4.518  -0.992  -5.780
  519    HA   CYS  73           HA       CYS  73  -3.241  -0.926  -3.271
  520    HB2  CYS  73           1HB      CYS  73  -5.234   0.053  -2.436
  521    HB3  CYS  73           2HB      CYS  73  -5.095   0.600  -4.104
  522    H    ASN  74           H        ASN  74  -4.331  -1.815  -1.243
  523    HA   ASN  74           HA       ASN  74  -4.192  -4.614  -1.281
  524    HB2  ASN  74           1HB      ASN  74  -3.726  -3.412   0.754
  525    HB3  ASN  74           2HB      ASN  74  -5.348  -2.724   0.777
  526   HD21  ASN  74          1HD2      ASN  74  -4.526  -3.940   2.991
  527   HD22  ASN  74          2HD2      ASN  74  -5.305  -5.469   3.194
  528    H    GLU  75           H        GLU  75  -7.044  -2.523  -0.803
  529    HA   GLU  75           HA       GLU  75  -9.025  -4.379  -0.632
  530    HB2  GLU  75           1HB      GLU  75  -9.373  -1.934  -0.505
  531    HB3  GLU  75           2HB      GLU  75  -9.172  -1.828  -2.248
  532    HG2  GLU  75           1HG      GLU  75 -11.340  -3.366  -0.838
  533    HG3  GLU  75           2HG      GLU  75 -11.523  -1.771  -1.566
  534    H    CYS  76           H        CYS  76  -7.369  -3.322  -3.554
  535    HA   CYS  76           HA       CYS  76  -9.054  -4.871  -5.301
  536    HB2  CYS  76           1HB      CYS  76  -6.472  -3.367  -5.745
  537    HB3  CYS  76           2HB      CYS  76  -7.307  -4.245  -7.023
  538    H    LEU  77           H        LEU  77  -5.674  -5.096  -4.204
  539    HA   LEU  77           HA       LEU  77  -4.798  -7.315  -5.489
  540    HB2  LEU  77           1HB      LEU  77  -4.368  -6.363  -2.687
  541    HB3  LEU  77           2HB      LEU  77  -3.635  -7.870  -3.232
  542    HG   LEU  77           HG       LEU  77  -3.174  -5.168  -4.493
  543   HD11  LEU  77          1HD1      LEU  77  -1.833  -4.802  -2.753
  544   HD12  LEU  77          2HD1      LEU  77  -0.800  -6.068  -3.416
  545   HD13  LEU  77          3HD1      LEU  77  -1.991  -6.462  -2.178
  546   HD21  LEU  77          1HD2      LEU  77  -1.329  -6.331  -5.640
  547   HD22  LEU  77          2HD2      LEU  77  -2.911  -6.977  -6.077
  548   HD23  LEU  77          3HD2      LEU  77  -1.882  -7.855  -4.945
  549    HA   PRO  78           HA       PRO  78  -7.210 -10.802  -4.353
  550    HB2  PRO  78           1HB      PRO  78  -5.340 -12.770  -4.365
  551    HB3  PRO  78           2HB      PRO  78  -5.948 -12.014  -5.842
  552    HG2  PRO  78           1HG      PRO  78  -3.416 -11.471  -4.340
  553    HG3  PRO  78           2HG      PRO  78  -3.671 -11.613  -6.089
  554    HD2  PRO  78           1HD      PRO  78  -3.460  -9.221  -4.837
  555    HD3  PRO  78           2HD      PRO  78  -4.475  -9.460  -6.274
  556    H    ALA  79           H        ALA  79  -5.143  -9.372  -2.257
  557    HA   ALA  79           HA       ALA  79  -4.354 -10.936  -0.253
  558    HB1  ALA  79           1HB      ALA  79  -5.258  -9.170   1.354
  559    HB2  ALA  79           2HB      ALA  79  -4.159  -8.627   0.086
  560    HB3  ALA  79           3HB      ALA  79  -5.895  -8.366  -0.081
  561    H    SER  80           H        SER  80  -5.159 -12.211   1.350
  562    HA   SER  80           HA       SER  80  -7.834 -13.208   1.009
  563    HB2  SER  80           1HB      SER  80  -5.932 -14.698   1.571
  564    HB3  SER  80           2HB      SER  80  -5.787 -13.893   3.133
  565    HG   SER  80           HG       SER  80  -8.242 -15.012   2.340
  566    H    GLY  81           H        GLY  81  -9.563 -13.032   2.400
  567    HA2  GLY  81           1HA      GLY  81 -10.867 -12.188   4.102
  568    HA3  GLY  81           2HA      GLY  81  -9.389 -11.756   4.948
  569    HA   PRO  82           HA       PRO  82 -11.596  -8.063   2.778
  570    HB2  PRO  82           1HB      PRO  82 -13.340  -7.277   4.705
  571    HB3  PRO  82           2HB      PRO  82 -13.779  -8.399   3.412
  572    HG2  PRO  82           1HG      PRO  82 -13.004  -8.982   6.244
  573    HG3  PRO  82           2HG      PRO  82 -14.302  -9.696   5.270
  574    HD2  PRO  82           1HD      PRO  82 -11.932 -10.941   5.676
  575    HD3  PRO  82           2HD      PRO  82 -12.865 -11.129   4.178
  576    H    SER  83           H        SER  83  -9.601  -7.053   3.085
  577    HA   SER  83           HA       SER  83  -8.410  -6.374   5.497
  578    HB2  SER  83           1HB      SER  83  -7.227  -4.598   4.193
  579    HB3  SER  83           2HB      SER  83  -7.192  -6.180   3.415
  580    HG   SER  83           HG       SER  83  -8.940  -4.030   2.791
  581    H    SER  84           H        SER  84  -9.041  -5.097   7.092
  582    HA   SER  84           HA       SER  84 -10.753  -2.784   6.458
  583    HB2  SER  84           1HB      SER  84 -10.960  -4.675   8.811
  584    HB3  SER  84           2HB      SER  84 -11.826  -3.143   8.704
  585    HG   SER  84           HG       SER  84 -13.269  -4.261   7.674
  586    H    GLY  85           H        GLY  85  -9.990  -0.882   7.117
  587    HA2  GLY  85           1HA      GLY  85  -8.873   0.684   8.402
  588    HA3  GLY  85           2HA      GLY  85  -8.477  -0.592   9.544
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1 -35.227  34.460  -0.367
    2    HA2  GLY   1           1HA      GLY   1 -33.398  32.370  -1.026
    3    HA3  GLY   1           2HA      GLY   1 -32.566  33.740  -0.306
    4    H    SER   2           H        SER   2 -32.204  31.663   1.137
    5    HA   SER   2           HA       SER   2 -33.642  32.164   3.559
    6    HB2  SER   2           1HB      SER   2 -35.043  30.496   2.063
    7    HB3  SER   2           2HB      SER   2 -33.879  29.317   2.668
    8    HG   SER   2           HG       SER   2 -35.717  29.470   4.019
    9    H    SER   3           H        SER   3 -32.978  30.328   5.224
   10    HA   SER   3           HA       SER   3 -30.361  29.207   4.746
   11    HB2  SER   3           1HB      SER   3 -29.329  30.416   6.689
   12    HB3  SER   3           2HB      SER   3 -29.674  31.450   5.303
   13    HG   SER   3           HG       SER   3 -30.654  32.611   6.768
   14    H    GLY   4           H        GLY   4 -29.531  28.100   6.776
   15    HA2  GLY   4           1HA      GLY   4 -31.746  27.271   8.531
   16    HA3  GLY   4           2HA      GLY   4 -30.797  26.054   7.690
   17    H    SER   5           H        SER   5 -30.136  25.129   9.658
   18    HA   SER   5           HA       SER   5 -27.693  26.109  10.673
   19    HB2  SER   5           1HB      SER   5 -29.445  27.636  11.792
   20    HB3  SER   5           2HB      SER   5 -29.885  26.214  12.738
   21    HG   SER   5           HG       SER   5 -27.779  27.877  13.033
   22    H    SER   6           H        SER   6 -26.811  24.728  12.386
   23    HA   SER   6           HA       SER   6 -28.138  22.099  12.488
   24    HB2  SER   6           1HB      SER   6 -26.038  22.316  10.999
   25    HB3  SER   6           2HB      SER   6 -25.144  22.424  12.515
   26    HG   SER   6           HG       SER   6 -26.957  20.322  11.967
   27    H    GLY   7           H        GLY   7 -27.224  20.710  14.308
   28    HA2  GLY   7           1HA      GLY   7 -26.818  22.417  16.687
   29    HA3  GLY   7           2HA      GLY   7 -27.791  20.954  16.703
   30    H    GLU   8           H        GLU   8 -26.802  18.957  16.838
   31    HA   GLU   8           HA       GLU   8 -24.219  18.936  18.050
   32    HB2  GLU   8           1HB      GLU   8 -24.516  16.506  18.161
   33    HB3  GLU   8           2HB      GLU   8 -25.951  17.351  18.725
   34    HG2  GLU   8           1HG      GLU   8 -26.613  15.485  17.380
   35    HG3  GLU   8           2HG      GLU   8 -26.998  16.977  16.524
   36    H    LEU   9           H        LEU   9 -22.419  17.572  17.312
   37    HA   LEU   9           HA       LEU   9 -22.269  17.032  14.465
   38    HB2  LEU   9           1HB      LEU   9 -20.552  19.081  15.842
   39    HB3  LEU   9           2HB      LEU   9 -20.097  18.320  14.319
   40    HG   LEU   9           HG       LEU   9 -22.642  19.891  14.675
   41   HD11  LEU   9          1HD1      LEU   9 -19.882  20.810  14.341
   42   HD12  LEU   9          2HD1      LEU   9 -21.314  21.681  14.887
   43   HD13  LEU   9          3HD1      LEU   9 -21.020  21.462  13.162
   44   HD21  LEU   9          1HD2      LEU   9 -21.098  19.165  12.191
   45   HD22  LEU   9          2HD2      LEU   9 -22.682  19.936  12.281
   46   HD23  LEU   9          3HD2      LEU   9 -22.486  18.260  12.799
   47    H    GLU  10           H        GLU  10 -19.911  16.238  13.964
   48    HA   GLU  10           HA       GLU  10 -19.313  14.221  15.992
   49    HB2  GLU  10           1HB      GLU  10 -18.708  14.484  13.063
   50    HB3  GLU  10           2HB      GLU  10 -17.801  13.357  14.062
   51    HG2  GLU  10           1HG      GLU  10 -20.798  13.339  13.936
   52    HG3  GLU  10           2HG      GLU  10 -19.793  12.434  12.806
   53    HA   PRO  11           HA       PRO  11 -15.715  16.398  17.345
   54    HB2  PRO  11           1HB      PRO  11 -14.533  14.349  18.676
   55    HB3  PRO  11           2HB      PRO  11 -15.938  15.218  19.304
   56    HG2  PRO  11           1HG      PRO  11 -15.818  12.585  17.884
   57    HG3  PRO  11           2HG      PRO  11 -16.770  13.047  19.308
   58    HD2  PRO  11           1HD      PRO  11 -17.834  12.929  16.821
   59    HD3  PRO  11           2HD      PRO  11 -18.390  14.090  18.044
   60    H    GLY  12           H        GLY  12 -13.318  16.174  17.271
   61    HA2  GLY  12           1HA      GLY  12 -11.491  16.075  15.854
   62    HA3  GLY  12           2HA      GLY  12 -11.788  14.349  15.994
   63    H    ALA  13           H        ALA  13 -13.582  16.935  14.334
   64    HA   ALA  13           HA       ALA  13 -13.812  15.258  11.980
   65    HB1  ALA  13           1HB      ALA  13 -15.145  17.664  13.014
   66    HB2  ALA  13           2HB      ALA  13 -14.975  17.594  11.260
   67    HB3  ALA  13           3HB      ALA  13 -15.802  16.295  12.119
   68    H    PHE  14           H        PHE  14 -11.198  15.742  12.276
   69    HA   PHE  14           HA       PHE  14 -10.071  18.036  11.240
   70    HB2  PHE  14           1HB      PHE  14  -9.234  15.165  11.262
   71    HB3  PHE  14           2HB      PHE  14  -8.290  16.321  10.328
   72    HD1  PHE  14           1HD      PHE  14  -9.877  16.193  13.707
   73    HD2  PHE  14           2HD      PHE  14  -6.433  17.126  11.388
   74    HE1  PHE  14           1HE      PHE  14  -8.686  16.863  15.753
   75    HE2  PHE  14           2HE      PHE  14  -5.235  17.797  13.430
   76    HZ   PHE  14           HZ       PHE  14  -6.361  17.664  15.616
   77    H    SER  15           H        SER  15  -9.224  18.545   9.140
   78    HA   SER  15           HA       SER  15 -11.115  18.000   7.049
   79    HB2  SER  15           1HB      SER  15  -8.519  19.558   6.992
   80    HB3  SER  15           2HB      SER  15  -9.723  19.536   5.704
   81    HG   SER  15           HG       SER  15  -9.795  21.325   7.310
   82    H    GLU  16           H        GLU  16 -11.021  16.426   5.597
   83    HA   GLU  16           HA       GLU  16  -8.411  15.186   5.028
   84    HB2  GLU  16           1HB      GLU  16  -9.462  13.010   4.903
   85    HB3  GLU  16           2HB      GLU  16  -9.800  13.731   6.471
   86    HG2  GLU  16           1HG      GLU  16 -12.028  14.335   5.751
   87    HG3  GLU  16           2HG      GLU  16 -11.698  13.713   4.135
   88    H    LEU  17           H        LEU  17  -8.498  13.869   2.951
   89    HA   LEU  17           HA       LEU  17  -9.883  15.474   0.920
   90    HB2  LEU  17           1HB      LEU  17  -7.521  13.618   0.662
   91    HB3  LEU  17           2HB      LEU  17  -8.237  14.547  -0.653
   92    HG   LEU  17           HG       LEU  17  -7.157  15.951   1.759
   93   HD11  LEU  17          1HD1      LEU  17  -5.490  15.200  -0.631
   94   HD12  LEU  17          2HD1      LEU  17  -5.431  14.347   0.911
   95   HD13  LEU  17          3HD1      LEU  17  -4.972  16.048   0.826
   96   HD21  LEU  17          1HD2      LEU  17  -7.945  16.612  -1.017
   97   HD22  LEU  17          2HD2      LEU  17  -6.568  17.485  -0.344
   98   HD23  LEU  17          3HD2      LEU  17  -8.131  17.542   0.470
   99    H    TYR  18           H        TYR  18 -10.835  14.414  -0.912
  100    HA   TYR  18           HA       TYR  18 -11.772  11.690  -0.290
  101    HB2  TYR  18           1HB      TYR  18 -13.716  12.940  -0.195
  102    HB3  TYR  18           2HB      TYR  18 -13.171  14.079  -1.420
  103    HD1  TYR  18           1HD      TYR  18 -13.892  10.412  -1.186
  104    HD2  TYR  18           2HD      TYR  18 -14.303  14.010  -3.420
  105    HE1  TYR  18           1HE      TYR  18 -15.199   9.202  -2.882
  106    HE2  TYR  18           2HE      TYR  18 -15.612  12.810  -5.122
  107    HH   TYR  18           HH       TYR  18 -15.707  10.199  -5.867
  108    H    GLN  19           H        GLN  19 -11.258  13.897  -3.044
  109    HA   GLN  19           HA       GLN  19 -11.099  11.758  -4.933
  110    HB2  GLN  19           1HB      GLN  19 -10.778  14.713  -5.006
  111    HB3  GLN  19           2HB      GLN  19 -10.036  13.788  -6.305
  112    HG2  GLN  19           1HG      GLN  19 -12.073  13.007  -7.088
  113    HG3  GLN  19           2HG      GLN  19 -12.897  13.343  -5.566
  114   HE21  GLN  19          1HE2      GLN  19 -14.322  14.236  -7.429
  115   HE22  GLN  19          2HE2      GLN  19 -14.128  15.923  -7.747
  116    H    ARG  20           H        ARG  20  -8.695  14.000  -3.564
  117    HA   ARG  20           HA       ARG  20  -6.527  12.440  -4.705
  118    HB2  ARG  20           1HB      ARG  20  -6.769  15.075  -3.336
  119    HB3  ARG  20           2HB      ARG  20  -5.218  14.250  -3.259
  120    HG2  ARG  20           1HG      ARG  20  -4.897  15.480  -5.139
  121    HG3  ARG  20           2HG      ARG  20  -5.606  14.035  -5.863
  122    HD2  ARG  20           1HD      ARG  20  -7.855  15.234  -5.563
  123    HD3  ARG  20           2HD      ARG  20  -6.892  16.690  -5.313
  124    HE   ARG  20           HE       ARG  20  -7.309  15.279  -7.799
  125   HH11  ARG  20          2HH1      ARG  20  -5.352  17.569  -6.053
  126   HH12  ARG  20          1HH1      ARG  20  -4.731  18.325  -7.482
  127   HH21  ARG  20          2HH2      ARG  20  -6.498  16.267  -9.688
  128   HH22  ARG  20          1HH2      ARG  20  -5.384  17.584  -9.549
  129    H    TYR  21           H        TYR  21  -5.989  10.622  -3.688
  130    HA   TYR  21           HA       TYR  21  -6.008  10.595  -0.744
  131    HB2  TYR  21           1HB      TYR  21  -7.483   8.930  -1.785
  132    HB3  TYR  21           2HB      TYR  21  -6.119   8.273  -2.682
  133    HD1  TYR  21           2HD      TYR  21  -4.102   7.454  -1.216
  134    HD2  TYR  21           1HD      TYR  21  -8.066   7.969   0.241
  135    HE1  TYR  21           2HE      TYR  21  -3.611   5.922   0.644
  136    HE2  TYR  21           1HE      TYR  21  -7.586   6.439   2.106
  137    HH   TYR  21           HH       TYR  21  -6.088   5.114   3.061
  138    H    ARG  22           H        ARG  22  -4.052  10.989   0.053
  139    HA   ARG  22           HA       ARG  22  -1.760   9.568  -1.124
  140    HB2  ARG  22           1HB      ARG  22  -0.413  11.640  -0.357
  141    HB3  ARG  22           2HB      ARG  22  -1.332  11.738  -1.853
  142    HG2  ARG  22           1HG      ARG  22  -2.995  13.069  -0.878
  143    HG3  ARG  22           2HG      ARG  22  -2.461  12.681   0.759
  144    HD2  ARG  22           1HD      ARG  22  -0.248  13.809   0.059
  145    HD3  ARG  22           2HD      ARG  22  -1.194  14.496  -1.262
  146    HE   ARG  22           HE       ARG  22  -2.618  15.020   1.037
  147   HH11  ARG  22          2HH1      ARG  22   0.549  15.761  -0.206
  148   HH12  ARG  22          1HH1      ARG  22   0.672  17.266   0.642
  149   HH21  ARG  22          2HH2      ARG  22  -2.467  17.000   2.159
  150   HH22  ARG  22          1HH2      ARG  22  -1.043  17.970   1.988
  151    H    HIS  23           H        HIS  23  -2.216   8.010   0.569
  152    HA   HIS  23           HA       HIS  23  -0.888   8.755   3.062
  153    HB2  HIS  23           1HB      HIS  23  -3.201   9.027   3.647
  154    HB3  HIS  23           2HB      HIS  23  -3.628   7.494   2.891
  155    HD1  HIS  23           1HD      HIS  23  -1.795   8.861   5.897
  156    HD2  HIS  23           2HD      HIS  23  -3.415   5.292   4.518
  157    HE1  HIS  23           1HE      HIS  23  -1.690   7.277   7.847
  158    HE2  HIS  23           2HE      HIS  23  -2.597   5.099   6.964
  159    H    CYS  24           H        CYS  24   0.741   7.384   3.282
  160    HA   CYS  24           HA       CYS  24   1.162   5.065   1.844
  161    HB2  CYS  24           1HB      CYS  24   3.053   5.947   2.900
  162    HB3  CYS  24           2HB      CYS  24   2.248   6.056   4.462
  163    H    ASP  25           H        ASP  25   0.042   3.243   1.804
  164    HA   ASP  25           HA       ASP  25  -0.923   2.119   4.342
  165    HB2  ASP  25           1HB      ASP  25  -2.741   3.281   2.927
  166    HB3  ASP  25           2HB      ASP  25  -2.556   1.922   1.821
  167    H    ALA  26           H        ALA  26   1.442   1.484   2.876
  168    HA   ALA  26           HA       ALA  26   0.920  -0.970   1.432
  169    HB1  ALA  26           1HB      ALA  26   3.678  -0.719   1.987
  170    HB2  ALA  26           2HB      ALA  26   2.839  -0.428   0.462
  171    HB3  ALA  26           3HB      ALA  26   3.070   0.893   1.608
  172    HA   PRO  27           HA       PRO  27   1.575  -3.924   4.612
  173    HB2  PRO  27           1HB      PRO  27   3.355  -5.676   3.549
  174    HB3  PRO  27           2HB      PRO  27   1.677  -5.561   3.004
  175    HG2  PRO  27           1HG      PRO  27   4.150  -4.393   1.786
  176    HG3  PRO  27           2HG      PRO  27   2.785  -5.198   0.991
  177    HD2  PRO  27           1HD      PRO  27   3.048  -2.504   1.061
  178    HD3  PRO  27           2HD      PRO  27   1.466  -3.309   1.065
  179    H    ILE  28           H        ILE  28   4.674  -2.942   3.159
  180    HA   ILE  28           HA       ILE  28   5.779  -2.687   5.867
  181    HB   ILE  28           HB       ILE  28   7.231  -3.981   3.556
  182   HG12  ILE  28          1HG1      ILE  28   5.480  -5.392   4.668
  183   HG13  ILE  28          2HG1      ILE  28   7.114  -6.032   4.806
  184   HG21  ILE  28          1HG2      ILE  28   8.092  -3.232   6.335
  185   HG22  ILE  28          2HG2      ILE  28   8.937  -4.449   5.379
  186   HG23  ILE  28          3HG2      ILE  28   8.834  -2.787   4.798
  187   HD11  ILE  28          1HD1      ILE  28   5.905  -4.362   6.976
  188   HD12  ILE  28          2HD1      ILE  28   5.617  -6.099   6.869
  189   HD13  ILE  28          3HD1      ILE  28   7.260  -5.487   7.064
  190    H    CYS  29           H        CYS  29   6.969  -0.895   6.194
  191    HA   CYS  29           HA       CYS  29   7.606   0.758   3.838
  192    HB2  CYS  29           1HB      CYS  29   5.793   1.500   5.606
  193    HB3  CYS  29           2HB      CYS  29   7.208   1.977   6.539
  194    H    LEU  30           H        LEU  30   9.691   1.139   3.517
  195    HA   LEU  30           HA       LEU  30  11.590   0.513   5.647
  196    HB2  LEU  30           1HB      LEU  30  12.272   1.234   2.815
  197    HB3  LEU  30           2HB      LEU  30  13.242   0.335   3.980
  198    HG   LEU  30           HG       LEU  30  10.659  -0.854   3.112
  199   HD11  LEU  30          1HD1      LEU  30  12.124  -1.929   1.232
  200   HD12  LEU  30          2HD1      LEU  30  13.026  -0.419   1.355
  201   HD13  LEU  30          3HD1      LEU  30  11.308  -0.389   0.961
  202   HD21  LEU  30          1HD2      LEU  30  12.960  -2.564   3.098
  203   HD22  LEU  30          2HD2      LEU  30  11.524  -2.631   4.120
  204   HD23  LEU  30          3HD2      LEU  30  12.904  -1.642   4.601
  205    H    TYR  31           H        TYR  31  10.350   3.189   3.815
  206    HA   TYR  31           HA       TYR  31  12.404   5.052   4.242
  207    HB2  TYR  31           1HB      TYR  31  10.294   5.193   2.730
  208    HB3  TYR  31           2HB      TYR  31   9.508   5.848   4.163
  209    HD1  TYR  31           2HD      TYR  31  12.789   6.351   2.429
  210    HD2  TYR  31           1HD      TYR  31   9.337   8.139   4.157
  211    HE1  TYR  31           2HE      TYR  31  13.682   8.579   1.892
  212    HE2  TYR  31           1HE      TYR  31  10.220  10.372   3.625
  213    HH   TYR  31           HH       TYR  31  13.168  11.101   3.073
  214    H    GLU  32           H        GLU  32  13.188   5.688   6.132
  215    HA   GLU  32           HA       GLU  32  12.324   5.246   8.637
  216    HB2  GLU  32           1HB      GLU  32  14.399   6.580   7.727
  217    HB3  GLU  32           2HB      GLU  32  13.395   7.981   8.069
  218    HG2  GLU  32           1HG      GLU  32  14.089   5.858  10.083
  219    HG3  GLU  32           2HG      GLU  32  14.956   7.382   9.896
  220    H    GLN  33           H        GLN  33  11.601   8.306   6.945
  221    HA   GLN  33           HA       GLN  33   9.832   9.343   8.809
  222    HB2  GLN  33           1HB      GLN  33  10.297   9.759   5.903
  223    HB3  GLN  33           2HB      GLN  33   8.798  10.387   6.574
  224    HG2  GLN  33           1HG      GLN  33   9.854  11.956   7.842
  225    HG3  GLN  33           2HG      GLN  33  11.327  11.001   7.997
  226   HE21  GLN  33          1HE2      GLN  33  12.310  13.110   7.515
  227   HE22  GLN  33          2HE2      GLN  33  12.530  13.553   5.860
  228    H    GLY  34           H        GLY  34   9.326   6.905   6.363
  229    HA2  GLY  34           1HA      GLY  34   7.378   5.842   5.655
  230    HA3  GLY  34           2HA      GLY  34   7.262   5.558   7.385
  231    H    ARG  35           H        ARG  35   6.930   8.658   5.729
  232    HA   ARG  35           HA       ARG  35   4.158   8.781   6.716
  233    HB2  ARG  35           1HB      ARG  35   4.387  11.094   7.028
  234    HB3  ARG  35           2HB      ARG  35   5.916  10.432   7.592
  235    HG2  ARG  35           1HG      ARG  35   6.773  10.927   5.225
  236    HG3  ARG  35           2HG      ARG  35   5.338  11.943   5.074
  237    HD2  ARG  35           1HD      ARG  35   7.348  12.193   7.304
  238    HD3  ARG  35           2HD      ARG  35   7.409  13.141   5.819
  239    HE   ARG  35           HE       ARG  35   5.520  14.324   6.515
  240   HH11  ARG  35          2HH1      ARG  35   6.399  11.840   8.790
  241   HH12  ARG  35          1HH1      ARG  35   5.413  12.476  10.065
  242   HH21  ARG  35          2HH2      ARG  35   4.219  15.172   8.186
  243   HH22  ARG  35          1HH2      ARG  35   4.173  14.371   9.720
  244    H    ASP  36           H        ASP  36   3.096  10.795   5.332
  245    HA   ASP  36           HA       ASP  36   2.731   9.649   2.721
  246    HB2  ASP  36           1HB      ASP  36   1.069  11.476   2.428
  247    HB3  ASP  36           2HB      ASP  36   0.801  10.527   3.888
  248    H    SER  37           H        SER  37   5.352  10.435   2.949
  249    HA   SER  37           HA       SER  37   5.514  12.893   1.338
  250    HB2  SER  37           1HB      SER  37   6.818  12.495   3.613
  251    HB3  SER  37           2HB      SER  37   7.945  11.651   2.552
  252    HG   SER  37           HG       SER  37   8.138  13.554   1.337
  253    H    PHE  38           H        PHE  38   6.552  12.900  -0.618
  254    HA   PHE  38           HA       PHE  38   7.942  10.545  -1.562
  255    HB2  PHE  38           1HB      PHE  38   5.509  11.483  -3.084
  256    HB3  PHE  38           2HB      PHE  38   6.505  10.070  -3.416
  257    HD1  PHE  38           1HD      PHE  38   4.185  11.525  -0.914
  258    HD2  PHE  38           2HD      PHE  38   5.972   7.999  -2.494
  259    HE1  PHE  38           1HE      PHE  38   2.680  10.149   0.463
  260    HE2  PHE  38           2HE      PHE  38   4.470   6.618  -1.119
  261    HZ   PHE  38           HZ       PHE  38   2.821   7.692   0.361
  262    H    GLU  39           H        GLU  39   9.084  10.897  -3.538
  263    HA   GLU  39           HA       GLU  39   9.629  13.736  -4.006
  264    HB2  GLU  39           1HB      GLU  39  11.397  11.835  -3.493
  265    HB3  GLU  39           2HB      GLU  39  11.270  11.560  -5.225
  266    HG2  GLU  39           1HG      GLU  39  13.118  13.094  -4.453
  267    HG3  GLU  39           2HG      GLU  39  12.075  13.701  -5.738
  268    H    ASP  40           H        ASP  40  10.353  14.198  -6.357
  269    HA   ASP  40           HA       ASP  40   8.182  14.138  -8.033
  270    HB2  ASP  40           1HB      ASP  40  10.495  15.386  -8.200
  271    HB3  ASP  40           2HB      ASP  40  10.916  14.033  -9.245
  272    H    GLU  41           H        GLU  41  10.860  11.825  -7.892
  273    HA   GLU  41           HA       GLU  41   9.236   9.687  -8.815
  274    HB2  GLU  41           1HB      GLU  41  10.287   9.245 -10.949
  275    HB3  GLU  41           2HB      GLU  41   9.593  10.860 -10.964
  276    HG2  GLU  41           1HG      GLU  41  11.884  11.733 -10.413
  277    HG3  GLU  41           2HG      GLU  41  12.489  10.104 -10.710
  278    H    GLY  42           H        GLY  42  10.649   7.695  -9.293
  279    HA2  GLY  42           1HA      GLY  42  13.004   6.872  -8.950
  280    HA3  GLY  42           2HA      GLY  42  12.945   7.761  -7.435
  281    H    ARG  43           H        ARG  43  12.713   6.464  -5.752
  282    HA   ARG  43           HA       ARG  43  11.116   4.012  -6.079
  283    HB2  ARG  43           1HB      ARG  43  12.415   3.119  -4.166
  284    HB3  ARG  43           2HB      ARG  43  13.422   3.516  -5.552
  285    HG2  ARG  43           1HG      ARG  43  14.224   5.495  -4.503
  286    HG3  ARG  43           2HG      ARG  43  13.047   5.346  -3.196
  287    HD2  ARG  43           1HD      ARG  43  14.869   4.468  -2.149
  288    HD3  ARG  43           2HD      ARG  43  14.236   3.000  -2.892
  289    HE   ARG  43           HE       ARG  43  16.149   4.431  -4.507
  290   HH11  ARG  43          2HH1      ARG  43  15.674   1.992  -2.069
  291   HH12  ARG  43          1HH1      ARG  43  17.169   1.182  -2.402
  292   HH21  ARG  43          2HH2      ARG  43  18.120   3.374  -4.956
  293   HH22  ARG  43          1HH2      ARG  43  18.560   1.970  -4.044
  294    H    TRP  44           H        TRP  44  11.616   6.885  -4.164
  295    HA   TRP  44           HA       TRP  44   9.508   6.084  -2.296
  296    HB2  TRP  44           1HB      TRP  44  11.263   8.546  -2.212
  297    HB3  TRP  44           2HB      TRP  44  10.214   7.953  -0.928
  298    HD1  TRP  44           HD       TRP  44  13.689   8.141  -1.538
  299    HE1  TRP  44           1HE      TRP  44  15.011   6.222  -0.444
  300    HE3  TRP  44           3HE      TRP  44   9.831   4.911  -0.632
  301    HZ2  TRP  44           2HZ      TRP  44  14.487   3.677   0.658
  302    HZ3  TRP  44           3HZ      TRP  44  10.327   2.755   0.445
  303    HH2  TRP  44           HH       TRP  44  12.607   2.152   1.075
  304    H    ARG  45           H        ARG  45   8.868   6.717  -5.039
  305    HA   ARG  45           HA       ARG  45   7.639   9.348  -4.961
  306    HB2  ARG  45           1HB      ARG  45   7.064   8.970  -7.267
  307    HB3  ARG  45           2HB      ARG  45   8.735   8.481  -7.024
  308    HG2  ARG  45           1HG      ARG  45   7.891   6.120  -6.789
  309    HG3  ARG  45           2HG      ARG  45   6.324   6.718  -7.340
  310    HD2  ARG  45           1HD      ARG  45   8.789   7.305  -8.925
  311    HD3  ARG  45           2HD      ARG  45   8.021   5.723  -9.052
  312    HE   ARG  45           HE       ARG  45   7.033   8.224 -10.086
  313   HH11  ARG  45          2HH1      ARG  45   6.217   4.986  -9.104
  314   HH12  ARG  45          1HH1      ARG  45   4.777   4.917 -10.065
  315   HH21  ARG  45          2HH2      ARG  45   5.140   8.146 -11.356
  316   HH22  ARG  45          1HH2      ARG  45   4.166   6.715 -11.346
  317    H    LEU  46           H        LEU  46   5.405   9.724  -5.151
  318    HA   LEU  46           HA       LEU  46   3.773   7.908  -3.682
  319    HB2  LEU  46           1HB      LEU  46   3.645  10.480  -3.830
  320    HB3  LEU  46           2HB      LEU  46   2.720  10.198  -5.304
  321    HG   LEU  46           HG       LEU  46   1.844   8.856  -2.791
  322   HD11  LEU  46          1HD1      LEU  46   0.373  11.117  -2.720
  323   HD12  LEU  46          2HD1      LEU  46   1.931  11.762  -3.233
  324   HD13  LEU  46          3HD1      LEU  46   1.809  10.840  -1.735
  325   HD21  LEU  46          1HD2      LEU  46   0.207   8.291  -4.180
  326   HD22  LEU  46          2HD2      LEU  46   0.836   9.354  -5.439
  327   HD23  LEU  46          3HD2      LEU  46  -0.275   9.987  -4.223
  328    H    ILE  47           H        ILE  47   3.072   6.066  -4.539
  329    HA   ILE  47           HA       ILE  47   2.243   6.038  -7.361
  330    HB   ILE  47           HB       ILE  47   2.928   3.720  -5.549
  331   HG12  ILE  47          1HG1      ILE  47   4.431   5.126  -7.753
  332   HG13  ILE  47          2HG1      ILE  47   4.947   4.846  -6.094
  333   HG21  ILE  47          1HG2      ILE  47   2.373   2.262  -7.212
  334   HG22  ILE  47          2HG2      ILE  47   1.191   3.530  -7.533
  335   HG23  ILE  47          3HG2      ILE  47   2.667   3.438  -8.494
  336   HD11  ILE  47          1HD1      ILE  47   4.601   2.741  -8.215
  337   HD12  ILE  47          2HD1      ILE  47   6.131   3.401  -7.637
  338   HD13  ILE  47          3HD1      ILE  47   5.112   2.455  -6.552
  339    H    LEU  48           H        LEU  48   0.136   6.190  -7.707
  340    HA   LEU  48           HA       LEU  48  -1.738   5.399  -5.608
  341    HB2  LEU  48           1HB      LEU  48  -2.038   7.009  -8.130
  342    HB3  LEU  48           2HB      LEU  48  -3.415   6.503  -7.154
  343    HG   LEU  48           HG       LEU  48  -1.170   8.157  -6.029
  344   HD11  LEU  48          1HD1      LEU  48  -1.851   9.701  -7.538
  345   HD12  LEU  48          2HD1      LEU  48  -3.113   9.958  -6.333
  346   HD13  LEU  48          3HD1      LEU  48  -3.438   8.960  -7.750
  347   HD21  LEU  48          1HD2      LEU  48  -3.850   7.242  -5.130
  348   HD22  LEU  48          2HD2      LEU  48  -3.300   8.838  -4.618
  349   HD23  LEU  48          3HD2      LEU  48  -2.346   7.407  -4.224
  350    H    CYS  49           H        CYS  49  -3.425   3.948  -5.946
  351    HA   CYS  49           HA       CYS  49  -2.883   1.668  -7.431
  352    HB2  CYS  49           1HB      CYS  49  -4.430   1.586  -5.585
  353    HB3  CYS  49           2HB      CYS  49  -5.517   2.718  -6.383
  354    H    ALA  50           H        ALA  50  -3.827   0.787  -9.321
  355    HA   ALA  50           HA       ALA  50  -4.540   2.831 -11.298
  356    HB1  ALA  50           1HB      ALA  50  -2.609   1.309 -11.733
  357    HB2  ALA  50           2HB      ALA  50  -3.753  -0.031 -11.811
  358    HB3  ALA  50           3HB      ALA  50  -3.854   1.283 -12.983
  359    H    THR  51           H        THR  51  -5.626  -0.272  -9.995
  360    HA   THR  51           HA       THR  51  -7.814  -0.721 -11.651
  361    HB   THR  51           HB       THR  51  -7.409  -1.432  -8.745
  362    HG1  THR  51           1HG      THR  51  -6.202  -2.350 -10.756
  363   HG21  THR  51          1HG2      THR  51  -9.644  -2.131 -10.632
  364   HG22  THR  51          2HG2      THR  51  -9.748  -1.500  -8.988
  365   HG23  THR  51          3HG2      THR  51  -9.223  -3.161  -9.264
  366    H    CYS  52           H        CYS  52  -8.082   0.507  -8.314
  367    HA   CYS  52           HA       CYS  52 -10.506   1.950  -9.122
  368    HB2  CYS  52           1HB      CYS  52 -11.153   1.941  -6.817
  369    HB3  CYS  52           2HB      CYS  52 -10.607   0.314  -7.212
  370    H    GLY  53           H        GLY  53  -7.302   2.381  -7.802
  371    HA2  GLY  53           1HA      GLY  53  -6.023   4.275  -7.556
  372    HA3  GLY  53           2HA      GLY  53  -7.234   5.127  -8.503
  373    H    SER  54           H        SER  54  -7.646   3.468  -5.403
  374    HA   SER  54           HA       SER  54  -8.384   6.066  -4.223
  375    HB2  SER  54           1HB      SER  54 -10.241   4.347  -4.545
  376    HB3  SER  54           2HB      SER  54  -9.431   3.385  -3.309
  377    HG   SER  54           HG       SER  54 -10.674   5.903  -3.070
  378    H    HIS  55           H        HIS  55  -5.742   4.785  -4.306
  379    HA   HIS  55           HA       HIS  55  -5.163   4.970  -1.469
  380    HB2  HIS  55           1HB      HIS  55  -4.777   2.458  -3.069
  381    HB3  HIS  55           2HB      HIS  55  -3.701   2.831  -1.726
  382    HD1  HIS  55           1HD      HIS  55  -4.476   2.114   0.521
  383    HD2  HIS  55           2HD      HIS  55  -7.595   2.317  -2.215
  384    HE1  HIS  55           1HE      HIS  55  -6.487   1.204   1.726
  385    HE2  HIS  55           2HE      HIS  55  -8.342   1.257   0.023
  386    H    GLY  56           H        GLY  56  -2.868   5.200  -1.025
  387    HA2  GLY  56           1HA      GLY  56  -1.148   5.676  -3.338
  388    HA3  GLY  56           2HA      GLY  56  -1.490   7.056  -2.305
  389    H    THR  57           H        THR  57   0.720   4.724  -2.918
  390    HA   THR  57           HA       THR  57   1.945   5.074  -0.288
  391    HB   THR  57           HB       THR  57   0.651   2.839  -0.449
  392    HG1  THR  57           1HG      THR  57   2.119   3.175   1.210
  393   HG21  THR  57          1HG2      THR  57   1.320   1.235  -1.873
  394   HG22  THR  57          2HG2      THR  57   3.028   1.589  -1.613
  395   HG23  THR  57          3HG2      THR  57   2.093   2.549  -2.759
  396    H    HIS  58           H        HIS  58   4.245   4.191  -0.310
  397    HA   HIS  58           HA       HIS  58   5.658   5.395  -2.443
  398    HB2  HIS  58           1HB      HIS  58   6.773   3.426  -0.441
  399    HB3  HIS  58           2HB      HIS  58   7.656   4.666  -1.327
  400    HD2  HIS  58           2HD      HIS  58   7.837   7.068  -0.049
  401    HE1  HIS  58           1HE      HIS  58   5.030   6.266   3.030
  402    HE2  HIS  58           2HE      HIS  58   6.680   7.926   2.099
  403    H    ARG  59           H        ARG  59   7.674   3.893  -3.260
  404    HA   ARG  59           HA       ARG  59   6.385   1.965  -4.999
  405    HB2  ARG  59           1HB      ARG  59   8.234   3.742  -5.587
  406    HB3  ARG  59           2HB      ARG  59   9.330   2.487  -5.027
  407    HG2  ARG  59           1HG      ARG  59   7.253   1.713  -6.994
  408    HG3  ARG  59           2HG      ARG  59   8.600   2.702  -7.561
  409    HD2  ARG  59           1HD      ARG  59   8.951   0.152  -5.999
  410    HD3  ARG  59           2HD      ARG  59   8.920   0.214  -7.760
  411    HE   ARG  59           HE       ARG  59  10.818   2.048  -6.983
  412   HH11  ARG  59          2HH1      ARG  59  10.298  -1.371  -6.585
  413   HH12  ARG  59          1HH1      ARG  59  11.987  -1.751  -6.506
  414   HH21  ARG  59          2HH2      ARG  59  13.044   1.561  -6.880
  415   HH22  ARG  59          1HH2      ARG  59  13.548  -0.082  -6.673
  416    H    ASP  60           H        ASP  60   9.405   1.875  -3.098
  417    HA   ASP  60           HA       ASP  60   9.549  -0.949  -3.082
  418    HB2  ASP  60           1HB      ASP  60  11.365   0.912  -2.596
  419    HB3  ASP  60           2HB      ASP  60  10.854   0.660  -0.929
  420    H    CYS  61           H        CYS  61   8.017   1.376  -0.984
  421    HA   CYS  61           HA       CYS  61   7.668  -0.174   1.311
  422    HB2  CYS  61           1HB      CYS  61   7.179   2.266   1.122
  423    HB3  CYS  61           2HB      CYS  61   5.732   1.867   0.201
  424    H    SER  62           H        SER  62   5.789  -0.019  -1.667
  425    HA   SER  62           HA       SER  62   3.795  -1.865  -0.673
  426    HB2  SER  62           1HB      SER  62   3.231  -1.737  -3.293
  427    HB3  SER  62           2HB      SER  62   2.740  -0.479  -2.158
  428    HG   SER  62           HG       SER  62   3.867   0.807  -3.366
  429    H    SER  63           H        SER  63   6.609  -2.717  -0.819
  430    HA   SER  63           HA       SER  63   7.941  -4.390  -1.672
  431    HB2  SER  63           1HB      SER  63   5.293  -5.542  -0.949
  432    HB3  SER  63           2HB      SER  63   6.426  -6.591  -1.801
  433    HG   SER  63           HG       SER  63   6.423  -5.888   0.772
  434    H    LEU  64           H        LEU  64   7.055  -2.760  -3.752
  435    HA   LEU  64           HA       LEU  64   6.025  -4.406  -5.884
  436    HB2  LEU  64           1HB      LEU  64   7.075  -1.588  -5.789
  437    HB3  LEU  64           2HB      LEU  64   6.520  -2.361  -7.273
  438    HG   LEU  64           HG       LEU  64   4.809  -1.874  -4.835
  439   HD11  LEU  64          1HD1      LEU  64   4.506   0.197  -5.556
  440   HD12  LEU  64          2HD1      LEU  64   3.954  -0.419  -7.113
  441   HD13  LEU  64          3HD1      LEU  64   5.665  -0.077  -6.858
  442   HD21  LEU  64          1HD2      LEU  64   3.493  -2.310  -7.385
  443   HD22  LEU  64          2HD2      LEU  64   3.209  -3.072  -5.820
  444   HD23  LEU  64          3HD2      LEU  64   4.469  -3.693  -6.888
  445    H    ARG  65           H        ARG  65   7.388  -3.844  -8.093
  446    HA   ARG  65           HA       ARG  65  10.087  -4.902  -7.565
  447    HB2  ARG  65           1HB      ARG  65   8.060  -5.527  -9.667
  448    HB3  ARG  65           2HB      ARG  65   9.765  -5.658 -10.078
  449    HG2  ARG  65           1HG      ARG  65  10.118  -7.284  -8.351
  450    HG3  ARG  65           2HG      ARG  65   8.472  -7.064  -7.753
  451    HD2  ARG  65           1HD      ARG  65   7.636  -7.850  -9.962
  452    HD3  ARG  65           2HD      ARG  65   9.302  -8.202 -10.418
  453    HE   ARG  65           HE       ARG  65   7.613  -9.766  -8.719
  454   HH11  ARG  65          2HH1      ARG  65  10.916  -8.901  -9.401
  455   HH12  ARG  65          1HH1      ARG  65  11.572 -10.363  -8.742
  456   HH21  ARG  65          2HH2      ARG  65   8.465 -11.694  -7.847
  457   HH22  ARG  65          1HH2      ARG  65  10.177 -11.951  -7.859
  458    HA   PRO  66           HA       PRO  66  11.929  -1.493  -9.623
  459    HB2  PRO  66           1HB      PRO  66  13.966  -2.667 -10.980
  460    HB3  PRO  66           2HB      PRO  66  13.966  -2.477  -9.222
  461    HG2  PRO  66           1HG      PRO  66  13.276  -4.881 -10.868
  462    HG3  PRO  66           2HG      PRO  66  14.237  -4.781  -9.381
  463    HD2  PRO  66           1HD      PRO  66  11.649  -5.576  -9.391
  464    HD3  PRO  66           2HD      PRO  66  12.371  -4.693  -8.031
  465    H    ASN  67           H        ASN  67  10.146  -3.719 -11.271
  466    HA   ASN  67           HA       ASN  67  10.513  -2.298 -13.826
  467    HB2  ASN  67           1HB      ASN  67   9.666  -4.452 -14.891
  468    HB3  ASN  67           2HB      ASN  67  11.294  -4.503 -14.221
  469   HD21  ASN  67          1HD2      ASN  67  11.675  -5.660 -12.326
  470   HD22  ASN  67          2HD2      ASN  67  10.564  -6.850 -11.746
  471    H    SER  68           H        SER  68   8.242  -3.956 -11.684
  472    HA   SER  68           HA       SER  68   5.861  -3.818 -12.884
  473    HB2  SER  68           1HB      SER  68   6.509  -4.241 -10.359
  474    HB3  SER  68           2HB      SER  68   5.973  -2.572 -10.165
  475    HG   SER  68           HG       SER  68   4.291  -4.191 -11.642
  476    H    LYS  69           H        LYS  69   4.585  -2.365 -13.829
  477    HA   LYS  69           HA       LYS  69   5.394   0.431 -13.802
  478    HB2  LYS  69           1HB      LYS  69   3.700  -1.280 -15.550
  479    HB3  LYS  69           2HB      LYS  69   3.322   0.437 -15.489
  480    HG2  LYS  69           1HG      LYS  69   5.636   0.953 -16.130
  481    HG3  LYS  69           2HG      LYS  69   5.975  -0.776 -16.239
  482    HD2  LYS  69           1HD      LYS  69   4.561  -1.051 -18.088
  483    HD3  LYS  69           2HD      LYS  69   3.746   0.489 -17.803
  484    HE2  LYS  69           1HE      LYS  69   6.672   0.381 -18.446
  485    HE3  LYS  69           2HE      LYS  69   5.460   0.325 -19.725
  486    HZ1  LYS  69           1HZ      LYS  69   6.164   2.579 -19.371
  487    HZ2  LYS  69           2HZ      LYS  69   5.806   2.488 -17.720
  488    HZ3  LYS  69           3HZ      LYS  69   4.558   2.425 -18.860
  489    H    LYS  70           H        LYS  70   2.217  -1.188 -13.676
  490    HA   LYS  70           HA       LYS  70   1.244   0.988 -11.974
  491    HB2  LYS  70           1HB      LYS  70  -0.988   0.219 -12.535
  492    HB3  LYS  70           2HB      LYS  70  -0.048   0.435 -14.006
  493    HG2  LYS  70           1HG      LYS  70   0.384  -2.014 -14.015
  494    HG3  LYS  70           2HG      LYS  70  -0.720  -2.164 -12.645
  495    HD2  LYS  70           1HD      LYS  70  -2.359  -0.857 -14.221
  496    HD3  LYS  70           2HD      LYS  70  -1.300  -1.474 -15.492
  497    HE2  LYS  70           1HE      LYS  70  -1.639  -3.752 -14.253
  498    HE3  LYS  70           2HE      LYS  70  -3.073  -2.961 -13.603
  499    HZ1  LYS  70           1HZ      LYS  70  -3.017  -2.476 -16.345
  500    HZ2  LYS  70           2HZ      LYS  70  -4.113  -3.432 -15.483
  501    HZ3  LYS  70           3HZ      LYS  70  -2.715  -4.127 -16.134
  502    H    TRP  71           H        TRP  71   0.090   0.566 -10.043
  503    HA   TRP  71           HA       TRP  71   0.576  -2.099  -8.885
  504    HB2  TRP  71           1HB      TRP  71   2.094  -0.892  -7.652
  505    HB3  TRP  71           2HB      TRP  71   1.185   0.609  -7.803
  506    HD1  TRP  71           HD       TRP  71   1.063  -2.714  -5.826
  507    HE1  TRP  71           1HE      TRP  71  -0.113  -2.263  -3.582
  508    HE3  TRP  71           3HE      TRP  71  -0.268   2.165  -6.574
  509    HZ2  TRP  71           2HZ      TRP  71  -1.431  -0.122  -2.298
  510    HZ3  TRP  71           3HZ      TRP  71  -1.484   3.342  -4.788
  511    HH2  TRP  71           HH       TRP  71  -2.054   2.220  -2.696
  512    H    GLU  72           H        GLU  72  -0.963  -2.861  -7.386
  513    HA   GLU  72           HA       GLU  72  -3.551  -1.458  -7.520
  514    HB2  GLU  72           1HB      GLU  72  -2.899  -4.399  -7.463
  515    HB3  GLU  72           2HB      GLU  72  -4.506  -3.791  -7.093
  516    HG2  GLU  72           1HG      GLU  72  -4.937  -3.200  -9.247
  517    HG3  GLU  72           2HG      GLU  72  -3.240  -2.903  -9.623
  518    H    CYS  73           H        CYS  73  -4.677  -1.092  -5.672
  519    HA   CYS  73           HA       CYS  73  -3.266  -1.144  -3.207
  520    HB2  CYS  73           1HB      CYS  73  -5.209  -0.123  -2.253
  521    HB3  CYS  73           2HB      CYS  73  -5.008   0.550  -3.868
  522    H    ASN  74           H        ASN  74  -4.356  -2.045  -1.181
  523    HA   ASN  74           HA       ASN  74  -4.357  -4.832  -1.294
  524    HB2  ASN  74           1HB      ASN  74  -3.878  -3.732   0.784
  525    HB3  ASN  74           2HB      ASN  74  -5.452  -2.942   0.794
  526   HD21  ASN  74          1HD2      ASN  74  -3.673  -5.734   1.606
  527   HD22  ASN  74          2HD2      ASN  74  -4.972  -6.644   2.291
  528    H    GLU  75           H        GLU  75  -7.141  -2.656  -0.798
  529    HA   GLU  75           HA       GLU  75  -9.192  -4.432  -0.699
  530    HB2  GLU  75           1HB      GLU  75  -9.139  -1.811  -2.203
  531    HB3  GLU  75           2HB      GLU  75 -10.603  -2.696  -1.800
  532    HG2  GLU  75           1HG      GLU  75 -10.072  -2.462   0.584
  533    HG3  GLU  75           2HG      GLU  75  -8.637  -1.531   0.158
  534    H    CYS  76           H        CYS  76  -7.513  -3.334  -3.607
  535    HA   CYS  76           HA       CYS  76  -9.202  -4.808  -5.395
  536    HB2  CYS  76           1HB      CYS  76  -6.568  -3.380  -5.743
  537    HB3  CYS  76           2HB      CYS  76  -7.346  -4.255  -7.057
  538    H    LEU  77           H        LEU  77  -5.828  -5.194  -4.315
  539    HA   LEU  77           HA       LEU  77  -5.181  -7.522  -5.621
  540    HB2  LEU  77           1HB      LEU  77  -4.404  -6.541  -2.888
  541    HB3  LEU  77           2HB      LEU  77  -3.708  -7.992  -3.607
  542    HG   LEU  77           HG       LEU  77  -3.510  -5.219  -4.781
  543   HD11  LEU  77          1HD1      LEU  77  -1.035  -6.411  -3.916
  544   HD12  LEU  77          2HD1      LEU  77  -2.166  -6.259  -2.572
  545   HD13  LEU  77          3HD1      LEU  77  -1.726  -4.838  -3.519
  546   HD21  LEU  77          1HD2      LEU  77  -2.881  -7.890  -5.762
  547   HD22  LEU  77          2HD2      LEU  77  -1.509  -6.783  -5.825
  548   HD23  LEU  77          3HD2      LEU  77  -3.019  -6.363  -6.635
  549    HA   PRO  78           HA       PRO  78  -7.688 -10.737  -3.980
  550    HB2  PRO  78           1HB      PRO  78  -6.012 -12.854  -4.265
  551    HB3  PRO  78           2HB      PRO  78  -6.817 -12.076  -5.632
  552    HG2  PRO  78           1HG      PRO  78  -4.019 -11.719  -4.629
  553    HG3  PRO  78           2HG      PRO  78  -4.599 -11.870  -6.298
  554    HD2  PRO  78           1HD      PRO  78  -3.976  -9.483  -5.183
  555    HD3  PRO  78           2HD      PRO  78  -5.251  -9.662  -6.405
  556    H    ALA  79           H        ALA  79  -7.549 -12.640  -2.400
  557    HA   ALA  79           HA       ALA  79  -5.545 -12.623  -0.381
  558    HB1  ALA  79           1HB      ALA  79  -8.175 -11.308   0.286
  559    HB2  ALA  79           2HB      ALA  79  -6.971 -11.809   1.475
  560    HB3  ALA  79           3HB      ALA  79  -6.578 -10.558   0.296
  561    H    SER  80           H        SER  80  -5.602 -14.479   0.772
  562    HA   SER  80           HA       SER  80  -7.949 -16.214   0.378
  563    HB2  SER  80           1HB      SER  80  -5.709 -16.923  -0.620
  564    HB3  SER  80           2HB      SER  80  -5.160 -17.162   1.039
  565    HG   SER  80           HG       SER  80  -6.532 -18.817   1.275
  566    H    GLY  81           H        GLY  81  -8.921 -17.161   2.107
  567    HA2  GLY  81           1HA      GLY  81  -9.200 -17.847   4.322
  568    HA3  GLY  81           2HA      GLY  81  -7.657 -17.107   4.721
  569    HA   PRO  82           HA       PRO  82 -11.086 -14.483   6.451
  570    HB2  PRO  82           1HB      PRO  82 -10.027 -14.308   8.945
  571    HB3  PRO  82           2HB      PRO  82 -11.092 -15.627   8.444
  572    HG2  PRO  82           1HG      PRO  82  -8.105 -15.572   8.634
  573    HG3  PRO  82           2HG      PRO  82  -9.234 -16.844   9.133
  574    HD2  PRO  82           1HD      PRO  82  -7.841 -16.960   6.814
  575    HD3  PRO  82           2HD      PRO  82  -9.466 -17.654   6.988
  576    H    SER  83           H        SER  83 -10.761 -12.371   7.721
  577    HA   SER  83           HA       SER  83  -8.292 -11.058   6.786
  578    HB2  SER  83           1HB      SER  83 -11.148 -10.164   6.709
  579    HB3  SER  83           2HB      SER  83  -9.875  -8.954   6.865
  580    HG   SER  83           HG       SER  83 -10.238  -9.257   4.698
  581    H    SER  84           H        SER  84  -7.636  -9.159   8.051
  582    HA   SER  84           HA       SER  84  -8.375  -9.440  10.891
  583    HB2  SER  84           1HB      SER  84  -5.963 -10.089   9.998
  584    HB3  SER  84           2HB      SER  84  -5.705  -8.349  10.112
  585    HG   SER  84           HG       SER  84  -6.799  -8.853  12.341
  586    H    GLY  85           H        GLY  85  -9.615  -7.764  11.430
  587    HA2  GLY  85           1HA      GLY  85  -9.796  -5.327  10.089
  588    HA3  GLY  85           2HA      GLY  85 -10.314  -5.601  11.746
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1   2.052  36.739  27.367
    2    HA2  GLY   1           1HA      GLY   1   2.006  34.433  25.522
    3    HA3  GLY   1           2HA      GLY   1   2.791  34.335  27.092
    4    H    SER   2           H        SER   2   1.146  32.446  26.996
    5    HA   SER   2           HA       SER   2  -0.891  33.004  28.865
    6    HB2  SER   2           1HB      SER   2  -2.876  32.557  27.494
    7    HB3  SER   2           2HB      SER   2  -2.021  33.984  26.906
    8    HG   SER   2           HG       SER   2  -2.584  32.631  25.180
    9    H    SER   3           H        SER   3  -2.468  31.015  28.975
   10    HA   SER   3           HA       SER   3  -0.870  28.588  28.477
   11    HB2  SER   3           1HB      SER   3  -1.210  29.464  30.926
   12    HB3  SER   3           2HB      SER   3  -2.815  28.755  30.753
   13    HG   SER   3           HG       SER   3  -0.620  27.206  30.001
   14    H    GLY   4           H        GLY   4  -2.282  26.557  28.587
   15    HA2  GLY   4           1HA      GLY   4  -4.939  27.072  27.420
   16    HA3  GLY   4           2HA      GLY   4  -3.812  25.997  26.606
   17    H    SER   5           H        SER   5  -5.931  24.697  26.980
   18    HA   SER   5           HA       SER   5  -5.466  23.042  29.356
   19    HB2  SER   5           1HB      SER   5  -8.081  24.281  28.517
   20    HB3  SER   5           2HB      SER   5  -8.029  22.817  29.500
   21    HG   SER   5           HG       SER   5  -6.538  24.164  30.874
   22    H    SER   6           H        SER   6  -6.910  20.983  29.166
   23    HA   SER   6           HA       SER   6  -6.978  20.088  26.364
   24    HB2  SER   6           1HB      SER   6  -6.116  17.862  27.168
   25    HB3  SER   6           2HB      SER   6  -4.942  19.176  27.260
   26    HG   SER   6           HG       SER   6  -5.620  17.603  29.195
   27    H    GLY   7           H        GLY   7  -8.297  18.117  26.045
   28    HA2  GLY   7           1HA      GLY   7 -10.021  17.023  27.931
   29    HA3  GLY   7           2HA      GLY   7 -10.845  18.421  27.255
   30    H    GLU   8           H        GLU   8 -12.453  17.039  26.386
   31    HA   GLU   8           HA       GLU   8 -11.571  15.294  24.195
   32    HB2  GLU   8           1HB      GLU   8 -13.679  14.183  24.356
   33    HB3  GLU   8           2HB      GLU   8 -13.053  14.354  25.990
   34    HG2  GLU   8           1HG      GLU   8 -15.194  14.993  26.353
   35    HG3  GLU   8           2HG      GLU   8 -14.504  16.559  25.933
   36    H    LEU   9           H        LEU   9 -11.998  15.772  22.128
   37    HA   LEU   9           HA       LEU   9 -13.588  18.187  21.592
   38    HB2  LEU   9           1HB      LEU   9 -11.436  16.849  19.960
   39    HB3  LEU   9           2HB      LEU   9 -12.368  18.249  19.432
   40    HG   LEU   9           HG       LEU   9 -11.399  19.264  21.690
   41   HD11  LEU   9          1HD1      LEU   9  -8.891  18.423  21.569
   42   HD12  LEU   9          2HD1      LEU   9  -9.679  16.929  21.062
   43   HD13  LEU   9          3HD1      LEU   9 -10.084  17.655  22.617
   44   HD21  LEU   9          1HD2      LEU   9 -10.642  20.626  20.109
   45   HD22  LEU   9          2HD2      LEU   9 -10.694  19.336  18.907
   46   HD23  LEU   9          3HD2      LEU   9  -9.257  19.553  19.907
   47    H    GLU  10           H        GLU  10 -14.588  18.156  19.312
   48    HA   GLU  10           HA       GLU  10 -16.723  16.565  19.128
   49    HB2  GLU  10           1HB      GLU  10 -14.991  17.607  16.898
   50    HB3  GLU  10           2HB      GLU  10 -16.485  16.739  16.575
   51    HG2  GLU  10           1HG      GLU  10 -16.388  19.161  18.343
   52    HG3  GLU  10           2HG      GLU  10 -16.600  19.269  16.596
   53    HA   PRO  11           HA       PRO  11 -15.429  12.387  18.607
   54    HB2  PRO  11           1HB      PRO  11 -17.732  11.367  17.596
   55    HB3  PRO  11           2HB      PRO  11 -17.543  11.810  19.297
   56    HG2  PRO  11           1HG      PRO  11 -18.829  13.344  17.071
   57    HG3  PRO  11           2HG      PRO  11 -19.384  13.116  18.740
   58    HD2  PRO  11           1HD      PRO  11 -18.145  15.377  17.913
   59    HD3  PRO  11           2HD      PRO  11 -17.977  14.745  19.564
   60    H    GLY  12           H        GLY  12 -14.922  10.841  16.992
   61    HA2  GLY  12           1HA      GLY  12 -13.893  10.442  14.944
   62    HA3  GLY  12           2HA      GLY  12 -15.556  10.619  14.403
   63    H    ALA  13           H        ALA  13 -13.239  13.028  15.612
   64    HA   ALA  13           HA       ALA  13 -13.782  14.637  13.225
   65    HB1  ALA  13           1HB      ALA  13 -12.121  15.995  15.109
   66    HB2  ALA  13           2HB      ALA  13 -13.771  16.369  14.610
   67    HB3  ALA  13           3HB      ALA  13 -13.485  15.266  15.957
   68    H    PHE  14           H        PHE  14 -12.455  13.445  11.783
   69    HA   PHE  14           HA       PHE  14  -9.580  13.953  12.162
   70    HB2  PHE  14           1HB      PHE  14 -10.980  11.446  11.334
   71    HB3  PHE  14           2HB      PHE  14  -9.402  11.800  10.638
   72    HD1  PHE  14           1HD      PHE  14 -11.210  11.225  13.804
   73    HD2  PHE  14           2HD      PHE  14  -7.422  11.501  11.882
   74    HE1  PHE  14           1HE      PHE  14 -10.126  10.314  15.817
   75    HE2  PHE  14           2HE      PHE  14  -6.332  10.590  13.890
   76    HZ   PHE  14           HZ       PHE  14  -7.684   9.995  15.861
   77    H    SER  15           H        SER  15  -9.251  15.635  10.825
   78    HA   SER  15           HA       SER  15 -10.630  16.097   8.413
   79    HB2  SER  15           1HB      SER  15  -7.905  17.141   9.218
   80    HB3  SER  15           2HB      SER  15  -8.972  17.834   7.997
   81    HG   SER  15           HG       SER  15 -10.508  18.152   9.723
   82    H    GLU  16           H        GLU  16 -10.501  15.002   6.580
   83    HA   GLU  16           HA       GLU  16  -7.889  13.988   5.709
   84    HB2  GLU  16           1HB      GLU  16  -8.790  11.863   5.068
   85    HB3  GLU  16           2HB      GLU  16  -9.217  12.141   6.751
   86    HG2  GLU  16           1HG      GLU  16 -11.078  12.698   4.458
   87    HG3  GLU  16           2HG      GLU  16 -11.026  11.164   5.326
   88    H    LEU  17           H        LEU  17  -7.690  13.688   3.425
   89    HA   LEU  17           HA       LEU  17  -9.401  15.517   1.926
   90    HB2  LEU  17           1HB      LEU  17  -6.877  14.145   1.024
   91    HB3  LEU  17           2HB      LEU  17  -7.690  15.499   0.243
   92    HG   LEU  17           HG       LEU  17  -6.362  15.621   2.950
   93   HD11  LEU  17          1HD1      LEU  17  -4.431  16.246   1.991
   94   HD12  LEU  17          2HD1      LEU  17  -5.238  17.119   0.688
   95   HD13  LEU  17          3HD1      LEU  17  -5.053  15.368   0.593
   96   HD21  LEU  17          1HD2      LEU  17  -6.728  18.119   1.572
   97   HD22  LEU  17          2HD2      LEU  17  -7.273  17.633   3.178
   98   HD23  LEU  17          3HD2      LEU  17  -8.272  17.287   1.766
   99    H    TYR  18           H        TYR  18 -10.587  14.940   0.145
  100    HA   TYR  18           HA       TYR  18 -11.030  12.062  -0.194
  101    HB2  TYR  18           1HB      TYR  18 -13.087  12.958  -1.503
  102    HB3  TYR  18           2HB      TYR  18 -13.090  13.056   0.254
  103    HD1  TYR  18           2HD      TYR  18 -12.578  15.253   1.354
  104    HD2  TYR  18           1HD      TYR  18 -13.213  14.908  -2.839
  105    HE1  TYR  18           2HE      TYR  18 -12.982  17.676   1.222
  106    HE2  TYR  18           1HE      TYR  18 -13.618  17.330  -2.983
  107    HH   TYR  18           HH       TYR  18 -14.093  19.281  -0.224
  108    H    GLN  19           H        GLN  19 -10.516  15.025  -2.078
  109    HA   GLN  19           HA       GLN  19 -10.428  13.739  -4.601
  110    HB2  GLN  19           1HB      GLN  19  -9.705  16.430  -3.550
  111    HB3  GLN  19           2HB      GLN  19  -9.044  15.956  -5.109
  112    HG2  GLN  19           1HG      GLN  19 -11.957  15.606  -4.637
  113    HG3  GLN  19           2HG      GLN  19 -11.330  17.230  -4.916
  114   HE21  GLN  19          1HE2      GLN  19 -12.303  14.320  -6.328
  115   HE22  GLN  19          2HE2      GLN  19 -11.841  14.668  -7.955
  116    H    ARG  20           H        ARG  20  -7.853  14.916  -2.443
  117    HA   ARG  20           HA       ARG  20  -5.910  13.367  -4.009
  118    HB2  ARG  20           1HB      ARG  20  -5.672  15.740  -2.189
  119    HB3  ARG  20           2HB      ARG  20  -4.272  14.722  -2.498
  120    HG2  ARG  20           1HG      ARG  20  -4.050  16.393  -4.074
  121    HG3  ARG  20           2HG      ARG  20  -4.832  15.103  -4.989
  122    HD2  ARG  20           1HD      ARG  20  -5.960  17.122  -5.530
  123    HD3  ARG  20           2HD      ARG  20  -7.028  16.202  -4.471
  124    HE   ARG  20           HE       ARG  20  -6.884  17.888  -2.940
  125   HH11  ARG  20          2HH1      ARG  20  -4.242  18.185  -5.187
  126   HH12  ARG  20          1HH1      ARG  20  -3.701  19.704  -4.551
  127   HH21  ARG  20          2HH2      ARG  20  -6.182  19.887  -2.094
  128   HH22  ARG  20          1HH2      ARG  20  -4.805  20.670  -2.792
  129    H    TYR  21           H        TYR  21  -5.761  11.349  -3.251
  130    HA   TYR  21           HA       TYR  21  -5.831  10.898  -0.355
  131    HB2  TYR  21           1HB      TYR  21  -7.343   9.563  -1.824
  132    HB3  TYR  21           2HB      TYR  21  -5.921   8.860  -2.588
  133    HD1  TYR  21           2HD      TYR  21  -4.330   7.504  -1.149
  134    HD2  TYR  21           1HD      TYR  21  -8.202   8.670   0.174
  135    HE1  TYR  21           2HE      TYR  21  -4.260   5.755   0.579
  136    HE2  TYR  21           1HE      TYR  21  -8.142   6.925   1.907
  137    HH   TYR  21           HH       TYR  21  -6.786   5.473   3.011
  138    H    ARG  22           H        ARG  22  -3.863  11.158   0.509
  139    HA   ARG  22           HA       ARG  22  -1.649   9.623  -0.671
  140    HB2  ARG  22           1HB      ARG  22  -0.124  11.471   0.141
  141    HB3  ARG  22           2HB      ARG  22  -1.137  11.868  -1.241
  142    HG2  ARG  22           1HG      ARG  22  -2.749  12.899   0.429
  143    HG3  ARG  22           2HG      ARG  22  -1.443  12.755   1.607
  144    HD2  ARG  22           1HD      ARG  22  -1.297  14.943   0.726
  145    HD3  ARG  22           2HD      ARG  22   0.003  14.022  -0.029
  146    HE   ARG  22           HE       ARG  22  -1.991  13.788  -1.819
  147   HH11  ARG  22          2HH1      ARG  22  -0.611  16.531  -0.180
  148   HH12  ARG  22          1HH1      ARG  22  -0.941  17.635  -1.474
  149   HH21  ARG  22          2HH2      ARG  22  -2.432  15.231  -3.529
  150   HH22  ARG  22          1HH2      ARG  22  -1.978  16.895  -3.378
  151    H    HIS  23           H        HIS  23  -1.767   7.954   0.785
  152    HA   HIS  23           HA       HIS  23  -0.736   8.512   3.432
  153    HB2  HIS  23           1HB      HIS  23  -3.473   7.338   2.977
  154    HB3  HIS  23           2HB      HIS  23  -2.570   7.043   4.460
  155    HD1  HIS  23           1HD      HIS  23  -4.785   9.460   2.857
  156    HD2  HIS  23           2HD      HIS  23  -2.019   9.481   5.958
  157    HE1  HIS  23           1HE      HIS  23  -5.261  11.552   4.169
  158    HE2  HIS  23           2HE      HIS  23  -3.521  11.587   5.989
  159    H    CYS  24           H        CYS  24   0.906   7.149   3.611
  160    HA   CYS  24           HA       CYS  24   1.322   4.896   2.013
  161    HB2  CYS  24           1HB      CYS  24   3.237   5.838   3.007
  162    HB3  CYS  24           2HB      CYS  24   2.523   5.809   4.616
  163    H    ASP  25           H        ASP  25   0.081   3.144   1.974
  164    HA   ASP  25           HA       ASP  25  -0.819   2.014   4.543
  165    HB2  ASP  25           1HB      ASP  25  -2.561   2.954   2.837
  166    HB3  ASP  25           2HB      ASP  25  -2.240   1.460   1.960
  167    H    ALA  26           H        ALA  26   1.634   1.561   2.834
  168    HA   ALA  26           HA       ALA  26   1.385  -1.058   1.721
  169    HB1  ALA  26           1HB      ALA  26   4.084  -0.637   2.234
  170    HB2  ALA  26           2HB      ALA  26   3.226  -0.304   0.728
  171    HB3  ALA  26           3HB      ALA  26   3.430   0.973   1.927
  172    HA   PRO  27           HA       PRO  27   2.164  -3.707   5.132
  173    HB2  PRO  27           1HB      PRO  27   4.064  -5.417   4.218
  174    HB3  PRO  27           2HB      PRO  27   2.389  -5.450   3.653
  175    HG2  PRO  27           1HG      PRO  27   4.798  -4.221   2.368
  176    HG3  PRO  27           2HG      PRO  27   3.495  -5.169   1.627
  177    HD2  PRO  27           1HD      PRO  27   3.587  -2.466   1.494
  178    HD3  PRO  27           2HD      PRO  27   2.059  -3.368   1.548
  179    H    ILE  28           H        ILE  28   5.276  -2.819   3.625
  180    HA   ILE  28           HA       ILE  28   6.304  -2.197   6.309
  181    HB   ILE  28           HB       ILE  28   7.849  -3.661   4.166
  182   HG12  ILE  28          1HG1      ILE  28   6.173  -5.068   5.323
  183   HG13  ILE  28          2HG1      ILE  28   7.822  -5.559   5.692
  184   HG21  ILE  28          1HG2      ILE  28   9.503  -3.886   6.116
  185   HG22  ILE  28          2HG2      ILE  28   9.413  -2.337   5.279
  186   HG23  ILE  28          3HG2      ILE  28   8.618  -2.543   6.839
  187   HD11  ILE  28          1HD1      ILE  28   5.727  -4.799   7.467
  188   HD12  ILE  28          2HD1      ILE  28   7.333  -5.425   7.840
  189   HD13  ILE  28          3HD1      ILE  28   7.085  -3.689   7.654
  190    H    CYS  29           H        CYS  29   7.569  -0.403   6.460
  191    HA   CYS  29           HA       CYS  29   8.036   1.092   3.963
  192    HB2  CYS  29           1HB      CYS  29   6.369   1.939   5.832
  193    HB3  CYS  29           2HB      CYS  29   7.856   2.482   6.602
  194    H    LEU  30           H        LEU  30  10.040   1.857   3.557
  195    HA   LEU  30           HA       LEU  30  12.129   1.200   5.518
  196    HB2  LEU  30           1HB      LEU  30  12.471   1.783   2.584
  197    HB3  LEU  30           2HB      LEU  30  13.676   1.127   3.690
  198    HG   LEU  30           HG       LEU  30  11.173  -0.423   3.245
  199   HD11  LEU  30          1HD1      LEU  30  11.549  -0.942   1.113
  200   HD12  LEU  30          2HD1      LEU  30  13.281  -1.132   1.380
  201   HD13  LEU  30          3HD1      LEU  30  12.609   0.467   1.064
  202   HD21  LEU  30          1HD2      LEU  30  13.329  -0.868   4.764
  203   HD22  LEU  30          2HD2      LEU  30  13.881  -1.611   3.263
  204   HD23  LEU  30          3HD2      LEU  30  12.390  -2.165   4.026
  205    H    TYR  31           H        TYR  31  10.807   3.772   3.541
  206    HA   TYR  31           HA       TYR  31  12.797   5.693   3.807
  207    HB2  TYR  31           1HB      TYR  31  10.536   5.712   2.481
  208    HB3  TYR  31           2HB      TYR  31   9.907   6.479   3.935
  209    HD1  TYR  31           2HD      TYR  31  13.207   6.871   2.242
  210    HD2  TYR  31           1HD      TYR  31   9.540   8.705   3.381
  211    HE1  TYR  31           2HE      TYR  31  14.056   9.043   1.457
  212    HE2  TYR  31           1HE      TYR  31  10.378  10.881   2.598
  213    HH   TYR  31           HH       TYR  31  13.546  11.176   1.038
  214    H    GLU  32           H        GLU  32  13.747   6.093   5.716
  215    HA   GLU  32           HA       GLU  32  12.965   5.837   8.249
  216    HB2  GLU  32           1HB      GLU  32  14.401   8.261   7.153
  217    HB3  GLU  32           2HB      GLU  32  14.351   7.805   8.850
  218    HG2  GLU  32           1HG      GLU  32  16.347   6.897   8.285
  219    HG3  GLU  32           2HG      GLU  32  15.299   5.532   7.904
  220    H    GLN  33           H        GLN  33  11.936   8.454   6.124
  221    HA   GLN  33           HA       GLN  33  10.695  10.163   7.867
  222    HB2  GLN  33           1HB      GLN  33  10.866  10.112   5.224
  223    HB3  GLN  33           2HB      GLN  33   9.239   9.459   5.360
  224    HG2  GLN  33           1HG      GLN  33   9.006  11.783   5.067
  225    HG3  GLN  33           2HG      GLN  33   8.668  11.460   6.767
  226   HE21  GLN  33          1HE2      GLN  33  10.420  13.315   4.608
  227   HE22  GLN  33          2HE2      GLN  33  11.543  14.018   5.716
  228    H    GLY  34           H        GLY  34   9.102   7.413   6.235
  229    HA2  GLY  34           1HA      GLY  34   7.388   6.049   6.936
  230    HA3  GLY  34           2HA      GLY  34   7.690   6.624   8.570
  231    H    ARG  35           H        ARG  35   6.717   8.445   5.685
  232    HA   ARG  35           HA       ARG  35   4.047   8.834   6.764
  233    HB2  ARG  35           1HB      ARG  35   4.148  11.138   7.066
  234    HB3  ARG  35           2HB      ARG  35   5.692  10.599   7.713
  235    HG2  ARG  35           1HG      ARG  35   6.716  11.149   5.500
  236    HG3  ARG  35           2HG      ARG  35   5.173  11.870   5.038
  237    HD2  ARG  35           1HD      ARG  35   5.352  13.350   7.038
  238    HD3  ARG  35           2HD      ARG  35   6.970  12.705   7.309
  239    HE   ARG  35           HE       ARG  35   7.744  14.007   5.588
  240   HH11  ARG  35          2HH1      ARG  35   4.266  13.899   5.479
  241   HH12  ARG  35          1HH1      ARG  35   4.137  15.122   4.258
  242   HH21  ARG  35          2HH2      ARG  35   7.587  15.617   3.981
  243   HH22  ARG  35          1HH2      ARG  35   6.026  16.098   3.406
  244    H    ASP  36           H        ASP  36   3.030  10.718   5.200
  245    HA   ASP  36           HA       ASP  36   3.023   9.473   2.607
  246    HB2  ASP  36           1HB      ASP  36   1.385  11.433   2.135
  247    HB3  ASP  36           2HB      ASP  36   0.894  10.168   3.259
  248    H    SER  37           H        SER  37   5.546  10.424   3.057
  249    HA   SER  37           HA       SER  37   5.745  12.917   1.523
  250    HB2  SER  37           1HB      SER  37   6.956  12.762   3.701
  251    HB3  SER  37           2HB      SER  37   7.925  11.451   3.028
  252    HG   SER  37           HG       SER  37   8.213  14.116   2.722
  253    H    PHE  38           H        PHE  38   6.250  12.851  -0.557
  254    HA   PHE  38           HA       PHE  38   7.946  10.700  -1.574
  255    HB2  PHE  38           1HB      PHE  38   5.415  11.443  -3.030
  256    HB3  PHE  38           2HB      PHE  38   6.472  10.065  -3.316
  257    HD1  PHE  38           1HD      PHE  38   4.100  11.514  -0.864
  258    HD2  PHE  38           2HD      PHE  38   6.066   8.015  -2.281
  259    HE1  PHE  38           1HE      PHE  38   2.678  10.130   0.591
  260    HE2  PHE  38           2HE      PHE  38   4.647   6.626  -0.829
  261    HZ   PHE  38           HZ       PHE  38   2.950   7.683   0.609
  262    H    GLU  39           H        GLU  39   8.723  11.143  -3.796
  263    HA   GLU  39           HA       GLU  39   8.952  14.045  -4.253
  264    HB2  GLU  39           1HB      GLU  39  11.009  12.515  -3.587
  265    HB3  GLU  39           2HB      GLU  39  10.995  12.141  -5.304
  266    HG2  GLU  39           1HG      GLU  39  12.434  13.901  -5.288
  267    HG3  GLU  39           2HG      GLU  39  10.911  14.752  -5.546
  268    H    ASP  40           H        ASP  40   9.193  14.741  -6.470
  269    HA   ASP  40           HA       ASP  40   7.275  14.088  -8.206
  270    HB2  ASP  40           1HB      ASP  40   9.299  15.775  -8.401
  271    HB3  ASP  40           2HB      ASP  40   9.973  14.508  -9.422
  272    H    GLU  41           H        GLU  41  10.376  12.391  -7.976
  273    HA   GLU  41           HA       GLU  41   9.161  10.007  -9.075
  274    HB2  GLU  41           1HB      GLU  41  11.535  11.277 -10.449
  275    HB3  GLU  41           2HB      GLU  41  10.830   9.717 -10.846
  276    HG2  GLU  41           1HG      GLU  41   8.687  10.941 -11.342
  277    HG3  GLU  41           2HG      GLU  41   9.609  12.437 -11.204
  278    H    GLY  42           H        GLY  42  10.625   8.125  -8.953
  279    HA2  GLY  42           1HA      GLY  42  12.817   7.315  -8.145
  280    HA3  GLY  42           2HA      GLY  42  12.679   8.508  -6.862
  281    H    ARG  43           H        ARG  43  13.175   5.875  -6.263
  282    HA   ARG  43           HA       ARG  43  11.207   4.078  -5.842
  283    HB2  ARG  43           1HB      ARG  43  12.353   3.446  -3.724
  284    HB3  ARG  43           2HB      ARG  43  13.450   3.646  -5.084
  285    HG2  ARG  43           1HG      ARG  43  13.959   5.937  -4.244
  286    HG3  ARG  43           2HG      ARG  43  12.998   5.564  -2.812
  287    HD2  ARG  43           1HD      ARG  43  15.504   4.174  -3.745
  288    HD3  ARG  43           2HD      ARG  43  15.314   5.179  -2.309
  289    HE   ARG  43           HE       ARG  43  13.523   3.233  -1.870
  290   HH11  ARG  43          2HH1      ARG  43  16.865   3.144  -2.842
  291   HH12  ARG  43          1HH1      ARG  43  17.180   1.618  -2.084
  292   HH21  ARG  43          2HH2      ARG  43  13.926   1.224  -0.868
  293   HH22  ARG  43          1HH2      ARG  43  15.507   0.526  -0.962
  294    H    TRP  44           H        TRP  44  11.683   7.067  -4.039
  295    HA   TRP  44           HA       TRP  44   9.431   6.492  -2.294
  296    HB2  TRP  44           1HB      TRP  44  10.971   9.081  -2.430
  297    HB3  TRP  44           2HB      TRP  44  10.047   8.432  -1.078
  298    HD1  TRP  44           HD       TRP  44  13.466   8.981  -1.928
  299    HE1  TRP  44           1HE      TRP  44  15.055   7.343  -0.737
  300    HE3  TRP  44           3HE      TRP  44  10.055   5.470  -0.455
  301    HZ2  TRP  44           2HZ      TRP  44  14.884   4.887   0.644
  302    HZ3  TRP  44           3HZ      TRP  44  10.850   3.506   0.797
  303    HH2  TRP  44           HH       TRP  44  13.215   3.222   1.334
  304    H    ARG  45           H        ARG  45   8.823   6.664  -5.065
  305    HA   ARG  45           HA       ARG  45   7.541   9.255  -5.430
  306    HB2  ARG  45           1HB      ARG  45   7.006   8.456  -7.676
  307    HB3  ARG  45           2HB      ARG  45   8.718   8.245  -7.331
  308    HG2  ARG  45           1HG      ARG  45   8.090   5.847  -6.677
  309    HG3  ARG  45           2HG      ARG  45   6.571   6.167  -7.517
  310    HD2  ARG  45           1HD      ARG  45   8.139   6.981  -9.438
  311    HD3  ARG  45           2HD      ARG  45   9.349   6.006  -8.606
  312    HE   ARG  45           HE       ARG  45   6.893   4.603  -9.089
  313   HH11  ARG  45          2HH1      ARG  45   9.960   5.533 -10.449
  314   HH12  ARG  45          1HH1      ARG  45  10.005   4.220 -11.578
  315   HH21  ARG  45          2HH2      ARG  45   6.940   2.870 -10.571
  316   HH22  ARG  45          1HH2      ARG  45   8.286   2.706 -11.648
  317    H    LEU  46           H        LEU  46   5.500   9.629  -4.888
  318    HA   LEU  46           HA       LEU  46   3.851   7.755  -3.638
  319    HB2  LEU  46           1HB      LEU  46   3.788  10.365  -3.706
  320    HB3  LEU  46           2HB      LEU  46   2.700  10.111  -5.069
  321    HG   LEU  46           HG       LEU  46   2.235   9.000  -2.304
  322   HD11  LEU  46          1HD1      LEU  46   2.141  11.651  -2.976
  323   HD12  LEU  46          2HD1      LEU  46   1.228  10.891  -1.673
  324   HD13  LEU  46          3HD1      LEU  46   0.478  11.129  -3.252
  325   HD21  LEU  46          1HD2      LEU  46   0.922   8.715  -4.898
  326   HD22  LEU  46          2HD2      LEU  46  -0.168   9.199  -3.598
  327   HD23  LEU  46          3HD2      LEU  46   0.791   7.727  -3.443
  328    H    ILE  47           H        ILE  47   3.160   5.954  -4.605
  329    HA   ILE  47           HA       ILE  47   2.198   6.100  -7.374
  330    HB   ILE  47           HB       ILE  47   2.870   3.690  -5.682
  331   HG12  ILE  47          1HG1      ILE  47   4.307   5.084  -7.942
  332   HG13  ILE  47          2HG1      ILE  47   4.885   4.819  -6.301
  333   HG21  ILE  47          1HG2      ILE  47   2.382   2.320  -7.526
  334   HG22  ILE  47          2HG2      ILE  47   1.024   3.439  -7.416
  335   HG23  ILE  47          3HG2      ILE  47   2.281   3.694  -8.627
  336   HD11  ILE  47          1HD1      ILE  47   6.037   3.275  -7.620
  337   HD12  ILE  47          2HD1      ILE  47   4.764   2.338  -6.838
  338   HD13  ILE  47          3HD1      ILE  47   4.589   2.831  -8.522
  339    H    LEU  48           H        LEU  48   0.093   6.092  -7.785
  340    HA   LEU  48           HA       LEU  48  -1.759   5.376  -5.624
  341    HB2  LEU  48           1HB      LEU  48  -2.041   7.072  -8.086
  342    HB3  LEU  48           2HB      LEU  48  -3.439   6.530  -7.160
  343    HG   LEU  48           HG       LEU  48  -1.199   8.217  -6.048
  344   HD11  LEU  48          1HD1      LEU  48  -2.170   9.770  -7.381
  345   HD12  LEU  48          2HD1      LEU  48  -3.302   9.854  -6.031
  346   HD13  LEU  48          3HD1      LEU  48  -3.706   8.906  -7.462
  347   HD21  LEU  48          1HD2      LEU  48  -3.813   7.225  -4.948
  348   HD22  LEU  48          2HD2      LEU  48  -2.985   8.631  -4.279
  349   HD23  LEU  48          3HD2      LEU  48  -2.195   7.054  -4.268
  350    H    CYS  49           H        CYS  49  -3.287   3.810  -5.850
  351    HA   CYS  49           HA       CYS  49  -2.894   1.587  -7.351
  352    HB2  CYS  49           1HB      CYS  49  -4.550   1.751  -5.531
  353    HB3  CYS  49           2HB      CYS  49  -5.598   2.703  -6.577
  354    H    ALA  50           H        ALA  50  -3.857   0.697  -9.250
  355    HA   ALA  50           HA       ALA  50  -4.428   2.743 -11.283
  356    HB1  ALA  50           1HB      ALA  50  -2.635   1.602 -12.124
  357    HB2  ALA  50           2HB      ALA  50  -3.107   0.079 -11.369
  358    HB3  ALA  50           3HB      ALA  50  -3.952   0.649 -12.809
  359    H    THR  51           H        THR  51  -5.505  -0.421 -10.100
  360    HA   THR  51           HA       THR  51  -7.631  -0.843 -11.838
  361    HB   THR  51           HB       THR  51  -7.324  -1.649  -8.943
  362    HG1  THR  51           1HG      THR  51  -6.849  -2.926 -11.438
  363   HG21  THR  51          1HG2      THR  51  -9.053  -3.438  -9.726
  364   HG22  THR  51          2HG2      THR  51  -9.493  -2.220 -10.924
  365   HG23  THR  51          3HG2      THR  51  -9.617  -1.851  -9.204
  366    H    CYS  52           H        CYS  52  -7.663   0.758  -8.656
  367    HA   CYS  52           HA       CYS  52 -10.267   1.936  -9.373
  368    HB2  CYS  52           1HB      CYS  52 -10.801   2.056  -7.040
  369    HB3  CYS  52           2HB      CYS  52 -10.227   0.423  -7.366
  370    H    GLY  53           H        GLY  53  -7.150   2.579  -7.808
  371    HA2  GLY  53           1HA      GLY  53  -5.891   4.520  -7.835
  372    HA3  GLY  53           2HA      GLY  53  -7.126   5.262  -8.841
  373    H    SER  54           H        SER  54  -6.901   4.001  -5.510
  374    HA   SER  54           HA       SER  54  -8.024   6.558  -4.579
  375    HB2  SER  54           1HB      SER  54  -8.776   3.785  -3.626
  376    HB3  SER  54           2HB      SER  54  -9.283   5.282  -2.843
  377    HG   SER  54           HG       SER  54  -9.767   5.143  -5.559
  378    H    HIS  55           H        HIS  55  -6.256   3.623  -3.656
  379    HA   HIS  55           HA       HIS  55  -5.211   4.817  -1.258
  380    HB2  HIS  55           1HB      HIS  55  -4.749   2.211  -2.684
  381    HB3  HIS  55           2HB      HIS  55  -3.726   2.696  -1.335
  382    HD1  HIS  55           1HD      HIS  55  -4.618   0.716   0.085
  383    HD2  HIS  55           2HD      HIS  55  -7.528   3.450  -1.063
  384    HE1  HIS  55           1HE      HIS  55  -6.631   0.189   1.498
  385    HE2  HIS  55           2HE      HIS  55  -8.406   1.800   0.726
  386    H    GLY  56           H        GLY  56  -2.957   5.196  -0.833
  387    HA2  GLY  56           1HA      GLY  56  -1.264   5.561  -3.202
  388    HA3  GLY  56           2HA      GLY  56  -1.586   6.957  -2.183
  389    H    THR  57           H        THR  57   0.684   4.757  -2.842
  390    HA   THR  57           HA       THR  57   1.962   5.124  -0.253
  391    HB   THR  57           HB       THR  57   0.695   2.911  -0.213
  392    HG1  THR  57           1HG      THR  57   3.172   2.007   0.225
  393   HG21  THR  57          1HG2      THR  57   1.652   2.489  -2.667
  394   HG22  THR  57          2HG2      THR  57   1.273   1.166  -1.563
  395   HG23  THR  57          3HG2      THR  57   2.939   1.716  -1.743
  396    H    HIS  58           H        HIS  58   4.264   4.318  -0.313
  397    HA   HIS  58           HA       HIS  58   5.599   5.432  -2.532
  398    HB2  HIS  58           1HB      HIS  58   6.790   3.532  -0.508
  399    HB3  HIS  58           2HB      HIS  58   7.637   4.747  -1.461
  400    HD2  HIS  58           2HD      HIS  58   7.628   7.302  -0.403
  401    HE1  HIS  58           1HE      HIS  58   5.309   6.388   3.030
  402    HE2  HIS  58           2HE      HIS  58   6.647   8.155   1.833
  403    H    ARG  59           H        ARG  59   7.608   3.896  -3.341
  404    HA   ARG  59           HA       ARG  59   6.262   1.878  -4.948
  405    HB2  ARG  59           1HB      ARG  59   7.839   3.618  -5.910
  406    HB3  ARG  59           2HB      ARG  59   9.147   2.739  -5.129
  407    HG2  ARG  59           1HG      ARG  59   7.306   1.214  -6.886
  408    HG3  ARG  59           2HG      ARG  59   8.472   2.302  -7.642
  409    HD2  ARG  59           1HD      ARG  59   9.342   0.352  -5.544
  410    HD3  ARG  59           2HD      ARG  59   9.129  -0.169  -7.215
  411    HE   ARG  59           HE       ARG  59  10.734   2.150  -7.125
  412   HH11  ARG  59          2HH1      ARG  59  10.826  -1.253  -6.399
  413   HH12  ARG  59          1HH1      ARG  59  12.535  -1.393  -6.649
  414   HH21  ARG  59          2HH2      ARG  59  12.984   1.979  -7.458
  415   HH22  ARG  59          1HH2      ARG  59  13.761   0.446  -7.251
  416    H    ASP  60           H        ASP  60   9.431   1.974  -3.312
  417    HA   ASP  60           HA       ASP  60   9.699  -0.827  -3.181
  418    HB2  ASP  60           1HB      ASP  60  11.025   1.282  -1.462
  419    HB3  ASP  60           2HB      ASP  60  11.558  -0.388  -1.637
  420    H    CYS  61           H        CYS  61   8.105   1.472  -1.128
  421    HA   CYS  61           HA       CYS  61   7.992  -0.023   1.250
  422    HB2  CYS  61           1HB      CYS  61   7.411   2.408   1.003
  423    HB3  CYS  61           2HB      CYS  61   5.902   1.915   0.242
  424    H    SER  62           H        SER  62   5.944   0.003  -1.618
  425    HA   SER  62           HA       SER  62   4.063  -1.870  -0.468
  426    HB2  SER  62           1HB      SER  62   3.120  -0.260  -1.960
  427    HB3  SER  62           2HB      SER  62   4.314  -0.619  -3.207
  428    HG   SER  62           HG       SER  62   2.451  -2.523  -2.243
  429    H    SER  63           H        SER  63   6.939  -2.582  -0.852
  430    HA   SER  63           HA       SER  63   8.258  -4.227  -1.784
  431    HB2  SER  63           1HB      SER  63   6.550  -5.250  -0.032
  432    HB3  SER  63           2HB      SER  63   5.946  -6.093  -1.459
  433    HG   SER  63           HG       SER  63   7.785  -7.186  -1.618
  434    H    LEU  64           H        LEU  64   7.322  -2.826  -3.869
  435    HA   LEU  64           HA       LEU  64   6.079  -4.664  -5.760
  436    HB2  LEU  64           1HB      LEU  64   6.936  -1.796  -6.116
  437    HB3  LEU  64           2HB      LEU  64   5.998  -2.748  -7.265
  438    HG   LEU  64           HG       LEU  64   5.046  -2.017  -4.499
  439   HD11  LEU  64          1HD1      LEU  64   4.008  -0.782  -7.011
  440   HD12  LEU  64          2HD1      LEU  64   5.450  -0.126  -6.236
  441   HD13  LEU  64          3HD1      LEU  64   3.927  -0.192  -5.351
  442   HD21  LEU  64          1HD2      LEU  64   4.158  -4.065  -5.870
  443   HD22  LEU  64          2HD2      LEU  64   3.301  -2.821  -6.780
  444   HD23  LEU  64          3HD2      LEU  64   3.036  -2.985  -5.043
  445    H    ARG  65           H        ARG  65   7.064  -4.403  -8.096
  446    HA   ARG  65           HA       ARG  65   9.743  -5.457  -7.918
  447    HB2  ARG  65           1HB      ARG  65   7.657  -5.241 -10.026
  448    HB3  ARG  65           2HB      ARG  65   9.328  -5.365 -10.558
  449    HG2  ARG  65           1HG      ARG  65   8.159  -7.538 -10.439
  450    HG3  ARG  65           2HG      ARG  65   9.598  -7.457  -9.420
  451    HD2  ARG  65           1HD      ARG  65   8.377  -7.424  -7.468
  452    HD3  ARG  65           2HD      ARG  65   6.946  -6.757  -8.252
  453    HE   ARG  65           HE       ARG  65   7.140  -9.200  -9.367
  454   HH11  ARG  65          2HH1      ARG  65   7.194  -8.104  -6.063
  455   HH12  ARG  65          1HH1      ARG  65   6.494  -9.557  -5.432
  456   HH21  ARG  65          2HH2      ARG  65   6.218 -11.119  -8.548
  457   HH22  ARG  65          1HH2      ARG  65   5.939 -11.272  -6.847
  458    HA   PRO  66           HA       PRO  66  12.082  -1.909  -9.002
  459    HB2  PRO  66           1HB      PRO  66  13.915  -2.908 -10.738
  460    HB3  PRO  66           2HB      PRO  66  13.948  -3.249  -9.004
  461    HG2  PRO  66           1HG      PRO  66  12.898  -4.933 -11.245
  462    HG3  PRO  66           2HG      PRO  66  13.868  -5.417  -9.842
  463    HD2  PRO  66           1HD      PRO  66  11.189  -5.792  -9.961
  464    HD3  PRO  66           2HD      PRO  66  12.040  -5.466  -8.438
  465    H    ASN  67           H        ASN  67  11.026  -0.380 -10.142
  466    HA   ASN  67           HA       ASN  67  10.484   0.914 -11.943
  467    HB2  ASN  67           1HB      ASN  67  12.650  -0.076 -12.891
  468    HB3  ASN  67           2HB      ASN  67  11.618  -1.206 -13.762
  469   HD21  ASN  67          1HD2      ASN  67  13.421   1.043 -14.600
  470   HD22  ASN  67          2HD2      ASN  67  12.442   2.015 -15.640
  471    H    SER  68           H        SER  68   8.592  -0.733 -10.817
  472    HA   SER  68           HA       SER  68   7.214  -2.428 -12.563
  473    HB2  SER  68           1HB      SER  68   6.896  -1.865  -9.985
  474    HB3  SER  68           2HB      SER  68   5.664  -0.774 -10.619
  475    HG   SER  68           HG       SER  68   5.384  -3.095 -11.856
  476    H    LYS  69           H        LYS  69   4.695  -1.703 -12.943
  477    HA   LYS  69           HA       LYS  69   4.828   0.769 -14.543
  478    HB2  LYS  69           1HB      LYS  69   3.016  -0.512 -15.949
  479    HB3  LYS  69           2HB      LYS  69   4.728  -0.811 -16.218
  480    HG2  LYS  69           1HG      LYS  69   3.175  -2.502 -14.303
  481    HG3  LYS  69           2HG      LYS  69   3.113  -2.811 -16.040
  482    HD2  LYS  69           1HD      LYS  69   5.786  -2.464 -14.793
  483    HD3  LYS  69           2HD      LYS  69   4.914  -3.961 -14.457
  484    HE2  LYS  69           1HE      LYS  69   5.645  -2.857 -17.167
  485    HE3  LYS  69           2HE      LYS  69   6.343  -4.271 -16.378
  486    HZ1  LYS  69           1HZ      LYS  69   4.819  -5.377 -17.560
  487    HZ2  LYS  69           2HZ      LYS  69   3.861  -4.009 -17.828
  488    HZ3  LYS  69           3HZ      LYS  69   3.725  -4.865 -16.376
  489    H    LYS  70           H        LYS  70   2.710  -1.460 -12.781
  490    HA   LYS  70           HA       LYS  70   1.082   0.820 -11.953
  491    HB2  LYS  70           1HB      LYS  70  -0.988  -0.147 -12.584
  492    HB3  LYS  70           2HB      LYS  70   0.049  -0.261 -14.000
  493    HG2  LYS  70           1HG      LYS  70   0.574  -2.627 -13.231
  494    HG3  LYS  70           2HG      LYS  70  -0.785  -2.445 -12.119
  495    HD2  LYS  70           1HD      LYS  70  -1.996  -1.641 -14.344
  496    HD3  LYS  70           2HD      LYS  70  -0.761  -2.663 -15.082
  497    HE2  LYS  70           1HE      LYS  70  -2.502  -3.619 -12.826
  498    HE3  LYS  70           2HE      LYS  70  -2.992  -3.756 -14.514
  499    HZ1  LYS  70           1HZ      LYS  70  -0.334  -4.739 -13.920
  500    HZ2  LYS  70           2HZ      LYS  70  -1.549  -5.414 -14.884
  501    HZ3  LYS  70           3HZ      LYS  70  -1.592  -5.616 -13.205
  502    H    TRP  71           H        TRP  71  -0.007   0.523  -9.993
  503    HA   TRP  71           HA       TRP  71   0.673  -1.948  -8.538
  504    HB2  TRP  71           1HB      TRP  71   2.084  -0.434  -7.493
  505    HB3  TRP  71           2HB      TRP  71   0.975   0.915  -7.721
  506    HD1  TRP  71           HD       TRP  71   1.232  -2.299  -5.565
  507    HE1  TRP  71           1HE      TRP  71   0.094  -1.828  -3.305
  508    HE3  TRP  71           3HE      TRP  71  -0.493   2.423  -6.493
  509    HZ2  TRP  71           2HZ      TRP  71  -1.345   0.268  -2.078
  510    HZ3  TRP  71           3HZ      TRP  71  -1.741   3.592  -4.724
  511    HH2  TRP  71           HH       TRP  71  -2.158   2.535  -2.563
  512    H    GLU  72           H        GLU  72  -0.880  -2.807  -7.204
  513    HA   GLU  72           HA       GLU  72  -3.533  -1.536  -7.357
  514    HB2  GLU  72           1HB      GLU  72  -2.707  -4.429  -7.298
  515    HB3  GLU  72           2HB      GLU  72  -4.343  -3.932  -6.891
  516    HG2  GLU  72           1HG      GLU  72  -4.732  -3.090  -9.061
  517    HG3  GLU  72           2HG      GLU  72  -3.025  -3.197  -9.486
  518    H    CYS  73           H        CYS  73  -4.741  -1.284  -5.525
  519    HA   CYS  73           HA       CYS  73  -3.312  -1.352  -3.025
  520    HB2  CYS  73           1HB      CYS  73  -5.177  -0.176  -2.108
  521    HB3  CYS  73           2HB      CYS  73  -4.900   0.483  -3.717
  522    H    ASN  74           H        ASN  74  -4.437  -2.220  -1.040
  523    HA   ASN  74           HA       ASN  74  -4.665  -4.971  -1.155
  524    HB2  ASN  74           1HB      ASN  74  -4.247  -4.000   0.962
  525    HB3  ASN  74           2HB      ASN  74  -5.673  -2.971   0.861
  526   HD21  ASN  74          1HD2      ASN  74  -6.806  -3.603   2.585
  527   HD22  ASN  74          2HD2      ASN  74  -7.352  -5.217   2.872
  528    H    GLU  75           H        GLU  75  -7.318  -2.603  -0.911
  529    HA   GLU  75           HA       GLU  75  -9.496  -4.226  -0.879
  530    HB2  GLU  75           1HB      GLU  75  -9.138  -1.680  -2.465
  531    HB3  GLU  75           2HB      GLU  75 -10.692  -2.447  -2.169
  532    HG2  GLU  75           1HG      GLU  75  -8.903  -1.678   0.101
  533    HG3  GLU  75           2HG      GLU  75  -9.960  -0.495  -0.667
  534    H    CYS  76           H        CYS  76  -7.568  -3.365  -3.715
  535    HA   CYS  76           HA       CYS  76  -9.233  -4.872  -5.517
  536    HB2  CYS  76           1HB      CYS  76  -6.550  -3.524  -5.854
  537    HB3  CYS  76           2HB      CYS  76  -7.374  -4.379  -7.155
  538    H    LEU  77           H        LEU  77  -5.821  -5.195  -4.518
  539    HA   LEU  77           HA       LEU  77  -5.057  -7.504  -5.610
  540    HB2  LEU  77           1HB      LEU  77  -4.701  -6.683  -2.737
  541    HB3  LEU  77           2HB      LEU  77  -3.851  -8.043  -3.468
  542    HG   LEU  77           HG       LEU  77  -3.629  -5.242  -4.540
  543   HD11  LEU  77          1HD1      LEU  77  -2.797  -4.896  -2.416
  544   HD12  LEU  77          2HD1      LEU  77  -1.353  -5.387  -3.301
  545   HD13  LEU  77          3HD1      LEU  77  -2.191  -6.546  -2.269
  546   HD21  LEU  77          1HD2      LEU  77  -2.425  -6.233  -6.115
  547   HD22  LEU  77          2HD2      LEU  77  -2.681  -7.804  -5.355
  548   HD23  LEU  77          3HD2      LEU  77  -1.304  -6.809  -4.881
  549    HA   PRO  78           HA       PRO  78  -7.705 -10.815  -4.468
  550    HB2  PRO  78           1HB      PRO  78  -5.958 -12.893  -4.483
  551    HB3  PRO  78           2HB      PRO  78  -6.526 -12.106  -5.960
  552    HG2  PRO  78           1HG      PRO  78  -3.959 -11.713  -4.472
  553    HG3  PRO  78           2HG      PRO  78  -4.230 -11.844  -6.219
  554    HD2  PRO  78           1HD      PRO  78  -3.868  -9.466  -4.976
  555    HD3  PRO  78           2HD      PRO  78  -4.903  -9.648  -6.407
  556    H    ALA  79           H        ALA  79  -8.107 -10.033  -2.299
  557    HA   ALA  79           HA       ALA  79  -6.405 -10.818  -0.131
  558    HB1  ALA  79           1HB      ALA  79  -9.215  -9.726  -0.156
  559    HB2  ALA  79           2HB      ALA  79  -8.246  -9.979   1.297
  560    HB3  ALA  79           3HB      ALA  79  -7.723  -8.814   0.080
  561    H    SER  80           H        SER  80  -6.416 -12.656   0.998
  562    HA   SER  80           HA       SER  80  -8.737 -14.256   1.392
  563    HB2  SER  80           1HB      SER  80  -8.308 -14.945  -0.904
  564    HB3  SER  80           2HB      SER  80  -6.628 -15.306  -0.510
  565    HG   SER  80           HG       SER  80  -8.016 -17.167  -0.526
  566    H    GLY  81           H        GLY  81  -8.447 -15.806   2.987
  567    HA2  GLY  81           1HA      GLY  81  -6.877 -17.258   4.212
  568    HA3  GLY  81           2HA      GLY  81  -5.732 -15.925   4.150
  569    HA   PRO  82           HA       PRO  82  -7.386 -15.444   8.311
  570    HB2  PRO  82           1HB      PRO  82  -5.376 -13.827   9.159
  571    HB3  PRO  82           2HB      PRO  82  -5.222 -15.586   9.071
  572    HG2  PRO  82           1HG      PRO  82  -4.270 -13.502   7.144
  573    HG3  PRO  82           2HG      PRO  82  -3.434 -14.955   7.725
  574    HD2  PRO  82           1HD      PRO  82  -4.657 -14.845   5.312
  575    HD3  PRO  82           2HD      PRO  82  -4.560 -16.339   6.266
  576    H    SER  83           H        SER  83  -8.808 -13.962   8.991
  577    HA   SER  83           HA       SER  83  -8.516 -11.178   8.130
  578    HB2  SER  83           1HB      SER  83 -10.786 -11.006   7.382
  579    HB3  SER  83           2HB      SER  83 -10.081 -12.403   6.569
  580    HG   SER  83           HG       SER  83 -11.260 -13.738   7.798
  581    H    SER  84           H        SER  84  -8.880  -9.773   9.726
  582    HA   SER  84           HA       SER  84 -10.499 -10.619  12.025
  583    HB2  SER  84           1HB      SER  84  -7.679  -9.572  12.059
  584    HB3  SER  84           2HB      SER  84  -8.746  -9.330  13.443
  585    HG   SER  84           HG       SER  84  -7.317 -11.431  12.973
  586    H    GLY  85           H        GLY  85 -11.886  -9.112  12.743
  587    HA2  GLY  85           1HA      GLY  85 -11.424  -6.310  12.565
  588    HA3  GLY  85           2HA      GLY  85 -12.505  -6.841  11.285
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1 -16.246 -29.990  26.379
    2    HA2  GLY   1           1HA      GLY   1 -14.177 -28.036  26.088
    3    HA3  GLY   1           2HA      GLY   1 -14.213 -29.150  24.729
    4    H    SER   2           H        SER   2 -14.617 -26.591  24.133
    5    HA   SER   2           HA       SER   2 -17.185 -26.587  22.941
    6    HB2  SER   2           1HB      SER   2 -17.570 -25.921  25.442
    7    HB3  SER   2           2HB      SER   2 -16.913 -24.364  24.939
    8    HG   SER   2           HG       SER   2 -18.895 -25.484  23.338
    9    H    SER   3           H        SER   3 -17.649 -24.257  22.037
   10    HA   SER   3           HA       SER   3 -15.080 -23.112  21.156
   11    HB2  SER   3           1HB      SER   3 -16.582 -24.498  19.483
   12    HB3  SER   3           2HB      SER   3 -17.495 -22.992  19.394
   13    HG   SER   3           HG       SER   3 -14.691 -23.058  19.057
   14    H    GLY   4           H        GLY   4 -15.628 -20.882  19.981
   15    HA2  GLY   4           1HA      GLY   4 -17.601 -19.402  21.580
   16    HA3  GLY   4           2HA      GLY   4 -15.929 -18.861  21.581
   17    H    SER   5           H        SER   5 -16.994 -16.858  20.786
   18    HA   SER   5           HA       SER   5 -16.912 -16.835  17.873
   19    HB2  SER   5           1HB      SER   5 -19.332 -17.128  18.685
   20    HB3  SER   5           2HB      SER   5 -19.204 -15.474  19.282
   21    HG   SER   5           HG       SER   5 -19.227 -14.737  17.289
   22    H    SER   6           H        SER   6 -16.965 -14.545  17.033
   23    HA   SER   6           HA       SER   6 -16.310 -12.422  18.840
   24    HB2  SER   6           1HB      SER   6 -14.180 -13.886  18.596
   25    HB3  SER   6           2HB      SER   6 -14.072 -13.187  16.981
   26    HG   SER   6           HG       SER   6 -13.823 -11.187  17.859
   27    H    GLY   7           H        GLY   7 -16.429 -10.415  17.872
   28    HA2  GLY   7           1HA      GLY   7 -17.658 -10.382  15.252
   29    HA3  GLY   7           2HA      GLY   7 -17.447  -9.007  16.326
   30    H    GLU   8           H        GLU   8 -16.993  -8.883  13.566
   31    HA   GLU   8           HA       GLU   8 -14.065  -8.559  13.475
   32    HB2  GLU   8           1HB      GLU   8 -15.995  -9.304  11.279
   33    HB3  GLU   8           2HB      GLU   8 -14.349  -8.773  10.963
   34    HG2  GLU   8           1HG      GLU   8 -14.428 -11.163  10.907
   35    HG3  GLU   8           2HG      GLU   8 -13.516 -10.652  12.325
   36    H    LEU   9           H        LEU   9 -13.341  -6.552  13.219
   37    HA   LEU   9           HA       LEU   9 -15.068  -4.557  11.937
   38    HB2  LEU   9           1HB      LEU   9 -13.591  -4.158  14.535
   39    HB3  LEU   9           2HB      LEU   9 -14.455  -2.905  13.647
   40    HG   LEU   9           HG       LEU   9 -15.916  -5.341  14.585
   41   HD11  LEU   9          1HD1      LEU   9 -14.619  -3.391  16.284
   42   HD12  LEU   9          2HD1      LEU   9 -15.454  -4.885  16.710
   43   HD13  LEU   9          3HD1      LEU   9 -16.369  -3.392  16.502
   44   HD21  LEU   9          1HD2      LEU   9 -17.717  -3.564  14.801
   45   HD22  LEU   9          2HD2      LEU   9 -17.191  -3.963  13.166
   46   HD23  LEU   9          3HD2      LEU   9 -16.613  -2.488  13.943
   47    H    GLU  10           H        GLU  10 -13.957  -2.775  11.009
   48    HA   GLU  10           HA       GLU  10 -11.081  -3.271  10.592
   49    HB2  GLU  10           1HB      GLU  10 -13.050  -1.996   8.684
   50    HB3  GLU  10           2HB      GLU  10 -11.337  -2.247   8.377
   51    HG2  GLU  10           1HG      GLU  10 -13.227  -4.505   8.958
   52    HG3  GLU  10           2HG      GLU  10 -12.930  -3.899   7.330
   53    HA   PRO  11           HA       PRO  11 -10.657   0.678  12.616
   54    HB2  PRO  11           1HB      PRO  11  -7.949   0.777  12.449
   55    HB3  PRO  11           2HB      PRO  11  -8.803  -0.217  13.635
   56    HG2  PRO  11           1HG      PRO  11  -7.588  -1.015  11.019
   57    HG3  PRO  11           2HG      PRO  11  -7.526  -1.850  12.582
   58    HD2  PRO  11           1HD      PRO  11  -9.219  -2.589  10.602
   59    HD3  PRO  11           2HD      PRO  11  -9.627  -2.760  12.321
   60    H    GLY  12           H        GLY  12  -9.862   2.802  12.073
   61    HA2  GLY  12           1HA      GLY  12  -9.312   4.533  10.652
   62    HA3  GLY  12           2HA      GLY  12  -8.710   3.340   9.510
   63    H    ALA  13           H        ALA  13 -10.413   2.114   8.295
   64    HA   ALA  13           HA       ALA  13 -11.965   2.344   6.612
   65    HB1  ALA  13           1HB      ALA  13 -13.226   2.362   9.220
   66    HB2  ALA  13           2HB      ALA  13 -14.227   3.142   7.995
   67    HB3  ALA  13           3HB      ALA  13 -13.671   1.486   7.755
   68    H    PHE  14           H        PHE  14 -10.400   4.697   6.885
   69    HA   PHE  14           HA       PHE  14 -11.971   7.043   6.978
   70    HB2  PHE  14           1HB      PHE  14  -9.240   6.398   5.907
   71    HB3  PHE  14           2HB      PHE  14  -9.953   7.985   5.632
   72    HD1  PHE  14           1HD      PHE  14  -8.919   5.604   8.268
   73    HD2  PHE  14           2HD      PHE  14  -9.941   9.623   7.309
   74    HE1  PHE  14           1HE      PHE  14  -8.154   6.326  10.492
   75    HE2  PHE  14           2HE      PHE  14  -9.177  10.352   9.531
   76    HZ   PHE  14           HZ       PHE  14  -8.281   8.703  11.126
   77    H    SER  15           H        SER  15 -13.273   7.947   5.522
   78    HA   SER  15           HA       SER  15 -13.784   6.613   3.035
   79    HB2  SER  15           1HB      SER  15 -14.905   9.153   4.236
   80    HB3  SER  15           2HB      SER  15 -15.461   8.458   2.713
   81    HG   SER  15           HG       SER  15 -15.372   6.767   4.921
   82    H    GLU  16           H        GLU  16 -14.110   8.110   1.033
   83    HA   GLU  16           HA       GLU  16 -11.528   9.057   0.298
   84    HB2  GLU  16           1HB      GLU  16 -13.297   7.989  -1.213
   85    HB3  GLU  16           2HB      GLU  16 -14.072   9.567  -1.231
   86    HG2  GLU  16           1HG      GLU  16 -12.293  10.562  -2.367
   87    HG3  GLU  16           2HG      GLU  16 -11.196   9.234  -1.993
   88    H    LEU  17           H        LEU  17 -11.245  11.238  -0.767
   89    HA   LEU  17           HA       LEU  17 -12.812  13.354   0.508
   90    HB2  LEU  17           1HB      LEU  17  -9.801  13.343   0.529
   91    HB3  LEU  17           2HB      LEU  17 -10.871  14.532   1.270
   92    HG   LEU  17           HG       LEU  17 -10.993  11.695   2.190
   93   HD11  LEU  17          1HD1      LEU  17  -8.913  11.664   2.948
   94   HD12  LEU  17          2HD1      LEU  17  -9.231  13.128   3.878
   95   HD13  LEU  17          3HD1      LEU  17  -8.612  13.247   2.231
   96   HD21  LEU  17          1HD2      LEU  17 -12.553  12.790   3.390
   97   HD22  LEU  17          2HD2      LEU  17 -11.810  14.367   3.119
   98   HD23  LEU  17          3HD2      LEU  17 -11.169  13.291   4.361
   99    H    TYR  18           H        TYR  18 -12.057  15.562  -0.373
  100    HA   TYR  18           HA       TYR  18 -12.257  15.444  -3.221
  101    HB2  TYR  18           1HB      TYR  18 -11.993  17.980  -2.997
  102    HB3  TYR  18           2HB      TYR  18 -13.388  17.250  -2.211
  103    HD1  TYR  18           2HD      TYR  18 -13.385  16.942   0.262
  104    HD2  TYR  18           1HD      TYR  18 -10.319  19.109  -1.739
  105    HE1  TYR  18           2HE      TYR  18 -12.721  17.964   2.398
  106    HE2  TYR  18           1HE      TYR  18  -9.645  20.136   0.392
  107    HH   TYR  18           HH       TYR  18 -11.383  20.387   2.942
  108    H    GLN  19           H        GLN  19  -9.719  16.433  -0.949
  109    HA   GLN  19           HA       GLN  19  -7.842  17.156  -2.953
  110    HB2  GLN  19           1HB      GLN  19  -7.759  16.711  -0.009
  111    HB3  GLN  19           2HB      GLN  19  -6.233  16.699  -0.884
  112    HG2  GLN  19           1HG      GLN  19  -6.675  18.926  -1.735
  113    HG3  GLN  19           2HG      GLN  19  -8.242  18.940  -0.926
  114   HE21  GLN  19          1HE2      GLN  19  -8.073  18.443   1.490
  115   HE22  GLN  19          2HE2      GLN  19  -6.823  19.276   2.343
  116    H    ARG  20           H        ARG  20  -5.766  16.060  -3.322
  117    HA   ARG  20           HA       ARG  20  -6.075  13.477  -4.282
  118    HB2  ARG  20           1HB      ARG  20  -4.205  15.280  -4.674
  119    HB3  ARG  20           2HB      ARG  20  -3.382  14.420  -3.380
  120    HG2  ARG  20           1HG      ARG  20  -2.539  13.306  -5.170
  121    HG3  ARG  20           2HG      ARG  20  -3.976  12.325  -4.874
  122    HD2  ARG  20           1HD      ARG  20  -4.034  12.711  -7.171
  123    HD3  ARG  20           2HD      ARG  20  -5.148  13.912  -6.518
  124    HE   ARG  20           HE       ARG  20  -2.839  15.277  -6.624
  125   HH11  ARG  20          2HH1      ARG  20  -4.496  13.301  -8.962
  126   HH12  ARG  20          1HH1      ARG  20  -3.902  14.188 -10.326
  127   HH21  ARG  20          2HH2      ARG  20  -2.049  16.452  -8.412
  128   HH22  ARG  20          1HH2      ARG  20  -2.509  15.980 -10.012
  129    H    TYR  21           H        TYR  21  -5.611  11.447  -3.520
  130    HA   TYR  21           HA       TYR  21  -5.622  11.144  -0.646
  131    HB2  TYR  21           1HB      TYR  21  -7.006   9.732  -2.201
  132    HB3  TYR  21           2HB      TYR  21  -5.514   8.976  -2.749
  133    HD1  TYR  21           2HD      TYR  21  -4.198   7.567  -1.195
  134    HD2  TYR  21           1HD      TYR  21  -7.992   9.152  -0.102
  135    HE1  TYR  21           2HE      TYR  21  -4.334   5.951   0.653
  136    HE2  TYR  21           1HE      TYR  21  -8.138   7.540   1.751
  137    HH   TYR  21           HH       TYR  21  -5.789   6.055   3.085
  138    H    ARG  22           H        ARG  22  -3.775  11.279   0.440
  139    HA   ARG  22           HA       ARG  22  -1.429   9.855  -0.618
  140    HB2  ARG  22           1HB      ARG  22  -1.390  12.539   0.774
  141    HB3  ARG  22           2HB      ARG  22   0.024  11.631   0.255
  142    HG2  ARG  22           1HG      ARG  22  -0.966  11.778  -2.095
  143    HG3  ARG  22           2HG      ARG  22  -2.032  13.016  -1.427
  144    HD2  ARG  22           1HD      ARG  22  -0.308  14.496  -1.064
  145    HD3  ARG  22           2HD      ARG  22   0.903  13.220  -0.950
  146    HE   ARG  22           HE       ARG  22   0.124  13.079  -3.528
  147   HH11  ARG  22          2HH1      ARG  22   1.178  15.711  -1.508
  148   HH12  ARG  22          1HH1      ARG  22   1.879  16.606  -2.816
  149   HH21  ARG  22          2HH2      ARG  22   1.043  14.248  -5.258
  150   HH22  ARG  22          1HH2      ARG  22   1.801  15.773  -4.948
  151    H    HIS  23           H        HIS  23  -1.736   8.094   0.724
  152    HA   HIS  23           HA       HIS  23  -0.898   8.480   3.468
  153    HB2  HIS  23           1HB      HIS  23  -3.618   7.409   2.741
  154    HB3  HIS  23           2HB      HIS  23  -2.837   6.997   4.265
  155    HD1  HIS  23           1HD      HIS  23  -2.267   9.110   5.846
  156    HD2  HIS  23           2HD      HIS  23  -4.952   9.786   2.749
  157    HE1  HIS  23           1HE      HIS  23  -3.451  11.248   6.438
  158    HE2  HIS  23           2HE      HIS  23  -5.130  11.592   4.593
  159    H    CYS  24           H        CYS  24   0.759   7.117   3.566
  160    HA   CYS  24           HA       CYS  24   1.249   4.948   1.922
  161    HB2  CYS  24           1HB      CYS  24   3.049   5.835   3.203
  162    HB3  CYS  24           2HB      CYS  24   2.198   5.561   4.719
  163    H    ASP  25           H        ASP  25   0.331   3.025   1.720
  164    HA   ASP  25           HA       ASP  25  -0.906   1.781   4.078
  165    HB2  ASP  25           1HB      ASP  25  -2.161   2.419   1.457
  166    HB3  ASP  25           2HB      ASP  25  -2.577   0.876   2.197
  167    H    ALA  26           H        ALA  26   1.667   1.370   2.742
  168    HA   ALA  26           HA       ALA  26   1.411  -1.153   1.339
  169    HB1  ALA  26           1HB      ALA  26   3.310  -0.475   0.418
  170    HB2  ALA  26           2HB      ALA  26   3.380   0.898   1.524
  171    HB3  ALA  26           3HB      ALA  26   4.115  -0.639   1.979
  172    HA   PRO  27           HA       PRO  27   2.186  -3.947   4.632
  173    HB2  PRO  27           1HB      PRO  27   4.106  -5.601   3.658
  174    HB3  PRO  27           2HB      PRO  27   2.436  -5.621   3.079
  175    HG2  PRO  27           1HG      PRO  27   4.845  -4.319   1.870
  176    HG3  PRO  27           2HG      PRO  27   3.556  -5.242   1.076
  177    HD2  PRO  27           1HD      PRO  27   3.629  -2.535   1.065
  178    HD3  PRO  27           2HD      PRO  27   2.107  -3.449   1.066
  179    H    ILE  28           H        ILE  28   5.329  -3.048   3.191
  180    HA   ILE  28           HA       ILE  28   6.345  -2.607   5.922
  181    HB   ILE  28           HB       ILE  28   7.886  -3.745   3.586
  182   HG12  ILE  28          1HG1      ILE  28   6.427  -5.414   4.556
  183   HG13  ILE  28          2HG1      ILE  28   8.081  -5.747   5.059
  184   HG21  ILE  28          1HG2      ILE  28   9.006  -3.669   6.329
  185   HG22  ILE  28          2HG2      ILE  28   9.818  -3.555   4.768
  186   HG23  ILE  28          3HG2      ILE  28   8.967  -2.156   5.422
  187   HD11  ILE  28          1HD1      ILE  28   7.131  -5.973   7.076
  188   HD12  ILE  28          2HD1      ILE  28   7.250  -4.213   7.110
  189   HD13  ILE  28          3HD1      ILE  28   5.734  -4.985   6.648
  190    H    CYS  29           H        CYS  29   7.413  -0.741   6.290
  191    HA   CYS  29           HA       CYS  29   7.883   1.023   3.975
  192    HB2  CYS  29           1HB      CYS  29   6.039   1.574   5.773
  193    HB3  CYS  29           2HB      CYS  29   7.419   2.121   6.720
  194    H    LEU  30           H        LEU  30   9.941   1.498   3.625
  195    HA   LEU  30           HA       LEU  30  11.893   1.040   5.754
  196    HB2  LEU  30           1HB      LEU  30  12.455   1.685   2.871
  197    HB3  LEU  30           2HB      LEU  30  13.553   0.982   4.056
  198    HG   LEU  30           HG       LEU  30  11.093  -0.532   3.331
  199   HD11  LEU  30          1HD1      LEU  30  11.601  -0.480   1.158
  200   HD12  LEU  30          2HD1      LEU  30  12.967  -1.510   1.587
  201   HD13  LEU  30          3HD1      LEU  30  13.187   0.234   1.451
  202   HD21  LEU  30          1HD2      LEU  30  13.880  -1.134   4.250
  203   HD22  LEU  30          2HD2      LEU  30  12.880  -2.383   3.508
  204   HD23  LEU  30          3HD2      LEU  30  12.341  -1.584   4.986
  205    H    TYR  31           H        TYR  31  10.570   3.572   3.741
  206    HA   TYR  31           HA       TYR  31  12.478   5.568   4.148
  207    HB2  TYR  31           1HB      TYR  31  10.457   5.587   2.579
  208    HB3  TYR  31           2HB      TYR  31   9.514   6.098   3.975
  209    HD1  TYR  31           2HD      TYR  31  12.838   7.047   2.534
  210    HD2  TYR  31           1HD      TYR  31   9.040   8.348   3.944
  211    HE1  TYR  31           2HE      TYR  31  13.486   9.381   2.109
  212    HE2  TYR  31           1HE      TYR  31   9.678  10.686   3.522
  213    HH   TYR  31           HH       TYR  31  11.199  11.992   2.327
  214    H    GLU  32           H        GLU  32  13.233   6.188   6.062
  215    HA   GLU  32           HA       GLU  32  12.341   5.828   8.556
  216    HB2  GLU  32           1HB      GLU  32  13.643   8.312   7.442
  217    HB3  GLU  32           2HB      GLU  32  13.398   8.051   9.163
  218    HG2  GLU  32           1HG      GLU  32  15.027   6.315   7.321
  219    HG3  GLU  32           2HG      GLU  32  15.656   7.465   8.500
  220    H    GLN  33           H        GLN  33  11.375   8.604   6.549
  221    HA   GLN  33           HA       GLN  33   9.718   9.919   8.293
  222    HB2  GLN  33           1HB      GLN  33  10.350  10.338   5.752
  223    HB3  GLN  33           2HB      GLN  33   8.779   9.596   5.480
  224    HG2  GLN  33           1HG      GLN  33   8.136  11.762   5.602
  225    HG3  GLN  33           2HG      GLN  33   8.039  11.350   7.313
  226   HE21  GLN  33          1HE2      GLN  33   9.307  13.460   5.055
  227   HE22  GLN  33          2HE2      GLN  33  10.472  14.249   6.056
  228    H    GLY  34           H        GLY  34   8.549   7.565   5.870
  229    HA2  GLY  34           1HA      GLY  34   6.987   5.860   6.172
  230    HA3  GLY  34           2HA      GLY  34   6.752   6.402   7.828
  231    H    ARG  35           H        ARG  35   6.166   9.123   7.251
  232    HA   ARG  35           HA       ARG  35   3.404   9.005   6.900
  233    HB2  ARG  35           1HB      ARG  35   3.404  11.321   7.084
  234    HB3  ARG  35           2HB      ARG  35   4.902  10.880   7.892
  235    HG2  ARG  35           1HG      ARG  35   5.893  11.235   5.467
  236    HG3  ARG  35           2HG      ARG  35   4.474  12.273   5.310
  237    HD2  ARG  35           1HD      ARG  35   6.183  12.530   7.737
  238    HD3  ARG  35           2HD      ARG  35   6.763  13.210   6.217
  239    HE   ARG  35           HE       ARG  35   4.093  14.016   6.733
  240   HH11  ARG  35          2HH1      ARG  35   7.388  14.604   7.691
  241   HH12  ARG  35          1HH1      ARG  35   7.092  16.241   8.177
  242   HH21  ARG  35          2HH2      ARG  35   3.691  16.169   7.369
  243   HH22  ARG  35          1HH2      ARG  35   4.988  17.129   7.994
  244    H    ASP  36           H        ASP  36   2.495  10.769   5.136
  245    HA   ASP  36           HA       ASP  36   2.775   9.379   2.633
  246    HB2  ASP  36           1HB      ASP  36   1.126  11.210   1.875
  247    HB3  ASP  36           2HB      ASP  36   0.573  10.051   3.081
  248    H    SER  37           H        SER  37   5.215  10.440   3.272
  249    HA   SER  37           HA       SER  37   5.501  12.859   1.642
  250    HB2  SER  37           1HB      SER  37   7.105  11.595   3.808
  251    HB3  SER  37           2HB      SER  37   7.981  12.503   2.576
  252    HG   SER  37           HG       SER  37   7.179  14.306   3.330
  253    H    PHE  38           H        PHE  38   5.878  12.540  -0.442
  254    HA   PHE  38           HA       PHE  38   7.802  10.462  -1.220
  255    HB2  PHE  38           1HB      PHE  38   5.400  11.029  -2.931
  256    HB3  PHE  38           2HB      PHE  38   6.453   9.618  -2.934
  257    HD1  PHE  38           1HD      PHE  38   3.749  11.332  -1.109
  258    HD2  PHE  38           2HD      PHE  38   6.022   7.759  -1.536
  259    HE1  PHE  38           1HE      PHE  38   2.157  10.149   0.347
  260    HE2  PHE  38           2HE      PHE  38   4.433   6.570  -0.082
  261    HZ   PHE  38           HZ       PHE  38   2.498   7.765   0.862
  262    H    GLU  39           H        GLU  39   8.522  10.793  -3.553
  263    HA   GLU  39           HA       GLU  39   8.823  13.681  -4.057
  264    HB2  GLU  39           1HB      GLU  39  10.763  11.429  -4.130
  265    HB3  GLU  39           2HB      GLU  39  10.945  12.683  -5.348
  266    HG2  GLU  39           1HG      GLU  39  11.538  14.274  -3.831
  267    HG3  GLU  39           2HG      GLU  39  10.626  13.524  -2.522
  268    H    ASP  40           H        ASP  40   9.113  14.308  -6.308
  269    HA   ASP  40           HA       ASP  40   7.136  13.221  -7.986
  270    HB2  ASP  40           1HB      ASP  40   8.359  15.573  -7.963
  271    HB3  ASP  40           2HB      ASP  40   9.389  14.790  -9.158
  272    H    GLU  41           H        GLU  41  10.563  12.598  -7.686
  273    HA   GLU  41           HA       GLU  41  10.271  10.334  -9.510
  274    HB2  GLU  41           1HB      GLU  41  12.511  10.922 -10.534
  275    HB3  GLU  41           2HB      GLU  41  11.160  11.944 -11.004
  276    HG2  GLU  41           1HG      GLU  41  11.939  13.513  -9.142
  277    HG3  GLU  41           2HG      GLU  41  13.432  12.577  -9.159
  278    H    GLY  42           H        GLY  42  11.239   8.548  -8.763
  279    HA2  GLY  42           1HA      GLY  42  13.487   7.831  -7.738
  280    HA3  GLY  42           2HA      GLY  42  12.970   8.845  -6.399
  281    H    ARG  43           H        ARG  43  13.518   6.380  -5.695
  282    HA   ARG  43           HA       ARG  43  11.445   4.481  -5.991
  283    HB2  ARG  43           1HB      ARG  43  12.531   3.310  -4.112
  284    HB3  ARG  43           2HB      ARG  43  13.687   3.808  -5.339
  285    HG2  ARG  43           1HG      ARG  43  14.408   5.658  -3.977
  286    HG3  ARG  43           2HG      ARG  43  13.164   5.299  -2.778
  287    HD2  ARG  43           1HD      ARG  43  14.951   4.268  -1.800
  288    HD3  ARG  43           2HD      ARG  43  14.339   2.937  -2.781
  289    HE   ARG  43           HE       ARG  43  16.242   3.044  -4.051
  290   HH11  ARG  43          2HH1      ARG  43  15.966   5.950  -2.153
  291   HH12  ARG  43          1HH1      ARG  43  17.543   6.530  -2.574
  292   HH21  ARG  43          2HH2      ARG  43  18.320   3.798  -4.613
  293   HH22  ARG  43          1HH2      ARG  43  18.881   5.306  -3.975
  294    H    TRP  44           H        TRP  44  11.794   7.260  -4.002
  295    HA   TRP  44           HA       TRP  44   9.685   6.383  -2.173
  296    HB2  TRP  44           1HB      TRP  44  11.206   8.991  -2.100
  297    HB3  TRP  44           2HB      TRP  44  10.264   8.259  -0.804
  298    HD1  TRP  44           HD       TRP  44  13.713   8.757  -1.713
  299    HE1  TRP  44           1HE      TRP  44  15.264   7.037  -0.589
  300    HE3  TRP  44           3HE      TRP  44  10.205   5.345  -0.233
  301    HZ2  TRP  44           2HZ      TRP  44  15.031   4.562   0.747
  302    HZ3  TRP  44           3HZ      TRP  44  10.952   3.328   0.961
  303    HH2  TRP  44           HH       TRP  44  13.316   2.946   1.440
  304    H    ARG  45           H        ARG  45   8.874   6.750  -4.815
  305    HA   ARG  45           HA       ARG  45   7.558   9.355  -4.908
  306    HB2  ARG  45           1HB      ARG  45   6.922   8.739  -7.187
  307    HB3  ARG  45           2HB      ARG  45   8.653   8.548  -6.946
  308    HG2  ARG  45           1HG      ARG  45   8.405   6.158  -6.744
  309    HG3  ARG  45           2HG      ARG  45   6.649   6.304  -6.844
  310    HD2  ARG  45           1HD      ARG  45   8.337   7.419  -9.037
  311    HD3  ARG  45           2HD      ARG  45   8.066   5.678  -8.959
  312    HE   ARG  45           HE       ARG  45   5.836   6.017  -9.495
  313   HH11  ARG  45          2HH1      ARG  45   7.458   9.055  -8.985
  314   HH12  ARG  45          1HH1      ARG  45   6.177  10.002  -9.666
  315   HH21  ARG  45          2HH2      ARG  45   4.143   7.253 -10.393
  316   HH22  ARG  45          1HH2      ARG  45   4.291   8.976 -10.466
  317    H    LEU  46           H        LEU  46   5.321   9.613  -5.021
  318    HA   LEU  46           HA       LEU  46   3.810   7.673  -3.545
  319    HB2  LEU  46           1HB      LEU  46   3.561  10.173  -3.382
  320    HB3  LEU  46           2HB      LEU  46   2.772  10.121  -4.956
  321    HG   LEU  46           HG       LEU  46   1.724   8.544  -2.625
  322   HD11  LEU  46          1HD1      LEU  46   2.007  11.141  -2.293
  323   HD12  LEU  46          2HD1      LEU  46   0.537  10.306  -1.789
  324   HD13  LEU  46          3HD1      LEU  46   0.568  11.196  -3.312
  325   HD21  LEU  46          1HD2      LEU  46   0.720   7.837  -4.606
  326   HD22  LEU  46          2HD2      LEU  46   0.671   9.468  -5.276
  327   HD23  LEU  46          3HD2      LEU  46  -0.418   9.021  -3.962
  328    H    ILE  47           H        ILE  47   3.141   5.868  -4.508
  329    HA   ILE  47           HA       ILE  47   2.237   5.989  -7.298
  330    HB   ILE  47           HB       ILE  47   2.951   3.598  -5.597
  331   HG12  ILE  47          1HG1      ILE  47   4.377   5.029  -7.842
  332   HG13  ILE  47          2HG1      ILE  47   4.939   4.789  -6.191
  333   HG21  ILE  47          1HG2      ILE  47   2.100   2.238  -7.151
  334   HG22  ILE  47          2HG2      ILE  47   1.216   3.650  -7.726
  335   HG23  ILE  47          3HG2      ILE  47   2.749   3.204  -8.475
  336   HD11  ILE  47          1HD1      ILE  47   4.701   2.755  -8.383
  337   HD12  ILE  47          2HD1      ILE  47   6.151   3.285  -7.529
  338   HD13  ILE  47          3HD1      ILE  47   4.939   2.316  -6.692
  339    H    LEU  48           H        LEU  48   0.128   6.147  -7.628
  340    HA   LEU  48           HA       LEU  48  -1.729   5.273  -5.544
  341    HB2  LEU  48           1HB      LEU  48  -2.075   6.989  -7.992
  342    HB3  LEU  48           2HB      LEU  48  -3.418   6.474  -6.975
  343    HG   LEU  48           HG       LEU  48  -1.096   8.083  -5.933
  344   HD11  LEU  48          1HD1      LEU  48  -3.122   9.848  -6.019
  345   HD12  LEU  48          2HD1      LEU  48  -3.464   8.917  -7.477
  346   HD13  LEU  48          3HD1      LEU  48  -1.897   9.702  -7.281
  347   HD21  LEU  48          1HD2      LEU  48  -2.187   7.104  -4.126
  348   HD22  LEU  48          2HD2      LEU  48  -3.776   7.253  -4.877
  349   HD23  LEU  48          3HD2      LEU  48  -2.955   8.686  -4.255
  350    H    CYS  49           H        CYS  49  -3.280   3.729  -5.851
  351    HA   CYS  49           HA       CYS  49  -2.832   1.548  -7.416
  352    HB2  CYS  49           1HB      CYS  49  -4.485   1.589  -5.606
  353    HB3  CYS  49           2HB      CYS  49  -5.536   2.615  -6.576
  354    H    ALA  50           H        ALA  50  -4.011   0.685  -9.288
  355    HA   ALA  50           HA       ALA  50  -4.515   2.800 -11.275
  356    HB1  ALA  50           1HB      ALA  50  -4.084   0.670 -12.827
  357    HB2  ALA  50           2HB      ALA  50  -2.782   1.707 -12.244
  358    HB3  ALA  50           3HB      ALA  50  -3.134   0.188 -11.421
  359    H    THR  51           H        THR  51  -5.577  -0.411 -10.202
  360    HA   THR  51           HA       THR  51  -7.740  -0.739 -11.923
  361    HB   THR  51           HB       THR  51  -7.445  -1.700  -9.071
  362    HG1  THR  51           1HG      THR  51  -5.995  -2.345 -11.027
  363   HG21  THR  51          1HG2      THR  51  -9.482  -2.590  -9.207
  364   HG22  THR  51          2HG2      THR  51  -9.054  -3.402 -10.713
  365   HG23  THR  51          3HG2      THR  51  -9.716  -1.768 -10.750
  366    H    CYS  52           H        CYS  52  -7.563   0.895  -8.787
  367    HA   CYS  52           HA       CYS  52 -10.235   2.023  -9.318
  368    HB2  CYS  52           1HB      CYS  52 -10.690   2.051  -6.964
  369    HB3  CYS  52           2HB      CYS  52 -10.142   0.430  -7.378
  370    H    GLY  53           H        GLY  53  -7.007   2.584  -8.013
  371    HA2  GLY  53           1HA      GLY  53  -5.767   4.518  -7.895
  372    HA3  GLY  53           2HA      GLY  53  -6.990   5.288  -8.894
  373    H    SER  54           H        SER  54  -6.774   3.984  -5.579
  374    HA   SER  54           HA       SER  54  -7.888   6.534  -4.617
  375    HB2  SER  54           1HB      SER  54  -8.632   3.762  -3.649
  376    HB3  SER  54           2HB      SER  54  -9.177   5.272  -2.918
  377    HG   SER  54           HG       SER  54  -9.621   5.181  -5.608
  378    H    HIS  55           H        HIS  55  -6.078   3.605  -3.783
  379    HA   HIS  55           HA       HIS  55  -5.071   4.696  -1.329
  380    HB2  HIS  55           1HB      HIS  55  -4.503   2.211  -2.920
  381    HB3  HIS  55           2HB      HIS  55  -3.481   2.656  -1.556
  382    HD1  HIS  55           1HD      HIS  55  -4.180   1.625   0.570
  383    HD2  HIS  55           2HD      HIS  55  -7.392   2.146  -2.014
  384    HE1  HIS  55           1HE      HIS  55  -6.168   0.650   1.763
  385    HE2  HIS  55           2HE      HIS  55  -8.082   0.900   0.145
  386    H    GLY  56           H        GLY  56  -2.699   4.874  -0.913
  387    HA2  GLY  56           1HA      GLY  56  -1.036   5.504  -3.206
  388    HA3  GLY  56           2HA      GLY  56  -1.469   6.880  -2.203
  389    H    THR  57           H        THR  57   0.872   4.655  -2.750
  390    HA   THR  57           HA       THR  57   2.095   5.177  -0.156
  391    HB   THR  57           HB       THR  57   0.843   2.903  -0.156
  392    HG1  THR  57           1HG      THR  57   3.055   3.767   0.999
  393   HG21  THR  57          1HG2      THR  57   2.392   2.498  -2.417
  394   HG22  THR  57          2HG2      THR  57   1.524   1.258  -1.511
  395   HG23  THR  57          3HG2      THR  57   3.224   1.577  -1.165
  396    H    HIS  58           H        HIS  58   4.412   4.477  -0.127
  397    HA   HIS  58           HA       HIS  58   5.780   5.516  -2.347
  398    HB2  HIS  58           1HB      HIS  58   7.027   3.657  -0.331
  399    HB3  HIS  58           2HB      HIS  58   7.780   4.994  -1.196
  400    HD2  HIS  58           2HD      HIS  58   7.739   7.379   0.131
  401    HE1  HIS  58           1HE      HIS  58   5.078   6.234   3.231
  402    HE2  HIS  58           2HE      HIS  58   6.539   8.070   2.316
  403    H    ARG  59           H        ARG  59   7.646   4.210  -3.396
  404    HA   ARG  59           HA       ARG  59   6.413   2.044  -4.840
  405    HB2  ARG  59           1HB      ARG  59   7.943   3.849  -5.816
  406    HB3  ARG  59           2HB      ARG  59   9.274   2.951  -5.098
  407    HG2  ARG  59           1HG      ARG  59   7.344   1.526  -6.864
  408    HG3  ARG  59           2HG      ARG  59   8.586   2.554  -7.581
  409    HD2  ARG  59           1HD      ARG  59   9.198   0.399  -5.572
  410    HD3  ARG  59           2HD      ARG  59   9.175   0.109  -7.311
  411    HE   ARG  59           HE       ARG  59  10.839   2.283  -6.879
  412   HH11  ARG  59          2HH1      ARG  59  10.722  -1.091  -6.027
  413   HH12  ARG  59          1HH1      ARG  59  12.444  -1.265  -5.952
  414   HH21  ARG  59          2HH2      ARG  59  13.108   2.066  -6.782
  415   HH22  ARG  59          1HH2      ARG  59  13.800   0.531  -6.380
  416    H    ASP  60           H        ASP  60   9.606   2.276  -3.266
  417    HA   ASP  60           HA       ASP  60  10.047  -0.481  -3.124
  418    HB2  ASP  60           1HB      ASP  60  11.634   0.240  -1.183
  419    HB3  ASP  60           2HB      ASP  60  11.969   0.790  -2.822
  420    H    CYS  61           H        CYS  61   8.256   1.665  -1.048
  421    HA   CYS  61           HA       CYS  61   8.143   0.076   1.266
  422    HB2  CYS  61           1HB      CYS  61   7.457   2.451   1.185
  423    HB3  CYS  61           2HB      CYS  61   6.057   2.000   0.216
  424    H    SER  62           H        SER  62   6.240   0.065  -1.690
  425    HA   SER  62           HA       SER  62   4.388  -1.912  -0.671
  426    HB2  SER  62           1HB      SER  62   4.654  -0.309  -3.162
  427    HB3  SER  62           2HB      SER  62   3.807  -1.851  -3.289
  428    HG   SER  62           HG       SER  62   2.286  -0.349  -2.753
  429    H    SER  63           H        SER  63   7.340  -2.441  -0.973
  430    HA   SER  63           HA       SER  63   8.762  -4.054  -1.754
  431    HB2  SER  63           1HB      SER  63   8.092  -6.178  -1.154
  432    HB3  SER  63           2HB      SER  63   6.877  -5.224  -0.302
  433    HG   SER  63           HG       SER  63   6.424  -7.103  -2.032
  434    H    LEU  64           H        LEU  64   7.597  -2.480  -3.820
  435    HA   LEU  64           HA       LEU  64   6.924  -4.313  -5.970
  436    HB2  LEU  64           1HB      LEU  64   7.216  -1.316  -5.889
  437    HB3  LEU  64           2HB      LEU  64   6.757  -2.229  -7.324
  438    HG   LEU  64           HG       LEU  64   5.154  -2.277  -4.776
  439   HD11  LEU  64          1HD1      LEU  64   4.430  -0.628  -7.164
  440   HD12  LEU  64          2HD1      LEU  64   5.469   0.028  -5.900
  441   HD13  LEU  64          3HD1      LEU  64   3.839  -0.517  -5.506
  442   HD21  LEU  64          1HD2      LEU  64   4.805  -3.289  -7.561
  443   HD22  LEU  64          2HD2      LEU  64   3.386  -2.816  -6.626
  444   HD23  LEU  64          3HD2      LEU  64   4.458  -4.080  -6.023
  445    H    ARG  65           H        ARG  65   8.049  -3.392  -8.180
  446    HA   ARG  65           HA       ARG  65  10.911  -3.869  -7.735
  447    HB2  ARG  65           1HB      ARG  65   9.005  -4.525  -9.910
  448    HB3  ARG  65           2HB      ARG  65  10.644  -4.121 -10.401
  449    HG2  ARG  65           1HG      ARG  65  10.382  -6.516 -10.135
  450    HG3  ARG  65           2HG      ARG  65  11.518  -5.876  -8.946
  451    HD2  ARG  65           1HD      ARG  65  10.149  -7.378  -7.760
  452    HD3  ARG  65           2HD      ARG  65   9.553  -5.772  -7.344
  453    HE   ARG  65           HE       ARG  65   7.942  -6.396  -9.363
  454   HH11  ARG  65          2HH1      ARG  65   8.964  -8.286  -6.623
  455   HH12  ARG  65          1HH1      ARG  65   7.504  -9.217  -6.556
  456   HH21  ARG  65          2HH2      ARG  65   6.016  -7.615  -9.284
  457   HH22  ARG  65          1HH2      ARG  65   5.828  -8.835  -8.071
  458    HA   PRO  66           HA       PRO  66  12.159   0.104  -9.112
  459    HB2  PRO  66           1HB      PRO  66  14.298  -0.444 -10.691
  460    HB3  PRO  66           2HB      PRO  66  14.335  -0.609  -8.932
  461    HG2  PRO  66           1HG      PRO  66  13.956  -2.715 -11.025
  462    HG3  PRO  66           2HG      PRO  66  14.947  -2.765  -9.556
  463    HD2  PRO  66           1HD      PRO  66  12.510  -3.935  -9.710
  464    HD3  PRO  66           2HD      PRO  66  13.141  -3.240  -8.204
  465    H    ASN  67           H        ASN  67  11.698  -2.311 -11.636
  466    HA   ASN  67           HA       ASN  67  11.073  -0.152 -13.538
  467    HB2  ASN  67           1HB      ASN  67  12.920  -1.996 -13.966
  468    HB3  ASN  67           2HB      ASN  67  11.528  -2.966 -14.439
  469   HD21  ASN  67          1HD2      ASN  67  13.650  -2.145 -16.130
  470   HD22  ASN  67          2HD2      ASN  67  12.977  -1.136 -17.360
  471    H    SER  68           H        SER  68   9.165  -0.858 -11.647
  472    HA   SER  68           HA       SER  68   7.335  -2.798 -12.675
  473    HB2  SER  68           1HB      SER  68   7.474  -2.150 -10.264
  474    HB3  SER  68           2HB      SER  68   6.787  -0.582 -10.687
  475    HG   SER  68           HG       SER  68   5.502  -3.016 -11.334
  476    H    LYS  69           H        LYS  69   4.960  -2.055 -13.007
  477    HA   LYS  69           HA       LYS  69   4.968   0.250 -14.844
  478    HB2  LYS  69           1HB      LYS  69   3.645  -2.439 -15.072
  479    HB3  LYS  69           2HB      LYS  69   3.022  -1.049 -15.951
  480    HG2  LYS  69           1HG      LYS  69   5.222  -0.775 -17.024
  481    HG3  LYS  69           2HG      LYS  69   5.785  -2.223 -16.187
  482    HD2  LYS  69           1HD      LYS  69   4.456  -3.629 -17.448
  483    HD3  LYS  69           2HD      LYS  69   3.302  -2.353 -17.843
  484    HE2  LYS  69           1HE      LYS  69   6.121  -2.220 -18.842
  485    HE3  LYS  69           2HE      LYS  69   4.925  -3.212 -19.673
  486    HZ1  LYS  69           1HZ      LYS  69   5.253  -0.805 -20.433
  487    HZ2  LYS  69           2HZ      LYS  69   4.371  -0.381 -19.054
  488    HZ3  LYS  69           3HZ      LYS  69   3.668  -1.365 -20.237
  489    H    LYS  70           H        LYS  70   2.657  -1.805 -13.060
  490    HA   LYS  70           HA       LYS  70   1.435   0.608 -11.949
  491    HB2  LYS  70           1HB      LYS  70  -0.827  -0.193 -12.496
  492    HB3  LYS  70           2HB      LYS  70   0.120   0.128 -13.943
  493    HG2  LYS  70           1HG      LYS  70   0.300  -2.103 -14.486
  494    HG3  LYS  70           2HG      LYS  70   0.024  -2.637 -12.827
  495    HD2  LYS  70           1HD      LYS  70  -2.164  -1.176 -14.215
  496    HD3  LYS  70           2HD      LYS  70  -1.847  -2.846 -14.689
  497    HE2  LYS  70           1HE      LYS  70  -2.077  -2.166 -11.793
  498    HE3  LYS  70           2HE      LYS  70  -3.542  -2.294 -12.765
  499    HZ1  LYS  70           1HZ      LYS  70  -1.504  -4.398 -12.299
  500    HZ2  LYS  70           2HZ      LYS  70  -2.736  -4.535 -13.450
  501    HZ3  LYS  70           3HZ      LYS  70  -3.123  -4.407 -11.808
  502    H    TRP  71           H        TRP  71   0.380   0.303  -9.982
  503    HA   TRP  71           HA       TRP  71   0.690  -2.374  -8.789
  504    HB2  TRP  71           1HB      TRP  71   2.286  -1.227  -7.594
  505    HB3  TRP  71           2HB      TRP  71   1.454   0.317  -7.757
  506    HD1  TRP  71           HD       TRP  71   1.388  -2.896  -5.643
  507    HE1  TRP  71           1HE      TRP  71   0.181  -2.382  -3.428
  508    HE3  TRP  71           3HE      TRP  71  -0.187   1.861  -6.659
  509    HZ2  TRP  71           2HZ      TRP  71  -1.249  -0.244  -2.265
  510    HZ3  TRP  71           3HZ      TRP  71  -1.469   3.071  -4.943
  511    HH2  TRP  71           HH       TRP  71  -1.988   2.038  -2.792
  512    H    GLU  72           H        GLU  72  -0.926  -3.094  -7.413
  513    HA   GLU  72           HA       GLU  72  -3.412  -1.518  -7.498
  514    HB2  GLU  72           1HB      GLU  72  -2.909  -4.484  -7.473
  515    HB3  GLU  72           2HB      GLU  72  -4.472  -3.818  -7.022
  516    HG2  GLU  72           1HG      GLU  72  -4.951  -3.125  -9.148
  517    HG3  GLU  72           2HG      GLU  72  -3.254  -2.981  -9.601
  518    H    CYS  73           H        CYS  73  -4.732  -1.416  -5.648
  519    HA   CYS  73           HA       CYS  73  -3.243  -1.506  -3.163
  520    HB2  CYS  73           1HB      CYS  73  -5.025  -0.237  -2.220
  521    HB3  CYS  73           2HB      CYS  73  -4.755   0.408  -3.836
  522    H    ASN  74           H        ASN  74  -4.594  -2.238  -1.173
  523    HA   ASN  74           HA       ASN  74  -4.879  -5.008  -1.282
  524    HB2  ASN  74           1HB      ASN  74  -4.535  -3.502   0.766
  525    HB3  ASN  74           2HB      ASN  74  -6.282  -3.282   0.752
  526   HD21  ASN  74          1HD2      ASN  74  -6.059  -4.246   2.906
  527   HD22  ASN  74          2HD2      ASN  74  -6.070  -5.969   3.041
  528    H    GLU  75           H        GLU  75  -7.496  -2.615  -0.857
  529    HA   GLU  75           HA       GLU  75  -9.709  -4.112  -0.941
  530    HB2  GLU  75           1HB      GLU  75  -9.480  -1.551  -1.040
  531    HB3  GLU  75           2HB      GLU  75  -9.513  -1.744  -2.787
  532    HG2  GLU  75           1HG      GLU  75 -11.701  -2.739  -2.684
  533    HG3  GLU  75           2HG      GLU  75 -11.666  -2.715  -0.922
  534    H    CYS  76           H        CYS  76  -7.660  -3.420  -3.724
  535    HA   CYS  76           HA       CYS  76  -9.386  -4.843  -5.551
  536    HB2  CYS  76           1HB      CYS  76  -6.642  -3.619  -5.869
  537    HB3  CYS  76           2HB      CYS  76  -7.498  -4.437  -7.172
  538    H    LEU  77           H        LEU  77  -6.089  -5.322  -4.285
  539    HA   LEU  77           HA       LEU  77  -5.530  -7.765  -5.438
  540    HB2  LEU  77           1HB      LEU  77  -4.737  -6.627  -2.770
  541    HB3  LEU  77           2HB      LEU  77  -4.101  -8.154  -3.379
  542    HG   LEU  77           HG       LEU  77  -3.785  -5.520  -4.811
  543   HD11  LEU  77          1HD1      LEU  77  -2.435  -5.033  -3.072
  544   HD12  LEU  77          2HD1      LEU  77  -1.316  -6.095  -3.926
  545   HD13  LEU  77          3HD1      LEU  77  -2.272  -6.720  -2.582
  546   HD21  LEU  77          1HD2      LEU  77  -3.049  -6.792  -6.473
  547   HD22  LEU  77          2HD2      LEU  77  -3.270  -8.251  -5.506
  548   HD23  LEU  77          3HD2      LEU  77  -1.750  -7.359  -5.422
  549    HA   PRO  78           HA       PRO  78  -8.220 -10.717  -3.606
  550    HB2  PRO  78           1HB      PRO  78  -6.659 -12.935  -3.733
  551    HB3  PRO  78           2HB      PRO  78  -7.416 -12.210  -5.157
  552    HG2  PRO  78           1HG      PRO  78  -4.607 -11.935  -4.159
  553    HG3  PRO  78           2HG      PRO  78  -5.187 -12.169  -5.818
  554    HD2  PRO  78           1HD      PRO  78  -4.441  -9.747  -4.863
  555    HD3  PRO  78           2HD      PRO  78  -5.720  -9.942  -6.080
  556    H    ALA  79           H        ALA  79  -8.455 -10.114  -1.466
  557    HA   ALA  79           HA       ALA  79  -6.459 -11.171   0.426
  558    HB1  ALA  79           1HB      ALA  79  -6.727  -9.363   1.756
  559    HB2  ALA  79           2HB      ALA  79  -7.234  -8.611   0.243
  560    HB3  ALA  79           3HB      ALA  79  -8.443  -9.204   1.381
  561    H    SER  80           H        SER  80  -7.255 -13.230   0.706
  562    HA   SER  80           HA       SER  80  -8.729 -14.906   1.256
  563    HB2  SER  80           1HB      SER  80  -9.641 -14.641   3.522
  564    HB3  SER  80           2HB      SER  80  -7.979 -14.056   3.442
  565    HG   SER  80           HG       SER  80  -9.970 -12.189   2.942
  566    H    GLY  81           H        GLY  81  -9.826 -13.274  -0.736
  567    HA2  GLY  81           1HA      GLY  81 -12.003 -13.585  -1.691
  568    HA3  GLY  81           2HA      GLY  81 -12.681 -13.531  -0.071
  569    HA   PRO  82           HA       PRO  82 -13.402  -9.411  -2.051
  570    HB2  PRO  82           1HB      PRO  82 -15.978  -9.207  -1.220
  571    HB3  PRO  82           2HB      PRO  82 -15.513 -10.031  -2.712
  572    HG2  PRO  82           1HG      PRO  82 -16.155 -11.192  -0.029
  573    HG3  PRO  82           2HG      PRO  82 -16.650 -11.751  -1.637
  574    HD2  PRO  82           1HD      PRO  82 -14.617 -12.891  -0.260
  575    HD3  PRO  82           2HD      PRO  82 -14.634 -12.795  -2.032
  576    H    SER  83           H        SER  83 -11.942  -8.542  -0.488
  577    HA   SER  83           HA       SER  83 -12.658  -8.212   2.246
  578    HB2  SER  83           1HB      SER  83 -10.720  -6.618   2.287
  579    HB3  SER  83           2HB      SER  83 -10.323  -8.209   1.638
  580    HG   SER  83           HG       SER  83  -9.644  -6.169   0.458
  581    H    SER  84           H        SER  84 -13.860  -6.700   3.200
  582    HA   SER  84           HA       SER  84 -15.170  -4.708   1.571
  583    HB2  SER  84           1HB      SER  84 -16.367  -4.166   3.722
  584    HB3  SER  84           2HB      SER  84 -16.536  -5.839   3.192
  585    HG   SER  84           HG       SER  84 -15.821  -6.304   5.107
  586    H    GLY  85           H        GLY  85 -12.438  -4.234   1.669
  587    HA2  GLY  85           1HA      GLY  85 -12.066  -1.625   1.946
  588    HA3  GLY  85           2HA      GLY  85 -12.008  -2.117   3.632
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1 -40.610  24.497  25.650
    2    HA2  GLY   1           1HA      GLY   1 -40.227  21.643  25.995
    3    HA3  GLY   1           2HA      GLY   1 -39.891  22.241  24.377
    4    H    SER   2           H        SER   2 -37.761  21.220  25.155
    5    HA   SER   2           HA       SER   2 -36.078  23.410  26.135
    6    HB2  SER   2           1HB      SER   2 -35.921  20.563  27.156
    7    HB3  SER   2           2HB      SER   2 -34.807  21.865  27.573
    8    HG   SER   2           HG       SER   2 -37.454  22.479  27.972
    9    H    SER   3           H        SER   3 -33.653  22.599  25.943
   10    HA   SER   3           HA       SER   3 -33.315  21.064  23.467
   11    HB2  SER   3           1HB      SER   3 -32.477  23.899  23.960
   12    HB3  SER   3           2HB      SER   3 -31.495  22.876  22.913
   13    HG   SER   3           HG       SER   3 -34.094  23.836  22.545
   14    H    GLY   4           H        GLY   4 -30.837  20.788  23.054
   15    HA2  GLY   4           1HA      GLY   4 -29.550  20.220  25.654
   16    HA3  GLY   4           2HA      GLY   4 -29.481  19.099  24.302
   17    H    SER   5           H        SER   5 -27.196  19.152  24.374
   18    HA   SER   5           HA       SER   5 -26.031  21.077  22.648
   19    HB2  SER   5           1HB      SER   5 -24.413  22.055  24.255
   20    HB3  SER   5           2HB      SER   5 -26.079  22.502  24.626
   21    HG   SER   5           HG       SER   5 -25.809  20.400  26.001
   22    H    SER   6           H        SER   6 -23.655  20.718  22.400
   23    HA   SER   6           HA       SER   6 -23.132  17.911  22.284
   24    HB2  SER   6           1HB      SER   6 -21.602  20.379  21.518
   25    HB3  SER   6           2HB      SER   6 -20.801  18.808  21.527
   26    HG   SER   6           HG       SER   6 -22.364  18.071  20.054
   27    H    GLY   7           H        GLY   7 -20.762  17.231  22.952
   28    HA2  GLY   7           1HA      GLY   7 -20.304  18.162  25.718
   29    HA3  GLY   7           2HA      GLY   7 -20.323  16.452  25.315
   30    H    GLU   8           H        GLU   8 -18.217  16.093  26.003
   31    HA   GLU   8           HA       GLU   8 -15.966  17.584  25.464
   32    HB2  GLU   8           1HB      GLU   8 -16.417  14.657  25.903
   33    HB3  GLU   8           2HB      GLU   8 -14.813  15.226  25.460
   34    HG2  GLU   8           1HG      GLU   8 -14.738  16.652  27.405
   35    HG3  GLU   8           2HG      GLU   8 -16.391  16.209  27.827
   36    H    LEU   9           H        LEU   9 -14.097  16.724  24.015
   37    HA   LEU   9           HA       LEU   9 -14.994  16.978  21.303
   38    HB2  LEU   9           1HB      LEU   9 -12.574  16.795  20.765
   39    HB3  LEU   9           2HB      LEU   9 -12.971  18.074  21.910
   40    HG   LEU   9           HG       LEU   9 -12.325  16.150  23.648
   41   HD11  LEU   9          1HD1      LEU   9 -11.867  14.565  21.762
   42   HD12  LEU   9          2HD1      LEU   9 -10.529  14.790  22.888
   43   HD13  LEU   9          3HD1      LEU   9 -10.503  15.592  21.318
   44   HD21  LEU   9          1HD2      LEU   9 -10.433  17.371  24.065
   45   HD22  LEU   9          2HD2      LEU   9 -11.341  18.520  23.082
   46   HD23  LEU   9          3HD2      LEU   9 -10.047  17.566  22.355
   47    H    GLU  10           H        GLU  10 -14.380  15.498  19.575
   48    HA   GLU  10           HA       GLU  10 -14.723  12.718  20.426
   49    HB2  GLU  10           1HB      GLU  10 -15.281  14.224  17.906
   50    HB3  GLU  10           2HB      GLU  10 -15.005  12.490  17.812
   51    HG2  GLU  10           1HG      GLU  10 -17.020  13.675  19.688
   52    HG3  GLU  10           2HG      GLU  10 -17.409  13.292  18.012
   53    HA   PRO  11           HA       PRO  11 -10.521  11.720  19.551
   54    HB2  PRO  11           1HB      PRO  11 -10.799   9.036  19.255
   55    HB3  PRO  11           2HB      PRO  11 -10.867   9.841  20.827
   56    HG2  PRO  11           1HG      PRO  11 -13.110   8.906  19.079
   57    HG3  PRO  11           2HG      PRO  11 -12.925   8.759  20.836
   58    HD2  PRO  11           1HD      PRO  11 -14.477  10.658  19.689
   59    HD3  PRO  11           2HD      PRO  11 -13.614  10.925  21.217
   60    H    GLY  12           H        GLY  12  -9.154  10.972  17.858
   61    HA2  GLY  12           1HA      GLY  12  -8.583  11.025  15.618
   62    HA3  GLY  12           2HA      GLY  12  -9.725   9.692  15.542
   63    H    ALA  13           H        ALA  13  -9.890  13.247  15.803
   64    HA   ALA  13           HA       ALA  13 -12.011  13.191  13.760
   65    HB1  ALA  13           1HB      ALA  13 -11.536  15.535  15.555
   66    HB2  ALA  13           2HB      ALA  13 -13.019  15.022  14.749
   67    HB3  ALA  13           3HB      ALA  13 -12.420  14.127  16.145
   68    H    PHE  14           H        PHE  14 -10.321  13.096  12.119
   69    HA   PHE  14           HA       PHE  14  -9.524  15.769  11.312
   70    HB2  PHE  14           1HB      PHE  14  -7.656  14.579  12.713
   71    HB3  PHE  14           2HB      PHE  14  -7.392  13.664  11.232
   72    HD1  PHE  14           1HD      PHE  14  -7.545  17.115  12.583
   73    HD2  PHE  14           2HD      PHE  14  -6.113  14.553   9.500
   74    HE1  PHE  14           1HE      PHE  14  -6.163  18.951  11.704
   75    HE2  PHE  14           2HE      PHE  14  -4.727  16.384   8.617
   76    HZ   PHE  14           HZ       PHE  14  -4.751  18.586   9.719
   77    H    SER  15           H        SER  15  -9.805  16.027   9.191
   78    HA   SER  15           HA       SER  15  -9.908  13.616   7.498
   79    HB2  SER  15           1HB      SER  15 -11.776  15.956   7.657
   80    HB3  SER  15           2HB      SER  15 -11.574  15.108   6.123
   81    HG   SER  15           HG       SER  15 -11.930  13.165   7.652
   82    H    GLU  16           H        GLU  16  -8.911  13.702   5.535
   83    HA   GLU  16           HA       GLU  16  -7.409  16.168   4.952
   84    HB2  GLU  16           1HB      GLU  16  -5.766  14.745   3.818
   85    HB3  GLU  16           2HB      GLU  16  -5.972  14.268   5.498
   86    HG2  GLU  16           1HG      GLU  16  -7.527  12.894   3.354
   87    HG3  GLU  16           2HG      GLU  16  -5.844  12.461   3.649
   88    H    LEU  17           H        LEU  17  -6.833  16.376   2.567
   89    HA   LEU  17           HA       LEU  17  -8.978  16.930   1.026
   90    HB2  LEU  17           1HB      LEU  17  -6.297  15.894   0.131
   91    HB3  LEU  17           2HB      LEU  17  -7.499  16.565  -0.969
   92    HG   LEU  17           HG       LEU  17  -6.248  18.092   1.312
   93   HD11  LEU  17          1HD1      LEU  17  -5.454  19.093  -1.208
   94   HD12  LEU  17          2HD1      LEU  17  -5.133  17.359  -1.203
   95   HD13  LEU  17          3HD1      LEU  17  -4.448  18.385   0.057
   96   HD21  LEU  17          1HD2      LEU  17  -8.337  19.050   0.768
   97   HD22  LEU  17          2HD2      LEU  17  -8.068  18.844  -0.963
   98   HD23  LEU  17          3HD2      LEU  17  -7.125  20.030  -0.059
   99    H    TYR  18           H        TYR  18 -10.424  15.895  -0.240
  100    HA   TYR  18           HA       TYR  18 -10.478  12.988  -0.085
  101    HB2  TYR  18           1HB      TYR  18 -12.556  14.804  -1.309
  102    HB3  TYR  18           2HB      TYR  18 -12.763  13.137  -0.784
  103    HD1  TYR  18           2HD      TYR  18 -12.835  12.601   1.630
  104    HD2  TYR  18           1HD      TYR  18 -12.688  16.620   0.242
  105    HE1  TYR  18           2HE      TYR  18 -13.573  13.385   3.841
  106    HE2  TYR  18           1HE      TYR  18 -13.425  17.416   2.450
  107    HH   TYR  18           HH       TYR  18 -13.391  15.512   5.194
  108    H    GLN  19           H        GLN  19 -10.460  15.545  -2.537
  109    HA   GLN  19           HA       GLN  19 -10.675  13.982  -4.819
  110    HB2  GLN  19           1HB      GLN  19  -9.364  16.618  -4.251
  111    HB3  GLN  19           2HB      GLN  19  -9.197  15.879  -5.838
  112    HG2  GLN  19           1HG      GLN  19 -11.735  15.731  -5.860
  113    HG3  GLN  19           2HG      GLN  19 -11.694  16.822  -4.476
  114   HE21  GLN  19          1HE2      GLN  19  -9.951  18.669  -4.962
  115   HE22  GLN  19          2HE2      GLN  19 -10.248  19.505  -6.445
  116    H    ARG  20           H        ARG  20  -7.659  15.170  -3.323
  117    HA   ARG  20           HA       ARG  20  -6.188  13.094  -4.779
  118    HB2  ARG  20           1HB      ARG  20  -5.446  15.720  -3.566
  119    HB3  ARG  20           2HB      ARG  20  -4.207  14.480  -3.709
  120    HG2  ARG  20           1HG      ARG  20  -4.939  14.338  -6.173
  121    HG3  ARG  20           2HG      ARG  20  -5.710  15.897  -5.871
  122    HD2  ARG  20           1HD      ARG  20  -2.863  15.487  -5.075
  123    HD3  ARG  20           2HD      ARG  20  -3.254  15.776  -6.770
  124    HE   ARG  20           HE       ARG  20  -3.342  17.681  -4.620
  125   HH11  ARG  20          2HH1      ARG  20  -4.574  16.862  -7.772
  126   HH12  ARG  20          1HH1      ARG  20  -4.976  18.496  -8.183
  127   HH21  ARG  20          2HH2      ARG  20  -3.868  19.836  -5.150
  128   HH22  ARG  20          1HH2      ARG  20  -4.573  20.187  -6.691
  129    H    TYR  21           H        TYR  21  -6.074  11.235  -3.695
  130    HA   TYR  21           HA       TYR  21  -5.893  11.252  -0.782
  131    HB2  TYR  21           1HB      TYR  21  -7.513   9.729  -1.781
  132    HB3  TYR  21           2HB      TYR  21  -6.246   8.972  -2.740
  133    HD1  TYR  21           2HD      TYR  21  -4.264   7.940  -1.361
  134    HD2  TYR  21           1HD      TYR  21  -8.118   8.770   0.238
  135    HE1  TYR  21           2HE      TYR  21  -3.856   6.323   0.447
  136    HE2  TYR  21           1HE      TYR  21  -7.720   7.156   2.051
  137    HH   TYR  21           HH       TYR  21  -5.022   5.002   2.034
  138    H    ARG  22           H        ARG  22  -3.965  11.276   0.145
  139    HA   ARG  22           HA       ARG  22  -1.789   9.719  -1.065
  140    HB2  ARG  22           1HB      ARG  22  -1.461  12.491   0.095
  141    HB3  ARG  22           2HB      ARG  22  -0.188  11.488  -0.588
  142    HG2  ARG  22           1HG      ARG  22  -1.550  11.553  -2.751
  143    HG3  ARG  22           2HG      ARG  22  -2.435  12.881  -1.997
  144    HD2  ARG  22           1HD      ARG  22   0.542  12.768  -2.472
  145    HD3  ARG  22           2HD      ARG  22  -0.621  13.712  -3.402
  146    HE   ARG  22           HE       ARG  22   0.525  14.402  -0.881
  147   HH11  ARG  22          2HH1      ARG  22  -2.323  14.733  -2.856
  148   HH12  ARG  22          1HH1      ARG  22  -2.822  16.219  -2.116
  149   HH21  ARG  22          2HH2      ARG  22  -0.121  16.357   0.100
  150   HH22  ARG  22          1HH2      ARG  22  -1.568  17.142  -0.436
  151    H    HIS  23           H        HIS  23  -1.941   8.097   0.449
  152    HA   HIS  23           HA       HIS  23  -0.827   8.712   3.053
  153    HB2  HIS  23           1HB      HIS  23  -3.391   8.887   3.184
  154    HB3  HIS  23           2HB      HIS  23  -3.394   7.139   2.972
  155    HD1  HIS  23           1HD      HIS  23  -3.793   6.108   5.175
  156    HD2  HIS  23           2HD      HIS  23  -1.252   9.383   5.448
  157    HE1  HIS  23           1HE      HIS  23  -3.118   6.235   7.594
  158    HE2  HIS  23           2HE      HIS  23  -1.648   8.275   7.751
  159    H    CYS  24           H        CYS  24   0.812   7.337   3.175
  160    HA   CYS  24           HA       CYS  24   1.273   5.101   1.662
  161    HB2  CYS  24           1HB      CYS  24   3.068   5.995   2.939
  162    HB3  CYS  24           2HB      CYS  24   2.193   5.784   4.452
  163    H    ASP  25           H        ASP  25  -0.037   3.417   1.398
  164    HA   ASP  25           HA       ASP  25  -1.172   2.150   3.806
  165    HB2  ASP  25           1HB      ASP  25  -2.749   3.336   2.066
  166    HB3  ASP  25           2HB      ASP  25  -2.489   1.864   1.133
  167    H    ALA  26           H        ALA  26   1.337   1.456   2.911
  168    HA   ALA  26           HA       ALA  26   0.999  -1.001   1.354
  169    HB1  ALA  26           1HB      ALA  26   2.898  -0.284   0.442
  170    HB2  ALA  26           2HB      ALA  26   3.142   0.913   1.715
  171    HB3  ALA  26           3HB      ALA  26   3.693  -0.747   1.948
  172    HA   PRO  27           HA       PRO  27   1.534  -3.794   4.695
  173    HB2  PRO  27           1HB      PRO  27   3.378  -5.566   3.784
  174    HB3  PRO  27           2HB      PRO  27   1.723  -5.498   3.165
  175    HG2  PRO  27           1HG      PRO  27   4.230  -4.349   2.000
  176    HG3  PRO  27           2HG      PRO  27   2.908  -5.206   1.186
  177    HD2  PRO  27           1HD      PRO  27   3.136  -2.508   1.149
  178    HD3  PRO  27           2HD      PRO  27   1.564  -3.335   1.123
  179    H    ILE  28           H        ILE  28   4.647  -2.745   3.339
  180    HA   ILE  28           HA       ILE  28   5.633  -2.322   6.059
  181    HB   ILE  28           HB       ILE  28   7.213  -3.839   3.980
  182   HG12  ILE  28          1HG1      ILE  28   5.370  -5.151   5.033
  183   HG13  ILE  28          2HG1      ILE  28   6.973  -5.774   5.410
  184   HG21  ILE  28          1HG2      ILE  28   8.292  -3.995   6.613
  185   HG22  ILE  28          2HG2      ILE  28   9.026  -3.335   5.152
  186   HG23  ILE  28          3HG2      ILE  28   8.050  -2.299   6.194
  187   HD11  ILE  28          1HD1      ILE  28   6.878  -5.000   7.609
  188   HD12  ILE  28          2HD1      ILE  28   5.532  -3.914   7.262
  189   HD13  ILE  28          3HD1      ILE  28   5.272  -5.658   7.295
  190    H    CYS  29           H        CYS  29   6.955  -0.581   6.275
  191    HA   CYS  29           HA       CYS  29   7.605   0.894   3.807
  192    HB2  CYS  29           1HB      CYS  29   5.914   1.825   5.599
  193    HB3  CYS  29           2HB      CYS  29   7.387   2.257   6.463
  194    H    LEU  30           H        LEU  30   9.664   1.508   3.461
  195    HA   LEU  30           HA       LEU  30  11.638   0.780   5.515
  196    HB2  LEU  30           1HB      LEU  30  12.115   1.236   2.577
  197    HB3  LEU  30           2HB      LEU  30  13.242   0.555   3.747
  198    HG   LEU  30           HG       LEU  30  10.673  -0.872   3.284
  199   HD11  LEU  30          1HD1      LEU  30  12.854  -1.647   1.481
  200   HD12  LEU  30          2HD1      LEU  30  12.067  -0.119   1.085
  201   HD13  LEU  30          3HD1      LEU  30  11.112  -1.596   1.207
  202   HD21  LEU  30          1HD2      LEU  30  11.841  -2.719   4.007
  203   HD22  LEU  30          2HD2      LEU  30  12.625  -1.433   4.924
  204   HD23  LEU  30          3HD2      LEU  30  13.396  -2.079   3.475
  205    H    TYR  31           H        TYR  31  10.546   3.357   3.410
  206    HA   TYR  31           HA       TYR  31  12.629   5.167   3.654
  207    HB2  TYR  31           1HB      TYR  31  10.488   5.345   2.252
  208    HB3  TYR  31           2HB      TYR  31   9.734   6.005   3.699
  209    HD1  TYR  31           2HD      TYR  31  13.131   6.557   2.255
  210    HD2  TYR  31           1HD      TYR  31   9.374   8.261   3.297
  211    HE1  TYR  31           2HE      TYR  31  13.989   8.789   1.677
  212    HE2  TYR  31           1HE      TYR  31  10.221  10.497   2.721
  213    HH   TYR  31           HH       TYR  31  13.335  11.270   2.450
  214    H    GLU  32           H        GLU  32  13.587   5.802   5.467
  215    HA   GLU  32           HA       GLU  32  12.939   5.577   8.034
  216    HB2  GLU  32           1HB      GLU  32  14.152   8.041   6.774
  217    HB3  GLU  32           2HB      GLU  32  14.164   7.706   8.500
  218    HG2  GLU  32           1HG      GLU  32  15.519   5.759   8.177
  219    HG3  GLU  32           2HG      GLU  32  15.386   5.904   6.425
  220    H    GLN  33           H        GLN  33  11.766   8.224   5.982
  221    HA   GLN  33           HA       GLN  33  10.389   9.730   7.815
  222    HB2  GLN  33           1HB      GLN  33  10.649   9.867   5.163
  223    HB3  GLN  33           2HB      GLN  33   9.024   9.198   5.225
  224    HG2  GLN  33           1HG      GLN  33   9.142  11.685   5.078
  225    HG3  GLN  33           2HG      GLN  33   8.207  11.062   6.436
  226   HE21  GLN  33          1HE2      GLN  33  11.180  12.607   5.469
  227   HE22  GLN  33          2HE2      GLN  33  11.616  13.193   7.035
  228    H    GLY  34           H        GLY  34   8.827   7.237   5.786
  229    HA2  GLY  34           1HA      GLY  34   7.381   5.541   6.565
  230    HA3  GLY  34           2HA      GLY  34   7.257   6.385   8.102
  231    H    ARG  35           H        ARG  35   6.374   8.811   7.579
  232    HA   ARG  35           HA       ARG  35   3.656   8.505   7.080
  233    HB2  ARG  35           1HB      ARG  35   3.467  10.810   7.343
  234    HB3  ARG  35           2HB      ARG  35   4.943  10.439   8.225
  235    HG2  ARG  35           1HG      ARG  35   6.232  11.090   6.190
  236    HG3  ARG  35           2HG      ARG  35   4.712  11.631   5.473
  237    HD2  ARG  35           1HD      ARG  35   4.546  13.438   6.852
  238    HD3  ARG  35           2HD      ARG  35   5.384  12.637   8.180
  239    HE   ARG  35           HE       ARG  35   7.394  12.951   6.509
  240   HH11  ARG  35          2HH1      ARG  35   4.846  15.182   7.313
  241   HH12  ARG  35          1HH1      ARG  35   5.816  16.591   7.040
  242   HH21  ARG  35          2HH2      ARG  35   8.682  14.798   6.146
  243   HH22  ARG  35          1HH2      ARG  35   7.998  16.372   6.375
  244    H    ASP  36           H        ASP  36   2.691  10.274   5.350
  245    HA   ASP  36           HA       ASP  36   3.165   9.017   2.811
  246    HB2  ASP  36           1HB      ASP  36   1.386  10.551   1.999
  247    HB3  ASP  36           2HB      ASP  36   0.899   9.627   3.417
  248    H    SER  37           H        SER  37   5.515  10.167   3.574
  249    HA   SER  37           HA       SER  37   5.731  12.674   2.069
  250    HB2  SER  37           1HB      SER  37   7.380  11.362   4.191
  251    HB3  SER  37           2HB      SER  37   8.172  12.467   3.068
  252    HG   SER  37           HG       SER  37   6.016  13.708   3.792
  253    H    PHE  38           H        PHE  38   6.280  12.539   0.007
  254    HA   PHE  38           HA       PHE  38   8.216  10.478  -0.807
  255    HB2  PHE  38           1HB      PHE  38   5.989  11.360  -2.624
  256    HB3  PHE  38           2HB      PHE  38   6.993   9.918  -2.732
  257    HD1  PHE  38           1HD      PHE  38   4.314  11.518  -0.735
  258    HD2  PHE  38           2HD      PHE  38   6.298   7.901  -1.783
  259    HE1  PHE  38           1HE      PHE  38   2.580  10.229   0.442
  260    HE2  PHE  38           2HE      PHE  38   4.566   6.607  -0.609
  261    HZ   PHE  38           HZ       PHE  38   2.703   7.771   0.504
  262    H    GLU  39           H        GLU  39   9.151  11.004  -3.030
  263    HA   GLU  39           HA       GLU  39   9.755  13.883  -3.108
  264    HB2  GLU  39           1HB      GLU  39  11.547  11.965  -2.742
  265    HB3  GLU  39           2HB      GLU  39  11.469  11.874  -4.496
  266    HG2  GLU  39           1HG      GLU  39  12.160  14.140  -4.723
  267    HG3  GLU  39           2HG      GLU  39  12.010  14.417  -2.989
  268    H    ASP  40           H        ASP  40  10.423  14.662  -5.343
  269    HA   ASP  40           HA       ASP  40   8.363  14.782  -7.073
  270    HB2  ASP  40           1HB      ASP  40  10.790  15.844  -7.135
  271    HB3  ASP  40           2HB      ASP  40  11.069  14.567  -8.315
  272    H    GLU  41           H        GLU  41  10.904  12.308  -7.135
  273    HA   GLU  41           HA       GLU  41   9.165  10.313  -8.130
  274    HB2  GLU  41           1HB      GLU  41  10.067   9.994 -10.355
  275    HB3  GLU  41           2HB      GLU  41   9.425  11.624 -10.211
  276    HG2  GLU  41           1HG      GLU  41  11.426  11.913 -11.345
  277    HG3  GLU  41           2HG      GLU  41  11.828  12.322  -9.678
  278    H    GLY  42           H        GLY  42  10.291   8.259  -8.539
  279    HA2  GLY  42           1HA      GLY  42  12.551   7.180  -8.521
  280    HA3  GLY  42           2HA      GLY  42  12.880   8.184  -7.116
  281    H    ARG  43           H        ARG  43  13.397   5.897  -6.347
  282    HA   ARG  43           HA       ARG  43  11.589   3.903  -5.885
  283    HB2  ARG  43           1HB      ARG  43  12.920   3.285  -3.925
  284    HB3  ARG  43           2HB      ARG  43  13.953   3.742  -5.273
  285    HG2  ARG  43           1HG      ARG  43  14.327   5.924  -4.275
  286    HG3  ARG  43           2HG      ARG  43  13.248   5.511  -2.941
  287    HD2  ARG  43           1HD      ARG  43  15.589   5.243  -2.302
  288    HD3  ARG  43           2HD      ARG  43  14.741   3.697  -2.284
  289    HE   ARG  43           HE       ARG  43  16.122   4.265  -4.749
  290   HH11  ARG  43          2HH1      ARG  43  16.358   2.880  -1.563
  291   HH12  ARG  43          1HH1      ARG  43  17.684   1.842  -1.970
  292   HH21  ARG  43          2HH2      ARG  43  17.867   2.903  -5.297
  293   HH22  ARG  43          1HH2      ARG  43  18.542   1.856  -4.094
  294    H    TRP  44           H        TRP  44  11.958   6.912  -4.086
  295    HA   TRP  44           HA       TRP  44   9.751   6.166  -2.318
  296    HB2  TRP  44           1HB      TRP  44  11.411   8.690  -2.232
  297    HB3  TRP  44           2HB      TRP  44  10.376   8.043  -0.961
  298    HD1  TRP  44           HD       TRP  44  13.860   8.393  -1.597
  299    HE1  TRP  44           1HE      TRP  44  15.268   6.578  -0.435
  300    HE3  TRP  44           3HE      TRP  44  10.148   5.042  -0.537
  301    HZ2  TRP  44           2HZ      TRP  44  14.858   4.059   0.771
  302    HZ3  TRP  44           3HZ      TRP  44  10.740   2.953   0.622
  303    HH2  TRP  44           HH       TRP  44  13.047   2.474   1.261
  304    H    ARG  45           H        ARG  45   8.942   6.480  -4.917
  305    HA   ARG  45           HA       ARG  45   7.758   9.158  -5.069
  306    HB2  ARG  45           1HB      ARG  45   7.351   8.737  -7.378
  307    HB3  ARG  45           2HB      ARG  45   8.990   8.194  -7.043
  308    HG2  ARG  45           1HG      ARG  45   8.151   5.877  -6.875
  309    HG3  ARG  45           2HG      ARG  45   6.546   6.460  -7.324
  310    HD2  ARG  45           1HD      ARG  45   7.303   5.850  -9.384
  311    HD3  ARG  45           2HD      ARG  45   7.898   7.509  -9.344
  312    HE   ARG  45           HE       ARG  45   9.983   6.181  -8.344
  313   HH11  ARG  45          2HH1      ARG  45   7.991   5.545 -11.127
  314   HH12  ARG  45          1HH1      ARG  45   9.259   4.774 -12.021
  315   HH21  ARG  45          2HH2      ARG  45  11.660   5.167  -9.511
  316   HH22  ARG  45          1HH2      ARG  45  11.345   4.559 -11.101
  317    H    LEU  46           H        LEU  46   5.670   9.494  -4.654
  318    HA   LEU  46           HA       LEU  46   4.030   7.508  -3.542
  319    HB2  LEU  46           1HB      LEU  46   3.848   9.974  -3.175
  320    HB3  LEU  46           2HB      LEU  46   3.127  10.102  -4.778
  321    HG   LEU  46           HG       LEU  46   1.906   8.370  -2.652
  322   HD11  LEU  46          1HD1      LEU  46   1.570  10.214  -1.434
  323   HD12  LEU  46          2HD1      LEU  46   0.386  10.636  -2.671
  324   HD13  LEU  46          3HD1      LEU  46   2.022  11.288  -2.758
  325   HD21  LEU  46          1HD2      LEU  46   0.385   7.976  -4.217
  326   HD22  LEU  46          2HD2      LEU  46   1.344   8.915  -5.361
  327   HD23  LEU  46          3HD2      LEU  46   0.089   9.704  -4.405
  328    H    ILE  47           H        ILE  47   2.985   5.903  -4.497
  329    HA   ILE  47           HA       ILE  47   2.205   6.213  -7.322
  330    HB   ILE  47           HB       ILE  47   2.861   3.697  -5.788
  331   HG12  ILE  47          1HG1      ILE  47   4.217   4.942  -8.189
  332   HG13  ILE  47          2HG1      ILE  47   4.787   5.103  -6.531
  333   HG21  ILE  47          1HG2      ILE  47   2.668   2.867  -8.327
  334   HG22  ILE  47          2HG2      ILE  47   1.321   2.817  -7.191
  335   HG23  ILE  47          3HG2      ILE  47   1.452   4.144  -8.345
  336   HD11  ILE  47          1HD1      ILE  47   4.943   2.596  -6.463
  337   HD12  ILE  47          2HD1      ILE  47   4.652   2.615  -8.203
  338   HD13  ILE  47          3HD1      ILE  47   6.079   3.410  -7.539
  339    H    LEU  48           H        LEU  48   0.107   6.208  -7.785
  340    HA   LEU  48           HA       LEU  48  -1.788   5.470  -5.675
  341    HB2  LEU  48           1HB      LEU  48  -2.172   7.040  -8.219
  342    HB3  LEU  48           2HB      LEU  48  -3.444   6.686  -7.053
  343    HG   LEU  48           HG       LEU  48  -0.976   8.279  -6.382
  344   HD11  LEU  48          1HD1      LEU  48  -2.741  10.185  -6.439
  345   HD12  LEU  48          2HD1      LEU  48  -3.595   9.115  -7.550
  346   HD13  LEU  48          3HD1      LEU  48  -1.965   9.667  -7.935
  347   HD21  LEU  48          1HD2      LEU  48  -1.810   8.462  -4.315
  348   HD22  LEU  48          2HD2      LEU  48  -2.798   7.065  -4.741
  349   HD23  LEU  48          3HD2      LEU  48  -3.458   8.693  -4.898
  350    H    CYS  49           H        CYS  49  -3.283   3.882  -5.912
  351    HA   CYS  49           HA       CYS  49  -2.858   1.677  -7.442
  352    HB2  CYS  49           1HB      CYS  49  -4.484   1.768  -5.600
  353    HB3  CYS  49           2HB      CYS  49  -5.562   2.741  -6.597
  354    H    ALA  50           H        ALA  50  -3.826   0.796  -9.341
  355    HA   ALA  50           HA       ALA  50  -4.419   2.853 -11.350
  356    HB1  ALA  50           1HB      ALA  50  -3.873   0.022 -12.092
  357    HB2  ALA  50           2HB      ALA  50  -3.473   1.512 -12.948
  358    HB3  ALA  50           3HB      ALA  50  -2.537   1.028 -11.533
  359    H    THR  51           H        THR  51  -5.577  -0.256 -10.110
  360    HA   THR  51           HA       THR  51  -7.752  -0.605 -11.824
  361    HB   THR  51           HB       THR  51  -7.506  -1.448  -8.929
  362    HG1  THR  51           1HG      THR  51  -5.889  -2.243 -10.459
  363   HG21  THR  51          1HG2      THR  51  -9.078  -3.315 -10.009
  364   HG22  THR  51          2HG2      THR  51  -9.551  -1.950 -11.021
  365   HG23  THR  51          3HG2      THR  51  -9.724  -1.851  -9.269
  366    H    CYS  52           H        CYS  52  -7.665   0.906  -8.597
  367    HA   CYS  52           HA       CYS  52 -10.275   2.131  -9.187
  368    HB2  CYS  52           1HB      CYS  52 -10.517   2.412  -6.753
  369    HB3  CYS  52           2HB      CYS  52 -10.275   0.723  -7.188
  370    H    GLY  53           H        GLY  53  -7.117   2.813  -7.693
  371    HA2  GLY  53           1HA      GLY  53  -5.837   4.741  -7.869
  372    HA3  GLY  53           2HA      GLY  53  -7.111   5.461  -8.843
  373    H    SER  54           H        SER  54  -6.938   4.210  -5.508
  374    HA   SER  54           HA       SER  54  -7.899   6.837  -4.585
  375    HB2  SER  54           1HB      SER  54  -9.298   5.736  -2.924
  376    HB3  SER  54           2HB      SER  54  -9.717   5.144  -4.531
  377    HG   SER  54           HG       SER  54  -8.972   3.220  -4.031
  378    H    HIS  55           H        HIS  55  -6.240   3.838  -3.677
  379    HA   HIS  55           HA       HIS  55  -5.131   4.992  -1.285
  380    HB2  HIS  55           1HB      HIS  55  -4.802   2.361  -2.702
  381    HB3  HIS  55           2HB      HIS  55  -3.739   2.807  -1.370
  382    HD1  HIS  55           1HD      HIS  55  -4.528   2.077   0.851
  383    HD2  HIS  55           2HD      HIS  55  -7.671   2.527  -1.829
  384    HE1  HIS  55           1HE      HIS  55  -6.585   1.344   2.098
  385    HE2  HIS  55           2HE      HIS  55  -8.461   1.544   0.429
  386    H    GLY  56           H        GLY  56  -2.818   5.172  -0.883
  387    HA2  GLY  56           1HA      GLY  56  -1.143   5.480  -3.265
  388    HA3  GLY  56           2HA      GLY  56  -1.394   6.900  -2.260
  389    H    THR  57           H        THR  57   0.827   4.708  -2.922
  390    HA   THR  57           HA       THR  57   2.094   4.987  -0.323
  391    HB   THR  57           HB       THR  57   0.727   2.743  -0.512
  392    HG1  THR  57           1HG      THR  57   3.261   3.281   0.553
  393   HG21  THR  57          1HG2      THR  57   3.245   1.563  -1.493
  394   HG22  THR  57          2HG2      THR  57   2.260   2.375  -2.710
  395   HG23  THR  57          3HG2      THR  57   1.576   1.058  -1.758
  396    H    HIS  58           H        HIS  58   4.373   4.507  -0.363
  397    HA   HIS  58           HA       HIS  58   5.708   5.472  -2.603
  398    HB2  HIS  58           1HB      HIS  58   6.938   3.620  -0.560
  399    HB3  HIS  58           2HB      HIS  58   7.742   4.873  -1.501
  400    HD2  HIS  58           2HD      HIS  58   7.833   7.324  -0.301
  401    HE1  HIS  58           1HE      HIS  58   5.180   6.464   2.896
  402    HE2  HIS  58           2HE      HIS  58   6.707   8.181   1.864
  403    H    ARG  59           H        ARG  59   7.626   4.100  -3.586
  404    HA   ARG  59           HA       ARG  59   6.371   2.057  -5.157
  405    HB2  ARG  59           1HB      ARG  59   8.267   3.794  -5.771
  406    HB3  ARG  59           2HB      ARG  59   9.323   2.506  -5.207
  407    HG2  ARG  59           1HG      ARG  59   7.205   1.788  -7.152
  408    HG3  ARG  59           2HG      ARG  59   8.581   2.725  -7.738
  409    HD2  ARG  59           1HD      ARG  59   9.916   0.886  -6.358
  410    HD3  ARG  59           2HD      ARG  59   8.467  -0.055  -6.705
  411    HE   ARG  59           HE       ARG  59  10.541   0.556  -8.518
  412   HH11  ARG  59          2HH1      ARG  59   7.075   0.299  -8.335
  413   HH12  ARG  59          1HH1      ARG  59   6.886  -0.107 -10.009
  414   HH21  ARG  59          2HH2      ARG  59  10.306   0.023 -10.723
  415   HH22  ARG  59          1HH2      ARG  59   8.725  -0.265 -11.366
  416    H    ASP  60           H        ASP  60   9.428   1.955  -3.321
  417    HA   ASP  60           HA       ASP  60   9.550  -0.848  -3.205
  418    HB2  ASP  60           1HB      ASP  60  11.350   1.019  -2.704
  419    HB3  ASP  60           2HB      ASP  60  10.790   0.809  -1.047
  420    H    CYS  61           H        CYS  61   8.219   1.536  -0.966
  421    HA   CYS  61           HA       CYS  61   7.742   0.022   1.265
  422    HB2  CYS  61           1HB      CYS  61   7.215   2.454   0.986
  423    HB3  CYS  61           2HB      CYS  61   5.772   1.991   0.090
  424    H    SER  62           H        SER  62   5.868   0.098  -1.725
  425    HA   SER  62           HA       SER  62   3.919  -1.784  -0.707
  426    HB2  SER  62           1HB      SER  62   3.344  -1.680  -3.329
  427    HB3  SER  62           2HB      SER  62   2.817  -0.440  -2.192
  428    HG   SER  62           HG       SER  62   3.885   0.349  -4.131
  429    H    SER  63           H        SER  63   6.710  -2.616  -0.809
  430    HA   SER  63           HA       SER  63   8.088  -4.252  -1.677
  431    HB2  SER  63           1HB      SER  63   6.392  -5.356  -0.126
  432    HB3  SER  63           2HB      SER  63   5.547  -5.882  -1.582
  433    HG   SER  63           HG       SER  63   8.243  -6.472  -0.911
  434    H    LEU  64           H        LEU  64   7.239  -2.662  -3.769
  435    HA   LEU  64           HA       LEU  64   6.203  -4.326  -5.890
  436    HB2  LEU  64           1HB      LEU  64   7.203  -1.494  -5.770
  437    HB3  LEU  64           2HB      LEU  64   6.745  -2.269  -7.285
  438    HG   LEU  64           HG       LEU  64   4.879  -1.909  -4.944
  439   HD11  LEU  64          1HD1      LEU  64   3.933  -0.040  -6.090
  440   HD12  LEU  64          2HD1      LEU  64   5.006  -0.274  -7.470
  441   HD13  LEU  64          3HD1      LEU  64   5.665   0.247  -5.919
  442   HD21  LEU  64          1HD2      LEU  64   3.861  -2.228  -7.679
  443   HD22  LEU  64          2HD2      LEU  64   3.301  -2.941  -6.166
  444   HD23  LEU  64          3HD2      LEU  64   4.676  -3.646  -7.018
  445    H    ARG  65           H        ARG  65   7.536  -3.866  -8.099
  446    HA   ARG  65           HA       ARG  65  10.267  -4.830  -7.555
  447    HB2  ARG  65           1HB      ARG  65   8.212  -5.640  -9.550
  448    HB3  ARG  65           2HB      ARG  65   9.897  -5.688 -10.052
  449    HG2  ARG  65           1HG      ARG  65  10.420  -7.394  -8.628
  450    HG3  ARG  65           2HG      ARG  65   9.160  -6.961  -7.471
  451    HD2  ARG  65           1HD      ARG  65   8.438  -7.964 -10.196
  452    HD3  ARG  65           2HD      ARG  65   8.885  -9.095  -8.920
  453    HE   ARG  65           HE       ARG  65   6.998  -7.548  -7.749
  454   HH11  ARG  65          2HH1      ARG  65   7.113  -9.360 -10.720
  455   HH12  ARG  65          1HH1      ARG  65   5.413  -9.693 -10.735
  456   HH21  ARG  65          2HH2      ARG  65   4.758  -7.980  -7.758
  457   HH22  ARG  65          1HH2      ARG  65   4.074  -8.907  -9.051
  458    HA   PRO  66           HA       PRO  66  12.009  -1.505  -9.825
  459    HB2  PRO  66           1HB      PRO  66  14.017  -2.711 -11.198
  460    HB3  PRO  66           2HB      PRO  66  14.071  -2.449  -9.451
  461    HG2  PRO  66           1HG      PRO  66  13.358  -4.925 -10.974
  462    HG3  PRO  66           2HG      PRO  66  14.365  -4.754  -9.524
  463    HD2  PRO  66           1HD      PRO  66  11.788  -5.577  -9.419
  464    HD3  PRO  66           2HD      PRO  66  12.542  -4.632  -8.119
  465    H    ASN  67           H        ASN  67  10.184  -3.795 -11.315
  466    HA   ASN  67           HA       ASN  67  10.493  -2.519 -13.953
  467    HB2  ASN  67           1HB      ASN  67   9.528  -5.339 -13.439
  468    HB3  ASN  67           2HB      ASN  67   9.840  -4.596 -15.005
  469   HD21  ASN  67          1HD2      ASN  67  11.245  -5.987 -12.158
  470   HD22  ASN  67          2HD2      ASN  67  12.850  -6.143 -12.777
  471    H    SER  68           H        SER  68   8.242  -3.957 -11.640
  472    HA   SER  68           HA       SER  68   5.827  -3.805 -12.770
  473    HB2  SER  68           1HB      SER  68   6.224  -4.317 -10.372
  474    HB3  SER  68           2HB      SER  68   6.430  -2.594 -10.061
  475    HG   SER  68           HG       SER  68   4.207  -2.569 -11.202
  476    H    LYS  69           H        LYS  69   4.550  -2.363 -13.737
  477    HA   LYS  69           HA       LYS  69   5.465   0.396 -13.923
  478    HB2  LYS  69           1HB      LYS  69   3.297  -1.117 -15.385
  479    HB3  LYS  69           2HB      LYS  69   3.673   0.578 -15.665
  480    HG2  LYS  69           1HG      LYS  69   5.654   0.109 -16.717
  481    HG3  LYS  69           2HG      LYS  69   5.858  -1.432 -15.881
  482    HD2  LYS  69           1HD      LYS  69   3.529  -1.164 -17.699
  483    HD3  LYS  69           2HD      LYS  69   5.128  -1.273 -18.440
  484    HE2  LYS  69           1HE      LYS  69   4.337  -3.489 -18.295
  485    HE3  LYS  69           2HE      LYS  69   5.508  -3.315 -16.989
  486    HZ1  LYS  69           1HZ      LYS  69   2.584  -2.998 -16.609
  487    HZ2  LYS  69           2HZ      LYS  69   3.770  -3.118 -15.410
  488    HZ3  LYS  69           3HZ      LYS  69   3.399  -4.461 -16.369
  489    H    LYS  70           H        LYS  70   2.411  -1.303 -13.217
  490    HA   LYS  70           HA       LYS  70   1.569   1.059 -11.667
  491    HB2  LYS  70           1HB      LYS  70  -0.700   0.571 -12.200
  492    HB3  LYS  70           2HB      LYS  70   0.201   0.489 -13.708
  493    HG2  LYS  70           1HG      LYS  70   0.263  -1.962 -13.514
  494    HG3  LYS  70           2HG      LYS  70  -0.703  -1.850 -12.041
  495    HD2  LYS  70           1HD      LYS  70  -2.317  -0.470 -13.593
  496    HD3  LYS  70           2HD      LYS  70  -1.488  -1.355 -14.876
  497    HE2  LYS  70           1HE      LYS  70  -3.278  -2.739 -14.398
  498    HE3  LYS  70           2HE      LYS  70  -1.992  -3.439 -13.417
  499    HZ1  LYS  70           1HZ      LYS  70  -4.280  -1.789 -12.544
  500    HZ2  LYS  70           2HZ      LYS  70  -2.901  -1.947 -11.578
  501    HZ3  LYS  70           3HZ      LYS  70  -3.806  -3.316 -11.991
  502    H    TRP  71           H        TRP  71   0.348   0.674  -9.731
  503    HA   TRP  71           HA       TRP  71   0.820  -1.988  -8.557
  504    HB2  TRP  71           1HB      TRP  71   2.315  -0.742  -7.325
  505    HB3  TRP  71           2HB      TRP  71   1.371   0.737  -7.475
  506    HD1  TRP  71           HD       TRP  71   1.497  -2.520  -5.427
  507    HE1  TRP  71           1HE      TRP  71   0.230  -2.137  -3.220
  508    HE3  TRP  71           3HE      TRP  71  -0.373   2.145  -6.365
  509    HZ2  TRP  71           2HZ      TRP  71  -1.353  -0.123  -2.034
  510    HZ3  TRP  71           3HZ      TRP  71  -1.754   3.230  -4.642
  511    HH2  TRP  71           HH       TRP  71  -2.234   2.117  -2.522
  512    H    GLU  72           H        GLU  72  -0.776  -2.837  -7.239
  513    HA   GLU  72           HA       GLU  72  -3.359  -1.430  -7.358
  514    HB2  GLU  72           1HB      GLU  72  -2.659  -4.357  -7.329
  515    HB3  GLU  72           2HB      GLU  72  -4.276  -3.795  -6.928
  516    HG2  GLU  72           1HG      GLU  72  -4.752  -3.189  -9.066
  517    HG3  GLU  72           2HG      GLU  72  -3.072  -2.824  -9.455
  518    H    CYS  73           H        CYS  73  -4.624  -1.236  -5.535
  519    HA   CYS  73           HA       CYS  73  -3.219  -1.289  -3.028
  520    HB2  CYS  73           1HB      CYS  73  -5.148  -0.201  -2.111
  521    HB3  CYS  73           2HB      CYS  73  -4.849   0.502  -3.698
  522    H    ASN  74           H        ASN  74  -4.501  -2.136  -1.053
  523    HA   ASN  74           HA       ASN  74  -4.581  -4.923  -1.181
  524    HB2  ASN  74           1HB      ASN  74  -4.227  -3.667   0.907
  525    HB3  ASN  74           2HB      ASN  74  -5.897  -3.111   0.856
  526   HD21  ASN  74          1HD2      ASN  74  -7.570  -4.609   1.207
  527   HD22  ASN  74          2HD2      ASN  74  -7.278  -6.102   2.027
  528    H    GLU  75           H        GLU  75  -7.314  -2.648  -0.880
  529    HA   GLU  75           HA       GLU  75  -9.442  -4.314  -0.893
  530    HB2  GLU  75           1HB      GLU  75  -9.170  -1.785  -2.528
  531    HB3  GLU  75           2HB      GLU  75 -10.693  -2.574  -2.141
  532    HG2  GLU  75           1HG      GLU  75  -8.765  -1.317  -0.205
  533    HG3  GLU  75           2HG      GLU  75 -10.359  -0.718  -0.662
  534    H    CYS  76           H        CYS  76  -7.562  -3.369  -3.742
  535    HA   CYS  76           HA       CYS  76  -9.164  -4.928  -5.544
  536    HB2  CYS  76           1HB      CYS  76  -6.499  -3.541  -5.865
  537    HB3  CYS  76           2HB      CYS  76  -7.308  -4.401  -7.171
  538    H    LEU  77           H        LEU  77  -5.878  -5.241  -4.213
  539    HA   LEU  77           HA       LEU  77  -5.119  -7.604  -5.413
  540    HB2  LEU  77           1HB      LEU  77  -4.521  -6.533  -2.667
  541    HB3  LEU  77           2HB      LEU  77  -3.752  -7.979  -3.318
  542    HG   LEU  77           HG       LEU  77  -3.560  -5.240  -4.567
  543   HD11  LEU  77          1HD1      LEU  77  -1.559  -6.698  -2.847
  544   HD12  LEU  77          2HD1      LEU  77  -2.499  -5.289  -2.359
  545   HD13  LEU  77          3HD1      LEU  77  -1.312  -5.150  -3.655
  546   HD21  LEU  77          1HD2      LEU  77  -2.900  -6.463  -6.320
  547   HD22  LEU  77          2HD2      LEU  77  -2.728  -7.929  -5.353
  548   HD23  LEU  77          3HD2      LEU  77  -1.425  -6.740  -5.393
  549    HA   PRO  78           HA       PRO  78  -7.604 -10.834  -3.783
  550    HB2  PRO  78           1HB      PRO  78  -5.820 -12.877  -3.676
  551    HB3  PRO  78           2HB      PRO  78  -6.478 -12.255  -5.194
  552    HG2  PRO  78           1HG      PRO  78  -3.846 -11.674  -3.890
  553    HG3  PRO  78           2HG      PRO  78  -4.203 -11.989  -5.598
  554    HD2  PRO  78           1HD      PRO  78  -3.825  -9.491  -4.626
  555    HD3  PRO  78           2HD      PRO  78  -4.927  -9.834  -5.974
  556    H    ALA  79           H        ALA  79  -7.458 -12.689  -2.067
  557    HA   ALA  79           HA       ALA  79  -5.948 -11.838   0.294
  558    HB1  ALA  79           1HB      ALA  79  -8.788 -12.598   0.726
  559    HB2  ALA  79           2HB      ALA  79  -7.749 -11.520   1.659
  560    HB3  ALA  79           3HB      ALA  79  -8.439 -10.974   0.131
  561    H    SER  80           H        SER  80  -5.131 -13.495   1.429
  562    HA   SER  80           HA       SER  80  -5.774 -16.198   0.532
  563    HB2  SER  80           1HB      SER  80  -3.393 -15.427   0.661
  564    HB3  SER  80           2HB      SER  80  -3.574 -15.310   2.411
  565    HG   SER  80           HG       SER  80  -2.668 -17.328   1.615
  566    H    GLY  81           H        GLY  81  -7.541 -16.962   1.549
  567    HA2  GLY  81           1HA      GLY  81  -8.847 -17.784   3.248
  568    HA3  GLY  81           2HA      GLY  81  -7.398 -17.759   4.243
  569    HA   PRO  82           HA       PRO  82 -10.358 -14.781   6.134
  570    HB2  PRO  82           1HB      PRO  82  -9.753 -15.470   8.690
  571    HB3  PRO  82           2HB      PRO  82 -10.949 -16.337   7.719
  572    HG2  PRO  82           1HG      PRO  82  -8.094 -17.041   8.280
  573    HG3  PRO  82           2HG      PRO  82  -9.523 -18.091   8.268
  574    HD2  PRO  82           1HD      PRO  82  -7.785 -17.971   6.195
  575    HD3  PRO  82           2HD      PRO  82  -9.519 -18.280   5.970
  576    H    SER  83           H        SER  83  -9.916 -13.010   7.656
  577    HA   SER  83           HA       SER  83  -7.078 -12.222   7.578
  578    HB2  SER  83           1HB      SER  83  -9.611 -10.689   7.189
  579    HB3  SER  83           2HB      SER  83  -8.234  -9.856   7.911
  580    HG   SER  83           HG       SER  83  -7.672 -11.364   5.663
  581    H    SER  84           H        SER  84 -10.042 -12.063   9.516
  582    HA   SER  84           HA       SER  84 -10.342 -11.439  11.722
  583    HB2  SER  84           1HB      SER  84  -9.236 -13.059  13.237
  584    HB3  SER  84           2HB      SER  84  -9.933 -13.844  11.820
  585    HG   SER  84           HG       SER  84  -7.556 -14.198  12.610
  586    H    GLY  85           H        GLY  85  -8.692  -9.554  10.536
  587    HA2  GLY  85           1HA      GLY  85  -7.389  -8.463  12.822
  588    HA3  GLY  85           2HA      GLY  85  -6.215  -9.075  11.666
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1 -50.019  -7.810  22.598
    2    HA2  GLY   1           1HA      GLY   1 -48.786  -5.367  21.898
    3    HA3  GLY   1           2HA      GLY   1 -48.025  -6.004  23.348
    4    H    SER   2           H        SER   2 -46.638  -5.636  20.958
    5    HA   SER   2           HA       SER   2 -45.705  -8.340  20.510
    6    HB2  SER   2           1HB      SER   2 -46.616  -6.653  18.166
    7    HB3  SER   2           2HB      SER   2 -45.893  -8.260  18.083
    8    HG   SER   2           HG       SER   2 -47.751  -9.120  18.585
    9    H    SER   3           H        SER   3 -43.824  -8.217  18.803
   10    HA   SER   3           HA       SER   3 -42.346  -5.705  19.047
   11    HB2  SER   3           1HB      SER   3 -40.339  -6.816  19.857
   12    HB3  SER   3           2HB      SER   3 -41.672  -7.137  20.967
   13    HG   SER   3           HG       SER   3 -40.653  -8.876  18.969
   14    H    GLY   4           H        GLY   4 -40.184  -5.932  17.786
   15    HA2  GLY   4           1HA      GLY   4 -40.596  -7.612  15.399
   16    HA3  GLY   4           2HA      GLY   4 -40.270  -5.894  15.226
   17    H    SER   5           H        SER   5 -38.407  -6.448  13.982
   18    HA   SER   5           HA       SER   5 -36.122  -7.210  15.672
   19    HB2  SER   5           1HB      SER   5 -35.136  -8.384  13.720
   20    HB3  SER   5           2HB      SER   5 -36.648  -9.120  14.251
   21    HG   SER   5           HG       SER   5 -37.172  -7.223  12.438
   22    H    SER   6           H        SER   6 -34.100  -6.294  15.074
   23    HA   SER   6           HA       SER   6 -34.378  -3.658  13.904
   24    HB2  SER   6           1HB      SER   6 -32.328  -5.067  15.540
   25    HB3  SER   6           2HB      SER   6 -31.773  -3.753  14.503
   26    HG   SER   6           HG       SER   6 -33.974  -3.459  16.252
   27    H    GLY   7           H        GLY   7 -32.568  -2.887  12.430
   28    HA2  GLY   7           1HA      GLY   7 -32.247  -4.887  10.293
   29    HA3  GLY   7           2HA      GLY   7 -32.240  -3.144  10.065
   30    H    GLU   8           H        GLU   8 -30.282  -3.031   9.017
   31    HA   GLU   8           HA       GLU   8 -27.952  -3.232  10.734
   32    HB2  GLU   8           1HB      GLU   8 -28.304  -5.462   9.497
   33    HB3  GLU   8           2HB      GLU   8 -27.843  -4.582   8.047
   34    HG2  GLU   8           1HG      GLU   8 -25.702  -4.006   9.087
   35    HG3  GLU   8           2HG      GLU   8 -26.163  -4.922  10.521
   36    H    LEU   9           H        LEU   9 -26.261  -1.897  10.112
   37    HA   LEU   9           HA       LEU   9 -26.925   0.388   8.625
   38    HB2  LEU   9           1HB      LEU   9 -24.590   1.020   8.871
   39    HB3  LEU   9           2HB      LEU   9 -25.247   0.400  10.385
   40    HG   LEU   9           HG       LEU   9 -24.143  -1.841   9.606
   41   HD11  LEU   9          1HD1      LEU   9 -22.038  -1.409   8.368
   42   HD12  LEU   9          2HD1      LEU   9 -22.610   0.226   8.038
   43   HD13  LEU   9          3HD1      LEU   9 -23.491  -1.162   7.399
   44   HD21  LEU   9          1HD2      LEU   9 -22.036   0.032  10.414
   45   HD22  LEU   9          2HD2      LEU   9 -22.625  -1.429  11.207
   46   HD23  LEU   9          3HD2      LEU   9 -23.494   0.093  11.404
   47    H    GLU  10           H        GLU  10 -25.423   1.195   6.801
   48    HA   GLU  10           HA       GLU  10 -25.213  -0.947   4.788
   49    HB2  GLU  10           1HB      GLU  10 -26.072   1.919   4.582
   50    HB3  GLU  10           2HB      GLU  10 -25.408   1.096   3.177
   51    HG2  GLU  10           1HG      GLU  10 -27.886   1.081   3.300
   52    HG3  GLU  10           2HG      GLU  10 -27.154  -0.519   3.197
   53    HA   PRO  11           HA       PRO  11 -20.867  -0.080   4.806
   54    HB2  PRO  11           1HB      PRO  11 -20.229  -1.600   2.649
   55    HB3  PRO  11           2HB      PRO  11 -20.591  -2.289   4.236
   56    HG2  PRO  11           1HG      PRO  11 -22.361  -2.026   1.836
   57    HG3  PRO  11           2HG      PRO  11 -22.171  -3.400   2.942
   58    HD2  PRO  11           1HD      PRO  11 -24.245  -1.667   3.114
   59    HD3  PRO  11           2HD      PRO  11 -23.549  -2.468   4.537
   60    H    GLY  12           H        GLY  12 -19.219   0.790   3.328
   61    HA2  GLY  12           1HA      GLY  12 -18.622   2.625   2.043
   62    HA3  GLY  12           2HA      GLY  12 -19.419   1.681   0.793
   63    H    ALA  13           H        ALA  13 -20.279   3.860   3.482
   64    HA   ALA  13           HA       ALA  13 -22.338   5.033   1.728
   65    HB1  ALA  13           1HB      ALA  13 -22.493   4.048   4.407
   66    HB2  ALA  13           2HB      ALA  13 -22.854   5.775   4.394
   67    HB3  ALA  13           3HB      ALA  13 -23.779   4.673   3.374
   68    H    PHE  14           H        PHE  14 -19.587   5.822   1.687
   69    HA   PHE  14           HA       PHE  14 -19.712   8.489   2.924
   70    HB2  PHE  14           1HB      PHE  14 -17.393   6.729   2.158
   71    HB3  PHE  14           2HB      PHE  14 -17.184   8.456   2.429
   72    HD1  PHE  14           1HD      PHE  14 -18.561   5.412   4.069
   73    HD2  PHE  14           2HD      PHE  14 -16.732   9.224   4.556
   74    HE1  PHE  14           1HE      PHE  14 -18.359   5.002   6.487
   75    HE2  PHE  14           2HE      PHE  14 -16.526   8.820   6.974
   76    HZ   PHE  14           HZ       PHE  14 -17.340   6.707   7.943
   77    H    SER  15           H        SER  15 -18.783  10.276   1.684
   78    HA   SER  15           HA       SER  15 -19.500  10.034  -1.144
   79    HB2  SER  15           1HB      SER  15 -19.120  12.448   0.638
   80    HB3  SER  15           2HB      SER  15 -19.457  12.548  -1.090
   81    HG   SER  15           HG       SER  15 -21.400  11.378  -0.672
   82    H    GLU  16           H        GLU  16 -18.165  11.055  -2.770
   83    HA   GLU  16           HA       GLU  16 -15.470  10.298  -2.619
   84    HB2  GLU  16           1HB      GLU  16 -15.213  11.251  -4.776
   85    HB3  GLU  16           2HB      GLU  16 -16.854  10.623  -4.711
   86    HG2  GLU  16           1HG      GLU  16 -17.778  12.780  -4.487
   87    HG3  GLU  16           2HG      GLU  16 -16.204  13.499  -4.152
   88    H    LEU  17           H        LEU  17 -13.629  11.864  -3.096
   89    HA   LEU  17           HA       LEU  17 -13.919  14.315  -1.492
   90    HB2  LEU  17           1HB      LEU  17 -11.528  12.481  -1.491
   91    HB3  LEU  17           2HB      LEU  17 -11.716  13.960  -0.552
   92    HG   LEU  17           HG       LEU  17 -13.637  11.704  -0.157
   93   HD11  LEU  17          1HD1      LEU  17 -11.564  11.565   1.782
   94   HD12  LEU  17          2HD1      LEU  17 -10.840  11.444   0.180
   95   HD13  LEU  17          3HD1      LEU  17 -12.112  10.321   0.658
   96   HD21  LEU  17          1HD2      LEU  17 -13.691  12.624   2.116
   97   HD22  LEU  17          2HD2      LEU  17 -14.100  13.841   0.905
   98   HD23  LEU  17          3HD2      LEU  17 -12.499  13.837   1.647
   99    H    TYR  18           H        TYR  18 -12.694  16.090  -2.133
  100    HA   TYR  18           HA       TYR  18 -11.982  16.113  -4.927
  101    HB2  TYR  18           1HB      TYR  18 -13.135  18.042  -4.136
  102    HB3  TYR  18           2HB      TYR  18 -12.024  18.239  -2.786
  103    HD1  TYR  18           2HD      TYR  18  -9.696  19.029  -3.215
  104    HD2  TYR  18           1HD      TYR  18 -12.655  18.967  -6.273
  105    HE1  TYR  18           2HE      TYR  18  -8.333  20.574  -4.558
  106    HE2  TYR  18           1HE      TYR  18 -11.298  20.510  -7.625
  107    HH   TYR  18           HH       TYR  18  -8.862  22.326  -6.452
  108    H    GLN  19           H        GLN  19 -10.256  16.976  -1.925
  109    HA   GLN  19           HA       GLN  19  -7.752  17.422  -2.926
  110    HB2  GLN  19           1HB      GLN  19  -8.623  16.156  -0.338
  111    HB3  GLN  19           2HB      GLN  19  -6.928  16.461  -0.693
  112    HG2  GLN  19           1HG      GLN  19  -9.045  18.594  -0.738
  113    HG3  GLN  19           2HG      GLN  19  -8.069  18.210   0.679
  114   HE21  GLN  19          1HE2      GLN  19  -6.269  19.319   0.930
  115   HE22  GLN  19          2HE2      GLN  19  -5.425  20.181  -0.306
  116    H    ARG  20           H        ARG  20  -5.807  16.079  -2.932
  117    HA   ARG  20           HA       ARG  20  -6.304  13.587  -4.293
  118    HB2  ARG  20           1HB      ARG  20  -3.962  15.345  -3.813
  119    HB3  ARG  20           2HB      ARG  20  -3.626  13.640  -4.078
  120    HG2  ARG  20           1HG      ARG  20  -4.278  13.703  -6.253
  121    HG3  ARG  20           2HG      ARG  20  -5.462  14.982  -5.977
  122    HD2  ARG  20           1HD      ARG  20  -3.844  16.107  -7.167
  123    HD3  ARG  20           2HD      ARG  20  -3.355  16.443  -5.507
  124    HE   ARG  20           HE       ARG  20  -1.928  14.251  -6.055
  125   HH11  ARG  20          2HH1      ARG  20  -2.427  17.184  -7.863
  126   HH12  ARG  20          1HH1      ARG  20  -0.876  17.127  -8.634
  127   HH21  ARG  20          2HH2      ARG  20   0.116  14.165  -7.063
  128   HH22  ARG  20          1HH2      ARG  20   0.569  15.409  -8.179
  129    H    TYR  21           H        TYR  21  -5.535  11.539  -3.666
  130    HA   TYR  21           HA       TYR  21  -5.592  11.116  -0.802
  131    HB2  TYR  21           1HB      TYR  21  -6.863   9.646  -2.336
  132    HB3  TYR  21           2HB      TYR  21  -5.347   9.104  -3.048
  133    HD1  TYR  21           2HD      TYR  21  -3.596   8.186  -1.252
  134    HD2  TYR  21           1HD      TYR  21  -7.814   8.320  -0.708
  135    HE1  TYR  21           2HE      TYR  21  -3.427   6.415   0.446
  136    HE2  TYR  21           1HE      TYR  21  -7.657   6.550   0.992
  137    HH   TYR  21           HH       TYR  21  -5.687   4.543   1.383
  138    H    ARG  22           H        ARG  22  -3.776  11.359   0.318
  139    HA   ARG  22           HA       ARG  22  -1.319  10.131  -0.729
  140    HB2  ARG  22           1HB      ARG  22  -1.416  12.782   0.720
  141    HB3  ARG  22           2HB      ARG  22   0.011  11.994   0.060
  142    HG2  ARG  22           1HG      ARG  22  -0.638  12.418  -2.151
  143    HG3  ARG  22           2HG      ARG  22  -2.294  12.804  -1.677
  144    HD2  ARG  22           1HD      ARG  22  -1.266  14.873  -2.144
  145    HD3  ARG  22           2HD      ARG  22  -1.320  14.754  -0.386
  146    HE   ARG  22           HE       ARG  22   1.135  13.741  -1.267
  147   HH11  ARG  22          2HH1      ARG  22  -0.586  16.763  -1.102
  148   HH12  ARG  22          1HH1      ARG  22   0.851  17.725  -0.991
  149   HH21  ARG  22          2HH2      ARG  22   3.034  14.996  -1.120
  150   HH22  ARG  22          1HH2      ARG  22   2.910  16.718  -1.002
  151    H    HIS  23           H        HIS  23  -1.825   8.354   0.650
  152    HA   HIS  23           HA       HIS  23  -0.857   8.748   3.359
  153    HB2  HIS  23           1HB      HIS  23  -3.297   9.051   3.563
  154    HB3  HIS  23           2HB      HIS  23  -3.548   7.472   2.826
  155    HD1  HIS  23           1HD      HIS  23  -2.130   9.036   5.960
  156    HD2  HIS  23           2HD      HIS  23  -3.435   5.349   4.558
  157    HE1  HIS  23           1HE      HIS  23  -2.174   7.529   7.973
  158    HE2  HIS  23           2HE      HIS  23  -2.885   5.282   7.085
  159    H    CYS  24           H        CYS  24   0.701   7.293   3.564
  160    HA   CYS  24           HA       CYS  24   1.078   5.084   1.890
  161    HB2  CYS  24           1HB      CYS  24   2.996   5.884   2.989
  162    HB3  CYS  24           2HB      CYS  24   2.215   5.850   4.567
  163    H    ASP  25           H        ASP  25   0.097   3.183   1.809
  164    HA   ASP  25           HA       ASP  25  -1.062   2.074   4.273
  165    HB2  ASP  25           1HB      ASP  25  -2.783   3.126   2.709
  166    HB3  ASP  25           2HB      ASP  25  -2.405   1.824   1.584
  167    H    ALA  26           H        ALA  26   1.439   1.579   2.728
  168    HA   ALA  26           HA       ALA  26   1.143  -0.954   1.431
  169    HB1  ALA  26           1HB      ALA  26   3.109  -0.339   0.613
  170    HB2  ALA  26           2HB      ALA  26   3.208   0.989   1.769
  171    HB3  ALA  26           3HB      ALA  26   3.831  -0.603   2.201
  172    HA   PRO  27           HA       PRO  27   1.624  -3.829   4.711
  173    HB2  PRO  27           1HB      PRO  27   3.541  -5.538   3.831
  174    HB3  PRO  27           2HB      PRO  27   1.912  -5.488   3.148
  175    HG2  PRO  27           1HG      PRO  27   4.438  -4.257   2.115
  176    HG3  PRO  27           2HG      PRO  27   3.169  -5.120   1.227
  177    HD2  PRO  27           1HD      PRO  27   3.339  -2.418   1.266
  178    HD3  PRO  27           2HD      PRO  27   1.788  -3.276   1.156
  179    H    ILE  28           H        ILE  28   4.876  -3.005   3.486
  180    HA   ILE  28           HA       ILE  28   5.716  -2.559   6.270
  181    HB   ILE  28           HB       ILE  28   7.351  -3.948   4.143
  182   HG12  ILE  28          1HG1      ILE  28   5.576  -5.349   5.166
  183   HG13  ILE  28          2HG1      ILE  28   7.195  -5.913   5.564
  184   HG21  ILE  28          1HG2      ILE  28   9.115  -3.206   5.277
  185   HG22  ILE  28          2HG2      ILE  28   8.098  -2.546   6.556
  186   HG23  ILE  28          3HG2      ILE  28   8.595  -4.237   6.609
  187   HD11  ILE  28          1HD1      ILE  28   6.881  -4.494   7.708
  188   HD12  ILE  28          2HD1      ILE  28   5.166  -4.604   7.310
  189   HD13  ILE  28          3HD1      ILE  28   6.104  -6.072   7.579
  190    H    CYS  29           H        CYS  29   6.826  -0.727   6.625
  191    HA   CYS  29           HA       CYS  29   7.640   0.845   4.269
  192    HB2  CYS  29           1HB      CYS  29   5.729   1.619   5.934
  193    HB3  CYS  29           2HB      CYS  29   7.101   2.154   6.899
  194    H    LEU  30           H        LEU  30   9.688   1.560   4.145
  195    HA   LEU  30           HA       LEU  30  11.483   0.879   6.369
  196    HB2  LEU  30           1HB      LEU  30  12.322   1.555   3.567
  197    HB3  LEU  30           2HB      LEU  30  13.242   0.710   4.811
  198    HG   LEU  30           HG       LEU  30  10.745  -0.557   3.801
  199   HD11  LEU  30          1HD1      LEU  30  11.420  -0.761   1.703
  200   HD12  LEU  30          2HD1      LEU  30  12.944  -1.465   2.241
  201   HD13  LEU  30          3HD1      LEU  30  12.799   0.282   2.049
  202   HD21  LEU  30          1HD2      LEU  30  13.324  -1.368   5.039
  203   HD22  LEU  30          2HD2      LEU  30  12.500  -2.519   3.987
  204   HD23  LEU  30          3HD2      LEU  30  11.678  -1.881   5.412
  205    H    TYR  31           H        TYR  31  10.343   3.491   4.372
  206    HA   TYR  31           HA       TYR  31  12.316   5.405   4.889
  207    HB2  TYR  31           1HB      TYR  31  10.214   5.434   3.302
  208    HB3  TYR  31           2HB      TYR  31   9.445   6.218   4.677
  209    HD1  TYR  31           2HD      TYR  31  12.587   6.468   2.665
  210    HD2  TYR  31           1HD      TYR  31   9.513   8.521   4.772
  211    HE1  TYR  31           2HE      TYR  31  13.558   8.619   1.974
  212    HE2  TYR  31           1HE      TYR  31  10.475  10.678   4.085
  213    HH   TYR  31           HH       TYR  31  12.747  10.985   1.651
  214    H    GLU  32           H        GLU  32  12.989   6.077   6.809
  215    HA   GLU  32           HA       GLU  32  12.020   5.672   9.273
  216    HB2  GLU  32           1HB      GLU  32  13.215   8.298   8.367
  217    HB3  GLU  32           2HB      GLU  32  13.151   7.712  10.023
  218    HG2  GLU  32           1HG      GLU  32  14.456   5.677   9.069
  219    HG3  GLU  32           2HG      GLU  32  14.842   6.782   7.751
  220    H    GLN  33           H        GLN  33  11.197   8.582   7.380
  221    HA   GLN  33           HA       GLN  33   9.353   9.667   9.149
  222    HB2  GLN  33           1HB      GLN  33   9.895   9.924   6.247
  223    HB3  GLN  33           2HB      GLN  33   8.319  10.475   6.799
  224    HG2  GLN  33           1HG      GLN  33   9.181  12.212   7.985
  225    HG3  GLN  33           2HG      GLN  33  10.702  11.381   8.310
  226   HE21  GLN  33          1HE2      GLN  33  12.288  12.531   7.480
  227   HE22  GLN  33          2HE2      GLN  33  12.313  13.246   5.908
  228    H    GLY  34           H        GLY  34   8.923   7.208   6.658
  229    HA2  GLY  34           1HA      GLY  34   7.086   5.939   6.073
  230    HA3  GLY  34           2HA      GLY  34   6.911   5.791   7.816
  231    H    ARG  35           H        ARG  35   6.580   8.821   6.084
  232    HA   ARG  35           HA       ARG  35   3.726   8.833   6.811
  233    HB2  ARG  35           1HB      ARG  35   3.842  11.188   7.072
  234    HB3  ARG  35           2HB      ARG  35   5.253  10.536   7.894
  235    HG2  ARG  35           1HG      ARG  35   6.366  10.980   5.528
  236    HG3  ARG  35           2HG      ARG  35   5.075  12.180   5.438
  237    HD2  ARG  35           1HD      ARG  35   7.025  11.939   7.724
  238    HD3  ARG  35           2HD      ARG  35   7.213  13.053   6.371
  239    HE   ARG  35           HE       ARG  35   5.379  13.297   8.590
  240   HH11  ARG  35          2HH1      ARG  35   6.185  14.316   5.360
  241   HH12  ARG  35          1HH1      ARG  35   5.300  15.801   5.468
  242   HH21  ARG  35          2HH2      ARG  35   4.211  15.250   8.744
  243   HH22  ARG  35          1HH2      ARG  35   4.179  16.332   7.394
  244    H    ASP  36           H        ASP  36   2.730  10.829   5.343
  245    HA   ASP  36           HA       ASP  36   2.602   9.681   2.720
  246    HB2  ASP  36           1HB      ASP  36   0.997  11.549   2.274
  247    HB3  ASP  36           2HB      ASP  36   0.577  10.566   3.674
  248    H    SER  37           H        SER  37   5.194  10.421   3.108
  249    HA   SER  37           HA       SER  37   5.508  12.879   1.518
  250    HB2  SER  37           1HB      SER  37   7.134  11.625   3.672
  251    HB3  SER  37           2HB      SER  37   8.007  12.453   2.383
  252    HG   SER  37           HG       SER  37   5.823  13.729   3.593
  253    H    PHE  38           H        PHE  38   6.456  12.806  -0.437
  254    HA   PHE  38           HA       PHE  38   8.003  10.483  -1.244
  255    HB2  PHE  38           1HB      PHE  38   5.643  11.316  -2.927
  256    HB3  PHE  38           2HB      PHE  38   6.656   9.889  -3.111
  257    HD1  PHE  38           1HD      PHE  38   4.187  11.483  -0.850
  258    HD2  PHE  38           2HD      PHE  38   6.066   7.875  -2.102
  259    HE1  PHE  38           1HE      PHE  38   2.599  10.188   0.511
  260    HE2  PHE  38           2HE      PHE  38   4.480   6.574  -0.744
  261    HZ   PHE  38           HZ       PHE  38   2.743   7.730   0.565
  262    H    GLU  39           H        GLU  39   9.085  10.796  -3.320
  263    HA   GLU  39           HA       GLU  39   9.650  13.639  -3.772
  264    HB2  GLU  39           1HB      GLU  39  11.588  12.309  -3.176
  265    HB3  GLU  39           2HB      GLU  39  11.239  11.164  -4.464
  266    HG2  GLU  39           1HG      GLU  39  11.693  12.853  -6.134
  267    HG3  GLU  39           2HG      GLU  39  11.958  14.057  -4.874
  268    H    ASP  40           H        ASP  40  10.218  14.243  -6.048
  269    HA   ASP  40           HA       ASP  40   8.133  14.106  -7.761
  270    HB2  ASP  40           1HB      ASP  40  10.481  15.326  -7.917
  271    HB3  ASP  40           2HB      ASP  40  10.846  13.987  -9.002
  272    H    GLU  41           H        GLU  41  10.753  11.753  -7.512
  273    HA   GLU  41           HA       GLU  41   9.157   9.622  -8.444
  274    HB2  GLU  41           1HB      GLU  41  10.374   9.158 -10.566
  275    HB3  GLU  41           2HB      GLU  41   9.384  10.610 -10.626
  276    HG2  GLU  41           1HG      GLU  41  11.430  11.947 -10.176
  277    HG3  GLU  41           2HG      GLU  41  12.371  10.463 -10.311
  278    H    GLY  42           H        GLY  42  10.520   7.616  -8.850
  279    HA2  GLY  42           1HA      GLY  42  12.895   6.799  -8.555
  280    HA3  GLY  42           2HA      GLY  42  12.865   7.717  -7.057
  281    H    ARG  43           H        ARG  43  12.793   6.358  -5.400
  282    HA   ARG  43           HA       ARG  43  11.214   3.897  -5.647
  283    HB2  ARG  43           1HB      ARG  43  12.487   3.072  -3.743
  284    HB3  ARG  43           2HB      ARG  43  13.575   3.643  -5.000
  285    HG2  ARG  43           1HG      ARG  43  13.943   5.707  -3.773
  286    HG3  ARG  43           2HG      ARG  43  12.811   5.180  -2.526
  287    HD2  ARG  43           1HD      ARG  43  14.806   4.578  -1.569
  288    HD3  ARG  43           2HD      ARG  43  14.391   3.090  -2.418
  289    HE   ARG  43           HE       ARG  43  15.972   4.838  -4.025
  290   HH11  ARG  43          2HH1      ARG  43  16.114   2.490  -1.458
  291   HH12  ARG  43          1HH1      ARG  43  17.749   2.028  -1.796
  292   HH21  ARG  43          2HH2      ARG  43  18.125   4.238  -4.479
  293   HH22  ARG  43          1HH2      ARG  43  18.892   3.023  -3.514
  294    H    TRP  44           H        TRP  44  11.568   6.820  -3.743
  295    HA   TRP  44           HA       TRP  44   9.366   6.010  -1.994
  296    HB2  TRP  44           1HB      TRP  44  11.061   8.510  -1.845
  297    HB3  TRP  44           2HB      TRP  44   9.966   7.897  -0.609
  298    HD1  TRP  44           HD       TRP  44  13.478   8.132  -1.132
  299    HE1  TRP  44           1HE      TRP  44  14.787   6.271   0.071
  300    HE3  TRP  44           3HE      TRP  44   9.625   4.904  -0.198
  301    HZ2  TRP  44           2HZ      TRP  44  14.256   3.765   1.258
  302    HZ3  TRP  44           3HZ      TRP  44  10.110   2.797   0.976
  303    HH2  TRP  44           HH       TRP  44  12.378   2.241   1.688
  304    H    ARG  45           H        ARG  45   8.712   6.487  -4.688
  305    HA   ARG  45           HA       ARG  45   7.533   9.144  -4.802
  306    HB2  ARG  45           1HB      ARG  45   6.958   8.617  -7.080
  307    HB3  ARG  45           2HB      ARG  45   8.623   8.127  -6.798
  308    HG2  ARG  45           1HG      ARG  45   8.156   5.911  -7.001
  309    HG3  ARG  45           2HG      ARG  45   6.504   6.091  -6.407
  310    HD2  ARG  45           1HD      ARG  45   5.690   6.722  -8.465
  311    HD3  ARG  45           2HD      ARG  45   7.252   7.327  -9.014
  312    HE   ARG  45           HE       ARG  45   6.283   4.604  -9.164
  313   HH11  ARG  45          2HH1      ARG  45   9.024   6.742  -9.340
  314   HH12  ARG  45          1HH1      ARG  45   9.993   5.636 -10.256
  315   HH21  ARG  45          2HH2      ARG  45   7.549   3.138 -10.369
  316   HH22  ARG  45          1HH2      ARG  45   9.153   3.587 -10.841
  317    H    LEU  46           H        LEU  46   5.275   9.485  -5.191
  318    HA   LEU  46           HA       LEU  46   3.621   7.720  -3.612
  319    HB2  LEU  46           1HB      LEU  46   3.577  10.290  -3.655
  320    HB3  LEU  46           2HB      LEU  46   2.655  10.110  -5.146
  321    HG   LEU  46           HG       LEU  46   1.710   8.702  -2.693
  322   HD11  LEU  46          1HD1      LEU  46   2.168  10.920  -1.862
  323   HD12  LEU  46          2HD1      LEU  46   0.429  10.710  -2.056
  324   HD13  LEU  46          3HD1      LEU  46   1.341  11.643  -3.242
  325   HD21  LEU  46          1HD2      LEU  46   0.287  10.072  -4.973
  326   HD22  LEU  46          2HD2      LEU  46  -0.459   9.101  -3.703
  327   HD23  LEU  46          3HD2      LEU  46   0.626   8.344  -4.871
  328    H    ILE  47           H        ILE  47   3.168   5.857  -4.673
  329    HA   ILE  47           HA       ILE  47   2.239   5.969  -7.439
  330    HB   ILE  47           HB       ILE  47   2.772   3.576  -5.675
  331   HG12  ILE  47          1HG1      ILE  47   4.406   4.935  -7.820
  332   HG13  ILE  47          2HG1      ILE  47   4.845   4.678  -6.135
  333   HG21  ILE  47          1HG2      ILE  47   2.319   3.652  -8.652
  334   HG22  ILE  47          2HG2      ILE  47   2.515   2.227  -7.632
  335   HG23  ILE  47          3HG2      ILE  47   1.076   3.234  -7.473
  336   HD11  ILE  47          1HD1      ILE  47   6.068   3.143  -7.488
  337   HD12  ILE  47          2HD1      ILE  47   4.858   2.235  -6.581
  338   HD13  ILE  47          3HD1      ILE  47   4.595   2.595  -8.287
  339    H    LEU  48           H        LEU  48   0.149   6.178  -7.848
  340    HA   LEU  48           HA       LEU  48  -1.804   5.473  -5.793
  341    HB2  LEU  48           1HB      LEU  48  -1.967   7.071  -8.333
  342    HB3  LEU  48           2HB      LEU  48  -3.399   6.609  -7.415
  343    HG   LEU  48           HG       LEU  48  -1.145   8.243  -6.261
  344   HD11  LEU  48          1HD1      LEU  48  -2.046  10.156  -7.021
  345   HD12  LEU  48          2HD1      LEU  48  -3.699   9.553  -6.898
  346   HD13  LEU  48          3HD1      LEU  48  -2.704   9.119  -8.288
  347   HD21  LEU  48          1HD2      LEU  48  -2.239   7.617  -4.398
  348   HD22  LEU  48          2HD2      LEU  48  -3.700   7.168  -5.278
  349   HD23  LEU  48          3HD2      LEU  48  -3.391   8.860  -4.886
  350    H    CYS  49           H        CYS  49  -3.435   3.994  -6.083
  351    HA   CYS  49           HA       CYS  49  -2.982   1.697  -7.505
  352    HB2  CYS  49           1HB      CYS  49  -4.661   1.893  -5.717
  353    HB3  CYS  49           2HB      CYS  49  -5.682   2.855  -6.781
  354    H    ALA  50           H        ALA  50  -4.083   0.766  -9.364
  355    HA   ALA  50           HA       ALA  50  -4.564   2.787 -11.452
  356    HB1  ALA  50           1HB      ALA  50  -4.104   0.207 -12.571
  357    HB2  ALA  50           2HB      ALA  50  -3.131   1.670 -12.724
  358    HB3  ALA  50           3HB      ALA  50  -2.837   0.551 -11.393
  359    H    THR  51           H        THR  51  -5.740  -0.202 -10.021
  360    HA   THR  51           HA       THR  51  -7.827  -0.722 -11.834
  361    HB   THR  51           HB       THR  51  -7.626  -1.424  -8.900
  362    HG1  THR  51           1HG      THR  51  -6.193  -2.264 -10.875
  363   HG21  THR  51          1HG2      THR  51  -9.909  -1.510 -10.376
  364   HG22  THR  51          2HG2      THR  51  -9.548  -2.597  -9.035
  365   HG23  THR  51          3HG2      THR  51  -9.236  -3.108 -10.693
  366    H    CYS  52           H        CYS  52  -7.904   0.903  -8.660
  367    HA   CYS  52           HA       CYS  52 -10.444   2.159  -9.474
  368    HB2  CYS  52           1HB      CYS  52 -11.092   2.245  -7.164
  369    HB3  CYS  52           2HB      CYS  52 -10.571   0.600  -7.513
  370    H    GLY  53           H        GLY  53  -7.326   2.652  -7.901
  371    HA2  GLY  53           1HA      GLY  53  -6.025   4.561  -7.821
  372    HA3  GLY  53           2HA      GLY  53  -7.251   5.385  -8.773
  373    H    SER  54           H        SER  54  -7.701   3.767  -5.666
  374    HA   SER  54           HA       SER  54  -8.375   6.390  -4.502
  375    HB2  SER  54           1HB      SER  54  -9.743   3.749  -4.359
  376    HB3  SER  54           2HB      SER  54  -9.761   4.750  -2.908
  377    HG   SER  54           HG       SER  54 -10.866   6.300  -3.973
  378    H    HIS  55           H        HIS  55  -5.810   4.836  -4.552
  379    HA   HIS  55           HA       HIS  55  -5.265   5.052  -1.697
  380    HB2  HIS  55           1HB      HIS  55  -4.640   2.565  -3.303
  381    HB3  HIS  55           2HB      HIS  55  -4.055   2.885  -1.673
  382    HD1  HIS  55           1HD      HIS  55  -7.119   1.904  -3.570
  383    HD2  HIS  55           2HD      HIS  55  -5.949   2.549   0.364
  384    HE1  HIS  55           1HE      HIS  55  -8.982   0.981  -2.154
  385    HE2  HIS  55           2HE      HIS  55  -8.291   1.460   0.220
  386    H    GLY  56           H        GLY  56  -3.062   5.402  -1.197
  387    HA2  GLY  56           1HA      GLY  56  -1.227   5.714  -3.463
  388    HA3  GLY  56           2HA      GLY  56  -1.571   7.129  -2.479
  389    H    THR  57           H        THR  57   0.679   4.874  -2.977
  390    HA   THR  57           HA       THR  57   1.815   5.242  -0.327
  391    HB   THR  57           HB       THR  57   0.495   3.100  -0.233
  392    HG1  THR  57           1HG      THR  57   1.979   2.804   1.242
  393   HG21  THR  57          1HG2      THR  57   2.564   2.249  -2.260
  394   HG22  THR  57          2HG2      THR  57   0.812   2.265  -2.464
  395   HG23  THR  57          3HG2      THR  57   1.559   1.129  -1.341
  396    H    HIS  58           H        HIS  58   4.080   4.251  -0.253
  397    HA   HIS  58           HA       HIS  58   5.585   5.304  -2.406
  398    HB2  HIS  58           1HB      HIS  58   6.626   3.368  -0.341
  399    HB3  HIS  58           2HB      HIS  58   7.518   4.620  -1.201
  400    HD2  HIS  58           2HD      HIS  58   7.385   7.158  -0.084
  401    HE1  HIS  58           1HE      HIS  58   4.971   6.072   3.231
  402    HE2  HIS  58           2HE      HIS  58   6.301   7.912   2.140
  403    H    ARG  59           H        ARG  59   7.448   3.854  -3.338
  404    HA   ARG  59           HA       ARG  59   6.117   1.733  -4.807
  405    HB2  ARG  59           1HB      ARG  59   7.597   3.493  -5.878
  406    HB3  ARG  59           2HB      ARG  59   8.964   2.680  -5.129
  407    HG2  ARG  59           1HG      ARG  59   7.113   1.035  -6.757
  408    HG3  ARG  59           2HG      ARG  59   8.186   2.153  -7.601
  409    HD2  ARG  59           1HD      ARG  59   9.074   0.083  -5.597
  410    HD3  ARG  59           2HD      ARG  59   9.142  -0.115  -7.347
  411    HE   ARG  59           HE       ARG  59  10.930   1.424  -5.704
  412   HH11  ARG  59          2HH1      ARG  59   9.624   1.002  -8.903
  413   HH12  ARG  59          1HH1      ARG  59  10.972   1.749  -9.693
  414   HH21  ARG  59          2HH2      ARG  59  12.711   2.409  -6.733
  415   HH22  ARG  59          1HH2      ARG  59  12.728   2.548  -8.458
  416    H    ASP  60           H        ASP  60   9.283   2.011  -3.180
  417    HA   ASP  60           HA       ASP  60   9.748  -0.761  -3.062
  418    HB2  ASP  60           1HB      ASP  60  10.925   1.642  -1.740
  419    HB3  ASP  60           2HB      ASP  60  11.309   0.055  -1.077
  420    H    CYS  61           H        CYS  61   7.941   1.391  -1.023
  421    HA   CYS  61           HA       CYS  61   7.866  -0.183   1.317
  422    HB2  CYS  61           1HB      CYS  61   7.200   2.226   1.165
  423    HB3  CYS  61           2HB      CYS  61   5.736   1.722   0.327
  424    H    SER  62           H        SER  62   5.949  -0.190  -1.624
  425    HA   SER  62           HA       SER  62   4.042  -2.097  -0.588
  426    HB2  SER  62           1HB      SER  62   4.398  -0.577  -3.115
  427    HB3  SER  62           2HB      SER  62   3.533  -2.109  -3.228
  428    HG   SER  62           HG       SER  62   1.895  -1.244  -2.230
  429    H    SER  63           H        SER  63   7.007  -2.687  -0.855
  430    HA   SER  63           HA       SER  63   8.395  -4.366  -1.549
  431    HB2  SER  63           1HB      SER  63   6.474  -5.438  -0.070
  432    HB3  SER  63           2HB      SER  63   6.069  -6.243  -1.586
  433    HG   SER  63           HG       SER  63   7.658  -7.284  -0.089
  434    H    LEU  64           H        LEU  64   7.359  -2.854  -3.690
  435    HA   LEU  64           HA       LEU  64   6.606  -4.733  -5.772
  436    HB2  LEU  64           1HB      LEU  64   7.195  -1.789  -6.013
  437    HB3  LEU  64           2HB      LEU  64   6.371  -2.808  -7.192
  438    HG   LEU  64           HG       LEU  64   5.268  -2.225  -4.450
  439   HD11  LEU  64          1HD1      LEU  64   5.628  -0.313  -6.334
  440   HD12  LEU  64          2HD1      LEU  64   4.317  -0.318  -5.155
  441   HD13  LEU  64          3HD1      LEU  64   4.041  -0.935  -6.784
  442   HD21  LEU  64          1HD2      LEU  64   4.525  -3.976  -6.595
  443   HD22  LEU  64          2HD2      LEU  64   3.270  -2.762  -6.346
  444   HD23  LEU  64          3HD2      LEU  64   3.789  -3.783  -5.004
  445    H    ARG  65           H        ARG  65   7.778  -4.553  -7.912
  446    HA   ARG  65           HA       ARG  65  10.639  -4.846  -7.401
  447    HB2  ARG  65           1HB      ARG  65   8.738  -5.858  -9.447
  448    HB3  ARG  65           2HB      ARG  65  10.399  -5.596  -9.964
  449    HG2  ARG  65           1HG      ARG  65   9.994  -7.901  -9.241
  450    HG3  ARG  65           2HG      ARG  65  11.208  -7.092  -8.248
  451    HD2  ARG  65           1HD      ARG  65   9.953  -8.030  -6.595
  452    HD3  ARG  65           2HD      ARG  65   9.081  -6.510  -6.782
  453    HE   ARG  65           HE       ARG  65   7.302  -7.662  -7.694
  454   HH11  ARG  65          2HH1      ARG  65  10.051  -9.771  -7.347
  455   HH12  ARG  65          1HH1      ARG  65   9.148 -11.215  -7.666
  456   HH21  ARG  65          2HH2      ARG  65   6.103  -9.556  -8.116
  457   HH22  ARG  65          1HH2      ARG  65   6.902 -11.091  -8.104
  458    HA   PRO  66           HA       PRO  66  11.914  -1.190  -9.463
  459    HB2  PRO  66           1HB      PRO  66  14.091  -2.022 -10.856
  460    HB3  PRO  66           2HB      PRO  66  14.084  -1.849  -9.097
  461    HG2  PRO  66           1HG      PRO  66  13.754  -4.317 -10.758
  462    HG3  PRO  66           2HG      PRO  66  14.708  -4.081  -9.282
  463    HD2  PRO  66           1HD      PRO  66  12.274  -5.268  -9.270
  464    HD3  PRO  66           2HD      PRO  66  12.869  -4.296  -7.909
  465    H    ASN  67           H        ASN  67  10.530  -3.693 -11.133
  466    HA   ASN  67           HA       ASN  67  10.791  -2.347 -13.736
  467    HB2  ASN  67           1HB      ASN  67  10.183  -5.186 -12.961
  468    HB3  ASN  67           2HB      ASN  67   9.718  -4.572 -14.545
  469   HD21  ASN  67          1HD2      ASN  67  11.266  -4.183 -16.071
  470   HD22  ASN  67          2HD2      ASN  67  12.920  -4.642 -15.880
  471    H    SER  68           H        SER  68   8.445  -3.745 -11.484
  472    HA   SER  68           HA       SER  68   6.070  -3.543 -12.684
  473    HB2  SER  68           1HB      SER  68   6.555  -3.977 -10.207
  474    HB3  SER  68           2HB      SER  68   6.448  -2.230  -9.993
  475    HG   SER  68           HG       SER  68   4.448  -3.374  -9.637
  476    H    LYS  69           H        LYS  69   4.554  -2.001 -13.250
  477    HA   LYS  69           HA       LYS  69   5.574   0.759 -13.416
  478    HB2  LYS  69           1HB      LYS  69   3.601  -0.632 -15.238
  479    HB3  LYS  69           2HB      LYS  69   4.166   1.025 -15.409
  480    HG2  LYS  69           1HG      LYS  69   6.304   0.357 -16.053
  481    HG3  LYS  69           2HG      LYS  69   6.083  -1.277 -15.423
  482    HD2  LYS  69           1HD      LYS  69   4.714  -1.906 -17.210
  483    HD3  LYS  69           2HD      LYS  69   4.380  -0.233 -17.662
  484    HE2  LYS  69           1HE      LYS  69   7.160  -1.346 -17.795
  485    HE3  LYS  69           2HE      LYS  69   6.014  -1.611 -19.108
  486    HZ1  LYS  69           1HZ      LYS  69   6.439   1.117 -18.106
  487    HZ2  LYS  69           2HZ      LYS  69   5.984   0.601 -19.651
  488    HZ3  LYS  69           3HZ      LYS  69   7.589   0.435 -19.143
  489    H    LYS  70           H        LYS  70   2.602  -1.161 -13.073
  490    HA   LYS  70           HA       LYS  70   1.405   1.118 -11.636
  491    HB2  LYS  70           1HB      LYS  70  -0.753   0.456 -12.419
  492    HB3  LYS  70           2HB      LYS  70   0.314   0.510 -13.816
  493    HG2  LYS  70           1HG      LYS  70   0.426  -1.831 -13.957
  494    HG3  LYS  70           2HG      LYS  70  -0.249  -2.042 -12.339
  495    HD2  LYS  70           1HD      LYS  70  -2.365  -0.995 -13.192
  496    HD3  LYS  70           2HD      LYS  70  -1.670  -1.066 -14.813
  497    HE2  LYS  70           1HE      LYS  70  -1.710  -3.547 -13.169
  498    HE3  LYS  70           2HE      LYS  70  -3.220  -2.993 -13.889
  499    HZ1  LYS  70           1HZ      LYS  70  -0.759  -3.905 -15.220
  500    HZ2  LYS  70           2HZ      LYS  70  -1.805  -2.848 -16.026
  501    HZ3  LYS  70           3HZ      LYS  70  -2.363  -4.359 -15.511
  502    H    TRP  71           H        TRP  71   0.290   0.717  -9.731
  503    HA   TRP  71           HA       TRP  71   0.580  -2.003  -8.634
  504    HB2  TRP  71           1HB      TRP  71   2.100  -0.920  -7.303
  505    HB3  TRP  71           2HB      TRP  71   1.305   0.641  -7.482
  506    HD1  TRP  71           HD       TRP  71   1.102  -2.595  -5.421
  507    HE1  TRP  71           1HE      TRP  71  -0.234  -2.109  -3.275
  508    HE3  TRP  71           3HE      TRP  71  -0.422   2.171  -6.473
  509    HZ2  TRP  71           2HZ      TRP  71  -1.735   0.013  -2.174
  510    HZ3  TRP  71           3HZ      TRP  71  -1.805   3.358  -4.821
  511    HH2  TRP  71           HH       TRP  71  -2.448   2.300  -2.717
  512    H    GLU  72           H        GLU  72  -1.027  -2.686  -7.139
  513    HA   GLU  72           HA       GLU  72  -3.550  -1.180  -7.366
  514    HB2  GLU  72           1HB      GLU  72  -3.002  -4.137  -7.346
  515    HB3  GLU  72           2HB      GLU  72  -4.588  -3.501  -6.935
  516    HG2  GLU  72           1HG      GLU  72  -4.989  -2.741  -9.073
  517    HG3  GLU  72           2HG      GLU  72  -3.276  -2.675  -9.482
  518    H    CYS  73           H        CYS  73  -4.883  -1.016  -5.560
  519    HA   CYS  73           HA       CYS  73  -3.524  -0.971  -3.047
  520    HB2  CYS  73           1HB      CYS  73  -5.609  -0.107  -2.148
  521    HB3  CYS  73           2HB      CYS  73  -5.249   0.692  -3.675
  522    H    ASN  74           H        ASN  74  -4.435  -1.988  -1.072
  523    HA   ASN  74           HA       ASN  74  -4.402  -4.745  -1.202
  524    HB2  ASN  74           1HB      ASN  74  -4.004  -3.870   0.922
  525    HB3  ASN  74           2HB      ASN  74  -5.410  -2.811   0.858
  526   HD21  ASN  74          1HD2      ASN  74  -4.196  -5.861   1.765
  527   HD22  ASN  74          2HD2      ASN  74  -5.667  -6.521   2.387
  528    H    GLU  75           H        GLU  75  -7.266  -2.657  -0.817
  529    HA   GLU  75           HA       GLU  75  -9.250  -4.534  -0.750
  530    HB2  GLU  75           1HB      GLU  75  -9.818  -2.234  -0.490
  531    HB3  GLU  75           2HB      GLU  75  -9.207  -1.833  -2.089
  532    HG2  GLU  75           1HG      GLU  75 -11.040  -2.747  -3.164
  533    HG3  GLU  75           2HG      GLU  75 -11.476  -3.751  -1.783
  534    H    CYS  76           H        CYS  76  -7.584  -3.288  -3.609
  535    HA   CYS  76           HA       CYS  76  -9.173  -4.771  -5.466
  536    HB2  CYS  76           1HB      CYS  76  -6.575  -3.262  -5.695
  537    HB3  CYS  76           2HB      CYS  76  -7.253  -4.155  -7.052
  538    H    LEU  77           H        LEU  77  -5.786  -5.098  -4.396
  539    HA   LEU  77           HA       LEU  77  -5.026  -7.354  -5.698
  540    HB2  LEU  77           1HB      LEU  77  -4.483  -6.653  -2.818
  541    HB3  LEU  77           2HB      LEU  77  -3.612  -7.887  -3.726
  542    HG   LEU  77           HG       LEU  77  -3.667  -5.002  -4.576
  543   HD11  LEU  77          1HD1      LEU  77  -1.362  -6.177  -3.098
  544   HD12  LEU  77          2HD1      LEU  77  -2.733  -5.539  -2.193
  545   HD13  LEU  77          3HD1      LEU  77  -1.837  -4.490  -3.291
  546   HD21  LEU  77          1HD2      LEU  77  -2.808  -7.288  -5.850
  547   HD22  LEU  77          2HD2      LEU  77  -1.328  -6.638  -5.143
  548   HD23  LEU  77          3HD2      LEU  77  -2.304  -5.639  -6.223
  549    HA   PRO  78           HA       PRO  78  -7.514 -10.740  -4.423
  550    HB2  PRO  78           1HB      PRO  78  -5.727 -12.777  -4.573
  551    HB3  PRO  78           2HB      PRO  78  -6.405 -11.988  -6.001
  552    HG2  PRO  78           1HG      PRO  78  -3.757 -11.553  -4.676
  553    HG3  PRO  78           2HG      PRO  78  -4.137 -11.673  -6.404
  554    HD2  PRO  78           1HD      PRO  78  -3.748  -9.300  -5.159
  555    HD3  PRO  78           2HD      PRO  78  -4.868  -9.490  -6.523
  556    H    ALA  79           H        ALA  79  -7.893 -10.128  -2.242
  557    HA   ALA  79           HA       ALA  79  -6.242 -11.612  -0.304
  558    HB1  ALA  79           1HB      ALA  79  -5.698  -9.676   0.642
  559    HB2  ALA  79           2HB      ALA  79  -6.816  -8.786  -0.392
  560    HB3  ALA  79           3HB      ALA  79  -7.390  -9.507   1.111
  561    H    SER  80           H        SER  80  -7.312 -12.698   1.309
  562    HA   SER  80           HA       SER  80 -10.048 -13.361   0.801
  563    HB2  SER  80           1HB      SER  80  -8.091 -14.170   2.952
  564    HB3  SER  80           2HB      SER  80  -9.761 -14.737   2.934
  565    HG   SER  80           HG       SER  80  -7.831 -15.882   1.732
  566    H    GLY  81           H        GLY  81  -8.344 -11.661   3.416
  567    HA2  GLY  81           1HA      GLY  81 -10.363 -11.182   5.189
  568    HA3  GLY  81           2HA      GLY  81  -9.099 -10.012   4.839
  569    HA   PRO  82           HA       PRO  82 -13.452  -8.667   3.362
  570    HB2  PRO  82           1HB      PRO  82 -14.180  -7.106   5.461
  571    HB3  PRO  82           2HB      PRO  82 -14.591  -8.822   5.351
  572    HG2  PRO  82           1HG      PRO  82 -12.379  -7.497   6.873
  573    HG3  PRO  82           2HG      PRO  82 -13.463  -8.804   7.384
  574    HD2  PRO  82           1HD      PRO  82 -10.931  -9.258   6.539
  575    HD3  PRO  82           2HD      PRO  82 -12.249 -10.417   6.271
  576    H    SER  83           H        SER  83 -12.823  -7.233   1.858
  577    HA   SER  83           HA       SER  83 -11.032  -5.059   2.486
  578    HB2  SER  83           1HB      SER  83 -11.152  -4.529   0.113
  579    HB3  SER  83           2HB      SER  83 -10.920  -6.265   0.317
  580    HG   SER  83           HG       SER  83 -13.446  -6.090   0.262
  581    H    SER  84           H        SER  84 -11.503  -2.866   2.435
  582    HA   SER  84           HA       SER  84 -14.175  -1.922   1.935
  583    HB2  SER  84           1HB      SER  84 -13.158  -2.301   4.715
  584    HB3  SER  84           2HB      SER  84 -14.111  -0.858   4.371
  585    HG   SER  84           HG       SER  84 -15.423  -2.796   3.253
  586    H    GLY  85           H        GLY  85 -14.217   0.232   1.466
  587    HA2  GLY  85           1HA      GLY  85 -11.656   1.532   1.152
  588    HA3  GLY  85           2HA      GLY  85 -13.214   2.148   0.621
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1 -14.255 -17.287  39.423
    2    HA2  GLY   1           1HA      GLY   1 -12.059 -16.817  37.528
    3    HA3  GLY   1           2HA      GLY   1 -13.192 -18.121  37.203
    4    H    SER   2           H        SER   2 -12.836 -16.088  35.387
    5    HA   SER   2           HA       SER   2 -15.519 -15.011  35.265
    6    HB2  SER   2           1HB      SER   2 -13.097 -13.285  35.647
    7    HB3  SER   2           2HB      SER   2 -14.446 -12.690  34.680
    8    HG   SER   2           HG       SER   2 -15.741 -12.737  36.430
    9    H    SER   3           H        SER   3 -15.689 -13.612  33.161
   10    HA   SER   3           HA       SER   3 -14.029 -14.821  31.055
   11    HB2  SER   3           1HB      SER   3 -15.913 -15.295  29.692
   12    HB3  SER   3           2HB      SER   3 -16.337 -15.891  31.297
   13    HG   SER   3           HG       SER   3 -17.822 -14.378  29.941
   14    H    GLY   4           H        GLY   4 -14.448 -13.635  28.894
   15    HA2  GLY   4           1HA      GLY   4 -14.344 -10.749  29.481
   16    HA3  GLY   4           2HA      GLY   4 -13.565 -11.533  28.114
   17    H    SER   5           H        SER   5 -14.733  -9.605  27.110
   18    HA   SER   5           HA       SER   5 -17.211 -10.609  25.953
   19    HB2  SER   5           1HB      SER   5 -17.036  -7.826  27.130
   20    HB3  SER   5           2HB      SER   5 -18.431  -8.539  26.321
   21    HG   SER   5           HG       SER   5 -17.965  -8.600  28.854
   22    H    SER   6           H        SER   6 -17.511 -10.013  23.853
   23    HA   SER   6           HA       SER   6 -15.293  -8.571  22.607
   24    HB2  SER   6           1HB      SER   6 -17.276 -10.593  21.682
   25    HB3  SER   6           2HB      SER   6 -16.661  -9.450  20.489
   26    HG   SER   6           HG       SER   6 -14.562 -10.130  21.000
   27    H    GLY   7           H        GLY   7 -15.714  -6.991  20.929
   28    HA2  GLY   7           1HA      GLY   7 -18.097  -5.389  21.571
   29    HA3  GLY   7           2HA      GLY   7 -16.613  -4.770  20.862
   30    H    GLU   8           H        GLU   8 -17.400  -3.854  19.033
   31    HA   GLU   8           HA       GLU   8 -18.031  -5.567  16.849
   32    HB2  GLU   8           1HB      GLU   8 -20.225  -5.281  18.230
   33    HB3  GLU   8           2HB      GLU   8 -20.262  -3.677  17.513
   34    HG2  GLU   8           1HG      GLU   8 -21.603  -5.050  16.151
   35    HG3  GLU   8           2HG      GLU   8 -20.100  -4.789  15.268
   36    H    LEU   9           H        LEU   9 -17.794  -4.546  14.881
   37    HA   LEU   9           HA       LEU   9 -16.770  -1.804  15.029
   38    HB2  LEU   9           1HB      LEU   9 -15.915  -2.326  12.714
   39    HB3  LEU   9           2HB      LEU   9 -15.200  -3.245  14.038
   40    HG   LEU   9           HG       LEU   9 -16.733  -5.136  13.432
   41   HD11  LEU   9          1HD1      LEU   9 -17.291  -3.351  11.071
   42   HD12  LEU   9          2HD1      LEU   9 -18.451  -3.975  12.243
   43   HD13  LEU   9          3HD1      LEU   9 -17.655  -5.076  11.119
   44   HD21  LEU   9          1HD2      LEU   9 -15.064  -4.451  11.053
   45   HD22  LEU   9          2HD2      LEU   9 -15.249  -5.991  11.893
   46   HD23  LEU   9          3HD2      LEU   9 -14.293  -4.699  12.620
   47    H    GLU  10           H        GLU  10 -17.122  -0.606  12.808
   48    HA   GLU  10           HA       GLU  10 -20.013  -0.710  12.261
   49    HB2  GLU  10           1HB      GLU  10 -18.074   1.602  12.188
   50    HB3  GLU  10           2HB      GLU  10 -19.711   1.695  11.553
   51    HG2  GLU  10           1HG      GLU  10 -20.521   1.035  13.837
   52    HG3  GLU  10           2HG      GLU  10 -18.866   1.256  14.402
   53    HA   PRO  11           HA       PRO  11 -18.673  -2.044   8.208
   54    HB2  PRO  11           1HB      PRO  11 -21.177  -2.416   7.227
   55    HB3  PRO  11           2HB      PRO  11 -20.385  -3.573   8.304
   56    HG2  PRO  11           1HG      PRO  11 -22.408  -1.463   8.949
   57    HG3  PRO  11           2HG      PRO  11 -22.315  -3.137   9.525
   58    HD2  PRO  11           1HD      PRO  11 -21.483  -1.035  11.015
   59    HD3  PRO  11           2HD      PRO  11 -20.720  -2.635  11.111
   60    H    GLY  12           H        GLY  12 -18.374  -0.992   6.303
   61    HA2  GLY  12           1HA      GLY  12 -18.408   0.704   4.758
   62    HA3  GLY  12           2HA      GLY  12 -20.106   0.898   5.166
   63    H    ALA  13           H        ALA  13 -17.099   1.426   7.002
   64    HA   ALA  13           HA       ALA  13 -18.073   4.140   7.604
   65    HB1  ALA  13           1HB      ALA  13 -15.919   3.254   9.310
   66    HB2  ALA  13           2HB      ALA  13 -17.538   3.808   9.737
   67    HB3  ALA  13           3HB      ALA  13 -17.265   2.114   9.332
   68    H    PHE  14           H        PHE  14 -17.191   5.245   5.879
   69    HA   PHE  14           HA       PHE  14 -14.397   5.874   6.095
   70    HB2  PHE  14           1HB      PHE  14 -14.731   3.738   4.574
   71    HB3  PHE  14           2HB      PHE  14 -15.180   4.939   3.367
   72    HD1  PHE  14           1HD      PHE  14 -12.468   3.626   5.443
   73    HD2  PHE  14           2HD      PHE  14 -13.550   6.452   2.450
   74    HE1  PHE  14           1HE      PHE  14 -10.088   4.021   4.961
   75    HE2  PHE  14           2HE      PHE  14 -11.172   6.851   1.962
   76    HZ   PHE  14           HZ       PHE  14  -9.437   5.634   3.218
   77    H    SER  15           H        SER  15 -13.765   7.542   4.424
   78    HA   SER  15           HA       SER  15 -15.944   9.002   3.204
   79    HB2  SER  15           1HB      SER  15 -14.576   9.923   5.690
   80    HB3  SER  15           2HB      SER  15 -14.963  11.132   4.465
   81    HG   SER  15           HG       SER  15 -16.664   9.575   6.041
   82    H    GLU  16           H        GLU  16 -15.071  11.054   2.136
   83    HA   GLU  16           HA       GLU  16 -12.498  10.377   0.902
   84    HB2  GLU  16           1HB      GLU  16 -13.181  11.584  -1.002
   85    HB3  GLU  16           2HB      GLU  16 -14.616  10.712  -0.480
   86    HG2  GLU  16           1HG      GLU  16 -14.096  13.551   0.332
   87    HG3  GLU  16           2HG      GLU  16 -14.906  13.136  -1.178
   88    H    LEU  17           H        LEU  17 -11.245  12.379   0.119
   89    HA   LEU  17           HA       LEU  17 -11.274  14.469   2.188
   90    HB2  LEU  17           1HB      LEU  17  -8.834  13.106   1.059
   91    HB3  LEU  17           2HB      LEU  17  -8.821  14.469   2.176
   92    HG   LEU  17           HG       LEU  17 -10.037  11.804   2.870
   93   HD11  LEU  17          1HD1      LEU  17  -7.328  12.665   3.791
   94   HD12  LEU  17          2HD1      LEU  17  -7.519  11.819   2.256
   95   HD13  LEU  17          3HD1      LEU  17  -8.041  11.052   3.755
   96   HD21  LEU  17          1HD2      LEU  17 -10.055  12.578   5.076
   97   HD22  LEU  17          2HD2      LEU  17 -10.606  13.959   4.127
   98   HD23  LEU  17          3HD2      LEU  17  -8.944  13.901   4.718
   99    H    TYR  18           H        TYR  18 -11.196  16.491   1.432
  100    HA   TYR  18           HA       TYR  18 -11.515  17.108  -1.253
  101    HB2  TYR  18           1HB      TYR  18 -10.842  18.670   1.190
  102    HB3  TYR  18           2HB      TYR  18 -10.591  19.451  -0.368
  103    HD1  TYR  18           1HD      TYR  18 -13.206  17.480   1.438
  104    HD2  TYR  18           2HD      TYR  18 -12.347  20.643  -1.276
  105    HE1  TYR  18           1HE      TYR  18 -15.599  18.038   1.340
  106    HE2  TYR  18           2HE      TYR  18 -14.738  21.210  -1.380
  107    HH   TYR  18           HH       TYR  18 -17.144  19.217  -0.413
  108    H    GLN  19           H        GLN  19  -8.578  17.484   0.732
  109    HA   GLN  19           HA       GLN  19  -6.910  18.338  -1.361
  110    HB2  GLN  19           1HB      GLN  19  -6.328  17.018   1.284
  111    HB3  GLN  19           2HB      GLN  19  -5.051  17.512   0.181
  112    HG2  GLN  19           1HG      GLN  19  -5.905  19.824   0.284
  113    HG3  GLN  19           2HG      GLN  19  -7.101  19.300   1.468
  114   HE21  GLN  19          1HE2      GLN  19  -6.238  18.298   3.449
  115   HE22  GLN  19          2HE2      GLN  19  -4.762  18.916   4.100
  116    H    ARG  20           H        ARG  20  -4.905  17.040  -2.023
  117    HA   ARG  20           HA       ARG  20  -5.723  14.846  -3.564
  118    HB2  ARG  20           1HB      ARG  20  -3.599  16.457  -3.667
  119    HB3  ARG  20           2HB      ARG  20  -2.850  15.103  -2.831
  120    HG2  ARG  20           1HG      ARG  20  -4.421  14.603  -5.315
  121    HG3  ARG  20           2HG      ARG  20  -2.782  15.250  -5.428
  122    HD2  ARG  20           1HD      ARG  20  -2.266  13.280  -3.750
  123    HD3  ARG  20           2HD      ARG  20  -3.723  12.594  -4.467
  124    HE   ARG  20           HE       ARG  20  -1.162  12.710  -5.653
  125   HH11  ARG  20          2HH1      ARG  20  -4.540  13.061  -6.415
  126   HH12  ARG  20          1HH1      ARG  20  -4.352  12.578  -8.068
  127   HH21  ARG  20          2HH2      ARG  20  -0.900  12.073  -7.827
  128   HH22  ARG  20          1HH2      ARG  20  -2.281  12.016  -8.870
  129    H    TYR  21           H        TYR  21  -5.644  12.675  -3.275
  130    HA   TYR  21           HA       TYR  21  -5.604  11.657  -0.632
  131    HB2  TYR  21           1HB      TYR  21  -6.924  10.704  -2.544
  132    HB3  TYR  21           2HB      TYR  21  -5.418  10.071  -3.198
  133    HD1  TYR  21           2HD      TYR  21  -4.036   8.547  -1.580
  134    HD2  TYR  21           1HD      TYR  21  -8.181   9.385  -1.111
  135    HE1  TYR  21           2HE      TYR  21  -4.283   6.526  -0.200
  136    HE2  TYR  21           1HE      TYR  21  -8.439   7.367   0.271
  137    HH   TYR  21           HH       TYR  21  -6.083   5.830   1.737
  138    H    ARG  22           H        ARG  22  -3.733  11.744   0.472
  139    HA   ARG  22           HA       ARG  22  -1.452  10.271  -0.647
  140    HB2  ARG  22           1HB      ARG  22  -1.175  12.852   0.899
  141    HB3  ARG  22           2HB      ARG  22   0.116  11.918   0.153
  142    HG2  ARG  22           1HG      ARG  22  -0.884  12.387  -2.062
  143    HG3  ARG  22           2HG      ARG  22  -2.072  13.420  -1.265
  144    HD2  ARG  22           1HD      ARG  22  -0.366  14.855  -2.056
  145    HD3  ARG  22           2HD      ARG  22  -0.131  14.717  -0.314
  146    HE   ARG  22           HE       ARG  22   1.489  12.795  -1.294
  147   HH11  ARG  22          2HH1      ARG  22   1.099  16.175  -2.030
  148   HH12  ARG  22          1HH1      ARG  22   2.755  16.401  -2.487
  149   HH21  ARG  22          2HH2      ARG  22   3.672  13.079  -1.894
  150   HH22  ARG  22          1HH2      ARG  22   4.217  14.639  -2.411
  151    H    HIS  23           H        HIS  23  -1.898   8.497   0.647
  152    HA   HIS  23           HA       HIS  23  -1.030   8.749   3.399
  153    HB2  HIS  23           1HB      HIS  23  -3.608   9.075   3.234
  154    HB3  HIS  23           2HB      HIS  23  -3.643   7.338   2.946
  155    HD1  HIS  23           1HD      HIS  23  -2.991   9.877   5.603
  156    HD2  HIS  23           2HD      HIS  23  -3.026   5.745   5.172
  157    HE1  HIS  23           1HE      HIS  23  -2.906   8.956   7.941
  158    HE2  HIS  23           2HE      HIS  23  -2.842   6.455   7.652
  159    H    CYS  24           H        CYS  24   0.506   7.256   3.504
  160    HA   CYS  24           HA       CYS  24   0.871   5.115   1.786
  161    HB2  CYS  24           1HB      CYS  24   2.706   5.841   3.124
  162    HB3  CYS  24           2HB      CYS  24   1.817   5.557   4.617
  163    H    ASP  25           H        ASP  25  -0.290   3.347   1.472
  164    HA   ASP  25           HA       ASP  25  -1.657   2.128   3.780
  165    HB2  ASP  25           1HB      ASP  25  -2.697   2.370   0.948
  166    HB3  ASP  25           2HB      ASP  25  -3.474   1.446   2.230
  167    H    ALA  26           H        ALA  26   0.958   1.540   2.638
  168    HA   ALA  26           HA       ALA  26   0.629  -0.959   1.202
  169    HB1  ALA  26           1HB      ALA  26   2.582  -0.300   0.375
  170    HB2  ALA  26           2HB      ALA  26   2.757   0.940   1.617
  171    HB3  ALA  26           3HB      ALA  26   3.307  -0.705   1.931
  172    HA   PRO  27           HA       PRO  27   1.029  -3.795   4.527
  173    HB2  PRO  27           1HB      PRO  27   2.917  -5.553   3.682
  174    HB3  PRO  27           2HB      PRO  27   1.293  -5.481   2.988
  175    HG2  PRO  27           1HG      PRO  27   3.849  -4.314   1.954
  176    HG3  PRO  27           2HG      PRO  27   2.568  -5.165   1.070
  177    HD2  PRO  27           1HD      PRO  27   2.791  -2.466   1.073
  178    HD3  PRO  27           2HD      PRO  27   1.224  -3.295   0.966
  179    H    ILE  28           H        ILE  28   4.289  -2.998   3.310
  180    HA   ILE  28           HA       ILE  28   5.126  -2.546   6.092
  181    HB   ILE  28           HB       ILE  28   6.770  -3.980   4.002
  182   HG12  ILE  28          1HG1      ILE  28   4.898  -5.306   5.027
  183   HG13  ILE  28          2HG1      ILE  28   6.503  -5.959   5.336
  184   HG21  ILE  28          1HG2      ILE  28   8.167  -4.381   6.196
  185   HG22  ILE  28          2HG2      ILE  28   8.377  -2.917   5.237
  186   HG23  ILE  28          3HG2      ILE  28   7.389  -2.880   6.697
  187   HD11  ILE  28          1HD1      ILE  28   5.043  -6.038   7.304
  188   HD12  ILE  28          2HD1      ILE  28   6.478  -5.048   7.569
  189   HD13  ILE  28          3HD1      ILE  28   4.921  -4.279   7.265
  190    H    CYS  29           H        CYS  29   6.427  -0.810   6.431
  191    HA   CYS  29           HA       CYS  29   7.139   0.785   4.057
  192    HB2  CYS  29           1HB      CYS  29   5.413   1.604   5.892
  193    HB3  CYS  29           2HB      CYS  29   6.884   2.037   6.756
  194    H    LEU  30           H        LEU  30   9.178   1.618   3.878
  195    HA   LEU  30           HA       LEU  30  11.124   0.694   5.885
  196    HB2  LEU  30           1HB      LEU  30  11.674   1.425   3.017
  197    HB3  LEU  30           2HB      LEU  30  12.772   0.642   4.152
  198    HG   LEU  30           HG       LEU  30  10.229  -0.744   3.456
  199   HD11  LEU  30          1HD1      LEU  30  11.111   0.026   1.297
  200   HD12  LEU  30          2HD1      LEU  30  11.222  -1.724   1.475
  201   HD13  LEU  30          3HD1      LEU  30  12.661  -0.725   1.673
  202   HD21  LEU  30          1HD2      LEU  30  11.275  -2.194   4.793
  203   HD22  LEU  30          2HD2      LEU  30  12.817  -1.349   4.650
  204   HD23  LEU  30          3HD2      LEU  30  12.331  -2.514   3.418
  205    H    TYR  31           H        TYR  31  10.058   3.425   3.958
  206    HA   TYR  31           HA       TYR  31  12.106   5.232   4.477
  207    HB2  TYR  31           1HB      TYR  31   9.992   5.441   2.967
  208    HB3  TYR  31           2HB      TYR  31   9.239   6.119   4.406
  209    HD1  TYR  31           2HD      TYR  31  12.494   6.508   2.595
  210    HD2  TYR  31           1HD      TYR  31   9.183   8.416   4.467
  211    HE1  TYR  31           2HE      TYR  31  13.464   8.704   2.060
  212    HE2  TYR  31           1HE      TYR  31  10.144  10.617   3.936
  213    HH   TYR  31           HH       TYR  31  11.784  11.521   2.126
  214    H    GLU  32           H        GLU  32  12.895   5.856   6.366
  215    HA   GLU  32           HA       GLU  32  12.083   5.397   8.868
  216    HB2  GLU  32           1HB      GLU  32  14.143   6.676   8.131
  217    HB3  GLU  32           2HB      GLU  32  13.136   8.117   8.097
  218    HG2  GLU  32           1HG      GLU  32  14.239   8.154  10.165
  219    HG3  GLU  32           2HG      GLU  32  12.589   7.641  10.513
  220    H    GLN  33           H        GLN  33  11.042   8.246   7.005
  221    HA   GLN  33           HA       GLN  33   9.424   9.463   8.865
  222    HB2  GLN  33           1HB      GLN  33  10.006  10.009   6.324
  223    HB3  GLN  33           2HB      GLN  33   8.410   9.316   6.070
  224    HG2  GLN  33           1HG      GLN  33   8.214  11.693   6.263
  225    HG3  GLN  33           2HG      GLN  33   7.485  10.939   7.680
  226   HE21  GLN  33          1HE2      GLN  33   7.709  12.893   8.818
  227   HE22  GLN  33          2HE2      GLN  33   9.236  13.396   9.450
  228    H    GLY  34           H        GLY  34   8.284   7.168   6.374
  229    HA2  GLY  34           1HA      GLY  34   6.738   5.440   6.636
  230    HA3  GLY  34           2HA      GLY  34   6.467   5.966   8.291
  231    H    ARG  35           H        ARG  35   5.954   8.739   7.536
  232    HA   ARG  35           HA       ARG  35   3.156   8.543   7.135
  233    HB2  ARG  35           1HB      ARG  35   3.093  10.870   7.395
  234    HB3  ARG  35           2HB      ARG  35   4.481  10.376   8.356
  235    HG2  ARG  35           1HG      ARG  35   5.850  10.892   6.231
  236    HG3  ARG  35           2HG      ARG  35   4.419  11.791   5.724
  237    HD2  ARG  35           1HD      ARG  35   4.531  13.065   7.850
  238    HD3  ARG  35           2HD      ARG  35   6.033  12.225   8.233
  239    HE   ARG  35           HE       ARG  35   7.132  13.602   6.774
  240   HH11  ARG  35          2HH1      ARG  35   3.709  13.801   6.169
  241   HH12  ARG  35          1HH1      ARG  35   3.851  15.112   5.046
  242   HH21  ARG  35          2HH2      ARG  35   7.332  15.329   5.297
  243   HH22  ARG  35          1HH2      ARG  35   5.912  15.980   4.550
  244    H    ASP  36           H        ASP  36   2.328  10.410   5.426
  245    HA   ASP  36           HA       ASP  36   2.746   9.168   2.873
  246    HB2  ASP  36           1HB      ASP  36   1.069  10.754   2.057
  247    HB3  ASP  36           2HB      ASP  36   0.529   9.987   3.549
  248    H    SER  37           H        SER  37   5.169  10.111   3.673
  249    HA   SER  37           HA       SER  37   5.599  12.615   2.207
  250    HB2  SER  37           1HB      SER  37   7.716  12.773   3.341
  251    HB3  SER  37           2HB      SER  37   6.493  12.373   4.546
  252    HG   SER  37           HG       SER  37   8.092  10.421   3.258
  253    H    PHE  38           H        PHE  38   6.181  12.459   0.155
  254    HA   PHE  38           HA       PHE  38   8.031  10.320  -0.636
  255    HB2  PHE  38           1HB      PHE  38   5.802  11.173  -2.464
  256    HB3  PHE  38           2HB      PHE  38   6.781   9.710  -2.524
  257    HD1  PHE  38           1HD      PHE  38   4.039  11.407  -0.738
  258    HD2  PHE  38           2HD      PHE  38   6.156   7.763  -1.336
  259    HE1  PHE  38           1HE      PHE  38   2.288  10.192   0.491
  260    HE2  PHE  38           2HE      PHE  38   4.408   6.542  -0.108
  261    HZ   PHE  38           HZ       PHE  38   2.470   7.756   0.806
  262    H    GLU  39           H        GLU  39   8.947  10.778  -2.882
  263    HA   GLU  39           HA       GLU  39   9.489  13.665  -3.106
  264    HB2  GLU  39           1HB      GLU  39  11.341  11.873  -2.480
  265    HB3  GLU  39           2HB      GLU  39  11.375  11.642  -4.223
  266    HG2  GLU  39           1HG      GLU  39  11.569  14.261  -4.239
  267    HG3  GLU  39           2HG      GLU  39  12.176  14.002  -2.604
  268    H    ASP  40           H        ASP  40   9.990  14.455  -5.275
  269    HA   ASP  40           HA       ASP  40   8.086  14.182  -7.131
  270    HB2  ASP  40           1HB      ASP  40  10.266  15.626  -7.139
  271    HB3  ASP  40           2HB      ASP  40  10.909  14.323  -8.135
  272    H    GLU  41           H        GLU  41  10.924  12.074  -6.890
  273    HA   GLU  41           HA       GLU  41   9.489   9.886  -8.054
  274    HB2  GLU  41           1HB      GLU  41  10.854   9.558 -10.016
  275    HB3  GLU  41           2HB      GLU  41  10.149  11.167 -10.076
  276    HG2  GLU  41           1HG      GLU  41  12.165  12.215  -9.693
  277    HG3  GLU  41           2HG      GLU  41  12.881  10.791  -8.940
  278    H    GLY  42           H        GLY  42  10.917   7.922  -8.252
  279    HA2  GLY  42           1HA      GLY  42  13.122   6.983  -7.644
  280    HA3  GLY  42           2HA      GLY  42  13.087   8.052  -6.250
  281    H    ARG  43           H        ARG  43  13.568   5.774  -5.350
  282    HA   ARG  43           HA       ARG  43  11.651   3.781  -5.173
  283    HB2  ARG  43           1HB      ARG  43  12.781   3.093  -3.096
  284    HB3  ARG  43           2HB      ARG  43  13.927   3.469  -4.375
  285    HG2  ARG  43           1HG      ARG  43  14.191   5.738  -3.338
  286    HG3  ARG  43           2HG      ARG  43  13.236   5.144  -1.978
  287    HD2  ARG  43           1HD      ARG  43  15.855   4.018  -2.964
  288    HD3  ARG  43           2HD      ARG  43  15.606   4.957  -1.492
  289    HE   ARG  43           HE       ARG  43  13.929   2.842  -1.199
  290   HH11  ARG  43          2HH1      ARG  43  17.327   3.164  -1.885
  291   HH12  ARG  43          1HH1      ARG  43  17.758   1.674  -1.112
  292   HH21  ARG  43          2HH2      ARG  43  14.483   0.878  -0.179
  293   HH22  ARG  43          1HH2      ARG  43  16.139   0.374  -0.143
  294    H    TRP  44           H        TRP  44  11.858   6.836  -3.500
  295    HA   TRP  44           HA       TRP  44   9.574   6.121  -1.807
  296    HB2  TRP  44           1HB      TRP  44  11.160   8.684  -1.682
  297    HB3  TRP  44           2HB      TRP  44  10.127   7.983  -0.440
  298    HD1  TRP  44           HD       TRP  44  13.607   8.503  -0.995
  299    HE1  TRP  44           1HE      TRP  44  15.072   6.760   0.206
  300    HE3  TRP  44           3HE      TRP  44  10.035   4.981  -0.008
  301    HZ2  TRP  44           2HZ      TRP  44  14.755   4.228   1.412
  302    HZ3  TRP  44           3HZ      TRP  44  10.699   2.927   1.173
  303    HH2  TRP  44           HH       TRP  44  13.010   2.560   1.867
  304    H    ARG  45           H        ARG  45   8.931   6.348  -4.461
  305    HA   ARG  45           HA       ARG  45   7.780   9.020  -4.797
  306    HB2  ARG  45           1HB      ARG  45   7.414   8.424  -7.103
  307    HB3  ARG  45           2HB      ARG  45   9.068   8.012  -6.672
  308    HG2  ARG  45           1HG      ARG  45   8.325   5.659  -6.339
  309    HG3  ARG  45           2HG      ARG  45   6.744   6.127  -6.968
  310    HD2  ARG  45           1HD      ARG  45   9.382   6.282  -8.420
  311    HD3  ARG  45           2HD      ARG  45   8.076   5.140  -8.731
  312    HE   ARG  45           HE       ARG  45   7.053   7.727  -8.989
  313   HH11  ARG  45          2HH1      ARG  45   9.323   5.611 -10.566
  314   HH12  ARG  45          1HH1      ARG  45   9.092   6.316 -12.132
  315   HH21  ARG  45          2HH2      ARG  45   6.739   8.664 -11.045
  316   HH22  ARG  45          1HH2      ARG  45   7.623   8.053 -12.403
  317    H    LEU  46           H        LEU  46   5.626   9.406  -4.782
  318    HA   LEU  46           HA       LEU  46   3.910   7.489  -3.567
  319    HB2  LEU  46           1HB      LEU  46   3.467   9.723  -3.034
  320    HB3  LEU  46           2HB      LEU  46   3.510  10.225  -4.723
  321    HG   LEU  46           HG       LEU  46   1.379   8.774  -4.962
  322   HD11  LEU  46          1HD1      LEU  46   0.859   7.659  -3.097
  323   HD12  LEU  46          2HD1      LEU  46   0.240   9.205  -2.517
  324   HD13  LEU  46          3HD1      LEU  46   1.870   8.690  -2.083
  325   HD21  LEU  46          1HD2      LEU  46   1.648  11.465  -3.699
  326   HD22  LEU  46          2HD2      LEU  46   0.048  10.747  -3.886
  327   HD23  LEU  46          3HD2      LEU  46   1.060  11.028  -5.304
  328    H    ILE  47           H        ILE  47   2.854   5.890  -4.520
  329    HA   ILE  47           HA       ILE  47   2.248   6.122  -7.395
  330    HB   ILE  47           HB       ILE  47   2.762   3.639  -5.756
  331   HG12  ILE  47          1HG1      ILE  47   4.295   4.983  -7.989
  332   HG13  ILE  47          2HG1      ILE  47   4.811   4.788  -6.317
  333   HG21  ILE  47          1HG2      ILE  47   0.978   3.320  -7.434
  334   HG22  ILE  47          2HG2      ILE  47   2.098   3.849  -8.689
  335   HG23  ILE  47          3HG2      ILE  47   2.423   2.371  -7.783
  336   HD11  ILE  47          1HD1      ILE  47   5.997   3.170  -7.494
  337   HD12  ILE  47          2HD1      ILE  47   4.663   2.278  -6.762
  338   HD13  ILE  47          3HD1      ILE  47   4.598   2.719  -8.468
  339    H    LEU  48           H        LEU  48   0.172   6.360  -7.857
  340    HA   LEU  48           HA       LEU  48  -1.846   5.698  -5.866
  341    HB2  LEU  48           1HB      LEU  48  -1.885   7.222  -8.450
  342    HB3  LEU  48           2HB      LEU  48  -3.373   6.764  -7.625
  343    HG   LEU  48           HG       LEU  48  -1.205   8.507  -6.455
  344   HD11  LEU  48          1HD1      LEU  48  -3.795   9.140  -7.829
  345   HD12  LEU  48          2HD1      LEU  48  -2.189   9.798  -8.137
  346   HD13  LEU  48          3HD1      LEU  48  -3.060  10.250  -6.672
  347   HD21  LEU  48          1HD2      LEU  48  -2.260   7.522  -4.636
  348   HD22  LEU  48          2HD2      LEU  48  -3.831   7.485  -5.438
  349   HD23  LEU  48          3HD2      LEU  48  -3.171   9.015  -4.859
  350    H    CYS  49           H        CYS  49  -3.331   4.105  -6.047
  351    HA   CYS  49           HA       CYS  49  -2.869   1.821  -7.484
  352    HB2  CYS  49           1HB      CYS  49  -4.448   1.929  -5.616
  353    HB3  CYS  49           2HB      CYS  49  -5.554   2.893  -6.590
  354    H    ALA  50           H        ALA  50  -4.067   0.834  -9.266
  355    HA   ALA  50           HA       ALA  50  -4.705   2.821 -11.344
  356    HB1  ALA  50           1HB      ALA  50  -3.321   1.716 -12.675
  357    HB2  ALA  50           2HB      ALA  50  -2.948   0.604 -11.358
  358    HB3  ALA  50           3HB      ALA  50  -4.271   0.244 -12.468
  359    H    THR  51           H        THR  51  -5.651  -0.349 -10.059
  360    HA   THR  51           HA       THR  51  -7.840  -0.876 -11.660
  361    HB   THR  51           HB       THR  51  -7.440  -1.513  -8.734
  362    HG1  THR  51           1HG      THR  51  -7.008  -3.630  -9.738
  363   HG21  THR  51          1HG2      THR  51  -9.518  -2.533 -10.673
  364   HG22  THR  51          2HG2      THR  51  -9.803  -1.633  -9.183
  365   HG23  THR  51          3HG2      THR  51  -9.163  -3.275  -9.113
  366    H    CYS  52           H        CYS  52  -7.959   0.648  -8.432
  367    HA   CYS  52           HA       CYS  52 -10.538   1.844  -9.184
  368    HB2  CYS  52           1HB      CYS  52 -11.057   1.989  -6.859
  369    HB3  CYS  52           2HB      CYS  52 -10.411   0.375  -7.134
  370    H    GLY  53           H        GLY  53  -7.423   2.587  -7.654
  371    HA2  GLY  53           1HA      GLY  53  -6.194   4.552  -7.814
  372    HA3  GLY  53           2HA      GLY  53  -7.509   5.265  -8.736
  373    H    SER  54           H        SER  54  -7.617   3.803  -5.511
  374    HA   SER  54           HA       SER  54  -8.295   6.454  -4.418
  375    HB2  SER  54           1HB      SER  54  -9.590   3.812  -3.699
  376    HB3  SER  54           2HB      SER  54  -9.934   5.363  -2.933
  377    HG   SER  54           HG       SER  54 -10.302   5.921  -5.368
  378    H    HIS  55           H        HIS  55  -5.750   5.012  -4.465
  379    HA   HIS  55           HA       HIS  55  -5.204   5.130  -1.610
  380    HB2  HIS  55           1HB      HIS  55  -4.475   2.709  -3.271
  381    HB3  HIS  55           2HB      HIS  55  -4.000   2.988  -1.599
  382    HD1  HIS  55           1HD      HIS  55  -6.999   2.153  -3.706
  383    HD2  HIS  55           2HD      HIS  55  -5.919   2.369   0.300
  384    HE1  HIS  55           1HE      HIS  55  -8.895   1.092  -2.441
  385    HE2  HIS  55           2HE      HIS  55  -8.259   1.311  -0.014
  386    H    GLY  56           H        GLY  56  -2.915   5.292  -1.122
  387    HA2  GLY  56           1HA      GLY  56  -1.124   5.763  -3.374
  388    HA3  GLY  56           2HA      GLY  56  -1.483   7.155  -2.364
  389    H    THR  57           H        THR  57   0.778   4.908  -2.902
  390    HA   THR  57           HA       THR  57   1.918   5.247  -0.248
  391    HB   THR  57           HB       THR  57   0.616   3.098  -0.177
  392    HG1  THR  57           1HG      THR  57   3.408   2.625   0.021
  393   HG21  THR  57          1HG2      THR  57   1.110   1.290  -1.511
  394   HG22  THR  57          2HG2      THR  57   2.751   1.846  -1.842
  395   HG23  THR  57          3HG2      THR  57   1.381   2.610  -2.648
  396    H    HIS  58           H        HIS  58   4.195   4.373  -0.177
  397    HA   HIS  58           HA       HIS  58   5.689   5.442  -2.308
  398    HB2  HIS  58           1HB      HIS  58   6.744   3.455  -0.299
  399    HB3  HIS  58           2HB      HIS  58   7.627   4.737  -1.123
  400    HD2  HIS  58           2HD      HIS  58   7.779   7.070   0.270
  401    HE1  HIS  58           1HE      HIS  58   4.847   6.167   3.201
  402    HE2  HIS  58           2HE      HIS  58   6.540   7.852   2.402
  403    H    ARG  59           H        ARG  59   7.538   4.060  -3.318
  404    HA   ARG  59           HA       ARG  59   6.255   2.078  -4.950
  405    HB2  ARG  59           1HB      ARG  59   8.033   3.750  -5.697
  406    HB3  ARG  59           2HB      ARG  59   9.202   2.709  -4.896
  407    HG2  ARG  59           1HG      ARG  59   7.349   1.471  -6.856
  408    HG3  ARG  59           2HG      ARG  59   8.659   2.483  -7.467
  409    HD2  ARG  59           1HD      ARG  59   8.969   0.113  -5.627
  410    HD3  ARG  59           2HD      ARG  59   9.310   0.125  -7.357
  411    HE   ARG  59           HE       ARG  59  10.771   2.121  -5.909
  412   HH11  ARG  59          2HH1      ARG  59  10.713  -1.227  -6.860
  413   HH12  ARG  59          1HH1      ARG  59  12.430  -1.426  -6.739
  414   HH21  ARG  59          2HH2      ARG  59  13.032   1.872  -5.747
  415   HH22  ARG  59          1HH2      ARG  59  13.748   0.337  -6.105
  416    H    ASP  60           H        ASP  60   9.314   1.887  -3.124
  417    HA   ASP  60           HA       ASP  60   9.419  -0.911  -3.081
  418    HB2  ASP  60           1HB      ASP  60  10.772   1.278  -1.578
  419    HB3  ASP  60           2HB      ASP  60  10.897  -0.357  -0.936
  420    H    CYS  61           H        CYS  61   7.936   1.392  -0.882
  421    HA   CYS  61           HA       CYS  61   7.444  -0.229   1.311
  422    HB2  CYS  61           1HB      CYS  61   6.997   2.209   1.222
  423    HB3  CYS  61           2HB      CYS  61   5.605   1.896   0.190
  424    H    SER  62           H        SER  62   5.748  -0.031  -1.757
  425    HA   SER  62           HA       SER  62   3.638  -1.811  -0.887
  426    HB2  SER  62           1HB      SER  62   2.984  -0.122  -2.451
  427    HB3  SER  62           2HB      SER  62   4.294  -0.546  -3.553
  428    HG   SER  62           HG       SER  62   2.454  -2.535  -2.879
  429    H    SER  63           H        SER  63   6.511  -2.663  -0.950
  430    HA   SER  63           HA       SER  63   7.839  -4.371  -1.733
  431    HB2  SER  63           1HB      SER  63   5.925  -5.340  -0.219
  432    HB3  SER  63           2HB      SER  63   5.366  -6.066  -1.726
  433    HG   SER  63           HG       SER  63   8.069  -6.329  -1.122
  434    H    LEU  64           H        LEU  64   7.232  -2.871  -3.883
  435    HA   LEU  64           HA       LEU  64   6.260  -4.688  -5.964
  436    HB2  LEU  64           1HB      LEU  64   6.898  -1.743  -6.063
  437    HB3  LEU  64           2HB      LEU  64   6.271  -2.693  -7.409
  438    HG   LEU  64           HG       LEU  64   4.780  -2.326  -4.817
  439   HD11  LEU  64          1HD1      LEU  64   4.199  -0.817  -7.339
  440   HD12  LEU  64          2HD1      LEU  64   5.313  -0.183  -6.128
  441   HD13  LEU  64          3HD1      LEU  64   3.633  -0.504  -5.698
  442   HD21  LEU  64          1HD2      LEU  64   3.902  -4.177  -5.927
  443   HD22  LEU  64          2HD2      LEU  64   4.129  -3.452  -7.519
  444   HD23  LEU  64          3HD2      LEU  64   2.864  -2.849  -6.447
  445    H    ARG  65           H        ARG  65   7.513  -4.041  -8.179
  446    HA   ARG  65           HA       ARG  65  10.336  -4.651  -7.617
  447    HB2  ARG  65           1HB      ARG  65   8.430  -5.516  -9.726
  448    HB3  ARG  65           2HB      ARG  65  10.109  -5.303 -10.204
  449    HG2  ARG  65           1HG      ARG  65   9.549  -7.619  -9.554
  450    HG3  ARG  65           2HG      ARG  65  10.836  -6.908  -8.579
  451    HD2  ARG  65           1HD      ARG  65   9.546  -6.812  -6.696
  452    HD3  ARG  65           2HD      ARG  65   8.044  -6.641  -7.604
  453    HE   ARG  65           HE       ARG  65   9.325  -9.219  -7.846
  454   HH11  ARG  65          2HH1      ARG  65   7.029  -7.270  -6.100
  455   HH12  ARG  65          1HH1      ARG  65   6.152  -8.629  -5.478
  456   HH21  ARG  65          2HH2      ARG  65   8.178 -11.015  -7.034
  457   HH22  ARG  65          1HH2      ARG  65   6.807 -10.759  -6.010
  458    HA   PRO  66           HA       PRO  66  11.771  -0.978  -9.538
  459    HB2  PRO  66           1HB      PRO  66  13.917  -1.842 -10.960
  460    HB3  PRO  66           2HB      PRO  66  13.912  -1.739  -9.195
  461    HG2  PRO  66           1HG      PRO  66  13.487  -4.124 -10.954
  462    HG3  PRO  66           2HG      PRO  66  14.444  -3.986  -9.468
  463    HD2  PRO  66           1HD      PRO  66  11.964  -5.072  -9.507
  464    HD3  PRO  66           2HD      PRO  66  12.594  -4.180  -8.108
  465    H    ASN  67           H        ASN  67  10.229  -3.303 -11.282
  466    HA   ASN  67           HA       ASN  67  10.521  -1.826 -13.815
  467    HB2  ASN  67           1HB      ASN  67  11.249  -4.065 -14.175
  468    HB3  ASN  67           2HB      ASN  67   9.878  -4.727 -13.288
  469   HD21  ASN  67          1HD2      ASN  67   9.115  -5.988 -14.924
  470   HD22  ASN  67          2HD2      ASN  67   8.431  -5.352 -16.378
  471    H    SER  68           H        SER  68   8.231  -3.422 -11.646
  472    HA   SER  68           HA       SER  68   5.848  -3.164 -12.882
  473    HB2  SER  68           1HB      SER  68   6.265  -3.959 -10.513
  474    HB3  SER  68           2HB      SER  68   6.231  -2.266 -10.022
  475    HG   SER  68           HG       SER  68   4.187  -3.523  -9.919
  476    H    LYS  69           H        LYS  69   4.649  -1.599 -13.738
  477    HA   LYS  69           HA       LYS  69   5.491   1.176 -13.339
  478    HB2  LYS  69           1HB      LYS  69   4.198   1.675 -15.343
  479    HB3  LYS  69           2HB      LYS  69   5.315   0.351 -15.650
  480    HG2  LYS  69           1HG      LYS  69   3.223  -1.115 -15.012
  481    HG3  LYS  69           2HG      LYS  69   2.348   0.339 -15.501
  482    HD2  LYS  69           1HD      LYS  69   4.500  -0.715 -17.276
  483    HD3  LYS  69           2HD      LYS  69   2.940  -1.540 -17.246
  484    HE2  LYS  69           1HE      LYS  69   1.892   0.734 -17.642
  485    HE3  LYS  69           2HE      LYS  69   3.520   1.319 -17.982
  486    HZ1  LYS  69           1HZ      LYS  69   2.966   0.728 -20.066
  487    HZ2  LYS  69           2HZ      LYS  69   1.794  -0.388 -19.575
  488    HZ3  LYS  69           3HZ      LYS  69   3.431  -0.817 -19.558
  489    H    LYS  70           H        LYS  70   2.593  -0.859 -13.214
  490    HA   LYS  70           HA       LYS  70   1.233   1.290 -11.728
  491    HB2  LYS  70           1HB      LYS  70  -0.884   0.183 -12.408
  492    HB3  LYS  70           2HB      LYS  70   0.059   0.769 -13.772
  493    HG2  LYS  70           1HG      LYS  70   0.785  -1.431 -14.316
  494    HG3  LYS  70           2HG      LYS  70   0.112  -2.084 -12.821
  495    HD2  LYS  70           1HD      LYS  70  -1.710  -0.665 -14.702
  496    HD3  LYS  70           2HD      LYS  70  -1.174  -2.295 -15.116
  497    HE2  LYS  70           1HE      LYS  70  -2.507  -1.499 -12.530
  498    HE3  LYS  70           2HE      LYS  70  -3.311  -2.283 -13.889
  499    HZ1  LYS  70           1HZ      LYS  70  -2.794  -4.134 -12.754
  500    HZ2  LYS  70           2HZ      LYS  70  -1.534  -3.405 -11.892
  501    HZ3  LYS  70           3HZ      LYS  70  -1.274  -3.949 -13.473
  502    H    TRP  71           H        TRP  71   0.127   0.790  -9.831
  503    HA   TRP  71           HA       TRP  71   0.661  -1.885  -8.718
  504    HB2  TRP  71           1HB      TRP  71   2.101  -0.684  -7.401
  505    HB3  TRP  71           2HB      TRP  71   1.188   0.812  -7.581
  506    HD1  TRP  71           HD       TRP  71   1.101  -2.487  -5.578
  507    HE1  TRP  71           1HE      TRP  71  -0.198  -2.066  -3.396
  508    HE3  TRP  71           3HE      TRP  71  -0.444   2.305  -6.465
  509    HZ2  TRP  71           2HZ      TRP  71  -1.681   0.021  -2.209
  510    HZ3  TRP  71           3HZ      TRP  71  -1.800   3.443  -4.756
  511    HH2  TRP  71           HH       TRP  71  -2.405   2.322  -2.672
  512    H    GLU  72           H        GLU  72  -0.865  -2.659  -7.163
  513    HA   GLU  72           HA       GLU  72  -3.498  -1.350  -7.367
  514    HB2  GLU  72           1HB      GLU  72  -2.787  -4.281  -7.328
  515    HB3  GLU  72           2HB      GLU  72  -4.419  -3.696  -7.039
  516    HG2  GLU  72           1HG      GLU  72  -4.725  -3.049  -9.211
  517    HG3  GLU  72           2HG      GLU  72  -3.003  -2.809  -9.497
  518    H    CYS  73           H        CYS  73  -4.591  -0.949  -5.529
  519    HA   CYS  73           HA       CYS  73  -3.255  -1.040  -3.046
  520    HB2  CYS  73           1HB      CYS  73  -5.301  -0.170  -2.097
  521    HB3  CYS  73           2HB      CYS  73  -5.018   0.614  -3.649
  522    H    ASN  74           H        ASN  74  -4.451  -1.985  -1.052
  523    HA   ASN  74           HA       ASN  74  -4.282  -4.774  -1.183
  524    HB2  ASN  74           1HB      ASN  74  -4.198  -3.110   0.855
  525    HB3  ASN  74           2HB      ASN  74  -5.924  -3.452   0.943
  526   HD21  ASN  74          1HD2      ASN  74  -6.583  -5.655   1.225
  527   HD22  ASN  74          2HD2      ASN  74  -5.541  -6.769   2.036
  528    H    GLU  75           H        GLU  75  -7.216  -2.814  -0.629
  529    HA   GLU  75           HA       GLU  75  -9.143  -4.712  -0.708
  530    HB2  GLU  75           1HB      GLU  75  -9.408  -2.180  -0.507
  531    HB3  GLU  75           2HB      GLU  75  -9.443  -2.149  -2.264
  532    HG2  GLU  75           1HG      GLU  75 -11.684  -2.150  -1.610
  533    HG3  GLU  75           2HG      GLU  75 -11.355  -3.807  -2.110
  534    H    CYS  76           H        CYS  76  -7.499  -3.319  -3.511
  535    HA   CYS  76           HA       CYS  76  -9.046  -4.763  -5.431
  536    HB2  CYS  76           1HB      CYS  76  -6.461  -3.219  -5.600
  537    HB3  CYS  76           2HB      CYS  76  -7.155  -4.045  -6.991
  538    H    LEU  77           H        LEU  77  -5.765  -5.141  -4.117
  539    HA   LEU  77           HA       LEU  77  -4.958  -7.348  -5.582
  540    HB2  LEU  77           1HB      LEU  77  -4.319  -6.428  -2.800
  541    HB3  LEU  77           2HB      LEU  77  -3.602  -7.894  -3.465
  542    HG   LEU  77           HG       LEU  77  -3.318  -5.157  -4.699
  543   HD11  LEU  77          1HD1      LEU  77  -1.054  -6.517  -3.355
  544   HD12  LEU  77          2HD1      LEU  77  -2.263  -5.741  -2.333
  545   HD13  LEU  77          3HD1      LEU  77  -1.397  -4.797  -3.545
  546   HD21  LEU  77          1HD2      LEU  77  -3.042  -6.907  -6.317
  547   HD22  LEU  77          2HD2      LEU  77  -1.985  -7.809  -5.230
  548   HD23  LEU  77          3HD2      LEU  77  -1.449  -6.270  -5.906
  549    HA   PRO  78           HA       PRO  78  -7.360 -10.766  -4.231
  550    HB2  PRO  78           1HB      PRO  78  -5.548 -12.779  -4.418
  551    HB3  PRO  78           2HB      PRO  78  -6.273 -12.005  -5.832
  552    HG2  PRO  78           1HG      PRO  78  -3.599 -11.527  -4.574
  553    HG3  PRO  78           2HG      PRO  78  -4.020 -11.659  -6.291
  554    HD2  PRO  78           1HD      PRO  78  -3.634  -9.276  -5.065
  555    HD3  PRO  78           2HD      PRO  78  -4.784  -9.488  -6.401
  556    H    ALA  79           H        ALA  79  -7.919 -10.657  -2.116
  557    HA   ALA  79           HA       ALA  79  -5.936 -11.006  -0.028
  558    HB1  ALA  79           1HB      ALA  79  -7.710  -9.338   0.238
  559    HB2  ALA  79           2HB      ALA  79  -8.920 -10.621   0.184
  560    HB3  ALA  79           3HB      ALA  79  -7.763 -10.555   1.514
  561    H    SER  80           H        SER  80  -5.674 -12.772   1.244
  562    HA   SER  80           HA       SER  80  -6.535 -15.287   0.281
  563    HB2  SER  80           1HB      SER  80  -4.420 -14.926   1.539
  564    HB3  SER  80           2HB      SER  80  -5.367 -14.632   2.997
  565    HG   SER  80           HG       SER  80  -5.810 -16.710   3.149
  566    H    GLY  81           H        GLY  81  -8.813 -15.203   0.216
  567    HA2  GLY  81           1HA      GLY  81 -10.630 -16.320   1.360
  568    HA3  GLY  81           2HA      GLY  81 -10.058 -15.605   2.859
  569    HA   PRO  82           HA       PRO  82 -12.922 -12.677   0.219
  570    HB2  PRO  82           1HB      PRO  82 -15.333 -13.915   0.046
  571    HB3  PRO  82           2HB      PRO  82 -14.094 -14.045  -1.208
  572    HG2  PRO  82           1HG      PRO  82 -14.779 -15.965   0.984
  573    HG3  PRO  82           2HG      PRO  82 -14.414 -16.296  -0.719
  574    HD2  PRO  82           1HD      PRO  82 -12.589 -16.629   1.253
  575    HD3  PRO  82           2HD      PRO  82 -12.138 -16.139  -0.393
  576    H    SER  83           H        SER  83 -14.366 -14.963   2.553
  577    HA   SER  83           HA       SER  83 -15.247 -12.640   4.139
  578    HB2  SER  83           1HB      SER  83 -16.538 -15.290   3.593
  579    HB3  SER  83           2HB      SER  83 -16.899 -14.440   5.096
  580    HG   SER  83           HG       SER  83 -17.010 -12.919   2.784
  581    H    SER  84           H        SER  84 -15.412 -13.058   6.498
  582    HA   SER  84           HA       SER  84 -14.531 -13.691   8.502
  583    HB2  SER  84           1HB      SER  84 -15.014 -16.016   7.601
  584    HB3  SER  84           2HB      SER  84 -13.325 -16.079   7.097
  585    HG   SER  84           HG       SER  84 -12.819 -15.619   9.352
  586    H    GLY  85           H        GLY  85 -13.156 -11.844   6.953
  587    HA2  GLY  85           1HA      GLY  85 -10.357 -12.528   6.848
  588    HA3  GLY  85           2HA      GLY  85 -11.060 -10.950   6.526
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1 -47.204  20.827  32.920
    2    HA2  GLY   1           1HA      GLY   1 -44.549  21.595  32.308
    3    HA3  GLY   1           2HA      GLY   1 -44.530  20.139  33.292
    4    H    SER   2           H        SER   2 -43.818  20.705  30.421
    5    HA   SER   2           HA       SER   2 -45.009  18.310  29.341
    6    HB2  SER   2           1HB      SER   2 -46.589  20.299  28.839
    7    HB3  SER   2           2HB      SER   2 -45.349  20.804  27.691
    8    HG   SER   2           HG       SER   2 -46.217  18.149  27.617
    9    H    SER   3           H        SER   3 -43.500  17.257  28.236
   10    HA   SER   3           HA       SER   3 -41.459  18.765  26.775
   11    HB2  SER   3           1HB      SER   3 -39.660  17.367  27.690
   12    HB3  SER   3           2HB      SER   3 -40.484  18.245  28.978
   13    HG   SER   3           HG       SER   3 -41.440  15.707  28.345
   14    H    GLY   4           H        GLY   4 -40.062  17.184  25.452
   15    HA2  GLY   4           1HA      GLY   4 -41.601  14.835  24.596
   16    HA3  GLY   4           2HA      GLY   4 -41.211  16.062  23.400
   17    H    SER   5           H        SER   5 -40.098  14.348  22.265
   18    HA   SER   5           HA       SER   5 -37.535  13.578  23.481
   19    HB2  SER   5           1HB      SER   5 -39.179  11.814  22.585
   20    HB3  SER   5           2HB      SER   5 -38.706  12.370  20.980
   21    HG   SER   5           HG       SER   5 -37.138  10.990  21.242
   22    H    SER   6           H        SER   6 -35.611  13.674  22.205
   23    HA   SER   6           HA       SER   6 -35.746  15.625  20.000
   24    HB2  SER   6           1HB      SER   6 -33.669  15.406  22.189
   25    HB3  SER   6           2HB      SER   6 -33.494  16.427  20.762
   26    HG   SER   6           HG       SER   6 -35.840  16.699  22.231
   27    H    GLY   7           H        GLY   7 -33.698  15.566  18.631
   28    HA2  GLY   7           1HA      GLY   7 -33.188  12.763  17.958
   29    HA3  GLY   7           2HA      GLY   7 -32.879  14.150  16.924
   30    H    GLU   8           H        GLU   8 -30.811  14.606  16.623
   31    HA   GLU   8           HA       GLU   8 -28.922  14.788  18.721
   32    HB2  GLU   8           1HB      GLU   8 -29.189  12.255  18.364
   33    HB3  GLU   8           2HB      GLU   8 -28.353  12.510  16.838
   34    HG2  GLU   8           1HG      GLU   8 -26.926  11.770  18.766
   35    HG3  GLU   8           2HG      GLU   8 -26.383  13.215  17.917
   36    H    LEU   9           H        LEU   9 -26.961  15.700  18.050
   37    HA   LEU   9           HA       LEU   9 -27.018  17.420  15.902
   38    HB2  LEU   9           1HB      LEU   9 -24.635  16.180  17.265
   39    HB3  LEU   9           2HB      LEU   9 -24.540  17.536  16.143
   40    HG   LEU   9           HG       LEU   9 -26.229  17.730  18.608
   41   HD11  LEU   9          1HD1      LEU   9 -23.291  18.383  18.492
   42   HD12  LEU   9          2HD1      LEU   9 -23.963  16.953  19.275
   43   HD13  LEU   9          3HD1      LEU   9 -24.374  18.560  19.873
   44   HD21  LEU   9          1HD2      LEU   9 -26.120  19.395  16.600
   45   HD22  LEU   9          2HD2      LEU   9 -24.613  19.908  17.359
   46   HD23  LEU   9          3HD2      LEU   9 -26.130  20.003  18.255
   47    H    GLU  10           H        GLU  10 -25.308  17.404  14.081
   48    HA   GLU  10           HA       GLU  10 -25.668  14.898  12.611
   49    HB2  GLU  10           1HB      GLU  10 -25.167  17.739  11.814
   50    HB3  GLU  10           2HB      GLU  10 -24.726  16.445  10.709
   51    HG2  GLU  10           1HG      GLU  10 -26.862  17.059  10.041
   52    HG3  GLU  10           2HG      GLU  10 -27.119  15.610  11.011
   53    HA   PRO  11           HA       PRO  11 -21.385  14.013  13.563
   54    HB2  PRO  11           1HB      PRO  11 -21.372  11.568  12.383
   55    HB3  PRO  11           2HB      PRO  11 -22.071  11.860  13.980
   56    HG2  PRO  11           1HG      PRO  11 -23.438  11.642  11.326
   57    HG3  PRO  11           2HG      PRO  11 -23.915  10.956  12.890
   58    HD2  PRO  11           1HD      PRO  11 -25.035  13.206  11.882
   59    HD3  PRO  11           2HD      PRO  11 -24.824  12.943  13.625
   60    H    GLY  12           H        GLY  12 -22.942  14.117  10.456
   61    HA2  GLY  12           1HA      GLY  12 -20.438  13.857   8.996
   62    HA3  GLY  12           2HA      GLY  12 -22.036  14.079   8.298
   63    H    ALA  13           H        ALA  13 -20.444  16.050  10.769
   64    HA   ALA  13           HA       ALA  13 -20.823  18.387   9.045
   65    HB1  ALA  13           1HB      ALA  13 -21.753  18.440  11.332
   66    HB2  ALA  13           2HB      ALA  13 -20.117  18.295  11.975
   67    HB3  ALA  13           3HB      ALA  13 -20.575  19.720  11.041
   68    H    PHE  14           H        PHE  14 -18.328  16.830  11.039
   69    HA   PHE  14           HA       PHE  14 -16.286  18.557   9.877
   70    HB2  PHE  14           1HB      PHE  14 -16.392  17.954  12.358
   71    HB3  PHE  14           2HB      PHE  14 -15.843  16.350  11.883
   72    HD1  PHE  14           1HD      PHE  14 -14.927  19.935  11.430
   73    HD2  PHE  14           2HD      PHE  14 -13.587  15.921  11.884
   74    HE1  PHE  14           1HE      PHE  14 -12.596  20.723  11.485
   75    HE2  PHE  14           2HE      PHE  14 -11.255  16.702  11.942
   76    HZ   PHE  14           HZ       PHE  14 -10.757  19.106  11.743
   77    H    SER  15           H        SER  15 -16.189  17.817   7.754
   78    HA   SER  15           HA       SER  15 -15.191  15.064   7.419
   79    HB2  SER  15           1HB      SER  15 -16.078  15.157   5.119
   80    HB3  SER  15           2HB      SER  15 -17.351  15.415   6.312
   81    HG   SER  15           HG       SER  15 -15.974  17.518   5.000
   82    H    GLU  16           H        GLU  16 -13.635  14.742   5.669
   83    HA   GLU  16           HA       GLU  16 -12.001  17.140   5.159
   84    HB2  GLU  16           1HB      GLU  16  -9.993  15.857   5.443
   85    HB3  GLU  16           2HB      GLU  16 -10.997  15.620   6.867
   86    HG2  GLU  16           1HG      GLU  16 -11.607  13.446   6.201
   87    HG3  GLU  16           2HG      GLU  16 -10.982  13.688   4.570
   88    H    LEU  17           H        LEU  17 -10.585  16.956   3.253
   89    HA   LEU  17           HA       LEU  17 -11.792  16.612   0.902
   90    HB2  LEU  17           1HB      LEU  17  -8.948  15.819   1.509
   91    HB3  LEU  17           2HB      LEU  17  -9.593  16.069  -0.112
   92    HG   LEU  17           HG       LEU  17  -9.496  18.218   2.000
   93   HD11  LEU  17          1HD1      LEU  17  -7.304  18.314   1.650
   94   HD12  LEU  17          2HD1      LEU  17  -7.669  18.828   0.003
   95   HD13  LEU  17          3HD1      LEU  17  -7.388  17.123   0.352
   96   HD21  LEU  17          1HD2      LEU  17  -9.602  18.731  -0.923
   97   HD22  LEU  17          2HD2      LEU  17 -10.270  19.663   0.417
   98   HD23  LEU  17          3HD2      LEU  17 -11.077  18.190  -0.123
   99    H    TYR  18           H        TYR  18 -12.669  15.039  -0.280
  100    HA   TYR  18           HA       TYR  18 -11.951  12.252   0.346
  101    HB2  TYR  18           1HB      TYR  18 -14.622  13.549   0.173
  102    HB3  TYR  18           2HB      TYR  18 -14.474  11.920  -0.478
  103    HD1  TYR  18           2HD      TYR  18 -12.756  10.513   1.307
  104    HD2  TYR  18           1HD      TYR  18 -15.654  13.488   2.233
  105    HE1  TYR  18           2HE      TYR  18 -12.977   9.584   3.574
  106    HE2  TYR  18           1HE      TYR  18 -15.882  12.568   4.503
  107    HH   TYR  18           HH       TYR  18 -15.075  11.110   5.988
  108    H    GLN  19           H        GLN  19 -11.080  14.177  -1.774
  109    HA   GLN  19           HA       GLN  19 -12.036  12.730  -4.150
  110    HB2  GLN  19           1HB      GLN  19 -11.080  15.518  -3.699
  111    HB3  GLN  19           2HB      GLN  19 -10.773  14.780  -5.266
  112    HG2  GLN  19           1HG      GLN  19 -13.418  15.325  -3.958
  113    HG3  GLN  19           2HG      GLN  19 -12.789  15.977  -5.470
  114   HE21  GLN  19          1HE2      GLN  19 -15.016  13.981  -4.321
  115   HE22  GLN  19          2HE2      GLN  19 -15.108  12.821  -5.597
  116    H    ARG  20           H        ARG  20  -9.080  14.148  -2.758
  117    HA   ARG  20           HA       ARG  20  -7.486  12.307  -4.395
  118    HB2  ARG  20           1HB      ARG  20  -6.874  14.663  -4.567
  119    HB3  ARG  20           2HB      ARG  20  -6.667  14.756  -2.824
  120    HG2  ARG  20           1HG      ARG  20  -4.666  13.670  -2.860
  121    HG3  ARG  20           2HG      ARG  20  -5.072  12.740  -4.304
  122    HD2  ARG  20           1HD      ARG  20  -3.549  14.196  -5.189
  123    HD3  ARG  20           2HD      ARG  20  -5.030  15.122  -5.430
  124    HE   ARG  20           HE       ARG  20  -3.783  15.689  -2.923
  125   HH11  ARG  20          2HH1      ARG  20  -3.714  16.399  -6.330
  126   HH12  ARG  20          1HH1      ARG  20  -2.990  17.960  -6.123
  127   HH21  ARG  20          2HH2      ARG  20  -2.830  17.742  -2.637
  128   HH22  ARG  20          1HH2      ARG  20  -2.487  18.722  -4.022
  129    H    TYR  21           H        TYR  21  -6.134  10.807  -3.509
  130    HA   TYR  21           HA       TYR  21  -6.316  10.461  -0.589
  131    HB2  TYR  21           1HB      TYR  21  -7.398   8.670  -1.915
  132    HB3  TYR  21           2HB      TYR  21  -5.856   8.339  -2.696
  133    HD1  TYR  21           2HD      TYR  21  -3.921   7.560  -1.242
  134    HD2  TYR  21           1HD      TYR  21  -7.942   7.677   0.143
  135    HE1  TYR  21           2HE      TYR  21  -3.338   5.994   0.563
  136    HE2  TYR  21           1HE      TYR  21  -7.370   6.113   1.953
  137    HH   TYR  21           HH       TYR  21  -5.694   5.084   3.037
  138    H    ARG  22           H        ARG  22  -4.505  10.961   0.435
  139    HA   ARG  22           HA       ARG  22  -1.939  10.184  -0.766
  140    HB2  ARG  22           1HB      ARG  22  -2.344  12.797   0.689
  141    HB3  ARG  22           2HB      ARG  22  -0.917  12.267  -0.192
  142    HG2  ARG  22           1HG      ARG  22  -3.473  12.484  -1.684
  143    HG3  ARG  22           2HG      ARG  22  -2.644  13.972  -1.224
  144    HD2  ARG  22           1HD      ARG  22  -1.393  11.687  -2.745
  145    HD3  ARG  22           2HD      ARG  22  -2.014  13.168  -3.475
  146    HE   ARG  22           HE       ARG  22   0.494  12.827  -2.164
  147   HH11  ARG  22          2HH1      ARG  22  -2.045  15.124  -2.793
  148   HH12  ARG  22          1HH1      ARG  22  -1.012  16.506  -2.637
  149   HH21  ARG  22          2HH2      ARG  22   1.864  14.638  -1.956
  150   HH22  ARG  22          1HH2      ARG  22   1.211  16.229  -2.161
  151    H    HIS  23           H        HIS  23  -2.177   8.374   0.710
  152    HA   HIS  23           HA       HIS  23  -0.967   8.959   3.274
  153    HB2  HIS  23           1HB      HIS  23  -3.235   9.127   3.972
  154    HB3  HIS  23           2HB      HIS  23  -3.705   7.716   3.029
  155    HD1  HIS  23           1HD      HIS  23  -4.285   5.903   4.596
  156    HD2  HIS  23           2HD      HIS  23  -0.984   8.063   5.900
  157    HE1  HIS  23           1HE      HIS  23  -3.530   4.767   6.708
  158    HE2  HIS  23           2HE      HIS  23  -1.584   6.142   7.525
  159    H    CYS  24           H        CYS  24   0.519   7.467   3.726
  160    HA   CYS  24           HA       CYS  24   0.928   5.250   1.987
  161    HB2  CYS  24           1HB      CYS  24   2.916   6.118   2.826
  162    HB3  CYS  24           2HB      CYS  24   2.274   6.284   4.456
  163    H    ASP  25           H        ASP  25  -0.277   3.476   2.041
  164    HA   ASP  25           HA       ASP  25  -0.983   2.347   4.670
  165    HB2  ASP  25           1HB      ASP  25  -2.898   3.374   3.272
  166    HB3  ASP  25           2HB      ASP  25  -2.697   1.971   2.226
  167    H    ALA  26           H        ALA  26   1.306   1.829   2.884
  168    HA   ALA  26           HA       ALA  26   0.901  -0.659   1.561
  169    HB1  ALA  26           1HB      ALA  26   2.825  -0.002   0.669
  170    HB2  ALA  26           2HB      ALA  26   3.055   1.207   1.933
  171    HB3  ALA  26           3HB      ALA  26   3.621  -0.445   2.180
  172    HA   PRO  27           HA       PRO  27   1.458  -3.672   4.702
  173    HB2  PRO  27           1HB      PRO  27   3.304  -5.381   3.680
  174    HB3  PRO  27           2HB      PRO  27   1.650  -5.273   3.066
  175    HG2  PRO  27           1HG      PRO  27   4.157  -4.050   1.979
  176    HG3  PRO  27           2HG      PRO  27   2.836  -4.854   1.110
  177    HD2  PRO  27           1HD      PRO  27   3.063  -2.159   1.248
  178    HD3  PRO  27           2HD      PRO  27   1.492  -2.982   1.168
  179    H    ILE  28           H        ILE  28   4.557  -2.495   3.429
  180    HA   ILE  28           HA       ILE  28   5.544  -2.254   6.167
  181    HB   ILE  28           HB       ILE  28   7.128  -3.652   4.008
  182   HG12  ILE  28          1HG1      ILE  28   5.292  -5.030   4.963
  183   HG13  ILE  28          2HG1      ILE  28   6.890  -5.662   5.344
  184   HG21  ILE  28          1HG2      ILE  28   7.862  -3.368   6.906
  185   HG22  ILE  28          2HG2      ILE  28   8.881  -3.865   5.556
  186   HG23  ILE  28          3HG2      ILE  28   8.353  -2.188   5.691
  187   HD11  ILE  28          1HD1      ILE  28   4.870  -5.286   7.129
  188   HD12  ILE  28          2HD1      ILE  28   6.580  -5.421   7.538
  189   HD13  ILE  28          3HD1      ILE  28   5.840  -3.831   7.357
  190    H    CYS  29           H        CYS  29   6.747  -0.469   6.488
  191    HA   CYS  29           HA       CYS  29   7.557   1.066   4.105
  192    HB2  CYS  29           1HB      CYS  29   5.655   1.905   5.750
  193    HB3  CYS  29           2HB      CYS  29   7.034   2.434   6.707
  194    H    LEU  30           H        LEU  30   9.661   1.436   3.907
  195    HA   LEU  30           HA       LEU  30  11.418   0.845   6.165
  196    HB2  LEU  30           1HB      LEU  30  12.316   1.514   3.385
  197    HB3  LEU  30           2HB      LEU  30  13.155   0.578   4.620
  198    HG   LEU  30           HG       LEU  30  10.604  -0.517   3.565
  199   HD11  LEU  30          1HD1      LEU  30  11.245  -0.739   1.455
  200   HD12  LEU  30          2HD1      LEU  30  12.793  -1.422   1.950
  201   HD13  LEU  30          3HD1      LEU  30  12.610   0.325   1.796
  202   HD21  LEU  30          1HD2      LEU  30  13.049  -1.436   4.898
  203   HD22  LEU  30          2HD2      LEU  30  12.465  -2.500   3.618
  204   HD23  LEU  30          3HD2      LEU  30  11.407  -2.076   4.965
  205    H    TYR  31           H        TYR  31  10.240   3.497   4.298
  206    HA   TYR  31           HA       TYR  31  12.298   5.362   4.743
  207    HB2  TYR  31           1HB      TYR  31  10.143   5.448   3.222
  208    HB3  TYR  31           2HB      TYR  31   9.443   6.244   4.627
  209    HD1  TYR  31           2HD      TYR  31  12.697   6.431   2.783
  210    HD2  TYR  31           1HD      TYR  31   9.400   8.536   4.458
  211    HE1  TYR  31           2HE      TYR  31  13.701   8.560   2.070
  212    HE2  TYR  31           1HE      TYR  31  10.395  10.671   3.749
  213    HH   TYR  31           HH       TYR  31  13.346  10.768   1.811
  214    H    GLU  32           H        GLU  32  13.041   5.989   6.653
  215    HA   GLU  32           HA       GLU  32  12.089   5.579   9.136
  216    HB2  GLU  32           1HB      GLU  32  14.263   6.623   8.668
  217    HB3  GLU  32           2HB      GLU  32  13.451   8.117   8.218
  218    HG2  GLU  32           1HG      GLU  32  12.443   7.883  10.646
  219    HG3  GLU  32           2HG      GLU  32  13.907   6.935  10.899
  220    H    GLN  33           H        GLN  33  11.300   8.428   7.157
  221    HA   GLN  33           HA       GLN  33   9.597   9.666   9.006
  222    HB2  GLN  33           1HB      GLN  33  10.046   9.859   6.075
  223    HB3  GLN  33           2HB      GLN  33   8.551  10.540   6.703
  224    HG2  GLN  33           1HG      GLN  33  10.571  12.081   6.476
  225    HG3  GLN  33           2HG      GLN  33   9.663  12.124   7.987
  226   HE21  GLN  33          1HE2      GLN  33  12.682  12.005   6.675
  227   HE22  GLN  33          2HE2      GLN  33  13.560  11.395   8.032
  228    H    GLY  34           H        GLY  34   8.991   7.199   6.563
  229    HA2  GLY  34           1HA      GLY  34   7.081   6.016   6.034
  230    HA3  GLY  34           2HA      GLY  34   6.925   5.913   7.782
  231    H    ARG  35           H        ARG  35   6.674   8.824   5.798
  232    HA   ARG  35           HA       ARG  35   3.850   9.030   6.618
  233    HB2  ARG  35           1HB      ARG  35   4.082  11.283   7.050
  234    HB3  ARG  35           2HB      ARG  35   5.660  10.687   7.544
  235    HG2  ARG  35           1HG      ARG  35   6.382  11.256   5.136
  236    HG3  ARG  35           2HG      ARG  35   4.912  12.232   5.097
  237    HD2  ARG  35           1HD      ARG  35   7.104  12.474   7.154
  238    HD3  ARG  35           2HD      ARG  35   6.911  13.526   5.752
  239    HE   ARG  35           HE       ARG  35   4.538  13.462   7.302
  240   HH11  ARG  35          2HH1      ARG  35   7.760  14.779   7.243
  241   HH12  ARG  35          1HH1      ARG  35   7.351  16.166   8.198
  242   HH21  ARG  35          2HH2      ARG  35   3.987  15.283   8.560
  243   HH22  ARG  35          1HH2      ARG  35   5.205  16.451   8.947
  244    H    ASP  36           H        ASP  36   2.925  11.020   5.118
  245    HA   ASP  36           HA       ASP  36   2.794   9.843   2.499
  246    HB2  ASP  36           1HB      ASP  36   1.128  11.574   2.030
  247    HB3  ASP  36           2HB      ASP  36   0.793  10.789   3.571
  248    H    SER  37           H        SER  37   5.385  10.593   2.913
  249    HA   SER  37           HA       SER  37   5.701  13.027   1.285
  250    HB2  SER  37           1HB      SER  37   6.768  12.715   3.689
  251    HB3  SER  37           2HB      SER  37   7.996  11.832   2.782
  252    HG   SER  37           HG       SER  37   7.832  13.879   1.376
  253    H    PHE  38           H        PHE  38   6.368  12.776  -0.735
  254    HA   PHE  38           HA       PHE  38   8.082  10.501  -1.416
  255    HB2  PHE  38           1HB      PHE  38   5.780  11.254  -3.203
  256    HB3  PHE  38           2HB      PHE  38   6.753   9.787  -3.226
  257    HD1  PHE  38           1HD      PHE  38   4.369  11.646  -1.054
  258    HD2  PHE  38           2HD      PHE  38   5.934   7.870  -2.242
  259    HE1  PHE  38           1HE      PHE  38   2.684  10.513   0.337
  260    HE2  PHE  38           2HE      PHE  38   4.252   6.732  -0.853
  261    HZ   PHE  38           HZ       PHE  38   2.624   8.053   0.438
  262    H    GLU  39           H        GLU  39   8.936  10.743  -3.714
  263    HA   GLU  39           HA       GLU  39   9.544  13.586  -4.194
  264    HB2  GLU  39           1HB      GLU  39  11.689  12.921  -5.045
  265    HB3  GLU  39           2HB      GLU  39  11.462  12.162  -3.475
  266    HG2  GLU  39           1HG      GLU  39  10.764  10.086  -4.657
  267    HG3  GLU  39           2HG      GLU  39  11.201  10.865  -6.176
  268    H    ASP  40           H        ASP  40  10.104  14.104  -6.484
  269    HA   ASP  40           HA       ASP  40   7.995  13.603  -8.197
  270    HB2  ASP  40           1HB      ASP  40   9.991  15.337  -8.289
  271    HB3  ASP  40           2HB      ASP  40  10.690  14.135  -9.371
  272    H    GLU  41           H        GLU  41  11.052  11.882  -7.876
  273    HA   GLU  41           HA       GLU  41   9.923   9.557  -9.141
  274    HB2  GLU  41           1HB      GLU  41  12.241  10.993 -10.447
  275    HB3  GLU  41           2HB      GLU  41  11.696   9.376 -10.870
  276    HG2  GLU  41           1HG      GLU  41   9.470  10.364 -11.431
  277    HG3  GLU  41           2HG      GLU  41  10.191  11.956 -11.203
  278    H    GLY  42           H        GLY  42  10.807   7.738  -8.336
  279    HA2  GLY  42           1HA      GLY  42  13.219   6.886  -7.762
  280    HA3  GLY  42           2HA      GLY  42  13.044   8.065  -6.471
  281    H    ARG  43           H        ARG  43  13.527   5.611  -5.642
  282    HA   ARG  43           HA       ARG  43  11.482   3.775  -5.375
  283    HB2  ARG  43           1HB      ARG  43  12.644   2.935  -3.428
  284    HB3  ARG  43           2HB      ARG  43  13.823   3.418  -4.641
  285    HG2  ARG  43           1HG      ARG  43  14.146   5.545  -3.421
  286    HG3  ARG  43           2HG      ARG  43  13.048   4.955  -2.172
  287    HD2  ARG  43           1HD      ARG  43  15.419   4.631  -1.582
  288    HD3  ARG  43           2HD      ARG  43  14.532   3.111  -1.686
  289    HE   ARG  43           HE       ARG  43  16.667   4.011  -3.424
  290   HH11  ARG  43          2HH1      ARG  43  14.052   1.768  -2.924
  291   HH12  ARG  43          1HH1      ARG  43  14.669   0.597  -4.041
  292   HH21  ARG  43          2HH2      ARG  43  17.490   2.477  -4.897
  293   HH22  ARG  43          1HH2      ARG  43  16.626   1.001  -5.163
  294    H    TRP  44           H        TRP  44  11.836   6.871  -3.882
  295    HA   TRP  44           HA       TRP  44   9.640   6.301  -2.019
  296    HB2  TRP  44           1HB      TRP  44  11.388   8.766  -2.122
  297    HB3  TRP  44           2HB      TRP  44  10.291   8.291  -0.828
  298    HD1  TRP  44           HD       TRP  44  13.791   8.466  -1.323
  299    HE1  TRP  44           1HE      TRP  44  15.086   6.699   0.028
  300    HE3  TRP  44           3HE      TRP  44   9.930   5.305  -0.210
  301    HZ2  TRP  44           2HZ      TRP  44  14.543   4.284   1.385
  302    HZ3  TRP  44           3HZ      TRP  44  10.403   3.288   1.119
  303    HH2  TRP  44           HH       TRP  44  12.662   2.790   1.898
  304    H    ARG  45           H        ARG  45   9.044   6.509  -4.770
  305    HA   ARG  45           HA       ARG  45   7.873   9.163  -5.109
  306    HB2  ARG  45           1HB      ARG  45   7.473   8.543  -7.391
  307    HB3  ARG  45           2HB      ARG  45   9.115   8.065  -6.981
  308    HG2  ARG  45           1HG      ARG  45   8.499   5.777  -6.822
  309    HG3  ARG  45           2HG      ARG  45   6.781   6.171  -6.917
  310    HD2  ARG  45           1HD      ARG  45   8.701   6.848  -9.126
  311    HD3  ARG  45           2HD      ARG  45   7.905   5.278  -9.029
  312    HE   ARG  45           HE       ARG  45   5.906   7.172  -8.831
  313   HH11  ARG  45          2HH1      ARG  45   8.331   6.255 -11.154
  314   HH12  ARG  45          1HH1      ARG  45   7.395   6.754 -12.523
  315   HH21  ARG  45          2HH2      ARG  45   4.663   7.834 -10.626
  316   HH22  ARG  45          1HH2      ARG  45   5.309   7.653 -12.222
  317    H    LEU  46           H        LEU  46   5.733   9.582  -5.015
  318    HA   LEU  46           HA       LEU  46   4.017   7.754  -3.704
  319    HB2  LEU  46           1HB      LEU  46   3.946  10.311  -3.711
  320    HB3  LEU  46           2HB      LEU  46   3.100  10.160  -5.249
  321    HG   LEU  46           HG       LEU  46   2.079   8.804  -2.774
  322   HD11  LEU  46          1HD1      LEU  46   2.141  10.984  -1.985
  323   HD12  LEU  46          2HD1      LEU  46   0.529  10.862  -2.687
  324   HD13  LEU  46          3HD1      LEU  46   1.817  11.677  -3.574
  325   HD21  LEU  46          1HD2      LEU  46   0.723   8.013  -4.377
  326   HD22  LEU  46          2HD2      LEU  46   1.168   9.279  -5.521
  327   HD23  LEU  46          3HD2      LEU  46  -0.042   9.599  -4.277
  328    H    ILE  47           H        ILE  47   2.975   6.083  -4.541
  329    HA   ILE  47           HA       ILE  47   2.269   6.153  -7.402
  330    HB   ILE  47           HB       ILE  47   2.897   3.744  -5.692
  331   HG12  ILE  47          1HG1      ILE  47   4.392   5.068  -7.963
  332   HG13  ILE  47          2HG1      ILE  47   4.909   4.954  -6.284
  333   HG21  ILE  47          1HG2      ILE  47   1.494   2.738  -7.135
  334   HG22  ILE  47          2HG2      ILE  47   1.593   4.050  -8.308
  335   HG23  ILE  47          3HG2      ILE  47   2.868   2.834  -8.236
  336   HD11  ILE  47          1HD1      ILE  47   4.656   2.361  -6.804
  337   HD12  ILE  47          2HD1      ILE  47   4.988   2.937  -8.437
  338   HD13  ILE  47          3HD1      ILE  47   6.134   3.262  -7.137
  339    H    LEU  48           H        LEU  48   0.172   6.182  -7.844
  340    HA   LEU  48           HA       LEU  48  -1.736   5.538  -5.723
  341    HB2  LEU  48           1HB      LEU  48  -1.913   7.067  -8.295
  342    HB3  LEU  48           2HB      LEU  48  -3.367   6.524  -7.459
  343    HG   LEU  48           HG       LEU  48  -1.296   8.465  -6.442
  344   HD11  LEU  48          1HD1      LEU  48  -2.688   9.658  -7.853
  345   HD12  LEU  48          2HD1      LEU  48  -3.469   9.861  -6.285
  346   HD13  LEU  48          3HD1      LEU  48  -4.105   8.692  -7.442
  347   HD21  LEU  48          1HD2      LEU  48  -2.960   8.666  -4.517
  348   HD22  LEU  48          2HD2      LEU  48  -1.907   7.250  -4.533
  349   HD23  LEU  48          3HD2      LEU  48  -3.586   7.107  -5.054
  350    H    CYS  49           H        CYS  49  -3.485   4.127  -6.044
  351    HA   CYS  49           HA       CYS  49  -2.936   1.733  -7.336
  352    HB2  CYS  49           1HB      CYS  49  -4.575   1.893  -5.541
  353    HB3  CYS  49           2HB      CYS  49  -5.619   2.889  -6.550
  354    H    ALA  50           H        ALA  50  -4.042   0.711  -9.142
  355    HA   ALA  50           HA       ALA  50  -4.618   2.645 -11.288
  356    HB1  ALA  50           1HB      ALA  50  -3.612  -0.185 -11.558
  357    HB2  ALA  50           2HB      ALA  50  -3.847   0.977 -12.864
  358    HB3  ALA  50           3HB      ALA  50  -2.610   1.264 -11.640
  359    H    THR  51           H        THR  51  -5.586  -0.469  -9.906
  360    HA   THR  51           HA       THR  51  -7.680  -1.111 -11.601
  361    HB   THR  51           HB       THR  51  -7.430  -1.614  -8.632
  362    HG1  THR  51           1HG      THR  51  -6.524  -2.872 -10.953
  363   HG21  THR  51          1HG2      THR  51  -9.181  -3.199  -8.788
  364   HG22  THR  51          2HG2      THR  51  -9.225  -3.088 -10.548
  365   HG23  THR  51          3HG2      THR  51  -9.789  -1.738  -9.564
  366    H    CYS  52           H        CYS  52  -8.013   0.496  -8.428
  367    HA   CYS  52           HA       CYS  52 -10.521   1.692  -9.401
  368    HB2  CYS  52           1HB      CYS  52 -11.303   1.757  -7.170
  369    HB3  CYS  52           2HB      CYS  52 -10.547   0.177  -7.349
  370    H    GLY  53           H        GLY  53  -7.448   2.364  -7.827
  371    HA2  GLY  53           1HA      GLY  53  -6.232   4.329  -7.797
  372    HA3  GLY  53           2HA      GLY  53  -7.499   5.079  -8.758
  373    H    SER  54           H        SER  54  -7.534   3.583  -5.529
  374    HA   SER  54           HA       SER  54  -8.410   6.174  -4.438
  375    HB2  SER  54           1HB      SER  54 -10.217   4.304  -4.757
  376    HB3  SER  54           2HB      SER  54  -9.472   3.599  -3.321
  377    HG   SER  54           HG       SER  54 -11.116   5.760  -3.545
  378    H    HIS  55           H        HIS  55  -5.831   4.554  -4.505
  379    HA   HIS  55           HA       HIS  55  -5.235   4.881  -1.663
  380    HB2  HIS  55           1HB      HIS  55  -4.497   2.398  -3.227
  381    HB3  HIS  55           2HB      HIS  55  -4.031   2.748  -1.565
  382    HD1  HIS  55           1HD      HIS  55  -7.032   1.840  -3.647
  383    HD2  HIS  55           2HD      HIS  55  -5.936   2.156   0.348
  384    HE1  HIS  55           1HE      HIS  55  -8.921   0.808  -2.348
  385    HE2  HIS  55           2HE      HIS  55  -8.275   1.086   0.070
  386    H    GLY  56           H        GLY  56  -3.064   5.356  -1.205
  387    HA2  GLY  56           1HA      GLY  56  -1.263   5.659  -3.505
  388    HA3  GLY  56           2HA      GLY  56  -1.624   7.074  -2.527
  389    H    THR  57           H        THR  57   0.669   4.866  -3.047
  390    HA   THR  57           HA       THR  57   1.847   5.288  -0.424
  391    HB   THR  57           HB       THR  57   0.512   3.033  -0.524
  392    HG1  THR  57           1HG      THR  57   1.759   2.497   1.134
  393   HG21  THR  57          1HG2      THR  57   3.082   1.914  -1.520
  394   HG22  THR  57          2HG2      THR  57   1.928   2.523  -2.707
  395   HG23  THR  57          3HG2      THR  57   1.454   1.242  -1.593
  396    H    HIS  58           H        HIS  58   4.138   4.437  -0.372
  397    HA   HIS  58           HA       HIS  58   5.577   5.471  -2.559
  398    HB2  HIS  58           1HB      HIS  58   6.665   3.570  -0.481
  399    HB3  HIS  58           2HB      HIS  58   7.555   4.780  -1.401
  400    HD2  HIS  58           2HD      HIS  58   7.595   7.300  -0.295
  401    HE1  HIS  58           1HE      HIS  58   5.027   6.455   2.974
  402    HE2  HIS  58           2HE      HIS  58   6.505   8.177   1.881
  403    H    ARG  59           H        ARG  59   7.572   3.886  -3.285
  404    HA   ARG  59           HA       ARG  59   6.236   1.865  -4.897
  405    HB2  ARG  59           1HB      ARG  59   7.867   3.554  -5.848
  406    HB3  ARG  59           2HB      ARG  59   9.139   2.680  -5.004
  407    HG2  ARG  59           1HG      ARG  59   7.330   1.154  -6.802
  408    HG3  ARG  59           2HG      ARG  59   8.567   2.187  -7.521
  409    HD2  ARG  59           1HD      ARG  59   9.060   0.020  -5.482
  410    HD3  ARG  59           2HD      ARG  59   9.344  -0.125  -7.216
  411    HE   ARG  59           HE       ARG  59  10.764   2.093  -6.302
  412   HH11  ARG  59          2HH1      ARG  59  10.754  -1.366  -5.902
  413   HH12  ARG  59          1HH1      ARG  59  12.454  -1.465  -5.586
  414   HH21  ARG  59          2HH2      ARG  59  13.004   1.975  -5.888
  415   HH22  ARG  59          1HH2      ARG  59  13.733   0.436  -5.578
  416    H    ASP  60           H        ASP  60   9.380   1.913  -3.215
  417    HA   ASP  60           HA       ASP  60   9.588  -0.881  -3.018
  418    HB2  ASP  60           1HB      ASP  60  11.445  -0.486  -1.525
  419    HB3  ASP  60           2HB      ASP  60  11.493   0.715  -2.813
  420    H    CYS  61           H        CYS  61   7.863   1.426  -1.128
  421    HA   CYS  61           HA       CYS  61   7.676  -0.046   1.287
  422    HB2  CYS  61           1HB      CYS  61   7.190   2.400   1.044
  423    HB3  CYS  61           2HB      CYS  61   5.701   1.973   0.206
  424    H    SER  62           H        SER  62   5.757   0.032  -1.662
  425    HA   SER  62           HA       SER  62   3.722  -1.713  -0.599
  426    HB2  SER  62           1HB      SER  62   3.087  -0.066  -2.268
  427    HB3  SER  62           2HB      SER  62   4.250  -0.732  -3.414
  428    HG   SER  62           HG       SER  62   2.988  -2.462  -3.720
  429    H    SER  63           H        SER  63   6.708  -2.447  -0.981
  430    HA   SER  63           HA       SER  63   7.953  -4.262  -1.575
  431    HB2  SER  63           1HB      SER  63   5.294  -5.338  -0.784
  432    HB3  SER  63           2HB      SER  63   6.411  -6.452  -1.572
  433    HG   SER  63           HG       SER  63   6.615  -5.166   0.900
  434    H    LEU  64           H        LEU  64   7.242  -2.792  -3.765
  435    HA   LEU  64           HA       LEU  64   6.234  -4.629  -5.790
  436    HB2  LEU  64           1HB      LEU  64   7.120  -1.759  -6.039
  437    HB3  LEU  64           2HB      LEU  64   6.323  -2.710  -7.290
  438    HG   LEU  64           HG       LEU  64   4.986  -2.178  -4.657
  439   HD11  LEU  64          1HD1      LEU  64   3.844  -0.387  -6.345
  440   HD12  LEU  64          2HD1      LEU  64   5.537  -0.282  -6.826
  441   HD13  LEU  64          3HD1      LEU  64   5.077   0.008  -5.148
  442   HD21  LEU  64          1HD2      LEU  64   4.289  -3.843  -6.623
  443   HD22  LEU  64          2HD2      LEU  64   3.560  -2.362  -7.245
  444   HD23  LEU  64          3HD2      LEU  64   3.107  -2.967  -5.651
  445    H    ARG  65           H        ARG  65   7.507  -4.226  -8.017
  446    HA   ARG  65           HA       ARG  65  10.205  -5.200  -7.480
  447    HB2  ARG  65           1HB      ARG  65   8.296  -5.383  -9.753
  448    HB3  ARG  65           2HB      ARG  65  10.011  -5.421 -10.138
  449    HG2  ARG  65           1HG      ARG  65  10.317  -7.329  -8.659
  450    HG3  ARG  65           2HG      ARG  65   8.604  -7.281  -8.234
  451    HD2  ARG  65           1HD      ARG  65   8.040  -7.667 -10.606
  452    HD3  ARG  65           2HD      ARG  65   9.761  -7.796 -10.971
  453    HE   ARG  65           HE       ARG  65   9.724  -9.931 -10.162
  454   HH11  ARG  65          2HH1      ARG  65   6.917  -8.237  -8.990
  455   HH12  ARG  65          1HH1      ARG  65   6.207  -9.645  -8.271
  456   HH21  ARG  65          2HH2      ARG  65   8.799 -11.791  -9.220
  457   HH22  ARG  65          1HH2      ARG  65   7.279 -11.665  -8.402
  458    HA   PRO  66           HA       PRO  66  12.356  -1.602  -8.772
  459    HB2  PRO  66           1HB      PRO  66  14.399  -2.622 -10.242
  460    HB3  PRO  66           2HB      PRO  66  14.311  -2.774  -8.483
  461    HG2  PRO  66           1HG      PRO  66  13.583  -4.766 -10.596
  462    HG3  PRO  66           2HG      PRO  66  14.464  -5.017  -9.078
  463    HD2  PRO  66           1HD      PRO  66  11.840  -5.626  -9.358
  464    HD3  PRO  66           2HD      PRO  66  12.533  -5.071  -7.820
  465    H    ASN  67           H        ASN  67  10.712  -3.504 -10.993
  466    HA   ASN  67           HA       ASN  67  11.003  -1.431 -13.054
  467    HB2  ASN  67           1HB      ASN  67  10.942  -3.145 -14.812
  468    HB3  ASN  67           2HB      ASN  67  12.335  -3.369 -13.757
  469   HD21  ASN  67          1HD2      ASN  67  11.279  -5.358 -15.412
  470   HD22  ASN  67          2HD2      ASN  67  10.656  -6.624 -14.414
  471    H    SER  68           H        SER  68   8.986  -1.532 -11.135
  472    HA   SER  68           HA       SER  68   6.655  -2.752 -12.364
  473    HB2  SER  68           1HB      SER  68   6.775  -2.881  -9.961
  474    HB3  SER  68           2HB      SER  68   7.007  -1.138  -9.830
  475    HG   SER  68           HG       SER  68   4.847  -1.714  -9.410
  476    H    LYS  69           H        LYS  69   4.828  -1.607 -13.075
  477    HA   LYS  69           HA       LYS  69   5.384   1.184 -13.840
  478    HB2  LYS  69           1HB      LYS  69   3.820   0.802 -15.726
  479    HB3  LYS  69           2HB      LYS  69   5.232  -0.245 -15.784
  480    HG2  LYS  69           1HG      LYS  69   3.897  -2.077 -14.844
  481    HG3  LYS  69           2HG      LYS  69   2.481  -1.023 -14.837
  482    HD2  LYS  69           1HD      LYS  69   2.493  -0.870 -17.220
  483    HD3  LYS  69           2HD      LYS  69   4.061  -1.674 -17.320
  484    HE2  LYS  69           1HE      LYS  69   2.449  -3.303 -17.897
  485    HE3  LYS  69           2HE      LYS  69   2.956  -3.680 -16.252
  486    HZ1  LYS  69           1HZ      LYS  69   0.436  -2.391 -17.124
  487    HZ2  LYS  69           2HZ      LYS  69   0.953  -2.380 -15.514
  488    HZ3  LYS  69           3HZ      LYS  69   0.624  -3.849 -16.286
  489    H    LYS  70           H        LYS  70   2.773  -1.047 -12.925
  490    HA   LYS  70           HA       LYS  70   1.383   1.231 -11.687
  491    HB2  LYS  70           1HB      LYS  70  -0.663   0.681 -12.604
  492    HB3  LYS  70           2HB      LYS  70   0.419   0.291 -13.935
  493    HG2  LYS  70           1HG      LYS  70   0.364  -2.065 -13.290
  494    HG3  LYS  70           2HG      LYS  70  -0.723  -1.673 -11.956
  495    HD2  LYS  70           1HD      LYS  70  -2.123  -0.575 -13.929
  496    HD3  LYS  70           2HD      LYS  70  -1.251  -1.782 -14.878
  497    HE2  LYS  70           1HE      LYS  70  -2.872  -2.370 -12.403
  498    HE3  LYS  70           2HE      LYS  70  -3.447  -2.580 -14.056
  499    HZ1  LYS  70           1HZ      LYS  70  -2.022  -4.394 -12.516
  500    HZ2  LYS  70           2HZ      LYS  70  -0.968  -3.887 -13.738
  501    HZ3  LYS  70           3HZ      LYS  70  -2.471  -4.550 -14.140
  502    H    TRP  71           H        TRP  71   0.243   0.790  -9.793
  503    HA   TRP  71           HA       TRP  71   0.666  -1.895  -8.655
  504    HB2  TRP  71           1HB      TRP  71   2.146  -0.746  -7.337
  505    HB3  TRP  71           2HB      TRP  71   1.304   0.787  -7.542
  506    HD1  TRP  71           HD       TRP  71   1.199  -2.417  -5.426
  507    HE1  TRP  71           1HE      TRP  71  -0.151  -1.935  -3.288
  508    HE3  TRP  71           3HE      TRP  71  -0.468   2.281  -6.560
  509    HZ2  TRP  71           2HZ      TRP  71  -1.716   0.159  -2.223
  510    HZ3  TRP  71           3HZ      TRP  71  -1.888   3.454  -4.928
  511    HH2  TRP  71           HH       TRP  71  -2.498   2.414  -2.806
  512    H    GLU  72           H        GLU  72  -0.916  -2.639  -7.179
  513    HA   GLU  72           HA       GLU  72  -3.480  -1.195  -7.354
  514    HB2  GLU  72           1HB      GLU  72  -3.182  -4.179  -7.037
  515    HB3  GLU  72           2HB      GLU  72  -4.638  -3.277  -7.433
  516    HG2  GLU  72           1HG      GLU  72  -4.115  -4.038  -9.498
  517    HG3  GLU  72           2HG      GLU  72  -3.183  -2.542  -9.513
  518    H    CYS  73           H        CYS  73  -4.766  -1.066  -5.532
  519    HA   CYS  73           HA       CYS  73  -3.407  -1.108  -3.032
  520    HB2  CYS  73           1HB      CYS  73  -5.502  -0.338  -2.084
  521    HB3  CYS  73           2HB      CYS  73  -5.198   0.515  -3.594
  522    H    ASN  74           H        ASN  74  -4.464  -2.170  -1.074
  523    HA   ASN  74           HA       ASN  74  -4.318  -4.959  -1.355
  524    HB2  ASN  74           1HB      ASN  74  -3.808  -4.281   0.791
  525    HB3  ASN  74           2HB      ASN  74  -5.111  -3.096   0.840
  526   HD21  ASN  74          1HD2      ASN  74  -6.874  -3.605   1.929
  527   HD22  ASN  74          2HD2      ASN  74  -7.313  -5.191   2.456
  528    H    GLU  75           H        GLU  75  -7.138  -2.865  -0.756
  529    HA   GLU  75           HA       GLU  75  -9.120  -4.770  -0.671
  530    HB2  GLU  75           1HB      GLU  75  -9.638  -2.479  -0.198
  531    HB3  GLU  75           2HB      GLU  75  -9.181  -1.981  -1.821
  532    HG2  GLU  75           1HG      GLU  75 -11.092  -3.651  -2.511
  533    HG3  GLU  75           2HG      GLU  75 -11.653  -3.324  -0.873
  534    H    CYS  76           H        CYS  76  -7.535  -3.383  -3.492
  535    HA   CYS  76           HA       CYS  76  -9.269  -4.665  -5.383
  536    HB2  CYS  76           1HB      CYS  76  -6.665  -3.171  -5.606
  537    HB3  CYS  76           2HB      CYS  76  -7.378  -3.981  -6.997
  538    H    LEU  77           H        LEU  77  -5.990  -5.259  -4.168
  539    HA   LEU  77           HA       LEU  77  -5.521  -7.546  -5.785
  540    HB2  LEU  77           1HB      LEU  77  -4.240  -6.513  -3.270
  541    HB3  LEU  77           2HB      LEU  77  -3.704  -7.990  -4.066
  542    HG   LEU  77           HG       LEU  77  -3.749  -5.305  -5.430
  543   HD11  LEU  77          1HD1      LEU  77  -2.172  -4.840  -3.851
  544   HD12  LEU  77          2HD1      LEU  77  -1.164  -5.666  -5.039
  545   HD13  LEU  77          3HD1      LEU  77  -1.742  -6.535  -3.617
  546   HD21  LEU  77          1HD2      LEU  77  -1.859  -6.718  -6.669
  547   HD22  LEU  77          2HD2      LEU  77  -3.554  -6.769  -7.152
  548   HD23  LEU  77          3HD2      LEU  77  -2.887  -8.048  -6.136
  549    HA   PRO  78           HA       PRO  78  -7.651 -10.726  -3.632
  550    HB2  PRO  78           1HB      PRO  78  -5.996 -12.835  -4.059
  551    HB3  PRO  78           2HB      PRO  78  -7.007 -12.135  -5.329
  552    HG2  PRO  78           1HG      PRO  78  -4.100 -11.698  -4.765
  553    HG3  PRO  78           2HG      PRO  78  -4.914 -11.938  -6.322
  554    HD2  PRO  78           1HD      PRO  78  -4.179  -9.491  -5.426
  555    HD3  PRO  78           2HD      PRO  78  -5.616  -9.746  -6.437
  556    H    ALA  79           H        ALA  79  -7.305  -9.749  -1.515
  557    HA   ALA  79           HA       ALA  79  -5.240 -11.147   0.057
  558    HB1  ALA  79           1HB      ALA  79  -4.750  -9.265   1.194
  559    HB2  ALA  79           2HB      ALA  79  -5.416  -8.473  -0.235
  560    HB3  ALA  79           3HB      ALA  79  -6.422  -8.702   1.195
  561    H    SER  80           H        SER  80  -5.824 -11.543   2.340
  562    HA   SER  80           HA       SER  80  -8.350 -12.847   2.505
  563    HB2  SER  80           1HB      SER  80  -6.135 -12.353   4.489
  564    HB3  SER  80           2HB      SER  80  -7.635 -13.154   4.956
  565    HG   SER  80           HG       SER  80  -5.595 -14.338   3.989
  566    H    GLY  81           H        GLY  81 -10.101 -12.394   3.888
  567    HA2  GLY  81           1HA      GLY  81 -11.515 -11.084   5.169
  568    HA3  GLY  81           2HA      GLY  81 -10.191  -9.954   5.409
  569    HA   PRO  82           HA       PRO  82 -13.100  -8.844   1.659
  570    HB2  PRO  82           1HB      PRO  82 -15.573  -8.429   2.698
  571    HB3  PRO  82           2HB      PRO  82 -15.066  -9.978   2.014
  572    HG2  PRO  82           1HG      PRO  82 -15.194  -9.125   4.880
  573    HG3  PRO  82           2HG      PRO  82 -15.689 -10.662   4.147
  574    HD2  PRO  82           1HD      PRO  82 -13.339 -10.363   5.458
  575    HD3  PRO  82           2HD      PRO  82 -13.532 -11.471   4.085
  576    H    SER  83           H        SER  83 -12.458  -7.733   4.784
  577    HA   SER  83           HA       SER  83 -13.673  -5.202   4.786
  578    HB2  SER  83           1HB      SER  83 -12.410  -6.498   6.680
  579    HB3  SER  83           2HB      SER  83 -10.994  -5.646   6.062
  580    HG   SER  83           HG       SER  83 -11.671  -3.972   7.112
  581    H    SER  84           H        SER  84 -12.472  -3.106   4.676
  582    HA   SER  84           HA       SER  84 -10.485  -3.134   2.501
  583    HB2  SER  84           1HB      SER  84 -12.928  -2.315   1.992
  584    HB3  SER  84           2HB      SER  84 -12.398  -0.847   2.814
  585    HG   SER  84           HG       SER  84 -11.429  -0.329   1.037
  586    H    GLY  85           H        GLY  85 -11.841  -1.175   5.148
  587    HA2  GLY  85           1HA      GLY  85 -10.196  -0.504   6.885
  588    HA3  GLY  85           2HA      GLY  85  -9.131  -0.066   5.557
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1 -59.566  10.058   3.187
    2    HA2  GLY   1           1HA      GLY   1 -57.983  10.740   5.327
    3    HA3  GLY   1           2HA      GLY   1 -57.973   8.982   5.306
    4    H    SER   2           H        SER   2 -55.608  10.196   5.013
    5    HA   SER   2           HA       SER   2 -54.803   9.347   2.386
    6    HB2  SER   2           1HB      SER   2 -54.764  12.262   3.143
    7    HB3  SER   2           2HB      SER   2 -53.624  11.606   1.969
    8    HG   SER   2           HG       SER   2 -55.849  10.686   1.138
    9    H    SER   3           H        SER   3 -52.512   9.171   2.163
   10    HA   SER   3           HA       SER   3 -51.014   9.473   4.679
   11    HB2  SER   3           1HB      SER   3 -51.085   7.079   2.837
   12    HB3  SER   3           2HB      SER   3 -49.817   7.325   4.039
   13    HG   SER   3           HG       SER   3 -51.761   7.587   5.519
   14    H    GLY   4           H        GLY   4 -50.516   8.622   1.244
   15    HA2  GLY   4           1HA      GLY   4 -49.314  10.401  -0.065
   16    HA3  GLY   4           2HA      GLY   4 -48.169  10.417   1.268
   17    H    SER   5           H        SER   5 -48.052   9.704  -1.707
   18    HA   SER   5           HA       SER   5 -47.425   6.931  -1.839
   19    HB2  SER   5           1HB      SER   5 -48.098   8.157  -3.840
   20    HB3  SER   5           2HB      SER   5 -46.685   9.203  -3.701
   21    HG   SER   5           HG       SER   5 -46.341   7.519  -5.202
   22    H    SER   6           H        SER   6 -45.288   6.057  -2.368
   23    HA   SER   6           HA       SER   6 -43.131   7.534  -1.006
   24    HB2  SER   6           1HB      SER   6 -44.021   4.702  -0.768
   25    HB3  SER   6           2HB      SER   6 -42.288   5.017  -0.687
   26    HG   SER   6           HG       SER   6 -42.558   5.797   1.238
   27    H    GLY   7           H        GLY   7 -40.913   6.441  -1.615
   28    HA2  GLY   7           1HA      GLY   7 -40.896   5.915  -4.518
   29    HA3  GLY   7           2HA      GLY   7 -39.808   7.100  -3.811
   30    H    GLU   8           H        GLU   8 -38.918   4.915  -5.313
   31    HA   GLU   8           HA       GLU   8 -38.011   2.869  -3.481
   32    HB2  GLU   8           1HB      GLU   8 -37.006   1.827  -5.402
   33    HB3  GLU   8           2HB      GLU   8 -38.620   2.366  -5.843
   34    HG2  GLU   8           1HG      GLU   8 -37.408   4.480  -6.716
   35    HG3  GLU   8           2HG      GLU   8 -35.971   3.459  -6.678
   36    H    LEU   9           H        LEU   9 -35.595   2.263  -3.658
   37    HA   LEU   9           HA       LEU   9 -34.082   4.257  -2.435
   38    HB2  LEU   9           1HB      LEU   9 -33.444   1.638  -3.706
   39    HB3  LEU   9           2HB      LEU   9 -32.122   2.706  -3.242
   40    HG   LEU   9           HG       LEU   9 -33.354   2.698  -0.920
   41   HD11  LEU   9          1HD1      LEU   9 -34.809   1.035  -0.475
   42   HD12  LEU   9          2HD1      LEU   9 -34.022  -0.097  -1.574
   43   HD13  LEU   9          3HD1      LEU   9 -35.116   1.131  -2.210
   44   HD21  LEU   9          1HD2      LEU   9 -31.224   1.910  -0.801
   45   HD22  LEU   9          2HD2      LEU   9 -31.444   0.785  -2.142
   46   HD23  LEU   9          3HD2      LEU   9 -32.089   0.395  -0.546
   47    H    GLU  10           H        GLU  10 -32.202   5.395  -3.164
   48    HA   GLU  10           HA       GLU  10 -32.067   5.809  -6.072
   49    HB2  GLU  10           1HB      GLU  10 -32.233   7.914  -3.920
   50    HB3  GLU  10           2HB      GLU  10 -31.636   8.260  -5.537
   51    HG2  GLU  10           1HG      GLU  10 -33.892   7.197  -6.292
   52    HG3  GLU  10           2HG      GLU  10 -34.392   7.569  -4.643
   53    HA   PRO  11           HA       PRO  11 -27.745   5.189  -5.465
   54    HB2  PRO  11           1HB      PRO  11 -26.867   6.225  -7.816
   55    HB3  PRO  11           2HB      PRO  11 -27.670   4.654  -7.699
   56    HG2  PRO  11           1HG      PRO  11 -28.802   7.305  -8.505
   57    HG3  PRO  11           2HG      PRO  11 -29.065   5.709  -9.232
   58    HD2  PRO  11           1HD      PRO  11 -30.852   6.857  -7.553
   59    HD3  PRO  11           2HD      PRO  11 -30.615   5.100  -7.639
   60    H    GLY  12           H        GLY  12 -28.698   8.352  -6.819
   61    HA2  GLY  12           1HA      GLY  12 -26.516   9.882  -6.363
   62    HA3  GLY  12           2HA      GLY  12 -28.146  10.477  -6.090
   63    H    ALA  13           H        ALA  13 -28.876   8.951  -3.883
   64    HA   ALA  13           HA       ALA  13 -28.226  10.385  -1.724
   65    HB1  ALA  13           1HB      ALA  13 -28.173   7.547  -1.042
   66    HB2  ALA  13           2HB      ALA  13 -29.300   8.813  -0.553
   67    HB3  ALA  13           3HB      ALA  13 -29.509   7.996  -2.102
   68    H    PHE  14           H        PHE  14 -26.358   7.518  -2.731
   69    HA   PHE  14           HA       PHE  14 -24.343   7.835  -0.773
   70    HB2  PHE  14           1HB      PHE  14 -24.609   6.242  -3.292
   71    HB3  PHE  14           2HB      PHE  14 -23.034   6.362  -2.516
   72    HD1  PHE  14           2HD      PHE  14 -22.660   5.399  -0.306
   73    HD2  PHE  14           1HD      PHE  14 -26.396   4.988  -2.306
   74    HE1  PHE  14           2HE      PHE  14 -23.288   3.595   1.244
   75    HE2  PHE  14           1HE      PHE  14 -27.030   3.184  -0.757
   76    HZ   PHE  14           HZ       PHE  14 -25.475   2.484   1.020
   77    H    SER  15           H        SER  15 -22.483   8.966  -0.758
   78    HA   SER  15           HA       SER  15 -21.928  10.656  -3.105
   79    HB2  SER  15           1HB      SER  15 -20.898  12.248  -1.577
   80    HB3  SER  15           2HB      SER  15 -22.531  11.873  -1.025
   81    HG   SER  15           HG       SER  15 -20.165  10.653  -0.037
   82    H    GLU  16           H        GLU  16 -19.593  11.269  -3.354
   83    HA   GLU  16           HA       GLU  16 -17.843   8.999  -2.670
   84    HB2  GLU  16           1HB      GLU  16 -16.717   9.306  -4.833
   85    HB3  GLU  16           2HB      GLU  16 -18.418   8.912  -5.035
   86    HG2  GLU  16           1HG      GLU  16 -18.680  11.521  -5.132
   87    HG3  GLU  16           2HG      GLU  16 -16.980  11.452  -5.591
   88    H    LEU  17           H        LEU  17 -15.474   9.590  -2.877
   89    HA   LEU  17           HA       LEU  17 -15.018  11.989  -1.334
   90    HB2  LEU  17           1HB      LEU  17 -13.195   9.801  -2.307
   91    HB3  LEU  17           2HB      LEU  17 -12.633  11.188  -1.377
   92    HG   LEU  17           HG       LEU  17 -14.682   9.214  -0.379
   93   HD11  LEU  17          1HD1      LEU  17 -11.706   9.200  -0.275
   94   HD12  LEU  17          2HD1      LEU  17 -12.836   7.860  -0.466
   95   HD13  LEU  17          3HD1      LEU  17 -12.616   8.609   1.115
   96   HD21  LEU  17          1HD2      LEU  17 -14.018  11.758   0.502
   97   HD22  LEU  17          2HD2      LEU  17 -13.112  10.680   1.565
   98   HD23  LEU  17          3HD2      LEU  17 -14.862  10.511   1.422
   99    H    TYR  18           H        TYR  18 -13.955  13.811  -1.971
  100    HA   TYR  18           HA       TYR  18 -13.533  14.106  -4.858
  101    HB2  TYR  18           1HB      TYR  18 -14.936  15.833  -4.265
  102    HB3  TYR  18           2HB      TYR  18 -14.250  15.980  -2.651
  103    HD1  TYR  18           1HD      TYR  18 -13.750  16.829  -6.208
  104    HD2  TYR  18           2HD      TYR  18 -12.441  17.470  -2.211
  105    HE1  TYR  18           1HE      TYR  18 -12.405  18.745  -6.962
  106    HE2  TYR  18           2HE      TYR  18 -11.093  19.389  -2.953
  107    HH   TYR  18           HH       TYR  18 -11.118  20.451  -6.339
  108    H    GLN  19           H        GLN  19 -11.982  14.844  -1.749
  109    HA   GLN  19           HA       GLN  19  -9.605  15.912  -2.744
  110    HB2  GLN  19           1HB      GLN  19 -10.204  14.413  -0.197
  111    HB3  GLN  19           2HB      GLN  19  -8.631  15.124  -0.532
  112    HG2  GLN  19           1HG      GLN  19 -10.038  17.289  -0.951
  113    HG3  GLN  19           2HG      GLN  19 -11.231  16.452   0.041
  114   HE21  GLN  19          1HE2      GLN  19 -10.621  15.828   2.182
  115   HE22  GLN  19          2HE2      GLN  19  -9.404  16.712   3.032
  116    H    ARG  20           H        ARG  20  -7.455  14.941  -2.772
  117    HA   ARG  20           HA       ARG  20  -7.510  12.389  -4.134
  118    HB2  ARG  20           1HB      ARG  20  -5.420  14.487  -3.651
  119    HB3  ARG  20           2HB      ARG  20  -4.952  12.888  -4.214
  120    HG2  ARG  20           1HG      ARG  20  -5.173  13.945  -6.212
  121    HG3  ARG  20           2HG      ARG  20  -6.826  13.360  -6.013
  122    HD2  ARG  20           1HD      ARG  20  -6.790  15.698  -6.715
  123    HD3  ARG  20           2HD      ARG  20  -7.493  15.523  -5.108
  124    HE   ARG  20           HE       ARG  20  -4.811  16.046  -4.722
  125   HH11  ARG  20          2HH1      ARG  20  -7.532  17.639  -6.199
  126   HH12  ARG  20          1HH1      ARG  20  -6.939  19.235  -5.876
  127   HH21  ARG  20          2HH2      ARG  20  -4.020  18.142  -4.291
  128   HH22  ARG  20          1HH2      ARG  20  -4.941  19.520  -4.792
  129    H    TYR  21           H        TYR  21  -6.716  10.479  -3.405
  130    HA   TYR  21           HA       TYR  21  -6.308  10.230  -0.557
  131    HB2  TYR  21           1HB      TYR  21  -7.660   8.584  -1.821
  132    HB3  TYR  21           2HB      TYR  21  -6.219   8.108  -2.713
  133    HD1  TYR  21           2HD      TYR  21  -4.165   7.453  -1.115
  134    HD2  TYR  21           1HD      TYR  21  -8.276   7.268  -0.035
  135    HE1  TYR  21           2HE      TYR  21  -3.627   5.803   0.627
  136    HE2  TYR  21           1HE      TYR  21  -7.749   5.619   1.712
  137    HH   TYR  21           HH       TYR  21  -4.420   4.728   2.453
  138    H    ARG  22           H        ARG  22  -4.377  10.708   0.258
  139    HA   ARG  22           HA       ARG  22  -2.005   9.537  -1.016
  140    HB2  ARG  22           1HB      ARG  22  -0.719  11.569  -0.579
  141    HB3  ARG  22           2HB      ARG  22  -2.079  11.905  -1.642
  142    HG2  ARG  22           1HG      ARG  22  -3.287  12.551   0.578
  143    HG3  ARG  22           2HG      ARG  22  -1.640  12.721   1.189
  144    HD2  ARG  22           1HD      ARG  22  -2.673  14.071  -1.300
  145    HD3  ARG  22           2HD      ARG  22  -2.635  14.829   0.292
  146    HE   ARG  22           HE       ARG  22  -0.300  14.937   0.165
  147   HH11  ARG  22          2HH1      ARG  22  -1.694  13.430  -2.647
  148   HH12  ARG  22          1HH1      ARG  22  -0.256  13.583  -3.602
  149   HH21  ARG  22          2HH2      ARG  22   1.598  15.144  -1.082
  150   HH22  ARG  22          1HH2      ARG  22   1.616  14.557  -2.711
  151    H    HIS  23           H        HIS  23  -2.160   7.910   0.604
  152    HA   HIS  23           HA       HIS  23  -0.846   8.673   3.075
  153    HB2  HIS  23           1HB      HIS  23  -3.594   7.427   3.009
  154    HB3  HIS  23           2HB      HIS  23  -2.542   7.329   4.418
  155    HD1  HIS  23           1HD      HIS  23  -5.196   9.293   3.112
  156    HD2  HIS  23           2HD      HIS  23  -1.720  10.135   5.226
  157    HE1  HIS  23           1HE      HIS  23  -5.561  11.564   4.129
  158    HE2  HIS  23           2HE      HIS  23  -3.411  12.089   5.333
  159    H    CYS  24           H        CYS  24   0.739   7.271   3.398
  160    HA   CYS  24           HA       CYS  24   1.185   4.994   1.869
  161    HB2  CYS  24           1HB      CYS  24   3.051   5.949   2.965
  162    HB3  CYS  24           2HB      CYS  24   2.268   5.869   4.540
  163    H    ASP  25           H        ASP  25  -0.158   3.311   1.769
  164    HA   ASP  25           HA       ASP  25  -1.138   2.167   4.302
  165    HB2  ASP  25           1HB      ASP  25  -2.934   3.111   2.864
  166    HB3  ASP  25           2HB      ASP  25  -2.459   1.995   1.586
  167    H    ALA  26           H        ALA  26   1.332   1.676   2.594
  168    HA   ALA  26           HA       ALA  26   1.047  -0.919   1.455
  169    HB1  ALA  26           1HB      ALA  26   3.751  -0.501   2.132
  170    HB2  ALA  26           2HB      ALA  26   2.980  -0.307   0.557
  171    HB3  ALA  26           3HB      ALA  26   3.092   1.066   1.659
  172    HA   PRO  27           HA       PRO  27   1.649  -3.651   4.836
  173    HB2  PRO  27           1HB      PRO  27   3.532  -5.394   3.950
  174    HB3  PRO  27           2HB      PRO  27   1.876  -5.372   3.331
  175    HG2  PRO  27           1HG      PRO  27   4.357  -4.185   2.148
  176    HG3  PRO  27           2HG      PRO  27   3.055  -5.083   1.347
  177    HD2  PRO  27           1HD      PRO  27   3.221  -2.382   1.270
  178    HD3  PRO  27           2HD      PRO  27   1.669  -3.244   1.257
  179    H    ILE  28           H        ILE  28   4.848  -2.881   3.448
  180    HA   ILE  28           HA       ILE  28   5.798  -2.309   6.173
  181    HB   ILE  28           HB       ILE  28   7.379  -3.783   4.062
  182   HG12  ILE  28          1HG1      ILE  28   5.663  -5.212   5.048
  183   HG13  ILE  28          2HG1      ILE  28   7.255  -5.692   5.625
  184   HG21  ILE  28          1HG2      ILE  28   8.594  -2.199   5.651
  185   HG22  ILE  28          2HG2      ILE  28   8.165  -3.339   6.925
  186   HG23  ILE  28          3HG2      ILE  28   9.170  -3.864   5.574
  187   HD11  ILE  28          1HD1      ILE  28   6.499  -5.542   7.693
  188   HD12  ILE  28          2HD1      ILE  28   6.273  -3.808   7.462
  189   HD13  ILE  28          3HD1      ILE  28   4.952  -4.923   7.116
  190    H    CYS  29           H        CYS  29   7.089  -0.547   6.394
  191    HA   CYS  29           HA       CYS  29   7.636   0.995   3.944
  192    HB2  CYS  29           1HB      CYS  29   6.065   1.839   5.905
  193    HB3  CYS  29           2HB      CYS  29   7.602   2.291   6.634
  194    H    LEU  30           H        LEU  30   9.636   1.966   3.667
  195    HA   LEU  30           HA       LEU  30  11.746   1.027   5.498
  196    HB2  LEU  30           1HB      LEU  30  12.106   1.744   2.599
  197    HB3  LEU  30           2HB      LEU  30  13.249   0.922   3.659
  198    HG   LEU  30           HG       LEU  30  10.634  -0.391   3.110
  199   HD11  LEU  30          1HD1      LEU  30  10.932  -0.438   0.913
  200   HD12  LEU  30          2HD1      LEU  30  12.407  -1.365   1.185
  201   HD13  LEU  30          3HD1      LEU  30  12.482   0.392   1.050
  202   HD21  LEU  30          1HD2      LEU  30  12.461  -1.220   4.688
  203   HD22  LEU  30          2HD2      LEU  30  13.388  -1.582   3.232
  204   HD23  LEU  30          3HD2      LEU  30  11.831  -2.367   3.504
  205    H    TYR  31           H        TYR  31  10.517   3.723   3.618
  206    HA   TYR  31           HA       TYR  31  12.583   5.551   3.962
  207    HB2  TYR  31           1HB      TYR  31  10.286   5.681   2.655
  208    HB3  TYR  31           2HB      TYR  31   9.756   6.505   4.118
  209    HD1  TYR  31           2HD      TYR  31  12.509   6.586   1.597
  210    HD2  TYR  31           1HD      TYR  31  10.066   8.794   4.292
  211    HE1  TYR  31           2HE      TYR  31  13.498   8.680   0.768
  212    HE2  TYR  31           1HE      TYR  31  11.048  10.894   3.470
  213    HH   TYR  31           HH       TYR  31  12.238  11.793   1.678
  214    H    GLU  32           H        GLU  32  13.441   6.437   5.711
  215    HA   GLU  32           HA       GLU  32  12.758   5.941   8.309
  216    HB2  GLU  32           1HB      GLU  32  14.020   8.473   7.242
  217    HB3  GLU  32           2HB      GLU  32  14.063   7.944   8.918
  218    HG2  GLU  32           1HG      GLU  32  15.295   6.523   6.569
  219    HG3  GLU  32           2HG      GLU  32  16.151   7.440   7.807
  220    H    GLN  33           H        GLN  33  11.961   8.957   6.575
  221    HA   GLN  33           HA       GLN  33  10.512  10.336   8.343
  222    HB2  GLN  33           1HB      GLN  33  10.810  10.607   5.731
  223    HB3  GLN  33           2HB      GLN  33   9.193   9.916   5.697
  224    HG2  GLN  33           1HG      GLN  33   8.255  11.724   6.797
  225    HG3  GLN  33           2HG      GLN  33   9.803  12.251   7.457
  226   HE21  GLN  33          1HE2      GLN  33   9.669  14.325   6.698
  227   HE22  GLN  33          2HE2      GLN  33   9.760  14.727   5.021
  228    H    GLY  34           H        GLY  34   9.118   7.684   6.406
  229    HA2  GLY  34           1HA      GLY  34   7.360   6.271   6.838
  230    HA3  GLY  34           2HA      GLY  34   7.577   6.662   8.538
  231    H    ARG  35           H        ARG  35   6.524   8.490   5.660
  232    HA   ARG  35           HA       ARG  35   3.888   8.854   6.780
  233    HB2  ARG  35           1HB      ARG  35   3.946  11.119   7.225
  234    HB3  ARG  35           2HB      ARG  35   5.547  10.627   7.760
  235    HG2  ARG  35           1HG      ARG  35   6.395  11.308   5.492
  236    HG3  ARG  35           2HG      ARG  35   4.806  12.020   5.204
  237    HD2  ARG  35           1HD      ARG  35   6.415  12.717   7.638
  238    HD3  ARG  35           2HD      ARG  35   6.682  13.534   6.099
  239    HE   ARG  35           HE       ARG  35   4.662  14.621   6.345
  240   HH11  ARG  35          2HH1      ARG  35   5.000  12.149   8.773
  241   HH12  ARG  35          1HH1      ARG  35   3.642  12.693   9.702
  242   HH21  ARG  35          2HH2      ARG  35   2.873  15.346   7.559
  243   HH22  ARG  35          1HH2      ARG  35   2.432  14.511   9.010
  244    H    ASP  36           H        ASP  36   2.836  10.772   5.282
  245    HA   ASP  36           HA       ASP  36   2.851   9.620   2.649
  246    HB2  ASP  36           1HB      ASP  36   0.758  10.384   3.685
  247    HB3  ASP  36           2HB      ASP  36   1.373  12.034   3.719
  248    H    SER  37           H        SER  37   5.363  10.577   3.127
  249    HA   SER  37           HA       SER  37   5.513  13.057   1.547
  250    HB2  SER  37           1HB      SER  37   7.294  11.888   3.662
  251    HB3  SER  37           2HB      SER  37   7.955  13.012   2.475
  252    HG   SER  37           HG       SER  37   7.016  14.585   3.492
  253    H    PHE  38           H        PHE  38   6.146  12.869  -0.487
  254    HA   PHE  38           HA       PHE  38   8.053  10.763  -1.208
  255    HB2  PHE  38           1HB      PHE  38   5.690  11.368  -2.972
  256    HB3  PHE  38           2HB      PHE  38   6.785   9.992  -3.043
  257    HD1  PHE  38           1HD      PHE  38   4.255  11.574  -0.819
  258    HD2  PHE  38           2HD      PHE  38   6.151   7.985  -2.098
  259    HE1  PHE  38           1HE      PHE  38   2.684  10.262   0.547
  260    HE2  PHE  38           2HE      PHE  38   4.583   6.667  -0.735
  261    HZ   PHE  38           HZ       PHE  38   2.846   7.805   0.589
  262    H    GLU  39           H        GLU  39   8.879  11.118  -3.504
  263    HA   GLU  39           HA       GLU  39   9.306  14.004  -3.894
  264    HB2  GLU  39           1HB      GLU  39  11.226  12.249  -3.373
  265    HB3  GLU  39           2HB      GLU  39  11.123  11.974  -5.106
  266    HG2  GLU  39           1HG      GLU  39  12.806  13.573  -4.831
  267    HG3  GLU  39           2HG      GLU  39  11.394  14.475  -5.380
  268    H    ASP  40           H        ASP  40   9.406  14.829  -6.034
  269    HA   ASP  40           HA       ASP  40   7.394  14.298  -7.728
  270    HB2  ASP  40           1HB      ASP  40   9.394  16.032  -7.852
  271    HB3  ASP  40           2HB      ASP  40  10.018  14.878  -9.028
  272    H    GLU  41           H        GLU  41  10.525  12.647  -7.754
  273    HA   GLU  41           HA       GLU  41   9.292  10.392  -9.120
  274    HB2  GLU  41           1HB      GLU  41  11.529  12.039 -10.257
  275    HB3  GLU  41           2HB      GLU  41  11.404  10.327 -10.636
  276    HG2  GLU  41           1HG      GLU  41   9.195  12.313 -11.098
  277    HG3  GLU  41           2HG      GLU  41  10.380  11.849 -12.318
  278    H    GLY  42           H        GLY  42  10.694   8.465  -9.117
  279    HA2  GLY  42           1HA      GLY  42  12.785   7.470  -8.287
  280    HA3  GLY  42           2HA      GLY  42  12.660   8.558  -6.913
  281    H    ARG  43           H        ARG  43  12.988   5.823  -6.592
  282    HA   ARG  43           HA       ARG  43  10.833   4.181  -6.358
  283    HB2  ARG  43           1HB      ARG  43  11.974   3.147  -4.406
  284    HB3  ARG  43           2HB      ARG  43  13.047   3.423  -5.772
  285    HG2  ARG  43           1HG      ARG  43  13.764   5.551  -4.624
  286    HG3  ARG  43           2HG      ARG  43  12.885   4.975  -3.207
  287    HD2  ARG  43           1HD      ARG  43  15.042   4.238  -2.797
  288    HD3  ARG  43           2HD      ARG  43  14.281   2.820  -3.517
  289    HE   ARG  43           HE       ARG  43  15.608   4.513  -5.423
  290   HH11  ARG  43          2HH1      ARG  43  15.993   1.891  -3.165
  291   HH12  ARG  43          1HH1      ARG  43  17.391   1.243  -3.956
  292   HH21  ARG  43          2HH2      ARG  43  17.447   3.668  -6.474
  293   HH22  ARG  43          1HH2      ARG  43  18.218   2.255  -5.838
  294    H    TRP  44           H        TRP  44  11.717   6.823  -4.197
  295    HA   TRP  44           HA       TRP  44   9.528   6.265  -2.390
  296    HB2  TRP  44           1HB      TRP  44  11.263   8.735  -2.436
  297    HB3  TRP  44           2HB      TRP  44  10.342   8.089  -1.082
  298    HD1  TRP  44           HD       TRP  44  13.761   8.333  -2.141
  299    HE1  TRP  44           1HE      TRP  44  15.234   6.496  -1.102
  300    HE3  TRP  44           3HE      TRP  44  10.089   5.157  -0.537
  301    HZ2  TRP  44           2HZ      TRP  44  14.887   4.027   0.221
  302    HZ3  TRP  44           3HZ      TRP  44  10.744   3.079   0.606
  303    HH2  TRP  44           HH       TRP  44  13.094   2.527   0.976
  304    H    ARG  45           H        ARG  45   8.534   6.603  -4.920
  305    HA   ARG  45           HA       ARG  45   7.425   9.321  -4.964
  306    HB2  ARG  45           1HB      ARG  45   6.815   8.904  -7.260
  307    HB3  ARG  45           2HB      ARG  45   8.505   8.472  -7.034
  308    HG2  ARG  45           1HG      ARG  45   7.829   6.100  -6.840
  309    HG3  ARG  45           2HG      ARG  45   6.169   6.581  -7.197
  310    HD2  ARG  45           1HD      ARG  45   6.851   6.039  -9.301
  311    HD3  ARG  45           2HD      ARG  45   7.342   7.732  -9.274
  312    HE   ARG  45           HE       ARG  45   9.561   7.072  -9.204
  313   HH11  ARG  45          2HH1      ARG  45   7.450   4.320  -8.896
  314   HH12  ARG  45          1HH1      ARG  45   8.711   3.160  -9.155
  315   HH21  ARG  45          2HH2      ARG  45  11.229   5.554  -9.545
  316   HH22  ARG  45          1HH2      ARG  45  10.860   3.863  -9.523
  317    H    LEU  46           H        LEU  46   5.220   9.693  -4.963
  318    HA   LEU  46           HA       LEU  46   3.628   7.820  -3.542
  319    HB2  LEU  46           1HB      LEU  46   3.258  10.164  -3.233
  320    HB3  LEU  46           2HB      LEU  46   2.947  10.392  -4.952
  321    HG   LEU  46           HG       LEU  46   0.908   8.916  -4.636
  322   HD11  LEU  46          1HD1      LEU  46   0.055   8.545  -2.469
  323   HD12  LEU  46          2HD1      LEU  46   1.274   9.582  -1.727
  324   HD13  LEU  46          3HD1      LEU  46   1.741   8.029  -2.420
  325   HD21  LEU  46          1HD2      LEU  46  -0.041  10.918  -4.781
  326   HD22  LEU  46          2HD2      LEU  46   1.353  11.684  -4.018
  327   HD23  LEU  46          3HD2      LEU  46   0.044  11.042  -3.024
  328    H    ILE  47           H        ILE  47   3.206   5.943  -4.583
  329    HA   ILE  47           HA       ILE  47   2.259   6.000  -7.342
  330    HB   ILE  47           HB       ILE  47   2.842   3.654  -5.531
  331   HG12  ILE  47          1HG1      ILE  47   4.416   5.011  -7.717
  332   HG13  ILE  47          2HG1      ILE  47   4.898   4.732  -6.047
  333   HG21  ILE  47          1HG2      ILE  47   2.690   3.296  -8.452
  334   HG22  ILE  47          2HG2      ILE  47   2.163   2.234  -7.148
  335   HG23  ILE  47          3HG2      ILE  47   1.159   3.600  -7.632
  336   HD11  ILE  47          1HD1      ILE  47   6.080   3.235  -7.513
  337   HD12  ILE  47          2HD1      ILE  47   4.963   2.316  -6.503
  338   HD13  ILE  47          3HD1      ILE  47   4.561   2.646  -8.188
  339    H    LEU  48           H        LEU  48   0.167   6.143  -7.771
  340    HA   LEU  48           HA       LEU  48  -1.774   5.405  -5.705
  341    HB2  LEU  48           1HB      LEU  48  -1.950   7.097  -8.181
  342    HB3  LEU  48           2HB      LEU  48  -3.382   6.581  -7.293
  343    HG   LEU  48           HG       LEU  48  -1.150   8.262  -6.153
  344   HD11  LEU  48          1HD1      LEU  48  -2.168   9.724  -7.608
  345   HD12  LEU  48          2HD1      LEU  48  -3.129   9.958  -6.148
  346   HD13  LEU  48          3HD1      LEU  48  -3.745   8.948  -7.456
  347   HD21  LEU  48          1HD2      LEU  48  -3.782   7.303  -5.057
  348   HD22  LEU  48          2HD2      LEU  48  -2.898   8.667  -4.372
  349   HD23  LEU  48          3HD2      LEU  48  -2.167   7.061  -4.390
  350    H    CYS  49           H        CYS  49  -3.198   3.774  -5.940
  351    HA   CYS  49           HA       CYS  49  -2.765   1.620  -7.554
  352    HB2  CYS  49           1HB      CYS  49  -4.288   1.517  -5.669
  353    HB3  CYS  49           2HB      CYS  49  -5.412   2.606  -6.476
  354    H    ALA  50           H        ALA  50  -3.842   0.764  -9.421
  355    HA   ALA  50           HA       ALA  50  -4.547   2.868 -11.344
  356    HB1  ALA  50           1HB      ALA  50  -4.225   0.807 -12.952
  357    HB2  ALA  50           2HB      ALA  50  -2.842   1.712 -12.336
  358    HB3  ALA  50           3HB      ALA  50  -3.296   0.180 -11.590
  359    H    THR  51           H        THR  51  -5.593  -0.336 -10.225
  360    HA   THR  51           HA       THR  51  -7.834  -0.685 -11.798
  361    HB   THR  51           HB       THR  51  -7.441  -1.486  -8.909
  362    HG1  THR  51           1HG      THR  51  -5.966  -2.369 -10.495
  363   HG21  THR  51          1HG2      THR  51  -9.273  -2.960  -9.107
  364   HG22  THR  51          2HG2      THR  51  -9.384  -2.717 -10.851
  365   HG23  THR  51          3HG2      THR  51  -9.848  -1.421  -9.748
  366    H    CYS  52           H        CYS  52  -7.990   0.459  -8.422
  367    HA   CYS  52           HA       CYS  52 -10.454   1.900  -9.103
  368    HB2  CYS  52           1HB      CYS  52 -10.997   1.857  -6.774
  369    HB3  CYS  52           2HB      CYS  52 -10.446   0.242  -7.206
  370    H    GLY  53           H        GLY  53  -7.259   2.334  -7.672
  371    HA2  GLY  53           1HA      GLY  53  -5.967   4.233  -7.495
  372    HA3  GLY  53           2HA      GLY  53  -7.172   5.076  -8.457
  373    H    SER  54           H        SER  54  -7.576   3.445  -5.338
  374    HA   SER  54           HA       SER  54  -8.373   6.044  -4.198
  375    HB2  SER  54           1HB      SER  54 -10.211   4.351  -4.439
  376    HB3  SER  54           2HB      SER  54  -9.331   3.311  -3.318
  377    HG   SER  54           HG       SER  54 -10.197   5.951  -2.734
  378    H    HIS  55           H        HIS  55  -5.738   4.478  -4.290
  379    HA   HIS  55           HA       HIS  55  -5.099   4.897  -1.470
  380    HB2  HIS  55           1HB      HIS  55  -4.728   2.324  -2.977
  381    HB3  HIS  55           2HB      HIS  55  -3.661   2.744  -1.641
  382    HD1  HIS  55           1HD      HIS  55  -4.500   2.276   0.671
  383    HD2  HIS  55           2HD      HIS  55  -7.508   2.053  -2.186
  384    HE1  HIS  55           1HE      HIS  55  -6.511   1.373   1.881
  385    HE2  HIS  55           2HE      HIS  55  -8.293   1.166   0.113
  386    H    GLY  56           H        GLY  56  -2.857   5.269  -1.061
  387    HA2  GLY  56           1HA      GLY  56  -1.122   5.561  -3.399
  388    HA3  GLY  56           2HA      GLY  56  -1.486   7.013  -2.479
  389    H    THR  57           H        THR  57   0.794   4.744  -2.919
  390    HA   THR  57           HA       THR  57   2.015   5.315  -0.339
  391    HB   THR  57           HB       THR  57   0.773   3.165  -0.038
  392    HG1  THR  57           1HG      THR  57   2.847   3.725   1.026
  393   HG21  THR  57          1HG2      THR  57   2.162   1.201  -1.157
  394   HG22  THR  57          2HG2      THR  57   2.445   2.432  -2.387
  395   HG23  THR  57          3HG2      THR  57   0.797   1.954  -1.980
  396    H    HIS  58           H        HIS  58   4.307   4.395  -0.285
  397    HA   HIS  58           HA       HIS  58   5.725   5.369  -2.519
  398    HB2  HIS  58           1HB      HIS  58   6.869   3.503  -0.447
  399    HB3  HIS  58           2HB      HIS  58   7.702   4.760  -1.357
  400    HD2  HIS  58           2HD      HIS  58   7.716   7.236  -0.176
  401    HE1  HIS  58           1HE      HIS  58   5.140   6.284   3.058
  402    HE2  HIS  58           2HE      HIS  58   6.602   8.049   2.012
  403    H    ARG  59           H        ARG  59   7.578   3.910  -3.464
  404    HA   ARG  59           HA       ARG  59   6.237   1.801  -4.908
  405    HB2  ARG  59           1HB      ARG  59   7.865   3.478  -5.915
  406    HB3  ARG  59           2HB      ARG  59   9.144   2.574  -5.116
  407    HG2  ARG  59           1HG      ARG  59   7.229   1.115  -6.867
  408    HG3  ARG  59           2HG      ARG  59   8.503   2.089  -7.604
  409    HD2  ARG  59           1HD      ARG  59   9.254   0.225  -5.415
  410    HD3  ARG  59           2HD      ARG  59   8.862  -0.464  -6.990
  411    HE   ARG  59           HE       ARG  59  10.625   1.523  -7.567
  412   HH11  ARG  59          2HH1      ARG  59  10.669  -1.220  -5.425
  413   HH12  ARG  59          1HH1      ARG  59  12.385  -1.439  -5.529
  414   HH21  ARG  59          2HH2      ARG  59  12.884   1.246  -7.712
  415   HH22  ARG  59          1HH2      ARG  59  13.644  -0.034  -6.830
  416    H    ASP  60           H        ASP  60   9.437   1.856  -3.335
  417    HA   ASP  60           HA       ASP  60   9.683  -0.915  -3.104
  418    HB2  ASP  60           1HB      ASP  60  11.427   1.015  -2.763
  419    HB3  ASP  60           2HB      ASP  60  10.930   0.905  -1.076
  420    H    CYS  61           H        CYS  61   8.046   1.407  -1.091
  421    HA   CYS  61           HA       CYS  61   7.823  -0.093   1.269
  422    HB2  CYS  61           1HB      CYS  61   7.273   2.316   1.088
  423    HB3  CYS  61           2HB      CYS  61   5.845   1.901   0.144
  424    H    SER  62           H        SER  62   5.899  -0.072  -1.679
  425    HA   SER  62           HA       SER  62   3.946  -1.913  -0.604
  426    HB2  SER  62           1HB      SER  62   3.295  -0.179  -2.246
  427    HB3  SER  62           2HB      SER  62   4.333  -0.945  -3.448
  428    HG   SER  62           HG       SER  62   1.873  -1.763  -2.432
  429    H    SER  63           H        SER  63   6.853  -2.635  -0.859
  430    HA   SER  63           HA       SER  63   8.192  -4.330  -1.639
  431    HB2  SER  63           1HB      SER  63   6.323  -5.319  -0.037
  432    HB3  SER  63           2HB      SER  63   5.830  -6.154  -1.509
  433    HG   SER  63           HG       SER  63   8.319  -6.284  -0.170
  434    H    LEU  64           H        LEU  64   7.233  -2.865  -3.777
  435    HA   LEU  64           HA       LEU  64   6.254  -4.752  -5.766
  436    HB2  LEU  64           1HB      LEU  64   6.891  -1.811  -5.934
  437    HB3  LEU  64           2HB      LEU  64   6.251  -2.774  -7.264
  438    HG   LEU  64           HG       LEU  64   4.782  -2.460  -4.658
  439   HD11  LEU  64          1HD1      LEU  64   3.427  -0.745  -5.899
  440   HD12  LEU  64          2HD1      LEU  64   4.723  -0.694  -7.093
  441   HD13  LEU  64          3HD1      LEU  64   5.046  -0.232  -5.422
  442   HD21  LEU  64          1HD2      LEU  64   3.011  -3.441  -5.710
  443   HD22  LEU  64          2HD2      LEU  64   4.334  -4.248  -6.552
  444   HD23  LEU  64          3HD2      LEU  64   3.507  -2.886  -7.309
  445    H    ARG  65           H        ARG  65   7.395  -4.171  -8.060
  446    HA   ARG  65           HA       ARG  65  10.187  -4.958  -7.659
  447    HB2  ARG  65           1HB      ARG  65   8.161  -5.411  -9.781
  448    HB3  ARG  65           2HB      ARG  65   9.835  -5.277 -10.301
  449    HG2  ARG  65           1HG      ARG  65  10.387  -7.048  -8.598
  450    HG3  ARG  65           2HG      ARG  65   8.649  -7.278  -8.401
  451    HD2  ARG  65           1HD      ARG  65   8.713  -7.477 -11.023
  452    HD3  ARG  65           2HD      ARG  65  10.400  -7.897 -10.731
  453    HE   ARG  65           HE       ARG  65   8.810  -9.432  -9.022
  454   HH11  ARG  65          2HH1      ARG  65   9.454  -9.074 -12.424
  455   HH12  ARG  65          1HH1      ARG  65   9.098 -10.727 -12.799
  456   HH21  ARG  65          2HH2      ARG  65   8.339 -11.611  -9.503
  457   HH22  ARG  65          1HH2      ARG  65   8.463 -12.170 -11.136
  458    HA   PRO  66           HA       PRO  66  11.921  -1.237  -9.207
  459    HB2  PRO  66           1HB      PRO  66  13.936  -2.124 -10.796
  460    HB3  PRO  66           2HB      PRO  66  13.986  -2.228  -9.032
  461    HG2  PRO  66           1HG      PRO  66  13.289  -4.341 -11.034
  462    HG3  PRO  66           2HG      PRO  66  14.294  -4.467  -9.579
  463    HD2  PRO  66           1HD      PRO  66  11.721  -5.307  -9.649
  464    HD3  PRO  66           2HD      PRO  66  12.469  -4.646  -8.182
  465    H    ASN  67           H        ASN  67  10.885   0.050 -10.593
  466    HA   ASN  67           HA       ASN  67  10.231   0.986 -12.571
  467    HB2  ASN  67           1HB      ASN  67  12.417  -0.081 -13.407
  468    HB3  ASN  67           2HB      ASN  67  11.398  -1.366 -14.050
  469   HD21  ASN  67          1HD2      ASN  67  11.294   2.183 -13.928
  470   HD22  ASN  67          2HD2      ASN  67  10.953   2.397 -15.608
  471    H    SER  68           H        SER  68   8.609  -0.838 -11.045
  472    HA   SER  68           HA       SER  68   7.214  -2.670 -12.654
  473    HB2  SER  68           1HB      SER  68   7.182  -2.264 -10.054
  474    HB3  SER  68           2HB      SER  68   5.826  -1.204 -10.441
  475    HG   SER  68           HG       SER  68   5.013  -3.122 -11.649
  476    H    LYS  69           H        LYS  69   5.309  -2.521 -13.813
  477    HA   LYS  69           HA       LYS  69   4.848  -0.101 -15.195
  478    HB2  LYS  69           1HB      LYS  69   4.401  -2.293 -16.193
  479    HB3  LYS  69           2HB      LYS  69   3.127  -2.581 -15.017
  480    HG2  LYS  69           1HG      LYS  69   1.774  -0.855 -15.945
  481    HG3  LYS  69           2HG      LYS  69   3.091  -0.307 -16.985
  482    HD2  LYS  69           1HD      LYS  69   1.608  -1.576 -18.346
  483    HD3  LYS  69           2HD      LYS  69   3.038  -2.575 -18.071
  484    HE2  LYS  69           1HE      LYS  69   1.746  -3.611 -16.140
  485    HE3  LYS  69           2HE      LYS  69   0.322  -2.811 -16.801
  486    HZ1  LYS  69           1HZ      LYS  69   1.862  -5.054 -17.878
  487    HZ2  LYS  69           2HZ      LYS  69   1.148  -3.988 -18.980
  488    HZ3  LYS  69           3HZ      LYS  69   0.188  -4.807 -17.853
  489    H    LYS  70           H        LYS  70   2.427  -1.895 -13.296
  490    HA   LYS  70           HA       LYS  70   1.547   0.652 -12.124
  491    HB2  LYS  70           1HB      LYS  70  -0.815  -0.084 -12.417
  492    HB3  LYS  70           2HB      LYS  70   0.014   0.240 -13.934
  493    HG2  LYS  70           1HG      LYS  70   0.183  -2.037 -14.458
  494    HG3  LYS  70           2HG      LYS  70  -0.191  -2.532 -12.805
  495    HD2  LYS  70           1HD      LYS  70  -2.213  -0.934 -14.295
  496    HD3  LYS  70           2HD      LYS  70  -2.005  -2.632 -14.728
  497    HE2  LYS  70           1HE      LYS  70  -2.358  -1.788 -11.872
  498    HE3  LYS  70           2HE      LYS  70  -3.748  -2.019 -12.932
  499    HZ1  LYS  70           1HZ      LYS  70  -2.557  -4.282 -13.401
  500    HZ2  LYS  70           2HZ      LYS  70  -3.544  -4.092 -12.041
  501    HZ3  LYS  70           3HZ      LYS  70  -1.863  -4.001 -11.883
  502    H    TRP  71           H        TRP  71   0.213   0.378 -10.182
  503    HA   TRP  71           HA       TRP  71   0.760  -2.166  -8.799
  504    HB2  TRP  71           1HB      TRP  71   2.221  -0.795  -7.662
  505    HB3  TRP  71           2HB      TRP  71   1.241   0.646  -7.924
  506    HD1  TRP  71           HD       TRP  71   1.226  -2.550  -5.736
  507    HE1  TRP  71           1HE      TRP  71   0.023  -1.996  -3.529
  508    HE3  TRP  71           3HE      TRP  71  -0.245   2.231  -6.791
  509    HZ2  TRP  71           2HZ      TRP  71  -1.366   0.180  -2.387
  510    HZ3  TRP  71           3HZ      TRP  71  -1.507   3.480  -5.088
  511    HH2  TRP  71           HH       TRP  71  -2.056   2.474  -2.932
  512    H    GLU  72           H        GLU  72  -0.786  -2.857  -7.277
  513    HA   GLU  72           HA       GLU  72  -3.399  -1.514  -7.511
  514    HB2  GLU  72           1HB      GLU  72  -2.725  -4.450  -7.374
  515    HB3  GLU  72           2HB      GLU  72  -4.346  -3.838  -7.071
  516    HG2  GLU  72           1HG      GLU  72  -4.709  -3.306  -9.253
  517    HG3  GLU  72           2HG      GLU  72  -3.002  -3.014  -9.582
  518    H    CYS  73           H        CYS  73  -4.607  -1.213  -5.683
  519    HA   CYS  73           HA       CYS  73  -3.189  -1.265  -3.187
  520    HB2  CYS  73           1HB      CYS  73  -5.050  -0.082  -2.283
  521    HB3  CYS  73           2HB      CYS  73  -4.804   0.542  -3.911
  522    H    ASN  74           H        ASN  74  -4.242  -2.141  -1.190
  523    HA   ASN  74           HA       ASN  74  -4.477  -4.890  -1.283
  524    HB2  ASN  74           1HB      ASN  74  -4.013  -3.749   0.797
  525    HB3  ASN  74           2HB      ASN  74  -5.583  -2.952   0.758
  526   HD21  ASN  74          1HD2      ASN  74  -5.867  -3.858   2.879
  527   HD22  ASN  74          2HD2      ASN  74  -6.404  -5.491   3.048
  528    H    GLU  75           H        GLU  75  -7.162  -2.579  -0.839
  529    HA   GLU  75           HA       GLU  75  -9.317  -4.186  -0.799
  530    HB2  GLU  75           1HB      GLU  75  -9.328  -1.676  -0.827
  531    HB3  GLU  75           2HB      GLU  75  -9.171  -1.749  -2.577
  532    HG2  GLU  75           1HG      GLU  75 -11.487  -1.380  -1.776
  533    HG3  GLU  75           2HG      GLU  75 -11.296  -2.801  -2.800
  534    H    CYS  76           H        CYS  76  -7.523  -3.294  -3.720
  535    HA   CYS  76           HA       CYS  76  -9.218  -4.821  -5.459
  536    HB2  CYS  76           1HB      CYS  76  -6.529  -3.505  -5.863
  537    HB3  CYS  76           2HB      CYS  76  -7.383  -4.365  -7.140
  538    H    LEU  77           H        LEU  77  -5.887  -5.221  -4.263
  539    HA   LEU  77           HA       LEU  77  -5.190  -7.579  -5.453
  540    HB2  LEU  77           1HB      LEU  77  -4.621  -6.581  -2.675
  541    HB3  LEU  77           2HB      LEU  77  -3.890  -8.048  -3.324
  542    HG   LEU  77           HG       LEU  77  -3.564  -5.297  -4.520
  543   HD11  LEU  77          1HD1      LEU  77  -2.463  -5.219  -2.441
  544   HD12  LEU  77          2HD1      LEU  77  -1.209  -5.574  -3.629
  545   HD13  LEU  77          3HD1      LEU  77  -1.850  -6.864  -2.613
  546   HD21  LEU  77          1HD2      LEU  77  -3.137  -7.843  -5.602
  547   HD22  LEU  77          2HD2      LEU  77  -1.541  -7.236  -5.162
  548   HD23  LEU  77          3HD2      LEU  77  -2.576  -6.297  -6.239
  549    HA   PRO  78           HA       PRO  78  -7.848 -10.753  -3.986
  550    HB2  PRO  78           1HB      PRO  78  -6.169 -12.884  -4.065
  551    HB3  PRO  78           2HB      PRO  78  -6.834 -12.131  -5.520
  552    HG2  PRO  78           1HG      PRO  78  -4.142 -11.769  -4.260
  553    HG3  PRO  78           2HG      PRO  78  -4.560 -11.952  -5.974
  554    HD2  PRO  78           1HD      PRO  78  -4.029  -9.545  -4.853
  555    HD3  PRO  78           2HD      PRO  78  -5.183  -9.743  -6.188
  556    H    ALA  79           H        ALA  79  -8.212 -10.104  -1.838
  557    HA   ALA  79           HA       ALA  79  -6.310 -10.938   0.207
  558    HB1  ALA  79           1HB      ALA  79  -8.636  -9.887   1.402
  559    HB2  ALA  79           2HB      ALA  79  -7.057  -9.119   1.232
  560    HB3  ALA  79           3HB      ALA  79  -8.287  -8.889  -0.010
  561    H    SER  80           H        SER  80  -6.879 -12.304   1.954
  562    HA   SER  80           HA       SER  80  -8.969 -14.251   1.257
  563    HB2  SER  80           1HB      SER  80  -6.509 -14.954   1.537
  564    HB3  SER  80           2HB      SER  80  -6.766 -14.705   3.264
  565    HG   SER  80           HG       SER  80  -7.490 -16.677   3.196
  566    H    GLY  81           H        GLY  81  -7.572 -12.524   4.035
  567    HA2  GLY  81           1HA      GLY  81  -9.972 -11.787   5.200
  568    HA3  GLY  81           2HA      GLY  81  -9.576 -13.361   5.873
  569    HA   PRO  82           HA       PRO  82  -6.797  -9.720   7.523
  570    HB2  PRO  82           1HB      PRO  82  -8.468  -8.083   8.902
  571    HB3  PRO  82           2HB      PRO  82  -8.032  -7.807   7.211
  572    HG2  PRO  82           1HG      PRO  82 -10.501  -9.058   8.350
  573    HG3  PRO  82           2HG      PRO  82 -10.348  -7.891   7.024
  574    HD2  PRO  82           1HD      PRO  82 -10.705 -10.542   6.599
  575    HD3  PRO  82           2HD      PRO  82  -9.767  -9.516   5.495
  576    H    SER  83           H        SER  83  -5.823 -10.398   9.320
  577    HA   SER  83           HA       SER  83  -7.364 -11.899  11.294
  578    HB2  SER  83           1HB      SER  83  -5.083 -12.488  12.195
  579    HB3  SER  83           2HB      SER  83  -5.376 -13.014  10.537
  580    HG   SER  83           HG       SER  83  -3.717 -10.967  11.495
  581    H    SER  84           H        SER  84  -5.847  -8.846  10.871
  582    HA   SER  84           HA       SER  84  -6.034  -8.290  13.754
  583    HB2  SER  84           1HB      SER  84  -3.821  -7.936  12.531
  584    HB3  SER  84           2HB      SER  84  -4.606  -6.585  11.712
  585    HG   SER  84           HG       SER  84  -5.155  -6.087  14.126
  586    H    GLY  85           H        GLY  85  -8.166  -7.739  13.986
  587    HA2  GLY  85           1HA      GLY  85  -9.567  -6.059  12.159
  588    HA3  GLY  85           2HA      GLY  85 -10.104  -6.517  13.768
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1 -53.133  -7.200  13.886
    2    HA2  GLY   1           1HA      GLY   1 -51.143  -8.002  11.856
    3    HA3  GLY   1           2HA      GLY   1 -52.178  -6.587  11.722
    4    H    SER   2           H        SER   2 -49.790  -5.868  11.275
    5    HA   SER   2           HA       SER   2 -48.963  -4.420  13.645
    6    HB2  SER   2           1HB      SER   2 -47.716  -6.664  13.593
    7    HB3  SER   2           2HB      SER   2 -46.869  -6.025  12.184
    8    HG   SER   2           HG       SER   2 -46.992  -4.688  14.681
    9    H    SER   3           H        SER   3 -46.921  -3.042  13.011
   10    HA   SER   3           HA       SER   3 -47.491  -1.890  10.362
   11    HB2  SER   3           1HB      SER   3 -46.740  -0.674  12.989
   12    HB3  SER   3           2HB      SER   3 -46.245   0.142  11.507
   13    HG   SER   3           HG       SER   3 -48.500   0.454  12.616
   14    H    GLY   4           H        GLY   4 -45.533  -0.617   9.483
   15    HA2  GLY   4           1HA      GLY   4 -43.287  -2.488   9.443
   16    HA3  GLY   4           2HA      GLY   4 -43.582  -1.194   8.291
   17    H    SER   5           H        SER   5 -41.443  -0.459   8.457
   18    HA   SER   5           HA       SER   5 -40.977   1.215  10.806
   19    HB2  SER   5           1HB      SER   5 -39.245  -1.046   9.904
   20    HB3  SER   5           2HB      SER   5 -38.466   0.405  10.537
   21    HG   SER   5           HG       SER   5 -40.245   0.007  12.279
   22    H    SER   6           H        SER   6 -39.270   2.827  10.446
   23    HA   SER   6           HA       SER   6 -39.281   3.696   7.646
   24    HB2  SER   6           1HB      SER   6 -38.653   5.914   8.554
   25    HB3  SER   6           2HB      SER   6 -40.153   5.310   9.257
   26    HG   SER   6           HG       SER   6 -38.982   5.992  10.966
   27    H    GLY   7           H        GLY   7 -37.256   5.000   7.017
   28    HA2  GLY   7           1HA      GLY   7 -34.996   3.220   7.322
   29    HA3  GLY   7           2HA      GLY   7 -35.084   4.630   6.277
   30    H    GLU   8           H        GLU   8 -32.793   4.679   7.239
   31    HA   GLU   8           HA       GLU   8 -32.835   6.639   9.394
   32    HB2  GLU   8           1HB      GLU   8 -31.151   4.130   9.513
   33    HB3  GLU   8           2HB      GLU   8 -31.034   5.486  10.626
   34    HG2  GLU   8           1HG      GLU   8 -32.317   3.963  11.791
   35    HG3  GLU   8           2HG      GLU   8 -33.524   5.041  11.092
   36    H    LEU   9           H        LEU   9 -30.472   7.425   9.777
   37    HA   LEU   9           HA       LEU   9 -29.564   8.655   7.468
   38    HB2  LEU   9           1HB      LEU   9 -27.491   9.125   8.743
   39    HB3  LEU   9           2HB      LEU   9 -28.973   9.519   9.612
   40    HG   LEU   9           HG       LEU   9 -28.660   7.224  10.746
   41   HD11  LEU   9          1HD1      LEU   9 -26.460   7.178   8.999
   42   HD12  LEU   9          2HD1      LEU   9 -26.868   6.016  10.261
   43   HD13  LEU   9          3HD1      LEU   9 -25.807   7.377  10.625
   44   HD21  LEU   9          1HD2      LEU   9 -27.405   9.820  11.245
   45   HD22  LEU   9          2HD2      LEU   9 -26.630   8.472  12.078
   46   HD23  LEU   9          3HD2      LEU   9 -28.349   8.788  12.319
   47    H    GLU  10           H        GLU  10 -27.194   8.431   6.684
   48    HA   GLU  10           HA       GLU  10 -26.959   5.836   5.502
   49    HB2  GLU  10           1HB      GLU  10 -25.368   8.376   5.348
   50    HB3  GLU  10           2HB      GLU  10 -24.735   6.890   4.654
   51    HG2  GLU  10           1HG      GLU  10 -25.773   7.775   2.835
   52    HG3  GLU  10           2HG      GLU  10 -27.087   6.804   3.497
   53    HA   PRO  11           HA       PRO  11 -24.482   4.002   8.683
   54    HB2  PRO  11           1HB      PRO  11 -23.759   1.782   7.298
   55    HB3  PRO  11           2HB      PRO  11 -25.370   1.999   7.992
   56    HG2  PRO  11           1HG      PRO  11 -24.450   2.413   5.173
   57    HG3  PRO  11           2HG      PRO  11 -25.933   1.642   5.764
   58    HD2  PRO  11           1HD      PRO  11 -25.884   4.185   4.836
   59    HD3  PRO  11           2HD      PRO  11 -26.990   3.658   6.121
   60    H    GLY  12           H        GLY  12 -23.224   3.991   5.342
   61    HA2  GLY  12           1HA      GLY  12 -20.489   3.867   6.225
   62    HA3  GLY  12           2HA      GLY  12 -21.044   4.088   4.572
   63    H    ALA  13           H        ALA  13 -21.437   5.980   7.568
   64    HA   ALA  13           HA       ALA  13 -20.819   8.404   6.070
   65    HB1  ALA  13           1HB      ALA  13 -22.023   7.860   8.755
   66    HB2  ALA  13           2HB      ALA  13 -21.406   9.463   8.354
   67    HB3  ALA  13           3HB      ALA  13 -22.696   8.748   7.387
   68    H    PHE  14           H        PHE  14 -18.637   6.689   6.387
   69    HA   PHE  14           HA       PHE  14 -17.040   7.693   8.592
   70    HB2  PHE  14           1HB      PHE  14 -16.128   5.881   6.356
   71    HB3  PHE  14           2HB      PHE  14 -15.399   6.081   7.946
   72    HD1  PHE  14           2HD      PHE  14 -16.906   5.446   9.970
   73    HD2  PHE  14           1HD      PHE  14 -17.569   4.124   5.979
   74    HE1  PHE  14           2HE      PHE  14 -18.241   3.563  10.820
   75    HE2  PHE  14           1HE      PHE  14 -18.907   2.239   6.822
   76    HZ   PHE  14           HZ       PHE  14 -19.244   1.956   9.245
   77    H    SER  15           H        SER  15 -14.689   8.289   7.996
   78    HA   SER  15           HA       SER  15 -14.698  10.718   6.641
   79    HB2  SER  15           1HB      SER  15 -12.981   9.852   8.322
   80    HB3  SER  15           2HB      SER  15 -12.237   9.001   6.968
   81    HG   SER  15           HG       SER  15 -12.381  11.742   7.494
   82    H    GLU  16           H        GLU  16 -13.648  11.358   4.669
   83    HA   GLU  16           HA       GLU  16 -13.162   9.273   2.692
   84    HB2  GLU  16           1HB      GLU  16 -14.692  10.181   1.067
   85    HB3  GLU  16           2HB      GLU  16 -15.582   9.815   2.538
   86    HG2  GLU  16           1HG      GLU  16 -15.241  12.279   3.134
   87    HG3  GLU  16           2HG      GLU  16 -14.796  12.487   1.441
   88    H    LEU  17           H        LEU  17 -12.279  10.192   0.646
   89    HA   LEU  17           HA       LEU  17 -10.245  12.113   1.264
   90    HB2  LEU  17           1HB      LEU  17  -9.500  11.755  -1.029
   91    HB3  LEU  17           2HB      LEU  17  -9.775  10.230  -0.190
   92    HG   LEU  17           HG       LEU  17 -12.100  10.328  -1.386
   93   HD11  LEU  17          1HD1      LEU  17 -12.249  12.296  -2.507
   94   HD12  LEU  17          2HD1      LEU  17 -11.477  11.331  -3.765
   95   HD13  LEU  17          3HD1      LEU  17 -10.508  12.412  -2.764
   96   HD21  LEU  17          1HD2      LEU  17 -10.108   8.748  -1.713
   97   HD22  LEU  17          2HD2      LEU  17  -9.722   9.741  -3.119
   98   HD23  LEU  17          3HD2      LEU  17 -11.269   8.896  -3.033
   99    H    TYR  18           H        TYR  18  -9.919  14.144   0.309
  100    HA   TYR  18           HA       TYR  18 -12.394  15.509  -0.397
  101    HB2  TYR  18           1HB      TYR  18  -9.691  16.376   0.540
  102    HB3  TYR  18           2HB      TYR  18 -10.694  17.528  -0.334
  103    HD1  TYR  18           1HD      TYR  18 -11.353  14.959   2.310
  104    HD2  TYR  18           2HD      TYR  18 -11.722  19.018   1.086
  105    HE1  TYR  18           1HE      TYR  18 -12.567  15.469   4.387
  106    HE2  TYR  18           2HE      TYR  18 -12.936  19.539   3.161
  107    HH   TYR  18           HH       TYR  18 -14.404  17.493   4.995
  108    H    GLN  19           H        GLN  19  -9.044  15.707  -1.610
  109    HA   GLN  19           HA       GLN  19 -10.118  15.716  -4.346
  110    HB2  GLN  19           1HB      GLN  19  -7.978  17.563  -3.275
  111    HB3  GLN  19           2HB      GLN  19  -8.461  17.443  -4.962
  112    HG2  GLN  19           1HG      GLN  19 -10.817  18.023  -4.097
  113    HG3  GLN  19           2HG      GLN  19  -9.978  18.564  -2.644
  114   HE21  GLN  19          1HE2      GLN  19 -10.087  18.968  -6.147
  115   HE22  GLN  19          2HE2      GLN  19  -9.570  20.616  -6.154
  116    H    ARG  20           H        ARG  20  -7.048  15.637  -2.527
  117    HA   ARG  20           HA       ARG  20  -6.118  13.548  -4.384
  118    HB2  ARG  20           1HB      ARG  20  -3.837  14.257  -3.857
  119    HB3  ARG  20           2HB      ARG  20  -4.782  15.598  -4.489
  120    HG2  ARG  20           1HG      ARG  20  -4.656  15.253  -1.545
  121    HG3  ARG  20           2HG      ARG  20  -3.222  15.857  -2.378
  122    HD2  ARG  20           1HD      ARG  20  -5.028  17.428  -3.528
  123    HD3  ARG  20           2HD      ARG  20  -5.892  17.107  -2.025
  124    HE   ARG  20           HE       ARG  20  -4.339  18.371  -0.888
  125   HH11  ARG  20          2HH1      ARG  20  -3.239  17.785  -4.138
  126   HH12  ARG  20          1HH1      ARG  20  -1.934  18.921  -4.041
  127   HH21  ARG  20          2HH2      ARG  20  -2.625  19.869  -0.747
  128   HH22  ARG  20          1HH2      ARG  20  -1.585  20.105  -2.111
  129    H    TYR  21           H        TYR  21  -5.320  11.654  -3.585
  130    HA   TYR  21           HA       TYR  21  -5.498  11.292  -0.666
  131    HB2  TYR  21           1HB      TYR  21  -7.225  10.053  -1.924
  132    HB3  TYR  21           2HB      TYR  21  -5.961   9.229  -2.830
  133    HD1  TYR  21           2HD      TYR  21  -4.211   7.921  -1.380
  134    HD2  TYR  21           1HD      TYR  21  -8.078   9.057  -0.014
  135    HE1  TYR  21           2HE      TYR  21  -4.108   6.173   0.347
  136    HE2  TYR  21           1HE      TYR  21  -7.985   7.313   1.718
  137    HH   TYR  21           HH       TYR  21  -6.853   5.263   2.208
  138    H    ARG  22           H        ARG  22  -3.482  11.339   0.108
  139    HA   ARG  22           HA       ARG  22  -1.508   9.538  -1.111
  140    HB2  ARG  22           1HB      ARG  22   0.259  11.233  -0.586
  141    HB3  ARG  22           2HB      ARG  22  -0.854  11.717  -1.858
  142    HG2  ARG  22           1HG      ARG  22  -2.130  12.966  -0.044
  143    HG3  ARG  22           2HG      ARG  22  -0.708  12.704   0.969
  144    HD2  ARG  22           1HD      ARG  22  -0.391  14.823   0.009
  145    HD3  ARG  22           2HD      ARG  22   0.636  13.737  -0.928
  146    HE   ARG  22           HE       ARG  22  -2.013  14.201  -2.007
  147   HH11  ARG  22          2HH1      ARG  22   1.345  15.121  -1.996
  148   HH12  ARG  22          1HH1      ARG  22   1.279  15.872  -3.556
  149   HH21  ARG  22          2HH2      ARG  22  -2.112  15.187  -4.061
  150   HH22  ARG  22          1HH2      ARG  22  -0.688  15.910  -4.729
  151    H    HIS  23           H        HIS  23  -2.221   8.113   0.610
  152    HA   HIS  23           HA       HIS  23  -0.900   8.757   3.159
  153    HB2  HIS  23           1HB      HIS  23  -3.649   7.630   2.705
  154    HB3  HIS  23           2HB      HIS  23  -2.771   7.283   4.191
  155    HD1  HIS  23           1HD      HIS  23  -5.181   9.539   2.946
  156    HD2  HIS  23           2HD      HIS  23  -1.837   9.943   5.377
  157    HE1  HIS  23           1HE      HIS  23  -5.512  11.699   4.192
  158    HE2  HIS  23           2HE      HIS  23  -3.436  11.964   5.593
  159    H    CYS  24           H        CYS  24   0.818   7.461   3.221
  160    HA   CYS  24           HA       CYS  24   1.344   5.184   1.827
  161    HB2  CYS  24           1HB      CYS  24   3.121   6.106   3.069
  162    HB3  CYS  24           2HB      CYS  24   2.218   6.033   4.579
  163    H    ASP  25           H        ASP  25   0.050   3.480   1.590
  164    HA   ASP  25           HA       ASP  25  -1.067   2.241   4.020
  165    HB2  ASP  25           1HB      ASP  25  -2.993   1.525   2.742
  166    HB3  ASP  25           2HB      ASP  25  -2.804   3.267   2.565
  167    H    ALA  26           H        ALA  26   1.496   1.667   2.944
  168    HA   ALA  26           HA       ALA  26   1.225  -0.848   1.504
  169    HB1  ALA  26           1HB      ALA  26   3.912  -0.430   2.240
  170    HB2  ALA  26           2HB      ALA  26   3.173  -0.221   0.651
  171    HB3  ALA  26           3HB      ALA  26   3.259   1.140   1.770
  172    HA   PRO  27           HA       PRO  27   1.767  -3.611   4.870
  173    HB2  PRO  27           1HB      PRO  27   3.677  -5.336   4.010
  174    HB3  PRO  27           2HB      PRO  27   2.036  -5.316   3.355
  175    HG2  PRO  27           1HG      PRO  27   4.536  -4.106   2.238
  176    HG3  PRO  27           2HG      PRO  27   3.256  -5.003   1.400
  177    HD2  PRO  27           1HD      PRO  27   3.411  -2.300   1.352
  178    HD3  PRO  27           2HD      PRO  27   1.864  -3.169   1.297
  179    H    ILE  28           H        ILE  28   4.966  -2.726   3.560
  180    HA   ILE  28           HA       ILE  28   5.863  -2.221   6.314
  181    HB   ILE  28           HB       ILE  28   7.491  -3.636   4.199
  182   HG12  ILE  28          1HG1      ILE  28   5.780  -5.086   5.190
  183   HG13  ILE  28          2HG1      ILE  28   7.389  -5.566   5.721
  184   HG21  ILE  28          1HG2      ILE  28   9.247  -3.772   5.806
  185   HG22  ILE  28          2HG2      ILE  28   8.747  -2.085   5.707
  186   HG23  ILE  28          3HG2      ILE  28   8.225  -3.080   7.066
  187   HD11  ILE  28          1HD1      ILE  28   6.405  -3.709   7.603
  188   HD12  ILE  28          2HD1      ILE  28   5.123  -4.879   7.285
  189   HD13  ILE  28          3HD1      ILE  28   6.711  -5.433   7.816
  190    H    CYS  29           H        CYS  29   6.944  -0.361   6.595
  191    HA   CYS  29           HA       CYS  29   7.700   1.149   4.180
  192    HB2  CYS  29           1HB      CYS  29   5.805   1.958   5.827
  193    HB3  CYS  29           2HB      CYS  29   7.172   2.508   6.791
  194    H    LEU  30           H        LEU  30   9.778   1.645   3.939
  195    HA   LEU  30           HA       LEU  30  11.587   1.192   6.204
  196    HB2  LEU  30           1HB      LEU  30  12.355   1.553   3.320
  197    HB3  LEU  30           2HB      LEU  30  13.332   0.886   4.626
  198    HG   LEU  30           HG       LEU  30  10.826  -0.535   3.876
  199   HD11  LEU  30          1HD1      LEU  30  12.271  -1.824   2.205
  200   HD12  LEU  30          2HD1      LEU  30  13.315  -0.403   2.208
  201   HD13  LEU  30          3HD1      LEU  30  11.632  -0.259   1.702
  202   HD21  LEU  30          1HD2      LEU  30  13.545  -1.268   4.924
  203   HD22  LEU  30          2HD2      LEU  30  12.408  -2.478   4.329
  204   HD23  LEU  30          3HD2      LEU  30  11.975  -1.461   5.704
  205    H    TYR  31           H        TYR  31  10.537   3.604   3.902
  206    HA   TYR  31           HA       TYR  31  12.523   5.523   4.221
  207    HB2  TYR  31           1HB      TYR  31  10.385   5.441   2.684
  208    HB3  TYR  31           2HB      TYR  31   9.663   6.373   3.991
  209    HD1  TYR  31           2HD      TYR  31  13.068   6.459   2.454
  210    HD2  TYR  31           1HD      TYR  31   9.473   8.571   3.300
  211    HE1  TYR  31           2HE      TYR  31  14.064   8.511   1.535
  212    HE2  TYR  31           1HE      TYR  31  10.458  10.629   2.382
  213    HH   TYR  31           HH       TYR  31  13.610  10.614   0.814
  214    H    GLU  32           H        GLU  32  13.275   6.125   6.156
  215    HA   GLU  32           HA       GLU  32  12.148   6.074   8.609
  216    HB2  GLU  32           1HB      GLU  32  14.482   6.775   8.115
  217    HB3  GLU  32           2HB      GLU  32  13.874   8.345   7.608
  218    HG2  GLU  32           1HG      GLU  32  14.807   8.247   9.927
  219    HG3  GLU  32           2HG      GLU  32  13.170   8.887   9.797
  220    H    GLN  33           H        GLN  33  11.687   8.604   6.189
  221    HA   GLN  33           HA       GLN  33  10.381  10.539   7.606
  222    HB2  GLN  33           1HB      GLN  33  10.894  10.247   5.022
  223    HB3  GLN  33           2HB      GLN  33   9.206   9.754   4.979
  224    HG2  GLN  33           1HG      GLN  33   9.321  12.077   4.477
  225    HG3  GLN  33           2HG      GLN  33   8.610  11.895   6.079
  226   HE21  GLN  33          1HE2      GLN  33  11.877  12.113   4.699
  227   HE22  GLN  33          2HE2      GLN  33  12.453  13.296   5.818
  228    H    GLY  34           H        GLY  34   8.861   7.684   6.107
  229    HA2  GLY  34           1HA      GLY  34   6.805   6.713   6.460
  230    HA3  GLY  34           2HA      GLY  34   7.137   7.049   8.153
  231    H    ARG  35           H        ARG  35   6.010   8.716   5.211
  232    HA   ARG  35           HA       ARG  35   3.611   9.593   6.453
  233    HB2  ARG  35           1HB      ARG  35   4.002  11.890   6.756
  234    HB3  ARG  35           2HB      ARG  35   5.410  11.108   7.463
  235    HG2  ARG  35           1HG      ARG  35   6.518  11.489   5.180
  236    HG3  ARG  35           2HG      ARG  35   5.196  12.622   4.890
  237    HD2  ARG  35           1HD      ARG  35   6.946  12.748   7.334
  238    HD3  ARG  35           2HD      ARG  35   7.338  13.594   5.837
  239    HE   ARG  35           HE       ARG  35   4.854  14.456   6.299
  240   HH11  ARG  35          2HH1      ARG  35   7.615  14.179   8.401
  241   HH12  ARG  35          1HH1      ARG  35   7.152  15.516   9.401
  242   HH21  ARG  35          2HH2      ARG  35   4.234  16.218   7.608
  243   HH22  ARG  35          1HH2      ARG  35   5.228  16.674   8.949
  244    H    ASP  36           H        ASP  36   2.801  11.646   4.982
  245    HA   ASP  36           HA       ASP  36   2.550  10.508   2.360
  246    HB2  ASP  36           1HB      ASP  36   1.163  12.608   1.949
  247    HB3  ASP  36           2HB      ASP  36   0.590  11.526   3.215
  248    H    SER  37           H        SER  37   5.198  11.029   2.728
  249    HA   SER  37           HA       SER  37   5.666  13.346   0.967
  250    HB2  SER  37           1HB      SER  37   7.091  12.437   3.417
  251    HB3  SER  37           2HB      SER  37   8.073  13.095   2.109
  252    HG   SER  37           HG       SER  37   7.494  14.965   2.851
  253    H    PHE  38           H        PHE  38   6.139  12.654  -1.005
  254    HA   PHE  38           HA       PHE  38   7.985  10.380  -1.285
  255    HB2  PHE  38           1HB      PHE  38   5.736  10.923  -3.218
  256    HB3  PHE  38           2HB      PHE  38   6.746   9.486  -3.104
  257    HD1  PHE  38           1HD      PHE  38   4.161  11.427  -1.285
  258    HD2  PHE  38           2HD      PHE  38   6.075   7.663  -1.821
  259    HE1  PHE  38           1HE      PHE  38   2.482  10.370   0.170
  260    HE2  PHE  38           2HE      PHE  38   4.398   6.600  -0.368
  261    HZ   PHE  38           HZ       PHE  38   2.598   7.953   0.629
  262    H    GLU  39           H        GLU  39   8.843  10.313  -3.643
  263    HA   GLU  39           HA       GLU  39   9.594  13.063  -4.387
  264    HB2  GLU  39           1HB      GLU  39  11.138  10.525  -4.227
  265    HB3  GLU  39           2HB      GLU  39  11.555  11.645  -5.516
  266    HG2  GLU  39           1HG      GLU  39  12.909  11.903  -3.453
  267    HG3  GLU  39           2HG      GLU  39  12.071  13.369  -3.960
  268    H    ASP  40           H        ASP  40   8.812  13.750  -6.255
  269    HA   ASP  40           HA       ASP  40   7.184  12.463  -7.988
  270    HB2  ASP  40           1HB      ASP  40   9.028  14.768  -8.261
  271    HB3  ASP  40           2HB      ASP  40   8.434  14.064  -9.763
  272    H    GLU  41           H        GLU  41  10.681  12.269  -7.900
  273    HA   GLU  41           HA       GLU  41  10.548  10.103  -9.879
  274    HB2  GLU  41           1HB      GLU  41  12.680  10.877 -10.858
  275    HB3  GLU  41           2HB      GLU  41  11.381  12.044 -11.068
  276    HG2  GLU  41           1HG      GLU  41  12.313  13.155  -8.950
  277    HG3  GLU  41           2HG      GLU  41  13.751  12.180  -9.248
  278    H    GLY  42           H        GLY  42  11.044   8.337  -8.745
  279    HA2  GLY  42           1HA      GLY  42  13.413   7.485  -7.911
  280    HA3  GLY  42           2HA      GLY  42  12.958   8.499  -6.550
  281    H    ARG  43           H        ARG  43  13.427   5.942  -5.982
  282    HA   ARG  43           HA       ARG  43  11.302   4.137  -6.257
  283    HB2  ARG  43           1HB      ARG  43  12.316   2.951  -4.339
  284    HB3  ARG  43           2HB      ARG  43  13.502   3.399  -5.558
  285    HG2  ARG  43           1HG      ARG  43  14.265   5.241  -4.208
  286    HG3  ARG  43           2HG      ARG  43  12.994   4.938  -3.021
  287    HD2  ARG  43           1HD      ARG  43  14.923   3.969  -2.102
  288    HD3  ARG  43           2HD      ARG  43  14.009   2.617  -2.769
  289    HE   ARG  43           HE       ARG  43  15.669   2.292  -4.335
  290   HH11  ARG  43          2HH1      ARG  43  16.187   5.296  -2.653
  291   HH12  ARG  43          1HH1      ARG  43  17.782   5.529  -3.291
  292   HH21  ARG  43          2HH2      ARG  43  17.766   2.587  -5.180
  293   HH22  ARG  43          1HH2      ARG  43  18.678   3.987  -4.729
  294    H    TRP  44           H        TRP  44  11.910   6.681  -3.913
  295    HA   TRP  44           HA       TRP  44   9.630   5.922  -2.290
  296    HB2  TRP  44           1HB      TRP  44  11.366   8.390  -2.078
  297    HB3  TRP  44           2HB      TRP  44  10.261   7.767  -0.856
  298    HD1  TRP  44           HD       TRP  44  13.788   7.909  -1.454
  299    HE1  TRP  44           1HE      TRP  44  15.057   6.005  -0.275
  300    HE3  TRP  44           3HE      TRP  44   9.845   4.822  -0.422
  301    HZ2  TRP  44           2HZ      TRP  44  14.465   3.522   0.931
  302    HZ3  TRP  44           3HZ      TRP  44  10.282   2.701   0.746
  303    HH2  TRP  44           HH       TRP  44  12.545   2.066   1.407
  304    H    ARG  45           H        ARG  45   8.960   6.494  -4.961
  305    HA   ARG  45           HA       ARG  45   7.787   9.162  -4.950
  306    HB2  ARG  45           1HB      ARG  45   7.201   8.719  -7.267
  307    HB3  ARG  45           2HB      ARG  45   8.896   8.341  -6.993
  308    HG2  ARG  45           1HG      ARG  45   8.275   5.948  -6.789
  309    HG3  ARG  45           2HG      ARG  45   6.621   6.385  -7.220
  310    HD2  ARG  45           1HD      ARG  45   8.998   7.036  -8.947
  311    HD3  ARG  45           2HD      ARG  45   8.076   5.541  -9.106
  312    HE   ARG  45           HE       ARG  45   7.243   8.200  -9.890
  313   HH11  ARG  45          2HH1      ARG  45   6.289   4.921  -9.218
  314   HH12  ARG  45          1HH1      ARG  45   4.821   5.023 -10.131
  315   HH21  ARG  45          2HH2      ARG  45   5.312   8.347 -11.096
  316   HH22  ARG  45          1HH2      ARG  45   4.266   6.972 -11.199
  317    H    LEU  46           H        LEU  46   5.584   9.574  -5.046
  318    HA   LEU  46           HA       LEU  46   3.915   7.722  -3.672
  319    HB2  LEU  46           1HB      LEU  46   3.594  10.072  -3.342
  320    HB3  LEU  46           2HB      LEU  46   3.329  10.326  -5.066
  321    HG   LEU  46           HG       LEU  46   1.257   8.859  -4.790
  322   HD11  LEU  46          1HD1      LEU  46   0.726   9.534  -2.106
  323   HD12  LEU  46          2HD1      LEU  46   2.297   8.736  -2.136
  324   HD13  LEU  46          3HD1      LEU  46   0.885   7.927  -2.815
  325   HD21  LEU  46          1HD2      LEU  46   0.285  10.989  -3.332
  326   HD22  LEU  46          2HD2      LEU  46   0.449  10.915  -5.087
  327   HD23  LEU  46          3HD2      LEU  46   1.725  11.645  -4.111
  328    H    ILE  47           H        ILE  47   2.937   6.024  -4.530
  329    HA   ILE  47           HA       ILE  47   2.179   6.121  -7.376
  330    HB   ILE  47           HB       ILE  47   2.828   3.699  -5.692
  331   HG12  ILE  47          1HG1      ILE  47   4.322   5.008  -7.975
  332   HG13  ILE  47          2HG1      ILE  47   4.817   4.991  -6.286
  333   HG21  ILE  47          1HG2      ILE  47   1.051   3.617  -7.624
  334   HG22  ILE  47          2HG2      ILE  47   2.486   3.607  -8.648
  335   HG23  ILE  47          3HG2      ILE  47   2.252   2.339  -7.445
  336   HD11  ILE  47          1HD1      ILE  47   5.007   2.536  -6.409
  337   HD12  ILE  47          2HD1      ILE  47   4.615   2.621  -8.126
  338   HD13  ILE  47          3HD1      ILE  47   6.089   3.375  -7.520
  339    H    LEU  48           H        LEU  48   0.078   6.131  -7.802
  340    HA   LEU  48           HA       LEU  48  -1.800   5.395  -5.676
  341    HB2  LEU  48           1HB      LEU  48  -2.112   7.010  -8.195
  342    HB3  LEU  48           2HB      LEU  48  -3.474   6.532  -7.184
  343    HG   LEU  48           HG       LEU  48  -1.212   8.059  -5.970
  344   HD11  LEU  48          1HD1      LEU  48  -1.548   9.537  -7.697
  345   HD12  LEU  48          2HD1      LEU  48  -2.739  10.102  -6.526
  346   HD13  LEU  48          3HD1      LEU  48  -3.247   9.101  -7.886
  347   HD21  LEU  48          1HD2      LEU  48  -2.670   8.460  -4.288
  348   HD22  LEU  48          2HD2      LEU  48  -3.429   6.992  -4.904
  349   HD23  LEU  48          3HD2      LEU  48  -4.059   8.573  -5.369
  350    H    CYS  49           H        CYS  49  -3.294   3.800  -5.899
  351    HA   CYS  49           HA       CYS  49  -2.846   1.576  -7.397
  352    HB2  CYS  49           1HB      CYS  49  -4.472   1.641  -5.573
  353    HB3  CYS  49           2HB      CYS  49  -5.543   2.648  -6.541
  354    H    ALA  50           H        ALA  50  -3.995   0.637  -9.233
  355    HA   ALA  50           HA       ALA  50  -4.510   2.667 -11.299
  356    HB1  ALA  50           1HB      ALA  50  -3.712  -0.222 -11.635
  357    HB2  ALA  50           2HB      ALA  50  -3.924   0.957 -12.930
  358    HB3  ALA  50           3HB      ALA  50  -2.629   1.165 -11.751
  359    H    THR  51           H        THR  51  -5.684  -0.436 -10.042
  360    HA   THR  51           HA       THR  51  -7.888  -0.758 -11.715
  361    HB   THR  51           HB       THR  51  -7.658  -1.583  -8.814
  362    HG1  THR  51           1HG      THR  51  -6.822  -3.494  -9.653
  363   HG21  THR  51          1HG2      THR  51  -9.406  -2.699 -11.010
  364   HG22  THR  51          2HG2      THR  51  -9.965  -1.650  -9.708
  365   HG23  THR  51          3HG2      THR  51  -9.334  -3.254  -9.339
  366    H    CYS  52           H        CYS  52  -7.725   0.793  -8.513
  367    HA   CYS  52           HA       CYS  52 -10.326   2.053  -9.082
  368    HB2  CYS  52           1HB      CYS  52 -10.699   2.209  -6.721
  369    HB3  CYS  52           2HB      CYS  52 -10.185   0.561  -7.064
  370    H    GLY  53           H        GLY  53  -7.109   2.640  -7.701
  371    HA2  GLY  53           1HA      GLY  53  -5.805   4.546  -7.825
  372    HA3  GLY  53           2HA      GLY  53  -7.066   5.300  -8.789
  373    H    SER  54           H        SER  54  -6.973   4.007  -5.470
  374    HA   SER  54           HA       SER  54  -7.876   6.651  -4.532
  375    HB2  SER  54           1HB      SER  54  -9.583   4.703  -4.497
  376    HB3  SER  54           2HB      SER  54  -8.630   4.087  -3.147
  377    HG   SER  54           HG       SER  54  -9.415   5.600  -1.910
  378    H    HIS  55           H        HIS  55  -6.200   3.656  -3.637
  379    HA   HIS  55           HA       HIS  55  -5.088   4.762  -1.241
  380    HB2  HIS  55           1HB      HIS  55  -4.531   2.238  -2.798
  381    HB3  HIS  55           2HB      HIS  55  -3.643   2.665  -1.338
  382    HD1  HIS  55           1HD      HIS  55  -4.516   1.311   0.526
  383    HD2  HIS  55           2HD      HIS  55  -7.556   2.575  -2.007
  384    HE1  HIS  55           1HE      HIS  55  -6.647   0.464   1.559
  385    HE2  HIS  55           2HE      HIS  55  -8.465   1.168  -0.036
  386    H    GLY  56           H        GLY  56  -2.829   5.133  -0.837
  387    HA2  GLY  56           1HA      GLY  56  -1.135   5.544  -3.187
  388    HA3  GLY  56           2HA      GLY  56  -1.510   6.956  -2.209
  389    H    THR  57           H        THR  57   0.826   4.798  -2.773
  390    HA   THR  57           HA       THR  57   2.073   5.289  -0.197
  391    HB   THR  57           HB       THR  57   0.787   3.034  -0.144
  392    HG1  THR  57           1HG      THR  57   2.753   3.890   1.161
  393   HG21  THR  57          1HG2      THR  57   1.437   1.346  -1.466
  394   HG22  THR  57          2HG2      THR  57   3.146   1.674  -1.178
  395   HG23  THR  57          3HG2      THR  57   2.275   2.567  -2.423
  396    H    HIS  58           H        HIS  58   4.377   4.387  -0.209
  397    HA   HIS  58           HA       HIS  58   5.717   5.406  -2.491
  398    HB2  HIS  58           1HB      HIS  58   6.980   3.643  -0.400
  399    HB3  HIS  58           2HB      HIS  58   7.733   4.921  -1.348
  400    HD2  HIS  58           2HD      HIS  58   7.760   7.365  -0.140
  401    HE1  HIS  58           1HE      HIS  58   5.101   6.441   3.034
  402    HE2  HIS  58           2HE      HIS  58   6.593   8.195   2.013
  403    H    ARG  59           H        ARG  59   7.458   4.114  -3.630
  404    HA   ARG  59           HA       ARG  59   6.228   1.907  -4.948
  405    HB2  ARG  59           1HB      ARG  59   7.925   3.647  -5.868
  406    HB3  ARG  59           2HB      ARG  59   9.144   2.576  -5.190
  407    HG2  ARG  59           1HG      ARG  59   7.068   1.382  -6.941
  408    HG3  ARG  59           2HG      ARG  59   8.329   2.363  -7.690
  409    HD2  ARG  59           1HD      ARG  59   8.944   0.134  -5.769
  410    HD3  ARG  59           2HD      ARG  59   8.767  -0.136  -7.503
  411    HE   ARG  59           HE       ARG  59  11.024   0.961  -6.179
  412   HH11  ARG  59          2HH1      ARG  59   9.147   1.205  -9.101
  413   HH12  ARG  59          1HH1      ARG  59  10.469   1.788 -10.057
  414   HH21  ARG  59          2HH2      ARG  59  12.773   1.728  -7.427
  415   HH22  ARG  59          1HH2      ARG  59  12.532   2.084  -9.104
  416    H    ASP  60           H        ASP  60   9.425   2.012  -3.375
  417    HA   ASP  60           HA       ASP  60   9.717  -0.746  -3.116
  418    HB2  ASP  60           1HB      ASP  60  11.540   0.944  -2.856
  419    HB3  ASP  60           2HB      ASP  60  10.880   1.353  -1.275
  420    H    CYS  61           H        CYS  61   8.335   1.619  -0.878
  421    HA   CYS  61           HA       CYS  61   8.014   0.114   1.390
  422    HB2  CYS  61           1HB      CYS  61   7.386   2.504   1.168
  423    HB3  CYS  61           2HB      CYS  61   5.966   2.025   0.244
  424    H    SER  62           H        SER  62   6.070   0.041  -1.548
  425    HA   SER  62           HA       SER  62   4.210  -1.878  -0.431
  426    HB2  SER  62           1HB      SER  62   4.428  -0.330  -2.960
  427    HB3  SER  62           2HB      SER  62   3.561  -1.864  -3.035
  428    HG   SER  62           HG       SER  62   2.402  -1.000  -1.107
  429    H    SER  63           H        SER  63   7.039  -2.597  -0.602
  430    HA   SER  63           HA       SER  63   8.455  -4.192  -1.492
  431    HB2  SER  63           1HB      SER  63   6.640  -5.260   0.124
  432    HB3  SER  63           2HB      SER  63   6.155  -6.094  -1.352
  433    HG   SER  63           HG       SER  63   8.052  -7.122  -1.420
  434    H    LEU  64           H        LEU  64   7.265  -2.718  -3.578
  435    HA   LEU  64           HA       LEU  64   6.259  -4.526  -5.574
  436    HB2  LEU  64           1HB      LEU  64   7.056  -1.635  -5.574
  437    HB3  LEU  64           2HB      LEU  64   6.651  -2.475  -7.069
  438    HG   LEU  64           HG       LEU  64   4.792  -2.165  -4.713
  439   HD11  LEU  64          1HD1      LEU  64   3.938  -0.283  -5.614
  440   HD12  LEU  64          2HD1      LEU  64   4.254  -0.799  -7.270
  441   HD13  LEU  64          3HD1      LEU  64   5.560  -0.133  -6.290
  442   HD21  LEU  64          1HD2      LEU  64   4.710  -3.701  -7.197
  443   HD22  LEU  64          2HD2      LEU  64   3.295  -2.679  -6.944
  444   HD23  LEU  64          3HD2      LEU  64   3.753  -3.869  -5.725
  445    H    ARG  65           H        ARG  65   7.436  -4.049  -7.881
  446    HA   ARG  65           HA       ARG  65  10.042  -5.291  -7.567
  447    HB2  ARG  65           1HB      ARG  65   8.154  -4.867  -9.852
  448    HB3  ARG  65           2HB      ARG  65   9.842  -5.230 -10.183
  449    HG2  ARG  65           1HG      ARG  65   9.537  -7.242  -8.648
  450    HG3  ARG  65           2HG      ARG  65   7.805  -6.931  -8.790
  451    HD2  ARG  65           1HD      ARG  65   8.053  -8.379 -10.528
  452    HD3  ARG  65           2HD      ARG  65   8.411  -6.872 -11.370
  453    HE   ARG  65           HE       ARG  65  10.619  -7.517 -11.551
  454   HH11  ARG  65          2HH1      ARG  65   8.897  -9.700  -9.456
  455   HH12  ARG  65          1HH1      ARG  65  10.169 -10.875  -9.418
  456   HH21  ARG  65          2HH2      ARG  65  12.301  -9.057 -11.510
  457   HH22  ARG  65          1HH2      ARG  65  12.105 -10.508 -10.586
  458    HA   PRO  66           HA       PRO  66  12.537  -1.778  -8.389
  459    HB2  PRO  66           1HB      PRO  66  14.498  -2.821  -9.951
  460    HB3  PRO  66           2HB      PRO  66  14.364  -3.161  -8.221
  461    HG2  PRO  66           1HG      PRO  66  13.485  -4.821 -10.553
  462    HG3  PRO  66           2HG      PRO  66  14.310  -5.327  -9.067
  463    HD2  PRO  66           1HD      PRO  66  11.645  -5.640  -9.432
  464    HD3  PRO  66           2HD      PRO  66  12.361  -5.332  -7.837
  465    H    ASN  67           H        ASN  67  10.926  -3.386 -10.926
  466    HA   ASN  67           HA       ASN  67  11.273  -1.034 -12.648
  467    HB2  ASN  67           1HB      ASN  67  11.151  -3.830 -13.772
  468    HB3  ASN  67           2HB      ASN  67  11.582  -2.340 -14.607
  469   HD21  ASN  67          1HD2      ASN  67  13.575  -1.281 -13.937
  470   HD22  ASN  67          2HD2      ASN  67  14.897  -2.256 -13.400
  471    H    SER  68           H        SER  68   9.152  -1.484 -10.894
  472    HA   SER  68           HA       SER  68   6.944  -2.631 -12.358
  473    HB2  SER  68           1HB      SER  68   6.835  -2.924 -10.003
  474    HB3  SER  68           2HB      SER  68   7.162  -1.217  -9.700
  475    HG   SER  68           HG       SER  68   5.106  -0.856  -9.843
  476    H    LYS  69           H        LYS  69   4.939  -1.383 -12.731
  477    HA   LYS  69           HA       LYS  69   5.458   1.445 -13.350
  478    HB2  LYS  69           1HB      LYS  69   4.041  -0.535 -15.144
  479    HB3  LYS  69           2HB      LYS  69   4.193   1.190 -15.452
  480    HG2  LYS  69           1HG      LYS  69   6.759   0.674 -15.234
  481    HG3  LYS  69           2HG      LYS  69   6.236  -0.962 -15.643
  482    HD2  LYS  69           1HD      LYS  69   6.591  -0.137 -17.744
  483    HD3  LYS  69           2HD      LYS  69   4.901   0.325 -17.531
  484    HE2  LYS  69           1HE      LYS  69   5.800   2.535 -16.626
  485    HE3  LYS  69           2HE      LYS  69   7.357   2.040 -17.287
  486    HZ1  LYS  69           1HZ      LYS  69   6.493   3.216 -19.025
  487    HZ2  LYS  69           2HZ      LYS  69   4.893   2.780 -18.694
  488    HZ3  LYS  69           3HZ      LYS  69   5.938   1.669 -19.426
  489    H    LYS  70           H        LYS  70   2.944  -1.052 -13.043
  490    HA   LYS  70           HA       LYS  70   1.184   1.002 -11.873
  491    HB2  LYS  70           1HB      LYS  70  -0.730  -0.300 -12.741
  492    HB3  LYS  70           2HB      LYS  70   0.307   0.307 -14.025
  493    HG2  LYS  70           1HG      LYS  70   1.213  -1.823 -14.443
  494    HG3  LYS  70           2HG      LYS  70   0.568  -2.478 -12.936
  495    HD2  LYS  70           1HD      LYS  70  -1.328  -1.375 -14.954
  496    HD3  LYS  70           2HD      LYS  70  -0.609  -2.962 -15.239
  497    HE2  LYS  70           1HE      LYS  70  -2.437  -3.621 -14.062
  498    HE3  LYS  70           2HE      LYS  70  -1.350  -3.312 -12.709
  499    HZ1  LYS  70           1HZ      LYS  70  -2.479  -0.892 -13.167
  500    HZ2  LYS  70           2HZ      LYS  70  -2.963  -1.986 -11.971
  501    HZ3  LYS  70           3HZ      LYS  70  -3.764  -1.952 -13.461
  502    H    TRP  71           H        TRP  71   0.311   0.587  -9.922
  503    HA   TRP  71           HA       TRP  71   0.675  -2.116  -8.808
  504    HB2  TRP  71           1HB      TRP  71   2.225  -1.031  -7.522
  505    HB3  TRP  71           2HB      TRP  71   1.442   0.535  -7.709
  506    HD1  TRP  71           HD       TRP  71   1.230  -2.673  -5.599
  507    HE1  TRP  71           1HE      TRP  71  -0.034  -2.130  -3.423
  508    HE3  TRP  71           3HE      TRP  71  -0.204   2.117  -6.666
  509    HZ2  TRP  71           2HZ      TRP  71  -1.452   0.041  -2.308
  510    HZ3  TRP  71           3HZ      TRP  71  -1.512   3.357  -4.992
  511    HH2  TRP  71           HH       TRP  71  -2.123   2.339  -2.859
  512    H    GLU  72           H        GLU  72  -0.893  -2.821  -7.302
  513    HA   GLU  72           HA       GLU  72  -3.411  -1.293  -7.400
  514    HB2  GLU  72           1HB      GLU  72  -3.098  -4.292  -7.187
  515    HB3  GLU  72           2HB      GLU  72  -4.611  -3.407  -7.319
  516    HG2  GLU  72           1HG      GLU  72  -4.378  -4.030  -9.479
  517    HG3  GLU  72           2HG      GLU  72  -3.472  -2.519  -9.536
  518    H    CYS  73           H        CYS  73  -4.723  -1.265  -5.548
  519    HA   CYS  73           HA       CYS  73  -3.248  -1.408  -3.073
  520    HB2  CYS  73           1HB      CYS  73  -5.149  -0.335  -2.070
  521    HB3  CYS  73           2HB      CYS  73  -4.847   0.442  -3.621
  522    H    ASN  74           H        ASN  74  -4.373  -2.370  -1.114
  523    HA   ASN  74           HA       ASN  74  -4.583  -5.132  -1.401
  524    HB2  ASN  74           1HB      ASN  74  -4.193  -3.639   0.717
  525    HB3  ASN  74           2HB      ASN  74  -5.946  -3.727   0.869
  526   HD21  ASN  74          1HD2      ASN  74  -6.891  -5.906   0.887
  527   HD22  ASN  74          2HD2      ASN  74  -6.007  -7.174   1.659
  528    H    GLU  75           H        GLU  75  -7.186  -2.761  -0.844
  529    HA   GLU  75           HA       GLU  75  -9.383  -4.349  -0.783
  530    HB2  GLU  75           1HB      GLU  75  -9.599  -1.967  -0.565
  531    HB3  GLU  75           2HB      GLU  75  -9.040  -1.713  -2.213
  532    HG2  GLU  75           1HG      GLU  75 -11.488  -3.341  -1.755
  533    HG3  GLU  75           2HG      GLU  75 -11.581  -1.587  -1.616
  534    H    CYS  76           H        CYS  76  -7.658  -3.313  -3.699
  535    HA   CYS  76           HA       CYS  76  -9.430  -4.731  -5.462
  536    HB2  CYS  76           1HB      CYS  76  -6.756  -3.395  -5.912
  537    HB3  CYS  76           2HB      CYS  76  -7.700  -4.147  -7.194
  538    H    LEU  77           H        LEU  77  -6.135  -5.224  -4.243
  539    HA   LEU  77           HA       LEU  77  -5.438  -7.489  -5.661
  540    HB2  LEU  77           1HB      LEU  77  -4.776  -6.630  -2.859
  541    HB3  LEU  77           2HB      LEU  77  -4.076  -8.071  -3.592
  542    HG   LEU  77           HG       LEU  77  -3.779  -5.295  -4.729
  543   HD11  LEU  77          1HD1      LEU  77  -2.707  -6.074  -2.368
  544   HD12  LEU  77          2HD1      LEU  77  -1.962  -4.914  -3.467
  545   HD13  LEU  77          3HD1      LEU  77  -1.459  -6.604  -3.495
  546   HD21  LEU  77          1HD2      LEU  77  -1.744  -7.240  -5.369
  547   HD22  LEU  77          2HD2      LEU  77  -2.740  -6.257  -6.443
  548   HD23  LEU  77          3HD2      LEU  77  -3.344  -7.805  -5.850
  549    HA   PRO  78           HA       PRO  78  -7.970 -10.793  -4.269
  550    HB2  PRO  78           1HB      PRO  78  -6.227 -12.873  -4.345
  551    HB3  PRO  78           2HB      PRO  78  -6.885 -12.117  -5.801
  552    HG2  PRO  78           1HG      PRO  78  -4.231 -11.696  -4.482
  553    HG3  PRO  78           2HG      PRO  78  -4.609 -11.865  -6.206
  554    HD2  PRO  78           1HD      PRO  78  -4.171  -9.461  -5.039
  555    HD3  PRO  78           2HD      PRO  78  -5.292  -9.672  -6.400
  556    H    ALA  79           H        ALA  79  -5.740  -9.414  -2.340
  557    HA   ALA  79           HA       ALA  79  -5.956 -11.418  -0.202
  558    HB1  ALA  79           1HB      ALA  79  -4.149 -10.212   0.903
  559    HB2  ALA  79           2HB      ALA  79  -3.689 -10.676  -0.736
  560    HB3  ALA  79           3HB      ALA  79  -4.150  -9.010  -0.388
  561    H    SER  80           H        SER  80  -6.593 -10.781   1.910
  562    HA   SER  80           HA       SER  80  -7.787  -8.155   2.259
  563    HB2  SER  80           1HB      SER  80  -9.518  -9.753   1.219
  564    HB3  SER  80           2HB      SER  80  -9.506 -10.576   2.779
  565    HG   SER  80           HG       SER  80 -10.513  -8.083   2.085
  566    H    GLY  81           H        GLY  81  -8.820  -8.054   4.548
  567    HA2  GLY  81           1HA      GLY  81  -6.909  -9.351   6.379
  568    HA3  GLY  81           2HA      GLY  81  -7.726  -7.826   6.685
  569    HA   PRO  82           HA       PRO  82  -9.935 -11.300   8.902
  570    HB2  PRO  82           1HB      PRO  82  -9.812 -10.168  11.367
  571    HB3  PRO  82           2HB      PRO  82  -8.541 -11.216  10.726
  572    HG2  PRO  82           1HG      PRO  82  -8.654  -8.226  10.839
  573    HG3  PRO  82           2HG      PRO  82  -7.296  -9.309  11.197
  574    HD2  PRO  82           1HD      PRO  82  -7.524  -7.987   8.845
  575    HD3  PRO  82           2HD      PRO  82  -6.767  -9.588   8.971
  576    H    SER  83           H        SER  83 -10.142  -7.831   9.725
  577    HA   SER  83           HA       SER  83 -13.019  -7.933   9.174
  578    HB2  SER  83           1HB      SER  83 -12.314  -8.093  11.714
  579    HB3  SER  83           2HB      SER  83 -12.089  -6.352  11.538
  580    HG   SER  83           HG       SER  83 -14.194  -6.731  12.181
  581    H    SER  84           H        SER  84 -13.632  -6.332   7.884
  582    HA   SER  84           HA       SER  84 -11.875  -4.448   6.823
  583    HB2  SER  84           1HB      SER  84 -14.213  -5.284   5.988
  584    HB3  SER  84           2HB      SER  84 -14.825  -3.907   6.904
  585    HG   SER  84           HG       SER  84 -13.075  -2.735   5.643
  586    H    GLY  85           H        GLY  85 -10.842  -3.002   8.064
  587    HA2  GLY  85           1HA      GLY  85 -12.083  -1.759  10.341
  588    HA3  GLY  85           2HA      GLY  85 -10.481  -1.414   9.707
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1 -21.520 -13.595  37.370
    2    HA2  GLY   1           1HA      GLY   1 -21.601 -15.331  35.359
    3    HA3  GLY   1           2HA      GLY   1 -23.318 -15.157  35.690
    4    H    SER   2           H        SER   2 -22.144 -14.499  33.232
    5    HA   SER   2           HA       SER   2 -23.197 -11.923  32.807
    6    HB2  SER   2           1HB      SER   2 -21.039 -10.789  32.151
    7    HB3  SER   2           2HB      SER   2 -21.240 -11.047  33.883
    8    HG   SER   2           HG       SER   2 -19.214 -11.740  33.436
    9    H    SER   3           H        SER   3 -22.625 -11.111  30.544
   10    HA   SER   3           HA       SER   3 -21.486 -12.847  28.636
   11    HB2  SER   3           1HB      SER   3 -24.400 -13.154  29.184
   12    HB3  SER   3           2HB      SER   3 -23.874 -13.199  27.501
   13    HG   SER   3           HG       SER   3 -23.693 -15.262  28.148
   14    H    GLY   4           H        GLY   4 -22.245 -12.182  26.332
   15    HA2  GLY   4           1HA      GLY   4 -23.531  -9.776  25.807
   16    HA3  GLY   4           2HA      GLY   4 -21.845  -9.382  26.107
   17    H    SER   5           H        SER   5 -22.875  -8.777  23.687
   18    HA   SER   5           HA       SER   5 -21.158 -10.173  21.918
   19    HB2  SER   5           1HB      SER   5 -24.037 -10.958  21.986
   20    HB3  SER   5           2HB      SER   5 -23.243 -10.848  20.415
   21    HG   SER   5           HG       SER   5 -21.587 -12.245  21.375
   22    H    SER   6           H        SER   6 -21.077  -9.227  19.825
   23    HA   SER   6           HA       SER   6 -22.812  -6.978  19.243
   24    HB2  SER   6           1HB      SER   6 -20.899  -6.159  20.748
   25    HB3  SER   6           2HB      SER   6 -19.844  -6.464  19.369
   26    HG   SER   6           HG       SER   6 -20.846  -4.270  19.650
   27    H    GLY   7           H        GLY   7 -21.934  -5.860  17.139
   28    HA2  GLY   7           1HA      GLY   7 -20.360  -6.616  15.217
   29    HA3  GLY   7           2HA      GLY   7 -21.368  -8.055  15.268
   30    H    GLU   8           H        GLU   8 -20.883  -5.396  13.536
   31    HA   GLU   8           HA       GLU   8 -23.404  -5.533  12.232
   32    HB2  GLU   8           1HB      GLU   8 -24.186  -3.260  12.668
   33    HB3  GLU   8           2HB      GLU   8 -24.102  -4.189  14.158
   34    HG2  GLU   8           1HG      GLU   8 -22.019  -3.100  14.751
   35    HG3  GLU   8           2HG      GLU   8 -22.033  -2.209  13.230
   36    H    LEU   9           H        LEU   9 -23.283  -4.738  10.186
   37    HA   LEU   9           HA       LEU   9 -21.282  -2.804   9.432
   38    HB2  LEU   9           1HB      LEU   9 -20.458  -4.484   7.617
   39    HB3  LEU   9           2HB      LEU   9 -19.760  -4.501   9.235
   40    HG   LEU   9           HG       LEU   9 -21.596  -6.347   9.646
   41   HD11  LEU   9          1HD1      LEU   9 -21.719  -5.905   6.795
   42   HD12  LEU   9          2HD1      LEU   9 -22.757  -6.885   7.830
   43   HD13  LEU   9          3HD1      LEU   9 -21.271  -7.569   7.172
   44   HD21  LEU   9          1HD2      LEU   9 -19.890  -8.034   8.751
   45   HD22  LEU   9          2HD2      LEU   9 -19.349  -6.893   9.982
   46   HD23  LEU   9          3HD2      LEU   9 -18.934  -6.625   8.289
   47    H    GLU  10           H        GLU  10 -21.658  -1.887   7.409
   48    HA   GLU  10           HA       GLU  10 -24.166  -2.733   6.114
   49    HB2  GLU  10           1HB      GLU  10 -22.998   0.023   6.490
   50    HB3  GLU  10           2HB      GLU  10 -24.307  -0.313   5.366
   51    HG2  GLU  10           1HG      GLU  10 -24.522  -1.069   8.252
   52    HG3  GLU  10           2HG      GLU  10 -24.881   0.568   7.706
   53    HA   PRO  11           HA       PRO  11 -21.423  -3.554   2.686
   54    HB2  PRO  11           1HB      PRO  11 -23.355  -4.508   1.034
   55    HB3  PRO  11           2HB      PRO  11 -22.657  -5.462   2.349
   56    HG2  PRO  11           1HG      PRO  11 -25.234  -3.940   2.273
   57    HG3  PRO  11           2HG      PRO  11 -24.907  -5.554   2.930
   58    HD2  PRO  11           1HD      PRO  11 -25.094  -3.354   4.497
   59    HD3  PRO  11           2HD      PRO  11 -24.025  -4.716   4.888
   60    H    GLY  12           H        GLY  12 -21.146  -2.772   0.524
   61    HA2  GLY  12           1HA      GLY  12 -21.052  -0.994  -0.941
   62    HA3  GLY  12           2HA      GLY  12 -22.794  -1.217  -0.994
   63    H    ALA  13           H        ALA  13 -20.441   0.130   1.327
   64    HA   ALA  13           HA       ALA  13 -22.130   2.542   1.464
   65    HB1  ALA  13           1HB      ALA  13 -20.732   1.119   3.721
   66    HB2  ALA  13           2HB      ALA  13 -21.432   2.733   3.856
   67    HB3  ALA  13           3HB      ALA  13 -22.467   1.349   3.505
   68    H    PHE  14           H        PHE  14 -19.869   2.114  -0.251
   69    HA   PHE  14           HA       PHE  14 -17.802   3.804   0.969
   70    HB2  PHE  14           1HB      PHE  14 -17.796   1.912  -1.368
   71    HB3  PHE  14           2HB      PHE  14 -16.535   3.127  -1.185
   72    HD1  PHE  14           1HD      PHE  14 -18.168   0.288   0.559
   73    HD2  PHE  14           2HD      PHE  14 -14.700   2.727   0.186
   74    HE1  PHE  14           1HE      PHE  14 -16.951  -1.214   2.082
   75    HE2  PHE  14           2HE      PHE  14 -13.478   1.229   1.707
   76    HZ   PHE  14           HZ       PHE  14 -14.603  -0.745   2.657
   77    H    SER  15           H        SER  15 -16.720   5.339  -0.637
   78    HA   SER  15           HA       SER  15 -18.582   6.486  -2.570
   79    HB2  SER  15           1HB      SER  15 -18.240   8.770  -1.621
   80    HB3  SER  15           2HB      SER  15 -19.130   7.696  -0.542
   81    HG   SER  15           HG       SER  15 -16.333   8.128  -0.374
   82    H    GLU  16           H        GLU  16 -17.462   8.469  -3.648
   83    HA   GLU  16           HA       GLU  16 -14.861   7.529  -4.536
   84    HB2  GLU  16           1HB      GLU  16 -15.090   9.103  -6.344
   85    HB3  GLU  16           2HB      GLU  16 -16.608   8.236  -6.160
   86    HG2  GLU  16           1HG      GLU  16 -17.345  10.235  -4.732
   87    HG3  GLU  16           2HG      GLU  16 -15.967  11.070  -5.447
   88    H    LEU  17           H        LEU  17 -13.212   9.327  -5.045
   89    HA   LEU  17           HA       LEU  17 -13.059  11.173  -2.753
   90    HB2  LEU  17           1HB      LEU  17 -10.792   9.670  -4.054
   91    HB3  LEU  17           2HB      LEU  17 -10.630  10.846  -2.752
   92    HG   LEU  17           HG       LEU  17 -12.242   8.333  -2.417
   93   HD11  LEU  17          1HD1      LEU  17  -9.774   8.024  -1.126
   94   HD12  LEU  17          2HD1      LEU  17  -9.404   8.532  -2.774
   95   HD13  LEU  17          3HD1      LEU  17 -10.400   7.103  -2.495
   96   HD21  LEU  17          1HD2      LEU  17 -11.061  10.415  -0.617
   97   HD22  LEU  17          2HD2      LEU  17 -11.423   8.798  -0.014
   98   HD23  LEU  17          3HD2      LEU  17 -12.713   9.800  -0.679
   99    H    TYR  18           H        TYR  18 -13.122  13.213  -3.395
  100    HA   TYR  18           HA       TYR  18 -12.597  13.941  -6.131
  101    HB2  TYR  18           1HB      TYR  18 -14.360  15.176  -5.270
  102    HB3  TYR  18           2HB      TYR  18 -13.593  15.372  -3.698
  103    HD1  TYR  18           1HD      TYR  18 -12.977  16.325  -7.264
  104    HD2  TYR  18           2HD      TYR  18 -12.809  17.473  -3.170
  105    HE1  TYR  18           1HE      TYR  18 -12.202  18.563  -7.929
  106    HE2  TYR  18           2HE      TYR  18 -12.035  19.714  -3.824
  107    HH   TYR  18           HH       TYR  18 -11.536  21.072  -5.502
  108    H    GLN  19           H        GLN  19 -11.198  14.825  -2.977
  109    HA   GLN  19           HA       GLN  19  -9.047  16.302  -4.121
  110    HB2  GLN  19           1HB      GLN  19  -9.472  15.191  -1.346
  111    HB3  GLN  19           2HB      GLN  19  -8.108  16.207  -1.792
  112    HG2  GLN  19           1HG      GLN  19  -9.893  17.884  -2.579
  113    HG3  GLN  19           2HG      GLN  19 -11.005  16.922  -1.607
  114   HE21  GLN  19          1HE2      GLN  19 -11.306  17.678   0.350
  115   HE22  GLN  19          2HE2      GLN  19 -10.156  18.546   1.302
  116    H    ARG  20           H        ARG  20  -6.728  15.735  -3.635
  117    HA   ARG  20           HA       ARG  20  -6.143  13.192  -4.799
  118    HB2  ARG  20           1HB      ARG  20  -4.500  15.486  -3.786
  119    HB3  ARG  20           2HB      ARG  20  -3.724  13.956  -4.170
  120    HG2  ARG  20           1HG      ARG  20  -3.497  14.994  -6.173
  121    HG3  ARG  20           2HG      ARG  20  -5.079  14.253  -6.423
  122    HD2  ARG  20           1HD      ARG  20  -6.170  16.332  -5.777
  123    HD3  ARG  20           2HD      ARG  20  -4.600  17.074  -5.468
  124    HE   ARG  20           HE       ARG  20  -5.869  16.716  -8.010
  125   HH11  ARG  20          2HH1      ARG  20  -2.803  17.008  -6.386
  126   HH12  ARG  20          1HH1      ARG  20  -1.971  17.600  -7.786
  127   HH21  ARG  20          2HH2      ARG  20  -4.783  17.494  -9.860
  128   HH22  ARG  20          1HH2      ARG  20  -3.098  17.877  -9.760
  129    H    TYR  21           H        TYR  21  -5.378  11.355  -3.875
  130    HA   TYR  21           HA       TYR  21  -5.559  11.194  -0.965
  131    HB2  TYR  21           1HB      TYR  21  -6.791   9.565  -2.409
  132    HB3  TYR  21           2HB      TYR  21  -5.239   8.949  -2.966
  133    HD1  TYR  21           1HD      TYR  21  -7.583   9.106  -0.158
  134    HD2  TYR  21           2HD      TYR  21  -3.830   7.616  -1.500
  135    HE1  TYR  21           1HE      TYR  21  -7.517   7.564   1.757
  136    HE2  TYR  21           2HE      TYR  21  -3.754   6.069   0.411
  137    HH   TYR  21           HH       TYR  21  -4.677   5.679   2.501
  138    H    ARG  22           H        ARG  22  -3.781  11.383   0.209
  139    HA   ARG  22           HA       ARG  22  -1.279  10.227  -0.805
  140    HB2  ARG  22           1HB      ARG  22  -1.497  12.919   0.555
  141    HB3  ARG  22           2HB      ARG  22  -0.014  12.149   0.008
  142    HG2  ARG  22           1HG      ARG  22  -0.590  12.427  -2.263
  143    HG3  ARG  22           2HG      ARG  22  -2.255  12.852  -1.862
  144    HD2  ARG  22           1HD      ARG  22  -0.957  14.826  -2.484
  145    HD3  ARG  22           2HD      ARG  22  -1.487  14.909  -0.804
  146    HE   ARG  22           HE       ARG  22   1.157  13.821  -1.158
  147   HH11  ARG  22          2HH1      ARG  22  -0.735  16.711  -0.727
  148   HH12  ARG  22          1HH1      ARG  22   0.582  17.633  -0.081
  149   HH21  ARG  22          2HH2      ARG  22   2.898  15.024  -0.308
  150   HH22  ARG  22          1HH2      ARG  22   2.648  16.673   0.156
  151    H    HIS  23           H        HIS  23  -1.656   8.463   0.594
  152    HA   HIS  23           HA       HIS  23  -0.741   8.935   3.300
  153    HB2  HIS  23           1HB      HIS  23  -3.305   9.125   3.261
  154    HB3  HIS  23           2HB      HIS  23  -3.304   7.391   2.955
  155    HD1  HIS  23           1HD      HIS  23  -4.526   7.105   5.268
  156    HD2  HIS  23           2HD      HIS  23  -0.663   8.616   5.491
  157    HE1  HIS  23           1HE      HIS  23  -3.854   6.878   7.680
  158    HE2  HIS  23           2HE      HIS  23  -1.545   7.877   7.807
  159    H    CYS  24           H        CYS  24   0.875   7.538   3.476
  160    HA   CYS  24           HA       CYS  24   1.256   5.282   1.866
  161    HB2  CYS  24           1HB      CYS  24   3.152   6.271   2.933
  162    HB3  CYS  24           2HB      CYS  24   2.442   6.060   4.531
  163    H    ASP  25           H        ASP  25  -0.132   3.632   1.808
  164    HA   ASP  25           HA       ASP  25  -1.045   2.496   4.370
  165    HB2  ASP  25           1HB      ASP  25  -2.895   3.393   3.037
  166    HB3  ASP  25           2HB      ASP  25  -2.404   2.400   1.668
  167    H    ALA  26           H        ALA  26   1.428   1.953   2.782
  168    HA   ALA  26           HA       ALA  26   1.125  -0.629   1.596
  169    HB1  ALA  26           1HB      ALA  26   3.825  -0.185   2.364
  170    HB2  ALA  26           2HB      ALA  26   3.108  -0.104   0.754
  171    HB3  ALA  26           3HB      ALA  26   3.158   1.337   1.770
  172    HA   PRO  27           HA       PRO  27   1.632  -3.372   4.983
  173    HB2  PRO  27           1HB      PRO  27   3.497  -5.146   4.120
  174    HB3  PRO  27           2HB      PRO  27   1.850  -5.096   3.480
  175    HG2  PRO  27           1HG      PRO  27   4.365  -3.949   2.330
  176    HG3  PRO  27           2HG      PRO  27   3.058  -4.825   1.511
  177    HD2  PRO  27           1HD      PRO  27   3.271  -2.126   1.440
  178    HD3  PRO  27           2HD      PRO  27   1.705  -2.962   1.406
  179    H    ILE  28           H        ILE  28   4.773  -2.369   3.647
  180    HA   ILE  28           HA       ILE  28   5.716  -1.882   6.374
  181    HB   ILE  28           HB       ILE  28   7.327  -3.432   4.343
  182   HG12  ILE  28          1HG1      ILE  28   5.470  -4.729   5.387
  183   HG13  ILE  28          2HG1      ILE  28   7.067  -5.344   5.800
  184   HG21  ILE  28          1HG2      ILE  28   8.399  -1.794   6.102
  185   HG22  ILE  28          2HG2      ILE  28   8.102  -3.140   7.200
  186   HG23  ILE  28          3HG2      ILE  28   9.113  -3.372   5.774
  187   HD11  ILE  28          1HD1      ILE  28   5.024  -4.759   7.553
  188   HD12  ILE  28          2HD1      ILE  28   6.716  -5.035   7.967
  189   HD13  ILE  28          3HD1      ILE  28   6.126  -3.392   7.717
  190    H    CYS  29           H        CYS  29   7.047  -0.144   6.576
  191    HA   CYS  29           HA       CYS  29   7.798   1.252   4.091
  192    HB2  CYS  29           1HB      CYS  29   5.942   2.237   5.664
  193    HB3  CYS  29           2HB      CYS  29   7.314   2.733   6.649
  194    H    LEU  30           H        LEU  30   9.895   1.643   3.829
  195    HA   LEU  30           HA       LEU  30  11.699   1.140   6.078
  196    HB2  LEU  30           1HB      LEU  30  12.623   1.633   3.283
  197    HB3  LEU  30           2HB      LEU  30  13.359   0.649   4.546
  198    HG   LEU  30           HG       LEU  30  10.745  -0.238   3.443
  199   HD11  LEU  30          1HD1      LEU  30  12.925   0.350   1.746
  200   HD12  LEU  30          2HD1      LEU  30  11.429  -0.497   1.353
  201   HD13  LEU  30          3HD1      LEU  30  12.837  -1.405   1.903
  202   HD21  LEU  30          1HD2      LEU  30  13.252  -1.559   4.458
  203   HD22  LEU  30          2HD2      LEU  30  11.927  -2.449   3.707
  204   HD23  LEU  30          3HD2      LEU  30  11.651  -1.547   5.198
  205    H    TYR  31           H        TYR  31  10.700   3.642   3.850
  206    HA   TYR  31           HA       TYR  31  12.739   5.496   4.193
  207    HB2  TYR  31           1HB      TYR  31  10.548   5.510   2.711
  208    HB3  TYR  31           2HB      TYR  31   9.913   6.456   4.053
  209    HD1  TYR  31           2HD      TYR  31  13.292   6.422   2.466
  210    HD2  TYR  31           1HD      TYR  31   9.776   8.655   3.335
  211    HE1  TYR  31           2HE      TYR  31  14.351   8.439   1.540
  212    HE2  TYR  31           1HE      TYR  31  10.825  10.678   2.410
  213    HH   TYR  31           HH       TYR  31  12.561  11.432   1.131
  214    H    GLU  32           H        GLU  32  13.527   6.278   6.024
  215    HA   GLU  32           HA       GLU  32  12.511   6.098   8.546
  216    HB2  GLU  32           1HB      GLU  32  14.775   6.815   8.205
  217    HB3  GLU  32           2HB      GLU  32  14.247   8.267   7.367
  218    HG2  GLU  32           1HG      GLU  32  14.919   8.940   9.520
  219    HG3  GLU  32           2HG      GLU  32  13.156   8.984   9.511
  220    H    GLN  33           H        GLN  33  11.830   8.595   6.157
  221    HA   GLN  33           HA       GLN  33  10.526  10.470   7.703
  222    HB2  GLN  33           1HB      GLN  33  11.037  10.353   5.121
  223    HB3  GLN  33           2HB      GLN  33   9.386   9.753   5.035
  224    HG2  GLN  33           1HG      GLN  33   9.321  12.091   4.656
  225    HG3  GLN  33           2HG      GLN  33   8.658  11.795   6.263
  226   HE21  GLN  33          1HE2      GLN  33   9.406  12.999   7.853
  227   HE22  GLN  33          2HE2      GLN  33  10.883  13.895   7.841
  228    H    GLY  34           H        GLY  34   9.070   7.658   6.063
  229    HA2  GLY  34           1HA      GLY  34   7.075   6.573   6.412
  230    HA3  GLY  34           2HA      GLY  34   7.368   6.910   8.112
  231    H    ARG  35           H        ARG  35   6.488   8.886   5.275
  232    HA   ARG  35           HA       ARG  35   3.939   9.555   6.453
  233    HB2  ARG  35           1HB      ARG  35   4.279  11.795   6.913
  234    HB3  ARG  35           2HB      ARG  35   5.809  11.098   7.428
  235    HG2  ARG  35           1HG      ARG  35   6.717  11.691   5.156
  236    HG3  ARG  35           2HG      ARG  35   5.230  12.606   4.896
  237    HD2  ARG  35           1HD      ARG  35   6.910  13.062   7.334
  238    HD3  ARG  35           2HD      ARG  35   7.318  13.832   5.801
  239    HE   ARG  35           HE       ARG  35   5.486  15.210   6.029
  240   HH11  ARG  35          2HH1      ARG  35   5.376  12.681   8.418
  241   HH12  ARG  35          1HH1      ARG  35   4.087  13.408   9.318
  242   HH21  ARG  35          2HH2      ARG  35   3.788  16.178   7.205
  243   HH22  ARG  35          1HH2      ARG  35   3.183  15.396   8.627
  244    H    ASP  36           H        ASP  36   3.102  11.608   4.998
  245    HA   ASP  36           HA       ASP  36   2.898  10.498   2.362
  246    HB2  ASP  36           1HB      ASP  36   1.465  12.546   1.948
  247    HB3  ASP  36           2HB      ASP  36   0.922  11.489   3.248
  248    H    SER  37           H        SER  37   5.534  11.053   2.763
  249    HA   SER  37           HA       SER  37   5.996  13.435   1.089
  250    HB2  SER  37           1HB      SER  37   7.546  12.289   3.383
  251    HB3  SER  37           2HB      SER  37   8.400  13.183   2.125
  252    HG   SER  37           HG       SER  37   7.799  14.650   3.668
  253    H    PHE  38           H        PHE  38   6.469  12.902  -0.928
  254    HA   PHE  38           HA       PHE  38   8.266  10.625  -1.400
  255    HB2  PHE  38           1HB      PHE  38   5.937  11.258  -3.209
  256    HB3  PHE  38           2HB      PHE  38   6.963   9.827  -3.224
  257    HD1  PHE  38           1HD      PHE  38   4.434  11.628  -1.196
  258    HD2  PHE  38           2HD      PHE  38   6.371   7.927  -2.013
  259    HE1  PHE  38           1HE      PHE  38   2.828  10.469   0.264
  260    HE2  PHE  38           2HE      PHE  38   4.767   6.762  -0.556
  261    HZ   PHE  38           HZ       PHE  38   2.992   8.032   0.584
  262    H    GLU  39           H        GLU  39   9.402  10.720  -3.464
  263    HA   GLU  39           HA       GLU  39  10.017  13.492  -4.174
  264    HB2  GLU  39           1HB      GLU  39  11.837  11.906  -3.467
  265    HB3  GLU  39           2HB      GLU  39  11.532  10.994  -4.939
  266    HG2  GLU  39           1HG      GLU  39  12.466  12.575  -6.284
  267    HG3  GLU  39           2HG      GLU  39  12.067  13.900  -5.193
  268    H    ASP  40           H        ASP  40  10.625  13.858  -6.515
  269    HA   ASP  40           HA       ASP  40   8.397  13.378  -8.153
  270    HB2  ASP  40           1HB      ASP  40  10.338  15.177  -8.271
  271    HB3  ASP  40           2HB      ASP  40  11.044  14.009  -9.384
  272    H    GLU  41           H        GLU  41  11.513  11.755  -7.903
  273    HA   GLU  41           HA       GLU  41  10.415   9.500  -9.389
  274    HB2  GLU  41           1HB      GLU  41  12.808  11.104 -10.219
  275    HB3  GLU  41           2HB      GLU  41  12.735   9.385 -10.581
  276    HG2  GLU  41           1HG      GLU  41  10.956   9.628 -12.033
  277    HG3  GLU  41           2HG      GLU  41  10.462  11.168 -11.332
  278    H    GLY  42           H        GLY  42  12.421   7.788  -9.502
  279    HA2  GLY  42           1HA      GLY  42  14.248   6.860  -8.230
  280    HA3  GLY  42           2HA      GLY  42  13.654   7.734  -6.826
  281    H    ARG  43           H        ARG  43  13.237   6.156  -5.393
  282    HA   ARG  43           HA       ARG  43  11.333   4.067  -6.226
  283    HB2  ARG  43           1HB      ARG  43  12.459   2.610  -4.482
  284    HB3  ARG  43           2HB      ARG  43  13.389   2.926  -5.941
  285    HG2  ARG  43           1HG      ARG  43  15.013   3.304  -4.414
  286    HG3  ARG  43           2HG      ARG  43  14.311   4.923  -4.452
  287    HD2  ARG  43           1HD      ARG  43  13.315   4.688  -2.404
  288    HD3  ARG  43           2HD      ARG  43  13.172   2.937  -2.555
  289    HE   ARG  43           HE       ARG  43  15.443   4.426  -1.543
  290   HH11  ARG  43          2HH1      ARG  43  14.224   1.382  -2.713
  291   HH12  ARG  43          1HH1      ARG  43  15.477   0.445  -1.969
  292   HH21  ARG  43          2HH2      ARG  43  17.098   3.204  -0.558
  293   HH22  ARG  43          1HH2      ARG  43  17.111   1.482  -0.743
  294    H    TRP  44           H        TRP  44  11.375   6.786  -4.664
  295    HA   TRP  44           HA       TRP  44   9.706   5.807  -2.442
  296    HB2  TRP  44           1HB      TRP  44  11.617   8.150  -2.457
  297    HB3  TRP  44           2HB      TRP  44  10.435   7.856  -1.185
  298    HD1  TRP  44           HD       TRP  44  13.922   7.484  -1.590
  299    HE1  TRP  44           1HE      TRP  44  14.894   5.525  -0.233
  300    HE3  TRP  44           3HE      TRP  44   9.594   4.942  -0.621
  301    HZ2  TRP  44           2HZ      TRP  44  13.951   3.208   1.074
  302    HZ3  TRP  44           3HZ      TRP  44   9.715   2.863   0.688
  303    HH2  TRP  44           HH       TRP  44  11.850   2.015   1.517
  304    H    ARG  45           H        ARG  45   9.175   6.797  -5.265
  305    HA   ARG  45           HA       ARG  45   7.817   9.303  -4.950
  306    HB2  ARG  45           1HB      ARG  45   7.190   9.077  -7.234
  307    HB3  ARG  45           2HB      ARG  45   8.829   8.453  -7.099
  308    HG2  ARG  45           1HG      ARG  45   8.022   6.186  -7.153
  309    HG3  ARG  45           2HG      ARG  45   6.349   6.748  -7.135
  310    HD2  ARG  45           1HD      ARG  45   8.227   7.634  -9.290
  311    HD3  ARG  45           2HD      ARG  45   7.441   6.059  -9.385
  312    HE   ARG  45           HE       ARG  45   5.354   7.663  -8.952
  313   HH11  ARG  45          2HH1      ARG  45   8.034   7.936 -11.158
  314   HH12  ARG  45          1HH1      ARG  45   7.132   8.810 -12.351
  315   HH21  ARG  45          2HH2      ARG  45   4.155   8.813 -10.516
  316   HH22  ARG  45          1HH2      ARG  45   4.926   9.309 -11.984
  317    H    LEU  46           H        LEU  46   5.553   9.658  -5.102
  318    HA   LEU  46           HA       LEU  46   4.009   7.754  -3.618
  319    HB2  LEU  46           1HB      LEU  46   3.630  10.065  -3.196
  320    HB3  LEU  46           2HB      LEU  46   3.339  10.390  -4.903
  321    HG   LEU  46           HG       LEU  46   1.273   8.956  -4.706
  322   HD11  LEU  46          1HD1      LEU  46   1.646   7.681  -2.773
  323   HD12  LEU  46          2HD1      LEU  46   0.395   8.838  -2.321
  324   HD13  LEU  46          3HD1      LEU  46   2.064   9.100  -1.813
  325   HD21  LEU  46          1HD2      LEU  46   0.782  11.196  -4.826
  326   HD22  LEU  46          2HD2      LEU  46   1.674  11.584  -3.355
  327   HD23  LEU  46          3HD2      LEU  46   0.102  10.790  -3.250
  328    H    ILE  47           H        ILE  47   3.257   5.974  -4.562
  329    HA   ILE  47           HA       ILE  47   2.304   6.130  -7.338
  330    HB   ILE  47           HB       ILE  47   3.006   3.693  -5.697
  331   HG12  ILE  47          1HG1      ILE  47   4.471   5.160  -7.894
  332   HG13  ILE  47          2HG1      ILE  47   5.013   4.888  -6.241
  333   HG21  ILE  47          1HG2      ILE  47   2.803   3.429  -8.599
  334   HG22  ILE  47          2HG2      ILE  47   2.186   2.387  -7.318
  335   HG23  ILE  47          3HG2      ILE  47   1.275   3.815  -7.808
  336   HD11  ILE  47          1HD1      ILE  47   5.020   2.433  -6.767
  337   HD12  ILE  47          2HD1      ILE  47   4.760   2.877  -8.454
  338   HD13  ILE  47          3HD1      ILE  47   6.221   3.403  -7.618
  339    H    LEU  48           H        LEU  48   0.199   6.029  -7.753
  340    HA   LEU  48           HA       LEU  48  -1.621   5.301  -5.570
  341    HB2  LEU  48           1HB      LEU  48  -2.126   6.813  -8.128
  342    HB3  LEU  48           2HB      LEU  48  -3.345   6.453  -6.908
  343    HG   LEU  48           HG       LEU  48  -0.894   8.064  -6.261
  344   HD11  LEU  48          1HD1      LEU  48  -2.652   8.857  -8.182
  345   HD12  LEU  48          2HD1      LEU  48  -1.715   9.944  -7.157
  346   HD13  LEU  48          3HD1      LEU  48  -3.377   9.542  -6.726
  347   HD21  LEU  48          1HD2      LEU  48  -3.308   8.773  -4.894
  348   HD22  LEU  48          2HD2      LEU  48  -1.790   8.165  -4.234
  349   HD23  LEU  48          3HD2      LEU  48  -3.038   7.035  -4.763
  350    H    CYS  49           H        CYS  49  -3.253   3.796  -5.839
  351    HA   CYS  49           HA       CYS  49  -2.777   1.507  -7.247
  352    HB2  CYS  49           1HB      CYS  49  -4.457   1.601  -5.501
  353    HB3  CYS  49           2HB      CYS  49  -5.457   2.676  -6.473
  354    H    ALA  50           H        ALA  50  -3.856   0.543  -9.104
  355    HA   ALA  50           HA       ALA  50  -4.227   2.519 -11.247
  356    HB1  ALA  50           1HB      ALA  50  -2.436   1.005 -11.706
  357    HB2  ALA  50           2HB      ALA  50  -3.454  -0.391 -11.348
  358    HB3  ALA  50           3HB      ALA  50  -3.780   0.596 -12.773
  359    H    THR  51           H        THR  51  -5.566  -0.558 -10.059
  360    HA   THR  51           HA       THR  51  -7.737  -0.778 -11.759
  361    HB   THR  51           HB       THR  51  -7.576  -1.574  -8.846
  362    HG1  THR  51           1HG      THR  51  -6.043  -2.514 -10.406
  363   HG21  THR  51          1HG2      THR  51  -9.605  -2.528  -8.983
  364   HG22  THR  51          2HG2      THR  51  -9.322  -3.109 -10.624
  365   HG23  THR  51          3HG2      THR  51  -9.859  -1.451 -10.356
  366    H    CYS  52           H        CYS  52  -7.858   0.540  -8.441
  367    HA   CYS  52           HA       CYS  52 -10.268   2.034  -9.202
  368    HB2  CYS  52           1HB      CYS  52 -10.845   2.112  -6.904
  369    HB3  CYS  52           2HB      CYS  52 -10.271   0.473  -7.193
  370    H    GLY  53           H        GLY  53  -7.078   2.415  -7.725
  371    HA2  GLY  53           1HA      GLY  53  -5.693   4.259  -7.685
  372    HA3  GLY  53           2HA      GLY  53  -6.860   5.098  -8.696
  373    H    SER  54           H        SER  54  -6.970   3.739  -5.402
  374    HA   SER  54           HA       SER  54  -7.926   6.369  -4.475
  375    HB2  SER  54           1HB      SER  54  -8.825   3.598  -3.859
  376    HB3  SER  54           2HB      SER  54  -8.852   4.769  -2.540
  377    HG   SER  54           HG       SER  54 -10.294   4.762  -4.950
  378    H    HIS  55           H        HIS  55  -6.017   3.512  -3.637
  379    HA   HIS  55           HA       HIS  55  -4.966   4.705  -1.238
  380    HB2  HIS  55           1HB      HIS  55  -4.279   2.180  -2.745
  381    HB3  HIS  55           2HB      HIS  55  -3.446   2.677  -1.275
  382    HD1  HIS  55           1HD      HIS  55  -4.271   0.776   0.186
  383    HD2  HIS  55           2HD      HIS  55  -7.350   2.908  -1.611
  384    HE1  HIS  55           1HE      HIS  55  -6.381  -0.028   1.294
  385    HE2  HIS  55           2HE      HIS  55  -8.238   1.214   0.130
  386    H    GLY  56           H        GLY  56  -2.699   5.144  -0.874
  387    HA2  GLY  56           1HA      GLY  56  -1.068   5.599  -3.257
  388    HA3  GLY  56           2HA      GLY  56  -1.483   7.008  -2.292
  389    H    THR  57           H        THR  57   0.883   4.830  -2.845
  390    HA   THR  57           HA       THR  57   2.201   5.471  -0.337
  391    HB   THR  57           HB       THR  57   0.927   3.205  -0.149
  392    HG1  THR  57           1HG      THR  57   3.670   3.004   0.477
  393   HG21  THR  57          1HG2      THR  57   3.350   1.900  -1.180
  394   HG22  THR  57          2HG2      THR  57   2.310   2.607  -2.416
  395   HG23  THR  57          3HG2      THR  57   1.661   1.409  -1.297
  396    H    HIS  58           H        HIS  58   4.511   4.629  -0.363
  397    HA   HIS  58           HA       HIS  58   5.828   5.579  -2.644
  398    HB2  HIS  58           1HB      HIS  58   7.013   3.668  -0.628
  399    HB3  HIS  58           2HB      HIS  58   7.861   4.864  -1.604
  400    HD2  HIS  58           2HD      HIS  58   8.150   7.303  -0.417
  401    HE1  HIS  58           1HE      HIS  58   5.519   6.643   2.845
  402    HE2  HIS  58           2HE      HIS  58   7.134   8.246   1.767
  403    H    ARG  59           H        ARG  59   7.764   3.929  -3.445
  404    HA   ARG  59           HA       ARG  59   6.296   1.940  -4.983
  405    HB2  ARG  59           1HB      ARG  59   8.098   3.672  -5.834
  406    HB3  ARG  59           2HB      ARG  59   9.224   2.420  -5.327
  407    HG2  ARG  59           1HG      ARG  59   6.940   1.625  -7.049
  408    HG3  ARG  59           2HG      ARG  59   8.268   2.528  -7.782
  409    HD2  ARG  59           1HD      ARG  59   8.696   0.063  -6.112
  410    HD3  ARG  59           2HD      ARG  59   8.442   0.000  -7.855
  411    HE   ARG  59           HE       ARG  59  10.815   0.879  -6.471
  412   HH11  ARG  59          2HH1      ARG  59   9.006   0.954  -9.444
  413   HH12  ARG  59          1HH1      ARG  59  10.385   1.323 -10.426
  414   HH21  ARG  59          2HH2      ARG  59  12.638   1.365  -7.753
  415   HH22  ARG  59          1HH2      ARG  59  12.450   1.556  -9.464
  416    H    ASP  60           H        ASP  60   9.447   1.979  -3.305
  417    HA   ASP  60           HA       ASP  60   9.594  -0.853  -3.136
  418    HB2  ASP  60           1HB      ASP  60  11.170   1.441  -2.084
  419    HB3  ASP  60           2HB      ASP  60  11.364  -0.111  -1.273
  420    H    CYS  61           H        CYS  61   7.847   1.439  -1.377
  421    HA   CYS  61           HA       CYS  61   7.855   0.116   1.164
  422    HB2  CYS  61           1HB      CYS  61   7.393   2.529   0.943
  423    HB3  CYS  61           2HB      CYS  61   5.921   2.160   0.051
  424    H    SER  62           H        SER  62   5.738   0.145  -1.658
  425    HA   SER  62           HA       SER  62   3.804  -1.603  -0.412
  426    HB2  SER  62           1HB      SER  62   3.494   0.239  -2.310
  427    HB3  SER  62           2HB      SER  62   3.813  -1.142  -3.359
  428    HG   SER  62           HG       SER  62   1.926  -1.339  -1.280
  429    H    SER  63           H        SER  63   6.670  -2.424  -0.876
  430    HA   SER  63           HA       SER  63   7.873  -4.224  -1.601
  431    HB2  SER  63           1HB      SER  63   6.932  -6.315  -1.060
  432    HB3  SER  63           2HB      SER  63   6.094  -5.184   0.001
  433    HG   SER  63           HG       SER  63   4.811  -6.800  -1.277
  434    H    LEU  64           H        LEU  64   7.441  -2.777  -3.734
  435    HA   LEU  64           HA       LEU  64   6.233  -4.480  -5.792
  436    HB2  LEU  64           1HB      LEU  64   7.254  -1.665  -6.092
  437    HB3  LEU  64           2HB      LEU  64   6.230  -2.560  -7.214
  438    HG   LEU  64           HG       LEU  64   5.322  -1.813  -4.444
  439   HD11  LEU  64          1HD1      LEU  64   4.396  -0.254  -6.780
  440   HD12  LEU  64          2HD1      LEU  64   6.020   0.088  -6.184
  441   HD13  LEU  64          3HD1      LEU  64   4.634   0.240  -5.103
  442   HD21  LEU  64          1HD2      LEU  64   3.909  -3.456  -5.271
  443   HD22  LEU  64          2HD2      LEU  64   4.029  -2.869  -6.930
  444   HD23  LEU  64          3HD2      LEU  64   3.092  -1.965  -5.740
  445    H    ARG  65           H        ARG  65   7.424  -4.374  -7.969
  446    HA   ARG  65           HA       ARG  65  10.198  -5.145  -7.464
  447    HB2  ARG  65           1HB      ARG  65   8.244  -5.677  -9.678
  448    HB3  ARG  65           2HB      ARG  65   9.968  -5.891  -9.951
  449    HG2  ARG  65           1HG      ARG  65  10.119  -7.613  -8.366
  450    HG3  ARG  65           2HG      ARG  65   8.549  -7.215  -7.665
  451    HD2  ARG  65           1HD      ARG  65   9.013  -8.308 -10.438
  452    HD3  ARG  65           2HD      ARG  65   8.452  -9.238  -9.049
  453    HE   ARG  65           HE       ARG  65   6.367  -8.230  -9.234
  454   HH11  ARG  65          2HH1      ARG  65   8.624  -6.866 -11.507
  455   HH12  ARG  65          1HH1      ARG  65   7.403  -6.063 -12.437
  456   HH21  ARG  65          2HH2      ARG  65   4.750  -7.177 -10.450
  457   HH22  ARG  65          1HH2      ARG  65   5.200  -6.239 -11.834
  458    HA   PRO  66           HA       PRO  66  12.017  -1.643  -9.379
  459    HB2  PRO  66           1HB      PRO  66  14.124  -2.745 -10.688
  460    HB3  PRO  66           2HB      PRO  66  14.062  -2.589  -8.929
  461    HG2  PRO  66           1HG      PRO  66  13.481  -4.975 -10.639
  462    HG3  PRO  66           2HG      PRO  66  14.391  -4.883  -9.120
  463    HD2  PRO  66           1HD      PRO  66  11.822  -5.734  -9.231
  464    HD3  PRO  66           2HD      PRO  66  12.480  -4.862  -7.831
  465    H    ASN  67           H        ASN  67  10.440  -3.970 -11.163
  466    HA   ASN  67           HA       ASN  67  10.697  -2.366 -13.618
  467    HB2  ASN  67           1HB      ASN  67  10.349  -5.370 -13.530
  468    HB3  ASN  67           2HB      ASN  67  10.550  -4.374 -14.969
  469   HD21  ASN  67          1HD2      ASN  67  12.096  -6.466 -13.063
  470   HD22  ASN  67          2HD2      ASN  67  13.726  -5.930 -13.260
  471    H    SER  68           H        SER  68   8.733  -2.552 -11.305
  472    HA   SER  68           HA       SER  68   6.316  -3.566 -12.504
  473    HB2  SER  68           1HB      SER  68   6.891  -3.501  -9.991
  474    HB3  SER  68           2HB      SER  68   6.436  -1.799 -10.066
  475    HG   SER  68           HG       SER  68   4.653  -3.591 -11.203
  476    H    LYS  69           H        LYS  69   4.875  -2.479 -13.683
  477    HA   LYS  69           HA       LYS  69   5.416   0.304 -14.321
  478    HB2  LYS  69           1HB      LYS  69   4.938  -1.284 -16.134
  479    HB3  LYS  69           2HB      LYS  69   3.356  -1.608 -15.438
  480    HG2  LYS  69           1HG      LYS  69   2.743   0.750 -15.801
  481    HG3  LYS  69           2HG      LYS  69   4.310   1.015 -16.570
  482    HD2  LYS  69           1HD      LYS  69   2.457  -1.134 -17.540
  483    HD3  LYS  69           2HD      LYS  69   2.259   0.539 -18.064
  484    HE2  LYS  69           1HE      LYS  69   4.590   0.537 -18.861
  485    HE3  LYS  69           2HE      LYS  69   4.738  -1.152 -18.381
  486    HZ1  LYS  69           1HZ      LYS  69   2.981  -0.028 -20.488
  487    HZ2  LYS  69           2HZ      LYS  69   2.853  -1.618 -19.925
  488    HZ3  LYS  69           3HZ      LYS  69   4.272  -1.103 -20.688
  489    H    LYS  70           H        LYS  70   2.622  -1.613 -13.216
  490    HA   LYS  70           HA       LYS  70   1.608   0.812 -11.890
  491    HB2  LYS  70           1HB      LYS  70  -0.616   0.341 -12.534
  492    HB3  LYS  70           2HB      LYS  70   0.343   0.148 -13.996
  493    HG2  LYS  70           1HG      LYS  70   0.406  -2.349 -13.356
  494    HG3  LYS  70           2HG      LYS  70  -0.950  -1.948 -12.300
  495    HD2  LYS  70           1HD      LYS  70  -1.996  -0.873 -14.385
  496    HD3  LYS  70           2HD      LYS  70  -0.778  -1.772 -15.293
  497    HE2  LYS  70           1HE      LYS  70  -2.555  -3.133 -13.297
  498    HE3  LYS  70           2HE      LYS  70  -3.095  -2.842 -14.949
  499    HZ1  LYS  70           1HZ      LYS  70  -2.173  -4.910 -15.136
  500    HZ2  LYS  70           2HZ      LYS  70  -0.977  -4.624 -13.975
  501    HZ3  LYS  70           3HZ      LYS  70  -0.828  -3.958 -15.522
  502    H    TRP  71           H        TRP  71   0.435   0.482  -9.954
  503    HA   TRP  71           HA       TRP  71   0.803  -2.186  -8.756
  504    HB2  TRP  71           1HB      TRP  71   2.315  -0.988  -7.506
  505    HB3  TRP  71           2HB      TRP  71   1.439   0.528  -7.704
  506    HD1  TRP  71           HD       TRP  71   1.251  -2.743  -5.654
  507    HE1  TRP  71           1HE      TRP  71   0.014  -2.238  -3.455
  508    HE3  TRP  71           3HE      TRP  71  -0.075   2.110  -6.565
  509    HZ2  TRP  71           2HZ      TRP  71  -1.345  -0.069  -2.263
  510    HZ3  TRP  71           3HZ      TRP  71  -1.342   3.329  -4.844
  511    HH2  TRP  71           HH       TRP  71  -1.964   2.260  -2.739
  512    H    GLU  72           H        GLU  72  -0.773  -2.864  -7.234
  513    HA   GLU  72           HA       GLU  72  -3.328  -1.410  -7.448
  514    HB2  GLU  72           1HB      GLU  72  -2.885  -4.390  -7.191
  515    HB3  GLU  72           2HB      GLU  72  -4.452  -3.594  -7.234
  516    HG2  GLU  72           1HG      GLU  72  -4.298  -4.211  -9.406
  517    HG3  GLU  72           2HG      GLU  72  -3.507  -2.639  -9.506
  518    H    CYS  73           H        CYS  73  -4.665  -1.320  -5.625
  519    HA   CYS  73           HA       CYS  73  -3.239  -1.370  -3.115
  520    HB2  CYS  73           1HB      CYS  73  -5.110  -0.218  -2.201
  521    HB3  CYS  73           2HB      CYS  73  -4.865   0.442  -3.815
  522    H    ASN  74           H        ASN  74  -4.259  -2.328  -1.159
  523    HA   ASN  74           HA       ASN  74  -4.511  -5.074  -1.359
  524    HB2  ASN  74           1HB      ASN  74  -3.989  -4.014   0.754
  525    HB3  ASN  74           2HB      ASN  74  -5.559  -3.215   0.785
  526   HD21  ASN  74          1HD2      ASN  74  -7.017  -4.130   2.021
  527   HD22  ASN  74          2HD2      ASN  74  -7.078  -5.799   2.466
  528    H    GLU  75           H        GLU  75  -7.173  -2.786  -0.701
  529    HA   GLU  75           HA       GLU  75  -9.335  -4.373  -0.698
  530    HB2  GLU  75           1HB      GLU  75  -9.104  -1.753  -0.791
  531    HB3  GLU  75           2HB      GLU  75  -9.468  -1.986  -2.496
  532    HG2  GLU  75           1HG      GLU  75 -11.517  -1.528  -1.441
  533    HG3  GLU  75           2HG      GLU  75 -11.512  -3.259  -1.771
  534    H    CYS  76           H        CYS  76  -7.620  -3.346  -3.625
  535    HA   CYS  76           HA       CYS  76  -9.368  -4.759  -5.396
  536    HB2  CYS  76           1HB      CYS  76  -6.666  -3.466  -5.763
  537    HB3  CYS  76           2HB      CYS  76  -7.506  -4.294  -7.070
  538    H    LEU  77           H        LEU  77  -5.957  -5.273  -4.481
  539    HA   LEU  77           HA       LEU  77  -5.321  -7.560  -5.714
  540    HB2  LEU  77           1HB      LEU  77  -4.832  -6.828  -2.840
  541    HB3  LEU  77           2HB      LEU  77  -4.106  -8.245  -3.595
  542    HG   LEU  77           HG       LEU  77  -3.675  -5.388  -4.467
  543   HD11  LEU  77          1HD1      LEU  77  -2.702  -6.122  -2.230
  544   HD12  LEU  77          2HD1      LEU  77  -1.581  -5.461  -3.420
  545   HD13  LEU  77          3HD1      LEU  77  -1.670  -7.204  -3.166
  546   HD21  LEU  77          1HD2      LEU  77  -2.855  -6.234  -6.344
  547   HD22  LEU  77          2HD2      LEU  77  -3.262  -7.864  -5.808
  548   HD23  LEU  77          3HD2      LEU  77  -1.690  -7.170  -5.409
  549    HA   PRO  78           HA       PRO  78  -8.078 -10.800  -4.623
  550    HB2  PRO  78           1HB      PRO  78  -6.427 -12.948  -4.791
  551    HB3  PRO  78           2HB      PRO  78  -7.010 -12.072  -6.211
  552    HG2  PRO  78           1HG      PRO  78  -4.378 -11.857  -4.802
  553    HG3  PRO  78           2HG      PRO  78  -4.715 -11.899  -6.542
  554    HD2  PRO  78           1HD      PRO  78  -4.204  -9.596  -5.211
  555    HD3  PRO  78           2HD      PRO  78  -5.295  -9.669  -6.610
  556    H    ALA  79           H        ALA  79  -5.818  -9.664  -2.560
  557    HA   ALA  79           HA       ALA  79  -5.236 -11.530  -0.660
  558    HB1  ALA  79           1HB      ALA  79  -4.672  -9.043  -0.693
  559    HB2  ALA  79           2HB      ALA  79  -6.217  -8.803   0.123
  560    HB3  ALA  79           3HB      ALA  79  -4.963  -9.784   0.881
  561    H    SER  80           H        SER  80  -8.267  -9.686  -0.911
  562    HA   SER  80           HA       SER  80  -9.600 -11.811   0.608
  563    HB2  SER  80           1HB      SER  80  -9.877  -8.847   1.161
  564    HB3  SER  80           2HB      SER  80 -10.889 -10.102   1.874
  565    HG   SER  80           HG       SER  80  -8.091 -10.254   2.097
  566    H    GLY  81           H        GLY  81 -12.048 -11.536   0.482
  567    HA2  GLY  81           1HA      GLY  81 -12.791 -11.444  -2.259
  568    HA3  GLY  81           2HA      GLY  81 -13.886 -11.622  -0.896
  569    HA   PRO  82           HA       PRO  82 -13.876  -7.236  -2.870
  570    HB2  PRO  82           1HB      PRO  82 -15.828  -7.515  -4.736
  571    HB3  PRO  82           2HB      PRO  82 -14.115  -7.763  -5.094
  572    HG2  PRO  82           1HG      PRO  82 -16.242  -9.790  -4.520
  573    HG3  PRO  82           2HG      PRO  82 -14.968  -9.823  -5.753
  574    HD2  PRO  82           1HD      PRO  82 -14.779 -11.195  -3.426
  575    HD3  PRO  82           2HD      PRO  82 -13.361 -10.520  -4.255
  576    H    SER  83           H        SER  83 -15.850  -9.415  -1.313
  577    HA   SER  83           HA       SER  83 -18.382  -8.554  -1.182
  578    HB2  SER  83           1HB      SER  83 -17.369 -10.299   0.295
  579    HB3  SER  83           2HB      SER  83 -16.717  -9.009   1.305
  580    HG   SER  83           HG       SER  83 -19.283  -9.982   1.122
  581    H    SER  84           H        SER  84 -15.774  -7.041   0.724
  582    HA   SER  84           HA       SER  84 -17.476  -4.798   1.389
  583    HB2  SER  84           1HB      SER  84 -14.646  -5.560   2.082
  584    HB3  SER  84           2HB      SER  84 -15.288  -3.966   2.476
  585    HG   SER  84           HG       SER  84 -16.292  -4.835   4.092
  586    H    GLY  85           H        GLY  85 -17.434  -4.768  -1.249
  587    HA2  GLY  85           1HA      GLY  85 -15.314  -3.489  -2.555
  588    HA3  GLY  85           2HA      GLY  85 -16.993  -3.452  -3.076
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1  -9.109 -13.843  26.711
    2    HA2  GLY   1           1HA      GLY   1  -9.189 -11.004  27.404
    3    HA3  GLY   1           2HA      GLY   1  -8.216 -11.459  26.014
    4    H    SER   2           H        SER   2 -10.338  -9.697  25.787
    5    HA   SER   2           HA       SER   2 -11.862 -10.955  23.734
    6    HB2  SER   2           1HB      SER   2 -12.965 -11.552  26.065
    7    HB3  SER   2           2HB      SER   2 -13.627  -9.925  25.918
    8    HG   SER   2           HG       SER   2 -14.218 -12.214  24.497
    9    H    SER   3           H        SER   3 -12.896  -9.474  22.407
   10    HA   SER   3           HA       SER   3 -13.072  -6.692  23.207
   11    HB2  SER   3           1HB      SER   3 -10.699  -7.285  22.224
   12    HB3  SER   3           2HB      SER   3 -11.548  -7.209  20.681
   13    HG   SER   3           HG       SER   3 -11.485  -5.153  22.639
   14    H    GLY   4           H        GLY   4 -14.571  -5.541  22.045
   15    HA2  GLY   4           1HA      GLY   4 -15.745  -6.815  19.673
   16    HA3  GLY   4           2HA      GLY   4 -16.794  -6.435  21.030
   17    H    SER   5           H        SER   5 -17.652  -5.299  18.895
   18    HA   SER   5           HA       SER   5 -17.368  -2.511  19.355
   19    HB2  SER   5           1HB      SER   5 -15.291  -3.214  17.939
   20    HB3  SER   5           2HB      SER   5 -16.444  -3.294  16.607
   21    HG   SER   5           HG       SER   5 -15.259  -1.152  17.602
   22    H    SER   6           H        SER   6 -18.510  -1.265  17.462
   23    HA   SER   6           HA       SER   6 -20.492  -2.762  16.016
   24    HB2  SER   6           1HB      SER   6 -21.258  -2.425  18.528
   25    HB3  SER   6           2HB      SER   6 -21.683  -0.816  17.947
   26    HG   SER   6           HG       SER   6 -22.778  -3.295  17.302
   27    H    GLY   7           H        GLY   7 -22.190  -1.082  15.099
   28    HA2  GLY   7           1HA      GLY   7 -21.279   1.603  14.758
   29    HA3  GLY   7           2HA      GLY   7 -20.878   0.610  13.365
   30    H    GLU   8           H        GLU   8 -22.432   2.645  12.794
   31    HA   GLU   8           HA       GLU   8 -25.120   1.467  12.535
   32    HB2  GLU   8           1HB      GLU   8 -26.089   3.695  12.662
   33    HB3  GLU   8           2HB      GLU   8 -25.148   3.360  14.108
   34    HG2  GLU   8           1HG      GLU   8 -24.133   4.952  11.768
   35    HG3  GLU   8           2HG      GLU   8 -24.871   5.656  13.205
   36    H    LEU   9           H        LEU   9 -26.363   2.573  10.691
   37    HA   LEU   9           HA       LEU   9 -24.555   2.755   8.378
   38    HB2  LEU   9           1HB      LEU   9 -27.493   2.087   8.402
   39    HB3  LEU   9           2HB      LEU   9 -26.405   2.015   7.017
   40    HG   LEU   9           HG       LEU   9 -25.929   0.299   9.428
   41   HD11  LEU   9          1HD1      LEU   9 -27.166  -1.484   8.092
   42   HD12  LEU   9          2HD1      LEU   9 -27.900  -0.146   7.209
   43   HD13  LEU   9          3HD1      LEU   9 -28.144  -0.293   8.949
   44   HD21  LEU   9          1HD2      LEU   9 -24.494   0.741   7.143
   45   HD22  LEU   9          2HD2      LEU   9 -25.416  -0.706   6.732
   46   HD23  LEU   9          3HD2      LEU   9 -24.378  -0.696   8.159
   47    H    GLU  10           H        GLU  10 -24.589   4.500   7.063
   48    HA   GLU  10           HA       GLU  10 -26.672   6.526   7.488
   49    HB2  GLU  10           1HB      GLU  10 -23.701   6.879   7.674
   50    HB3  GLU  10           2HB      GLU  10 -24.706   8.212   7.125
   51    HG2  GLU  10           1HG      GLU  10 -25.412   6.806   9.653
   52    HG3  GLU  10           2HG      GLU  10 -24.079   7.959   9.645
   53    HA   PRO  11           HA       PRO  11 -26.722   6.103   3.048
   54    HB2  PRO  11           1HB      PRO  11 -28.769   7.839   2.640
   55    HB3  PRO  11           2HB      PRO  11 -29.012   6.187   3.219
   56    HG2  PRO  11           1HG      PRO  11 -28.933   8.745   4.771
   57    HG3  PRO  11           2HG      PRO  11 -30.044   7.372   4.932
   58    HD2  PRO  11           1HD      PRO  11 -27.943   7.749   6.597
   59    HD3  PRO  11           2HD      PRO  11 -28.536   6.134   6.159
   60    H    GLY  12           H        GLY  12 -26.261   7.423   1.225
   61    HA2  GLY  12           1HA      GLY  12 -25.173   9.112   0.116
   62    HA3  GLY  12           2HA      GLY  12 -25.933  10.203   1.266
   63    H    ALA  13           H        ALA  13 -23.431   7.677   1.538
   64    HA   ALA  13           HA       ALA  13 -21.766   9.630   2.979
   65    HB1  ALA  13           1HB      ALA  13 -22.525   7.036   3.668
   66    HB2  ALA  13           2HB      ALA  13 -20.829   6.915   3.197
   67    HB3  ALA  13           3HB      ALA  13 -21.314   8.041   4.464
   68    H    PHE  14           H        PHE  14 -21.821   9.743   0.189
   69    HA   PHE  14           HA       PHE  14 -19.178   8.651  -0.525
   70    HB2  PHE  14           1HB      PHE  14 -21.604   9.176  -2.241
   71    HB3  PHE  14           2HB      PHE  14 -20.003   8.898  -2.919
   72    HD1  PHE  14           1HD      PHE  14 -22.280   7.335  -0.405
   73    HD2  PHE  14           2HD      PHE  14 -19.537   6.768  -3.610
   74    HE1  PHE  14           1HE      PHE  14 -22.662   4.907  -0.299
   75    HE2  PHE  14           2HE      PHE  14 -19.916   4.339  -3.510
   76    HZ   PHE  14           HZ       PHE  14 -21.481   3.405  -1.853
   77    H    SER  15           H        SER  15 -17.670  10.171  -0.485
   78    HA   SER  15           HA       SER  15 -18.050  12.645  -1.921
   79    HB2  SER  15           1HB      SER  15 -18.961  13.050   0.421
   80    HB3  SER  15           2HB      SER  15 -17.310  12.836   1.002
   81    HG   SER  15           HG       SER  15 -17.841  14.651  -1.078
   82    H    GLU  16           H        GLU  16 -16.064  13.836  -2.202
   83    HA   GLU  16           HA       GLU  16 -13.637  12.327  -1.512
   84    HB2  GLU  16           1HB      GLU  16 -12.735  12.665  -3.736
   85    HB3  GLU  16           2HB      GLU  16 -14.277  11.827  -3.847
   86    HG2  GLU  16           1HG      GLU  16 -15.385  13.751  -4.627
   87    HG3  GLU  16           2HG      GLU  16 -14.036  14.797  -4.189
   88    H    LEU  17           H        LEU  17 -11.640  13.749  -2.180
   89    HA   LEU  17           HA       LEU  17 -12.170  16.501  -1.269
   90    HB2  LEU  17           1HB      LEU  17  -9.732  14.812  -0.732
   91    HB3  LEU  17           2HB      LEU  17  -9.975  16.474  -0.198
   92    HG   LEU  17           HG       LEU  17 -11.724  14.182   0.678
   93   HD11  LEU  17          1HD1      LEU  17  -9.029  14.682   1.388
   94   HD12  LEU  17          2HD1      LEU  17 -10.147  13.505   2.076
   95   HD13  LEU  17          3HD1      LEU  17 -10.041  15.126   2.762
   96   HD21  LEU  17          1HD2      LEU  17 -12.778  16.326   0.916
   97   HD22  LEU  17          2HD2      LEU  17 -11.334  17.003   1.670
   98   HD23  LEU  17          3HD2      LEU  17 -12.272  15.767   2.510
   99    H    TYR  18           H        TYR  18 -11.662  18.024  -2.686
  100    HA   TYR  18           HA       TYR  18 -10.803  17.740  -5.223
  101    HB2  TYR  18           1HB      TYR  18 -11.529  19.875  -3.995
  102    HB3  TYR  18           2HB      TYR  18  -9.829  20.071  -3.582
  103    HD1  TYR  18           1HD      TYR  18 -12.285  20.097  -6.309
  104    HD2  TYR  18           2HD      TYR  18  -8.204  20.690  -5.260
  105    HE1  TYR  18           1HE      TYR  18 -11.891  21.184  -8.480
  106    HE2  TYR  18           2HE      TYR  18  -7.799  21.780  -7.427
  107    HH   TYR  18           HH       TYR  18 -10.096  21.701  -9.981
  108    H    GLN  19           H        GLN  19  -8.624  18.451  -2.492
  109    HA   GLN  19           HA       GLN  19  -6.220  18.423  -3.857
  110    HB2  GLN  19           1HB      GLN  19  -6.925  17.644  -1.036
  111    HB3  GLN  19           2HB      GLN  19  -5.265  17.601  -1.617
  112    HG2  GLN  19           1HG      GLN  19  -5.706  19.667  -0.443
  113    HG3  GLN  19           2HG      GLN  19  -5.386  19.980  -2.148
  114   HE21  GLN  19          1HE2      GLN  19  -8.003  19.539   0.182
  115   HE22  GLN  19          2HE2      GLN  19  -9.119  20.600  -0.601
  116    H    ARG  20           H        ARG  20  -4.486  16.735  -3.696
  117    HA   ARG  20           HA       ARG  20  -5.507  14.260  -4.771
  118    HB2  ARG  20           1HB      ARG  20  -3.578  15.211  -5.841
  119    HB3  ARG  20           2HB      ARG  20  -2.706  15.288  -4.316
  120    HG2  ARG  20           1HG      ARG  20  -1.857  13.463  -5.613
  121    HG3  ARG  20           2HG      ARG  20  -2.732  12.817  -4.223
  122    HD2  ARG  20           1HD      ARG  20  -3.309  11.534  -6.172
  123    HD3  ARG  20           2HD      ARG  20  -4.708  12.487  -5.679
  124    HE   ARG  20           HE       ARG  20  -3.281  13.948  -7.588
  125   HH11  ARG  20          2HH1      ARG  20  -5.162  11.027  -7.351
  126   HH12  ARG  20          1HH1      ARG  20  -5.696  11.083  -8.998
  127   HH21  ARG  20          2HH2      ARG  20  -3.978  14.032  -9.758
  128   HH22  ARG  20          1HH2      ARG  20  -5.022  12.792 -10.367
  129    H    TYR  21           H        TYR  21  -5.522  12.288  -3.822
  130    HA   TYR  21           HA       TYR  21  -5.216  12.188  -0.959
  131    HB2  TYR  21           1HB      TYR  21  -7.083  11.025  -2.010
  132    HB3  TYR  21           2HB      TYR  21  -5.970  10.044  -2.957
  133    HD1  TYR  21           2HD      TYR  21  -4.704   8.238  -1.913
  134    HD2  TYR  21           1HD      TYR  21  -7.462  10.569   0.337
  135    HE1  TYR  21           2HE      TYR  21  -4.662   6.551  -0.124
  136    HE2  TYR  21           1HE      TYR  21  -7.427   8.889   2.133
  137    HH   TYR  21           HH       TYR  21  -6.046   7.117   2.969
  138    H    ARG  22           H        ARG  22  -3.561  11.377   0.173
  139    HA   ARG  22           HA       ARG  22  -1.677   9.535  -1.025
  140    HB2  ARG  22           1HB      ARG  22   0.258  11.058  -0.280
  141    HB3  ARG  22           2HB      ARG  22  -0.570  11.452  -1.781
  142    HG2  ARG  22           1HG      ARG  22  -1.806  13.204  -0.708
  143    HG3  ARG  22           2HG      ARG  22  -1.169  12.741   0.871
  144    HD2  ARG  22           1HD      ARG  22   0.989  13.494   0.344
  145    HD3  ARG  22           2HD      ARG  22   0.641  13.543  -1.384
  146    HE   ARG  22           HE       ARG  22  -0.945  15.344   0.222
  147   HH11  ARG  22          2HH1      ARG  22   1.975  14.912  -1.625
  148   HH12  ARG  22          1HH1      ARG  22   2.196  16.606  -1.916
  149   HH21  ARG  22          2HH2      ARG  22  -0.664  17.576  -0.155
  150   HH22  ARG  22          1HH2      ARG  22   0.695  18.120  -1.079
  151    H    HIS  23           H        HIS  23  -1.619   8.007   0.485
  152    HA   HIS  23           HA       HIS  23  -0.798   8.690   3.177
  153    HB2  HIS  23           1HB      HIS  23  -3.134   8.870   3.545
  154    HB3  HIS  23           2HB      HIS  23  -3.475   7.445   2.568
  155    HD1  HIS  23           1HD      HIS  23  -4.754   6.370   4.558
  156    HD2  HIS  23           2HD      HIS  23  -0.736   7.118   5.302
  157    HE1  HIS  23           1HE      HIS  23  -4.208   5.088   6.651
  158    HE2  HIS  23           2HE      HIS  23  -1.794   5.625   7.130
  159    H    CYS  24           H        CYS  24   0.919   7.409   3.367
  160    HA   CYS  24           HA       CYS  24   1.475   5.102   1.958
  161    HB2  CYS  24           1HB      CYS  24   3.261   6.133   3.116
  162    HB3  CYS  24           2HB      CYS  24   2.411   6.061   4.656
  163    H    ASP  25           H        ASP  25   0.259   3.334   1.846
  164    HA   ASP  25           HA       ASP  25  -0.748   2.179   4.362
  165    HB2  ASP  25           1HB      ASP  25  -2.156   2.696   1.794
  166    HB3  ASP  25           2HB      ASP  25  -2.533   1.191   2.627
  167    H    ALA  26           H        ALA  26   1.739   1.663   2.919
  168    HA   ALA  26           HA       ALA  26   1.396  -0.907   1.637
  169    HB1  ALA  26           1HB      ALA  26   3.296  -0.332   0.651
  170    HB2  ALA  26           2HB      ALA  26   3.392   1.110   1.663
  171    HB3  ALA  26           3HB      ALA  26   4.129  -0.398   2.204
  172    HA   PRO  27           HA       PRO  27   2.211  -3.602   5.003
  173    HB2  PRO  27           1HB      PRO  27   4.070  -5.327   4.035
  174    HB3  PRO  27           2HB      PRO  27   2.385  -5.333   3.503
  175    HG2  PRO  27           1HG      PRO  27   4.783  -4.122   2.183
  176    HG3  PRO  27           2HG      PRO  27   3.455  -5.045   1.458
  177    HD2  PRO  27           1HD      PRO  27   3.579  -2.342   1.351
  178    HD3  PRO  27           2HD      PRO  27   2.040  -3.225   1.425
  179    H    ILE  28           H        ILE  28   5.312  -2.765   3.445
  180    HA   ILE  28           HA       ILE  28   6.411  -2.237   6.125
  181    HB   ILE  28           HB       ILE  28   7.900  -3.533   3.839
  182   HG12  ILE  28          1HG1      ILE  28   6.300  -5.059   4.921
  183   HG13  ILE  28          2HG1      ILE  28   7.962  -5.523   5.266
  184   HG21  ILE  28          1HG2      ILE  28   8.793  -2.114   6.169
  185   HG22  ILE  28          2HG2      ILE  28   9.307  -3.798   6.247
  186   HG23  ILE  28          3HG2      ILE  28   9.738  -2.809   4.852
  187   HD11  ILE  28          1HD1      ILE  28   7.814  -4.597   7.473
  188   HD12  ILE  28          2HD1      ILE  28   6.209  -3.950   7.134
  189   HD13  ILE  28          3HD1      ILE  28   6.458  -5.694   7.212
  190    H    CYS  29           H        CYS  29   7.560  -0.394   6.356
  191    HA   CYS  29           HA       CYS  29   8.041   1.206   3.928
  192    HB2  CYS  29           1HB      CYS  29   6.229   1.940   5.675
  193    HB3  CYS  29           2HB      CYS  29   7.621   2.475   6.610
  194    H    LEU  30           H        LEU  30  10.035   2.022   3.627
  195    HA   LEU  30           HA       LEU  30  12.048   1.422   5.677
  196    HB2  LEU  30           1HB      LEU  30  12.589   2.194   2.825
  197    HB3  LEU  30           2HB      LEU  30  13.671   1.394   3.964
  198    HG   LEU  30           HG       LEU  30  11.175  -0.017   3.161
  199   HD11  LEU  30          1HD1      LEU  30  13.324   0.773   1.328
  200   HD12  LEU  30          2HD1      LEU  30  11.681   0.228   0.991
  201   HD13  LEU  30          3HD1      LEU  30  12.948  -0.950   1.331
  202   HD21  LEU  30          1HD2      LEU  30  12.188  -1.659   4.253
  203   HD22  LEU  30          2HD2      LEU  30  13.556  -0.596   4.587
  204   HD23  LEU  30          3HD2      LEU  30  13.545  -1.587   3.127
  205    H    TYR  31           H        TYR  31  10.648   4.005   3.792
  206    HA   TYR  31           HA       TYR  31  12.528   6.015   4.181
  207    HB2  TYR  31           1HB      TYR  31  10.287   5.973   2.819
  208    HB3  TYR  31           2HB      TYR  31   9.601   6.645   4.295
  209    HD1  TYR  31           2HD      TYR  31  12.471   7.203   1.967
  210    HD2  TYR  31           1HD      TYR  31   9.557   8.942   4.532
  211    HE1  TYR  31           2HE      TYR  31  13.219   9.445   1.286
  212    HE2  TYR  31           1HE      TYR  31  10.295  11.189   3.857
  213    HH   TYR  31           HH       TYR  31  12.272  12.275   2.924
  214    H    GLU  32           H        GLU  32  13.362   6.728   6.020
  215    HA   GLU  32           HA       GLU  32  12.628   6.203   8.573
  216    HB2  GLU  32           1HB      GLU  32  13.861   8.739   7.493
  217    HB3  GLU  32           2HB      GLU  32  13.750   8.369   9.208
  218    HG2  GLU  32           1HG      GLU  32  15.911   7.743   8.597
  219    HG3  GLU  32           2HG      GLU  32  15.010   6.230   8.671
  220    H    GLN  33           H        GLN  33  11.540   9.015   6.687
  221    HA   GLN  33           HA       GLN  33   9.910  10.136   8.679
  222    HB2  GLN  33           1HB      GLN  33  10.168  10.417   5.734
  223    HB3  GLN  33           2HB      GLN  33   8.673  10.991   6.460
  224    HG2  GLN  33           1HG      GLN  33   9.896  12.895   6.573
  225    HG3  GLN  33           2HG      GLN  33  10.344  12.177   8.120
  226   HE21  GLN  33          1HE2      GLN  33  12.258  10.559   7.829
  227   HE22  GLN  33          2HE2      GLN  33  13.604  11.190   6.949
  228    H    GLY  34           H        GLY  34   9.231   7.753   6.158
  229    HA2  GLY  34           1HA      GLY  34   7.380   6.444   5.759
  230    HA3  GLY  34           2HA      GLY  34   7.315   6.330   7.511
  231    H    ARG  35           H        ARG  35   6.888   9.324   5.735
  232    HA   ARG  35           HA       ARG  35   4.093   9.380   6.658
  233    HB2  ARG  35           1HB      ARG  35   4.246  11.689   6.952
  234    HB3  ARG  35           2HB      ARG  35   5.816  11.112   7.495
  235    HG2  ARG  35           1HG      ARG  35   6.510  11.581   5.017
  236    HG3  ARG  35           2HG      ARG  35   5.102  12.644   5.047
  237    HD2  ARG  35           1HD      ARG  35   7.330  12.737   7.073
  238    HD3  ARG  35           2HD      ARG  35   7.268  13.753   5.633
  239    HE   ARG  35           HE       ARG  35   4.873  14.172   6.880
  240   HH11  ARG  35          2HH1      ARG  35   8.220  14.450   7.798
  241   HH12  ARG  35          1HH1      ARG  35   7.940  15.736   8.924
  242   HH21  ARG  35          2HH2      ARG  35   4.491  15.865   8.361
  243   HH22  ARG  35          1HH2      ARG  35   5.818  16.539   9.244
  244    H    ASP  36           H        ASP  36   3.000  11.329   5.201
  245    HA   ASP  36           HA       ASP  36   2.687  10.097   2.629
  246    HB2  ASP  36           1HB      ASP  36   1.520  12.776   3.262
  247    HB3  ASP  36           2HB      ASP  36   0.815  11.431   2.371
  248    H    SER  37           H        SER  37   5.296  10.858   2.811
  249    HA   SER  37           HA       SER  37   5.460  13.219   1.054
  250    HB2  SER  37           1HB      SER  37   6.651  13.092   3.421
  251    HB3  SER  37           2HB      SER  37   7.867  12.202   2.504
  252    HG   SER  37           HG       SER  37   6.963  14.853   2.111
  253    H    PHE  38           H        PHE  38   6.144  12.909  -0.959
  254    HA   PHE  38           HA       PHE  38   7.909  10.676  -1.584
  255    HB2  PHE  38           1HB      PHE  38   5.459  11.061  -3.280
  256    HB3  PHE  38           2HB      PHE  38   6.526   9.664  -3.181
  257    HD1  PHE  38           1HD      PHE  38   4.099  11.620  -1.150
  258    HD2  PHE  38           2HD      PHE  38   5.912   7.843  -1.900
  259    HE1  PHE  38           1HE      PHE  38   2.562  10.567   0.456
  260    HE2  PHE  38           2HE      PHE  38   4.377   6.783  -0.296
  261    HZ   PHE  38           HZ       PHE  38   2.698   8.145   0.884
  262    H    GLU  39           H        GLU  39   8.425  10.761  -4.052
  263    HA   GLU  39           HA       GLU  39   8.774  13.590  -4.802
  264    HB2  GLU  39           1HB      GLU  39  10.818  12.072  -4.091
  265    HB3  GLU  39           2HB      GLU  39  10.680  11.492  -5.745
  266    HG2  GLU  39           1HG      GLU  39  10.982  13.732  -6.595
  267    HG3  GLU  39           2HG      GLU  39  11.014  14.377  -4.955
  268    H    ASP  40           H        ASP  40   9.039  13.968  -7.139
  269    HA   ASP  40           HA       ASP  40   6.940  13.192  -8.662
  270    HB2  ASP  40           1HB      ASP  40   8.892  14.873  -9.145
  271    HB3  ASP  40           2HB      ASP  40   9.589  13.515 -10.024
  272    H    GLU  41           H        GLU  41  10.057  11.525  -8.443
  273    HA   GLU  41           HA       GLU  41   8.824   9.025  -9.147
  274    HB2  GLU  41           1HB      GLU  41  10.565  10.495 -11.080
  275    HB3  GLU  41           2HB      GLU  41  10.679   8.743 -11.002
  276    HG2  GLU  41           1HG      GLU  41   8.147   8.737 -11.295
  277    HG3  GLU  41           2HG      GLU  41   8.320  10.429 -11.757
  278    H    GLY  42           H        GLY  42  10.489   7.230  -9.183
  279    HA2  GLY  42           1HA      GLY  42  12.837   6.689  -8.580
  280    HA3  GLY  42           2HA      GLY  42  12.677   7.891  -7.307
  281    H    ARG  43           H        ARG  43  13.242   6.337  -5.735
  282    HA   ARG  43           HA       ARG  43  11.673   3.955  -5.401
  283    HB2  ARG  43           1HB      ARG  43  13.450   5.145  -3.289
  284    HB3  ARG  43           2HB      ARG  43  13.074   3.453  -3.584
  285    HG2  ARG  43           1HG      ARG  43  14.421   3.447  -5.576
  286    HG3  ARG  43           2HG      ARG  43  14.702   5.183  -5.431
  287    HD2  ARG  43           1HD      ARG  43  16.194   4.939  -3.722
  288    HD3  ARG  43           2HD      ARG  43  15.430   3.467  -3.122
  289    HE   ARG  43           HE       ARG  43  16.754   3.204  -5.677
  290   HH11  ARG  43          2HH1      ARG  43  17.038   2.951  -2.217
  291   HH12  ARG  43          1HH1      ARG  43  18.389   1.868  -2.275
  292   HH21  ARG  43          2HH2      ARG  43  18.532   1.777  -5.768
  293   HH22  ARG  43          1HH2      ARG  43  19.239   1.202  -4.296
  294    H    TRP  44           H        TRP  44  11.717   7.184  -4.035
  295    HA   TRP  44           HA       TRP  44   9.496   6.467  -2.252
  296    HB2  TRP  44           1HB      TRP  44  10.942   9.103  -2.209
  297    HB3  TRP  44           2HB      TRP  44  10.048   8.314  -0.913
  298    HD1  TRP  44           HD       TRP  44  13.444   9.095  -1.737
  299    HE1  TRP  44           1HE      TRP  44  15.116   7.492  -0.614
  300    HE3  TRP  44           3HE      TRP  44  10.218   5.359  -0.409
  301    HZ2  TRP  44           2HZ      TRP  44  15.072   4.976   0.665
  302    HZ3  TRP  44           3HZ      TRP  44  11.113   3.388   0.761
  303    HH2  TRP  44           HH       TRP  44  13.490   3.202   1.286
  304    H    ARG  45           H        ARG  45   8.827   6.583  -4.907
  305    HA   ARG  45           HA       ARG  45   7.648   9.219  -5.367
  306    HB2  ARG  45           1HB      ARG  45   7.399   8.621  -7.607
  307    HB3  ARG  45           2HB      ARG  45   8.904   7.835  -7.150
  308    HG2  ARG  45           1HG      ARG  45   7.715   5.721  -6.859
  309    HG3  ARG  45           2HG      ARG  45   6.206   6.510  -7.321
  310    HD2  ARG  45           1HD      ARG  45   8.532   6.718  -9.163
  311    HD3  ARG  45           2HD      ARG  45   7.675   5.179  -9.071
  312    HE   ARG  45           HE       ARG  45   5.776   7.195  -9.389
  313   HH11  ARG  45          2HH1      ARG  45   8.400   5.755 -11.167
  314   HH12  ARG  45          1HH1      ARG  45   7.701   6.082 -12.718
  315   HH21  ARG  45          2HH2      ARG  45   4.846   7.632 -11.426
  316   HH22  ARG  45          1HH2      ARG  45   5.680   7.151 -12.864
  317    H    LEU  46           H        LEU  46   5.531   9.638  -5.157
  318    HA   LEU  46           HA       LEU  46   3.838   7.877  -3.768
  319    HB2  LEU  46           1HB      LEU  46   3.583  10.299  -3.701
  320    HB3  LEU  46           2HB      LEU  46   3.150  10.312  -5.409
  321    HG   LEU  46           HG       LEU  46   1.169   8.825  -4.699
  322   HD11  LEU  46          1HD1      LEU  46   2.422   9.352  -2.150
  323   HD12  LEU  46          2HD1      LEU  46   1.123   8.232  -2.559
  324   HD13  LEU  46          3HD1      LEU  46   0.750   9.913  -2.178
  325   HD21  LEU  46          1HD2      LEU  46  -0.043  10.678  -4.953
  326   HD22  LEU  46          2HD2      LEU  46   1.491  11.547  -5.029
  327   HD23  LEU  46          3HD2      LEU  46   0.628  11.414  -3.496
  328    H    ILE  47           H        ILE  47   3.132   6.013  -4.578
  329    HA   ILE  47           HA       ILE  47   2.297   5.914  -7.395
  330    HB   ILE  47           HB       ILE  47   3.041   3.694  -5.490
  331   HG12  ILE  47          1HG1      ILE  47   4.314   4.679  -8.054
  332   HG13  ILE  47          2HG1      ILE  47   4.933   4.950  -6.428
  333   HG21  ILE  47          1HG2      ILE  47   2.806   2.700  -8.106
  334   HG22  ILE  47          2HG2      ILE  47   1.801   2.316  -6.710
  335   HG23  ILE  47          3HG2      ILE  47   1.339   3.629  -7.794
  336   HD11  ILE  47          1HD1      ILE  47   4.794   2.384  -7.968
  337   HD12  ILE  47          2HD1      ILE  47   6.208   3.195  -7.296
  338   HD13  ILE  47          3HD1      ILE  47   5.043   2.421  -6.223
  339    H    LEU  48           H        LEU  48   0.202   5.892  -7.840
  340    HA   LEU  48           HA       LEU  48  -1.700   5.315  -5.689
  341    HB2  LEU  48           1HB      LEU  48  -2.035   6.653  -8.366
  342    HB3  LEU  48           2HB      LEU  48  -3.365   6.318  -7.259
  343    HG   LEU  48           HG       LEU  48  -1.020   8.024  -6.467
  344   HD11  LEU  48          1HD1      LEU  48  -1.716   9.688  -7.751
  345   HD12  LEU  48          2HD1      LEU  48  -3.321   9.593  -7.027
  346   HD13  LEU  48          3HD1      LEU  48  -2.941   8.633  -8.457
  347   HD21  LEU  48          1HD2      LEU  48  -2.096   7.670  -4.516
  348   HD22  LEU  48          2HD2      LEU  48  -3.615   7.242  -5.305
  349   HD23  LEU  48          3HD2      LEU  48  -3.162   8.938  -5.121
  350    H    CYS  49           H        CYS  49  -3.238   3.732  -5.824
  351    HA   CYS  49           HA       CYS  49  -2.737   1.365  -7.076
  352    HB2  CYS  49           1HB      CYS  49  -4.399   1.469  -5.355
  353    HB3  CYS  49           2HB      CYS  49  -5.395   2.569  -6.301
  354    H    ALA  50           H        ALA  50  -3.698   0.263  -8.883
  355    HA   ALA  50           HA       ALA  50  -4.092   2.060 -11.161
  356    HB1  ALA  50           1HB      ALA  50  -2.363   0.464 -11.516
  357    HB2  ALA  50           2HB      ALA  50  -3.401  -0.866 -10.999
  358    HB3  ALA  50           3HB      ALA  50  -3.736  -0.022 -12.511
  359    H    THR  51           H        THR  51  -5.533  -0.873  -9.745
  360    HA   THR  51           HA       THR  51  -7.715  -1.146 -11.418
  361    HB   THR  51           HB       THR  51  -7.537  -1.726  -8.456
  362    HG1  THR  51           1HG      THR  51  -6.144  -2.850 -10.085
  363   HG21  THR  51          1HG2      THR  51  -9.512  -2.998  -8.611
  364   HG22  THR  51          2HG2      THR  51  -9.519  -2.929 -10.373
  365   HG23  THR  51          3HG2      THR  51  -9.888  -1.484  -9.432
  366    H    CYS  52           H        CYS  52  -8.026   0.204  -8.136
  367    HA   CYS  52           HA       CYS  52 -10.320   1.763  -9.023
  368    HB2  CYS  52           1HB      CYS  52 -10.836   2.071  -6.727
  369    HB3  CYS  52           2HB      CYS  52 -10.295   0.402  -6.877
  370    H    GLY  53           H        GLY  53  -7.099   2.255  -7.644
  371    HA2  GLY  53           1HA      GLY  53  -5.696   4.080  -7.829
  372    HA3  GLY  53           2HA      GLY  53  -6.890   4.836  -8.873
  373    H    SER  54           H        SER  54  -6.935   3.768  -5.473
  374    HA   SER  54           HA       SER  54  -7.759   6.502  -4.744
  375    HB2  SER  54           1HB      SER  54  -9.455   4.505  -4.549
  376    HB3  SER  54           2HB      SER  54  -8.544   4.131  -3.086
  377    HG   SER  54           HG       SER  54  -9.796   6.610  -3.682
  378    H    HIS  55           H        HIS  55  -6.126   3.562  -3.620
  379    HA   HIS  55           HA       HIS  55  -5.042   4.734  -1.273
  380    HB2  HIS  55           1HB      HIS  55  -4.197   2.291  -2.842
  381    HB3  HIS  55           2HB      HIS  55  -3.540   2.735  -1.269
  382    HD1  HIS  55           1HD      HIS  55  -4.494   1.132   0.353
  383    HD2  HIS  55           2HD      HIS  55  -7.344   2.467  -2.359
  384    HE1  HIS  55           1HE      HIS  55  -6.665   0.107   1.100
  385    HE2  HIS  55           2HE      HIS  55  -8.359   0.860  -0.605
  386    H    GLY  56           H        GLY  56  -2.651   4.919  -0.890
  387    HA2  GLY  56           1HA      GLY  56  -1.033   5.571  -3.207
  388    HA3  GLY  56           2HA      GLY  56  -1.470   6.945  -2.203
  389    H    THR  57           H        THR  57   0.876   4.714  -2.765
  390    HA   THR  57           HA       THR  57   2.143   5.283  -0.202
  391    HB   THR  57           HB       THR  57   0.890   2.985  -0.198
  392    HG1  THR  57           1HG      THR  57   2.110   3.037   1.531
  393   HG21  THR  57          1HG2      THR  57   2.327   2.515  -2.428
  394   HG22  THR  57          2HG2      THR  57   1.770   1.239  -1.346
  395   HG23  THR  57          3HG2      THR  57   3.420   1.848  -1.216
  396    H    HIS  58           H        HIS  58   4.463   4.495  -0.209
  397    HA   HIS  58           HA       HIS  58   5.788   5.530  -2.476
  398    HB2  HIS  58           1HB      HIS  58   7.052   3.742  -0.403
  399    HB3  HIS  58           2HB      HIS  58   7.819   5.011  -1.352
  400    HD2  HIS  58           2HD      HIS  58   7.842   7.470  -0.166
  401    HE1  HIS  58           1HE      HIS  58   5.221   6.553   3.041
  402    HE2  HIS  58           2HE      HIS  58   6.696   8.307   1.996
  403    H    ARG  59           H        ARG  59   7.726   4.128  -3.398
  404    HA   ARG  59           HA       ARG  59   6.461   1.976  -4.848
  405    HB2  ARG  59           1HB      ARG  59   8.153   3.766  -5.721
  406    HB3  ARG  59           2HB      ARG  59   9.369   2.667  -5.082
  407    HG2  ARG  59           1HG      ARG  59   7.274   1.544  -6.859
  408    HG3  ARG  59           2HG      ARG  59   8.543   2.535  -7.582
  409    HD2  ARG  59           1HD      ARG  59  10.089   0.987  -6.091
  410    HD3  ARG  59           2HD      ARG  59   8.721  -0.114  -6.246
  411    HE   ARG  59           HE       ARG  59   9.453  -0.554  -8.350
  412   HH11  ARG  59          2HH1      ARG  59  10.472   2.664  -7.497
  413   HH12  ARG  59          1HH1      ARG  59  11.302   2.938  -8.993
  414   HH21  ARG  59          2HH2      ARG  59  10.542  -0.205 -10.324
  415   HH22  ARG  59          1HH2      ARG  59  11.340   1.306 -10.601
  416    H    ASP  60           H        ASP  60   9.643   2.132  -3.245
  417    HA   ASP  60           HA       ASP  60   9.952  -0.638  -3.000
  418    HB2  ASP  60           1HB      ASP  60  11.242   1.751  -1.779
  419    HB3  ASP  60           2HB      ASP  60  11.516   0.195  -1.001
  420    H    CYS  61           H        CYS  61   8.306   1.683  -0.984
  421    HA   CYS  61           HA       CYS  61   8.120   0.202   1.386
  422    HB2  CYS  61           1HB      CYS  61   7.524   2.606   1.161
  423    HB3  CYS  61           2HB      CYS  61   6.081   2.137   0.268
  424    H    SER  62           H        SER  62   6.222   0.115  -1.568
  425    HA   SER  62           HA       SER  62   4.276  -1.714  -0.459
  426    HB2  SER  62           1HB      SER  62   3.435  -0.178  -2.086
  427    HB3  SER  62           2HB      SER  62   4.706  -0.598  -3.234
  428    HG   SER  62           HG       SER  62   3.144  -2.708  -2.378
  429    H    SER  63           H        SER  63   7.170  -2.433  -0.614
  430    HA   SER  63           HA       SER  63   8.544  -4.131  -1.327
  431    HB2  SER  63           1HB      SER  63   7.777  -6.214  -0.616
  432    HB3  SER  63           2HB      SER  63   6.735  -5.111   0.283
  433    HG   SER  63           HG       SER  63   5.343  -5.404  -1.748
  434    H    LEU  64           H        LEU  64   7.696  -2.731  -3.525
  435    HA   LEU  64           HA       LEU  64   6.724  -4.634  -5.499
  436    HB2  LEU  64           1HB      LEU  64   7.480  -1.724  -5.706
  437    HB3  LEU  64           2HB      LEU  64   6.875  -2.693  -7.048
  438    HG   LEU  64           HG       LEU  64   5.298  -2.242  -4.524
  439   HD11  LEU  64          1HD1      LEU  64   4.344  -0.337  -5.363
  440   HD12  LEU  64          2HD1      LEU  64   4.738  -0.740  -7.034
  441   HD13  LEU  64          3HD1      LEU  64   5.998  -0.152  -5.948
  442   HD21  LEU  64          1HD2      LEU  64   4.155  -2.794  -7.219
  443   HD22  LEU  64          2HD2      LEU  64   3.530  -3.204  -5.621
  444   HD23  LEU  64          3HD2      LEU  64   4.870  -4.123  -6.307
  445    H    ARG  65           H        ARG  65   7.975  -4.133  -7.768
  446    HA   ARG  65           HA       ARG  65  10.779  -4.843  -7.218
  447    HB2  ARG  65           1HB      ARG  65   8.791  -5.802  -9.208
  448    HB3  ARG  65           2HB      ARG  65  10.464  -5.691  -9.738
  449    HG2  ARG  65           1HG      ARG  65   9.789  -7.925  -8.868
  450    HG3  ARG  65           2HG      ARG  65  11.183  -7.210  -8.055
  451    HD2  ARG  65           1HD      ARG  65  10.036  -6.852  -6.107
  452    HD3  ARG  65           2HD      ARG  65   8.481  -6.701  -6.924
  453    HE   ARG  65           HE       ARG  65   9.703  -9.118  -5.943
  454   HH11  ARG  65          2HH1      ARG  65   7.377  -7.752  -8.143
  455   HH12  ARG  65          1HH1      ARG  65   6.436  -9.203  -8.254
  456   HH21  ARG  65          2HH2      ARG  65   8.472 -11.033  -6.080
  457   HH22  ARG  65          1HH2      ARG  65   7.059 -11.068  -7.080
  458    HA   PRO  66           HA       PRO  66  12.287  -1.384  -9.455
  459    HB2  PRO  66           1HB      PRO  66  14.377  -2.432 -10.835
  460    HB3  PRO  66           2HB      PRO  66  14.409  -2.184  -9.086
  461    HG2  PRO  66           1HG      PRO  66  13.877  -4.690 -10.634
  462    HG3  PRO  66           2HG      PRO  66  14.867  -4.462  -9.181
  463    HD2  PRO  66           1HD      PRO  66  12.354  -5.466  -9.089
  464    HD3  PRO  66           2HD      PRO  66  13.037  -4.482  -7.778
  465    H    ASN  67           H        ASN  67  11.084  -4.109 -11.143
  466    HA   ASN  67           HA       ASN  67  10.987  -2.558 -13.647
  467    HB2  ASN  67           1HB      ASN  67  11.129  -4.537 -14.903
  468    HB3  ASN  67           2HB      ASN  67  12.287  -4.783 -13.598
  469   HD21  ASN  67          1HD2      ASN  67  11.156  -6.849 -15.100
  470   HD22  ASN  67          2HD2      ASN  67  10.173  -7.810 -14.053
  471    H    SER  68           H        SER  68   9.116  -2.280 -11.502
  472    HA   SER  68           HA       SER  68   6.725  -3.690 -12.399
  473    HB2  SER  68           1HB      SER  68   6.908  -3.639 -10.036
  474    HB3  SER  68           2HB      SER  68   7.323  -1.925 -10.026
  475    HG   SER  68           HG       SER  68   4.879  -2.602 -11.155
  476    H    LYS  69           H        LYS  69   4.982  -2.731 -13.348
  477    HA   LYS  69           HA       LYS  69   5.446  -0.108 -14.520
  478    HB2  LYS  69           1HB      LYS  69   3.261  -2.144 -14.992
  479    HB3  LYS  69           2HB      LYS  69   3.429  -0.631 -15.873
  480    HG2  LYS  69           1HG      LYS  69   5.406  -1.337 -16.924
  481    HG3  LYS  69           2HG      LYS  69   5.615  -2.686 -15.805
  482    HD2  LYS  69           1HD      LYS  69   4.766  -3.809 -17.606
  483    HD3  LYS  69           2HD      LYS  69   3.261  -3.394 -16.782
  484    HE2  LYS  69           1HE      LYS  69   3.046  -2.897 -19.130
  485    HE3  LYS  69           2HE      LYS  69   3.076  -1.389 -18.218
  486    HZ1  LYS  69           1HZ      LYS  69   5.677  -1.762 -18.787
  487    HZ2  LYS  69           2HZ      LYS  69   4.625  -0.801 -19.698
  488    HZ3  LYS  69           3HZ      LYS  69   4.942  -2.393 -20.175
  489    H    LYS  70           H        LYS  70   2.756  -1.730 -12.826
  490    HA   LYS  70           HA       LYS  70   2.144   0.808 -11.497
  491    HB2  LYS  70           1HB      LYS  70   0.333  -0.756 -13.286
  492    HB3  LYS  70           2HB      LYS  70  -0.360   0.053 -11.887
  493    HG2  LYS  70           1HG      LYS  70   1.005   2.103 -12.843
  494    HG3  LYS  70           2HG      LYS  70   0.830   1.200 -14.350
  495    HD2  LYS  70           1HD      LYS  70  -1.050   2.565 -14.340
  496    HD3  LYS  70           2HD      LYS  70  -1.666   1.042 -13.693
  497    HE2  LYS  70           1HE      LYS  70  -2.543   2.662 -12.259
  498    HE3  LYS  70           2HE      LYS  70  -1.145   2.035 -11.388
  499    HZ1  LYS  70           1HZ      LYS  70  -0.929   4.432 -13.099
  500    HZ2  LYS  70           2HZ      LYS  70   0.084   3.939 -11.837
  501    HZ3  LYS  70           3HZ      LYS  70  -1.457   4.549 -11.496
  502    H    TRP  71           H        TRP  71   0.745   0.546  -9.609
  503    HA   TRP  71           HA       TRP  71   0.864  -2.173  -8.482
  504    HB2  TRP  71           1HB      TRP  71   2.480  -1.188  -7.181
  505    HB3  TRP  71           2HB      TRP  71   1.781   0.421  -7.342
  506    HD1  TRP  71           HD       TRP  71   1.647  -2.699  -5.170
  507    HE1  TRP  71           1HE      TRP  71   0.279  -2.185  -3.052
  508    HE3  TRP  71           3HE      TRP  71  -0.169   1.899  -6.473
  509    HZ2  TRP  71           2HZ      TRP  71  -1.355  -0.106  -2.064
  510    HZ3  TRP  71           3HZ      TRP  71  -1.628   3.083  -4.885
  511    HH2  TRP  71           HH       TRP  71  -2.208   2.100  -2.727
  512    H    GLU  72           H        GLU  72  -0.795  -2.743  -7.016
  513    HA   GLU  72           HA       GLU  72  -3.159  -0.985  -7.125
  514    HB2  GLU  72           1HB      GLU  72  -3.129  -4.009  -7.124
  515    HB3  GLU  72           2HB      GLU  72  -4.561  -2.989  -7.171
  516    HG2  GLU  72           1HG      GLU  72  -4.384  -3.459  -9.377
  517    HG3  GLU  72           2HG      GLU  72  -3.359  -2.027  -9.320
  518    H    CYS  73           H        CYS  73  -4.691  -1.267  -5.340
  519    HA   CYS  73           HA       CYS  73  -3.267  -1.503  -2.824
  520    HB2  CYS  73           1HB      CYS  73  -5.175  -0.467  -1.821
  521    HB3  CYS  73           2HB      CYS  73  -4.864   0.378  -3.334
  522    H    ASN  74           H        ASN  74  -4.591  -2.529  -0.966
  523    HA   ASN  74           HA       ASN  74  -4.765  -5.291  -1.450
  524    HB2  ASN  74           1HB      ASN  74  -4.386  -3.972   0.772
  525    HB3  ASN  74           2HB      ASN  74  -6.143  -4.004   0.884
  526   HD21  ASN  74          1HD2      ASN  74  -3.260  -5.716   1.355
  527   HD22  ASN  74          2HD2      ASN  74  -3.952  -7.231   1.815
  528    H    GLU  75           H        GLU  75  -7.401  -3.072  -0.510
  529    HA   GLU  75           HA       GLU  75  -9.584  -4.595  -0.699
  530    HB2  GLU  75           1HB      GLU  75  -9.194  -1.831  -1.839
  531    HB3  GLU  75           2HB      GLU  75 -10.769  -2.610  -1.764
  532    HG2  GLU  75           1HG      GLU  75 -10.588  -2.769   0.659
  533    HG3  GLU  75           2HG      GLU  75  -8.996  -2.014   0.595
  534    H    CYS  76           H        CYS  76  -7.823  -3.327  -3.497
  535    HA   CYS  76           HA       CYS  76  -9.597  -4.572  -5.390
  536    HB2  CYS  76           1HB      CYS  76  -6.946  -3.154  -5.672
  537    HB3  CYS  76           2HB      CYS  76  -7.800  -3.859  -7.041
  538    H    LEU  77           H        LEU  77  -6.153  -5.046  -4.580
  539    HA   LEU  77           HA       LEU  77  -5.471  -7.176  -6.062
  540    HB2  LEU  77           1HB      LEU  77  -4.894  -6.603  -3.177
  541    HB3  LEU  77           2HB      LEU  77  -4.219  -8.022  -3.975
  542    HG   LEU  77           HG       LEU  77  -3.770  -5.186  -4.898
  543   HD11  LEU  77          1HD1      LEU  77  -1.404  -6.352  -3.906
  544   HD12  LEU  77          2HD1      LEU  77  -2.646  -6.576  -2.674
  545   HD13  LEU  77          3HD1      LEU  77  -2.281  -4.958  -3.274
  546   HD21  LEU  77          1HD2      LEU  77  -1.907  -7.351  -5.596
  547   HD22  LEU  77          2HD2      LEU  77  -2.530  -6.025  -6.577
  548   HD23  LEU  77          3HD2      LEU  77  -3.508  -7.471  -6.325
  549    HA   PRO  78           HA       PRO  78  -7.988 -10.662  -5.182
  550    HB2  PRO  78           1HB      PRO  78  -6.205 -12.698  -5.394
  551    HB3  PRO  78           2HB      PRO  78  -6.797 -11.791  -6.791
  552    HG2  PRO  78           1HG      PRO  78  -4.226 -11.488  -5.286
  553    HG3  PRO  78           2HG      PRO  78  -4.508 -11.466  -7.037
  554    HD2  PRO  78           1HD      PRO  78  -4.179  -9.203  -5.586
  555    HD3  PRO  78           2HD      PRO  78  -5.220  -9.274  -7.022
  556    H    ALA  79           H        ALA  79  -5.884  -9.484  -2.991
  557    HA   ALA  79           HA       ALA  79  -5.861 -11.724  -1.150
  558    HB1  ALA  79           1HB      ALA  79  -3.925 -10.599  -0.805
  559    HB2  ALA  79           2HB      ALA  79  -4.619  -9.040  -1.251
  560    HB3  ALA  79           3HB      ALA  79  -4.929  -9.719   0.347
  561    H    SER  80           H        SER  80  -7.063 -11.926   0.693
  562    HA   SER  80           HA       SER  80  -9.642 -11.008   0.800
  563    HB2  SER  80           1HB      SER  80  -9.692 -11.724   3.127
  564    HB3  SER  80           2HB      SER  80  -8.734 -12.863   2.182
  565    HG   SER  80           HG       SER  80  -7.998 -11.456   4.319
  566    H    GLY  81           H        GLY  81 -10.501  -9.061   1.050
  567    HA2  GLY  81           1HA      GLY  81  -8.878  -6.924   2.216
  568    HA3  GLY  81           2HA      GLY  81 -10.352  -6.715   1.282
  569    HA   PRO  82           HA       PRO  82 -11.105  -7.369   6.056
  570    HB2  PRO  82           1HB      PRO  82  -9.807  -5.362   7.344
  571    HB3  PRO  82           2HB      PRO  82  -9.098  -6.963   7.098
  572    HG2  PRO  82           1HG      PRO  82  -8.656  -4.438   5.552
  573    HG3  PRO  82           2HG      PRO  82  -7.471  -5.640   6.093
  574    HD2  PRO  82           1HD      PRO  82  -8.408  -5.560   3.554
  575    HD3  PRO  82           2HD      PRO  82  -7.944  -7.076   4.354
  576    H    SER  83           H        SER  83 -13.151  -6.661   6.029
  577    HA   SER  83           HA       SER  83 -13.678  -3.838   5.420
  578    HB2  SER  83           1HB      SER  83 -16.018  -4.545   5.080
  579    HB3  SER  83           2HB      SER  83 -14.910  -5.459   4.057
  580    HG   SER  83           HG       SER  83 -14.984  -7.093   5.767
  581    H    SER  84           H        SER  84 -15.578  -2.888   6.655
  582    HA   SER  84           HA       SER  84 -15.422  -3.683   9.489
  583    HB2  SER  84           1HB      SER  84 -14.229  -1.519   8.870
  584    HB3  SER  84           2HB      SER  84 -15.823  -0.848   8.528
  585    HG   SER  84           HG       SER  84 -15.423  -0.352  10.624
  586    H    GLY  85           H        GLY  85 -17.321  -4.964   9.165
  587    HA2  GLY  85           1HA      GLY  85 -19.582  -5.330   9.319
  588    HA3  GLY  85           2HA      GLY  85 -19.710  -3.664   9.865
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1 -12.538 -10.022  41.172
    2    HA2  GLY   1           1HA      GLY   1 -11.788 -12.150  39.315
    3    HA3  GLY   1           2HA      GLY   1 -13.423 -11.519  39.185
    4    H    SER   2           H        SER   2 -12.817 -10.922  37.005
    5    HA   SER   2           HA       SER   2 -11.567  -8.275  36.955
    6    HB2  SER   2           1HB      SER   2 -10.314  -8.860  34.899
    7    HB3  SER   2           2HB      SER   2  -9.792  -9.813  36.288
    8    HG   SER   2           HG       SER   2 -11.155 -10.599  33.992
    9    H    SER   3           H        SER   3 -11.843  -7.349  34.610
   10    HA   SER   3           HA       SER   3 -14.573  -7.994  33.706
   11    HB2  SER   3           1HB      SER   3 -14.110  -5.740  34.962
   12    HB3  SER   3           2HB      SER   3 -13.427  -5.238  33.415
   13    HG   SER   3           HG       SER   3 -16.049  -5.648  34.137
   14    H    GLY   4           H        GLY   4 -14.927  -6.869  31.440
   15    HA2  GLY   4           1HA      GLY   4 -12.613  -7.638  29.771
   16    HA3  GLY   4           2HA      GLY   4 -14.286  -7.882  29.294
   17    H    SER   5           H        SER   5 -14.047  -6.713  27.382
   18    HA   SER   5           HA       SER   5 -14.252  -3.838  27.726
   19    HB2  SER   5           1HB      SER   5 -11.812  -4.289  27.411
   20    HB3  SER   5           2HB      SER   5 -12.187  -4.998  25.841
   21    HG   SER   5           HG       SER   5 -13.083  -2.407  26.455
   22    H    SER   6           H        SER   6 -14.991  -2.749  25.765
   23    HA   SER   6           HA       SER   6 -16.344  -4.581  23.896
   24    HB2  SER   6           1HB      SER   6 -17.417  -2.100  25.239
   25    HB3  SER   6           2HB      SER   6 -18.159  -2.787  23.795
   26    HG   SER   6           HG       SER   6 -17.652  -4.561  25.860
   27    H    GLY   7           H        GLY   7 -16.306  -4.055  21.754
   28    HA2  GLY   7           1HA      GLY   7 -14.247  -2.471  20.757
   29    HA3  GLY   7           2HA      GLY   7 -15.629  -3.021  19.821
   30    H    GLU   8           H        GLU   8 -14.346  -0.548  19.425
   31    HA   GLU   8           HA       GLU   8 -16.610   1.198  19.591
   32    HB2  GLU   8           1HB      GLU   8 -15.589   2.960  20.913
   33    HB3  GLU   8           2HB      GLU   8 -15.672   1.477  21.855
   34    HG2  GLU   8           1HG      GLU   8 -13.559   2.178  22.347
   35    HG3  GLU   8           2HG      GLU   8 -13.239   1.128  20.968
   36    H    LEU   9           H        LEU   9 -16.519   2.822  18.090
   37    HA   LEU   9           HA       LEU   9 -14.694   2.565  15.965
   38    HB2  LEU   9           1HB      LEU   9 -15.727   4.593  15.076
   39    HB3  LEU   9           2HB      LEU   9 -16.928   3.431  15.636
   40    HG   LEU   9           HG       LEU   9 -16.130   5.555  17.542
   41   HD11  LEU   9          1HD1      LEU   9 -17.344   7.278  16.539
   42   HD12  LEU   9          2HD1      LEU   9 -18.084   6.196  15.359
   43   HD13  LEU   9          3HD1      LEU   9 -16.376   6.611  15.224
   44   HD21  LEU   9          1HD2      LEU   9 -17.770   4.194  18.406
   45   HD22  LEU   9          2HD2      LEU   9 -18.552   3.958  16.843
   46   HD23  LEU   9          3HD2      LEU   9 -18.738   5.488  17.701
   47    H    GLU  10           H        GLU  10 -13.130   4.076  15.184
   48    HA   GLU  10           HA       GLU  10 -11.336   4.980  17.165
   49    HB2  GLU  10           1HB      GLU  10 -11.506   5.351  14.189
   50    HB3  GLU  10           2HB      GLU  10 -10.279   6.189  15.129
   51    HG2  GLU  10           1HG      GLU  10  -9.349   4.176  14.218
   52    HG3  GLU  10           2HG      GLU  10  -9.477   4.018  15.969
   53    HA   PRO  11           HA       PRO  11 -13.100   8.912  18.144
   54    HB2  PRO  11           1HB      PRO  11 -10.947   9.959  19.423
   55    HB3  PRO  11           2HB      PRO  11 -11.989   8.728  20.147
   56    HG2  PRO  11           1HG      PRO  11  -9.337   8.409  18.796
   57    HG3  PRO  11           2HG      PRO  11  -9.933   7.650  20.283
   58    HD2  PRO  11           1HD      PRO  11  -9.901   6.361  17.902
   59    HD3  PRO  11           2HD      PRO  11 -11.141   6.057  19.136
   60    H    GLY  12           H        GLY  12 -12.592  11.249  17.866
   61    HA2  GLY  12           1HA      GLY  12 -12.242  12.922  16.307
   62    HA3  GLY  12           2HA      GLY  12 -10.568  12.425  16.506
   63    H    ALA  13           H        ALA  13 -13.399  10.957  14.912
   64    HA   ALA  13           HA       ALA  13 -11.749  10.688  12.484
   65    HB1  ALA  13           1HB      ALA  13 -13.689   8.870  12.080
   66    HB2  ALA  13           2HB      ALA  13 -12.157   8.504  12.875
   67    HB3  ALA  13           3HB      ALA  13 -13.596   8.834  13.841
   68    H    PHE  14           H        PHE  14 -12.309  12.516  11.381
   69    HA   PHE  14           HA       PHE  14 -15.147  13.118  11.006
   70    HB2  PHE  14           1HB      PHE  14 -12.624  14.670  10.439
   71    HB3  PHE  14           2HB      PHE  14 -14.199  15.190   9.848
   72    HD1  PHE  14           1HD      PHE  14 -12.795  13.936  13.075
   73    HD2  PHE  14           2HD      PHE  14 -15.169  16.851  11.079
   74    HE1  PHE  14           1HE      PHE  14 -13.228  15.052  15.225
   75    HE2  PHE  14           2HE      PHE  14 -15.604  17.972  13.226
   76    HZ   PHE  14           HZ       PHE  14 -14.633  17.073  15.302
   77    H    SER  15           H        SER  15 -15.905  13.679   8.825
   78    HA   SER  15           HA       SER  15 -15.150  11.638   6.953
   79    HB2  SER  15           1HB      SER  15 -16.955  12.577   5.552
   80    HB3  SER  15           2HB      SER  15 -17.499  12.284   7.204
   81    HG   SER  15           HG       SER  15 -16.459  14.802   6.662
   82    H    GLU  16           H        GLU  16 -14.702  12.132   4.654
   83    HA   GLU  16           HA       GLU  16 -13.204  14.633   4.287
   84    HB2  GLU  16           1HB      GLU  16 -11.482  13.310   3.020
   85    HB3  GLU  16           2HB      GLU  16 -11.504  13.028   4.755
   86    HG2  GLU  16           1HG      GLU  16 -12.561  10.930   4.496
   87    HG3  GLU  16           2HG      GLU  16 -12.918  11.243   2.798
   88    H    LEU  17           H        LEU  17 -12.461  14.649   1.813
   89    HA   LEU  17           HA       LEU  17 -14.946  14.437   0.307
   90    HB2  LEU  17           1HB      LEU  17 -12.329  15.824  -0.185
   91    HB3  LEU  17           2HB      LEU  17 -13.554  15.672  -1.443
   92    HG   LEU  17           HG       LEU  17 -14.252  16.911   1.191
   93   HD11  LEU  17          1HD1      LEU  17 -13.663  18.942  -0.690
   94   HD12  LEU  17          2HD1      LEU  17 -12.248  17.898  -0.564
   95   HD13  LEU  17          3HD1      LEU  17 -12.919  18.651   0.882
   96   HD21  LEU  17          1HD2      LEU  17 -16.137  16.555  -0.139
   97   HD22  LEU  17          2HD2      LEU  17 -15.292  17.003  -1.621
   98   HD23  LEU  17          3HD2      LEU  17 -15.717  18.242  -0.439
   99    H    TYR  18           H        TYR  18 -12.767  12.268   0.993
  100    HA   TYR  18           HA       TYR  18 -11.560  10.645  -0.168
  101    HB2  TYR  18           1HB      TYR  18 -14.375  10.354  -1.238
  102    HB3  TYR  18           2HB      TYR  18 -13.149   9.091  -1.215
  103    HD1  TYR  18           1HD      TYR  18 -15.022  11.371   1.065
  104    HD2  TYR  18           2HD      TYR  18 -13.032   7.640   0.597
  105    HE1  TYR  18           1HE      TYR  18 -15.769  10.698   3.310
  106    HE2  TYR  18           2HE      TYR  18 -13.774   6.956   2.840
  107    HH   TYR  18           HH       TYR  18 -15.713   7.577   4.406
  108    H    GLN  19           H        GLN  19 -10.886  12.897  -1.463
  109    HA   GLN  19           HA       GLN  19 -11.189  12.219  -4.315
  110    HB2  GLN  19           1HB      GLN  19 -11.140  14.828  -2.884
  111    HB3  GLN  19           2HB      GLN  19 -10.391  14.758  -4.474
  112    HG2  GLN  19           1HG      GLN  19 -12.681  13.577  -5.086
  113    HG3  GLN  19           2HG      GLN  19 -13.239  14.513  -3.701
  114   HE21  GLN  19          1HE2      GLN  19 -14.575  15.570  -5.326
  115   HE22  GLN  19          2HE2      GLN  19 -13.909  16.879  -6.236
  116    H    ARG  20           H        ARG  20  -8.944  13.796  -2.036
  117    HA   ARG  20           HA       ARG  20  -6.714  12.817  -3.687
  118    HB2  ARG  20           1HB      ARG  20  -7.077  15.223  -1.955
  119    HB3  ARG  20           2HB      ARG  20  -5.460  14.560  -2.148
  120    HG2  ARG  20           1HG      ARG  20  -5.967  14.680  -4.679
  121    HG3  ARG  20           2HG      ARG  20  -7.250  15.792  -4.197
  122    HD2  ARG  20           1HD      ARG  20  -5.368  16.970  -2.852
  123    HD3  ARG  20           2HD      ARG  20  -4.285  16.086  -3.926
  124    HE   ARG  20           HE       ARG  20  -5.977  17.254  -5.655
  125   HH11  ARG  20          2HH1      ARG  20  -4.163  18.492  -2.954
  126   HH12  ARG  20          1HH1      ARG  20  -3.987  20.077  -3.631
  127   HH21  ARG  20          2HH2      ARG  20  -5.753  19.337  -6.557
  128   HH22  ARG  20          1HH2      ARG  20  -4.893  20.557  -5.680
  129    H    TYR  21           H        TYR  21  -5.960  10.948  -2.931
  130    HA   TYR  21           HA       TYR  21  -5.779  10.577  -0.017
  131    HB2  TYR  21           1HB      TYR  21  -7.163   8.921  -1.243
  132    HB3  TYR  21           2HB      TYR  21  -5.747   8.468  -2.186
  133    HD1  TYR  21           2HD      TYR  21  -3.706   7.589  -0.875
  134    HD2  TYR  21           1HD      TYR  21  -7.621   7.843   0.772
  135    HE1  TYR  21           2HE      TYR  21  -3.084   5.943   0.844
  136    HE2  TYR  21           1HE      TYR  21  -7.009   6.199   2.496
  137    HH   TYR  21           HH       TYR  21  -3.974   5.419   3.297
  138    H    ARG  22           H        ARG  22  -3.815  11.208   0.635
  139    HA   ARG  22           HA       ARG  22  -1.488  10.054  -0.747
  140    HB2  ARG  22           1HB      ARG  22  -1.791  12.872   0.298
  141    HB3  ARG  22           2HB      ARG  22  -0.246  12.161  -0.150
  142    HG2  ARG  22           1HG      ARG  22  -1.378  11.708  -2.427
  143    HG3  ARG  22           2HG      ARG  22  -2.552  12.913  -1.894
  144    HD2  ARG  22           1HD      ARG  22   0.353  13.541  -1.682
  145    HD3  ARG  22           2HD      ARG  22  -0.414  13.601  -3.268
  146    HE   ARG  22           HE       ARG  22  -2.014  15.046  -1.509
  147   HH11  ARG  22          2HH1      ARG  22   1.187  15.213  -2.868
  148   HH12  ARG  22          1HH1      ARG  22   1.268  16.942  -2.797
  149   HH21  ARG  22          2HH2      ARG  22  -1.919  17.323  -1.410
  150   HH22  ARG  22          1HH2      ARG  22  -0.499  18.141  -1.967
  151    H    HIS  23           H        HIS  23  -1.668   8.402   0.904
  152    HA   HIS  23           HA       HIS  23  -0.149   9.118   3.271
  153    HB2  HIS  23           1HB      HIS  23  -2.965   8.067   3.370
  154    HB3  HIS  23           2HB      HIS  23  -1.833   7.758   4.684
  155    HD1  HIS  23           1HD      HIS  23  -0.839   9.979   5.858
  156    HD2  HIS  23           2HD      HIS  23  -4.213  10.486   3.488
  157    HE1  HIS  23           1HE      HIS  23  -1.796  12.208   6.519
  158    HE2  HIS  23           2HE      HIS  23  -3.884  12.455   5.133
  159    H    CYS  24           H        CYS  24   1.387   7.648   3.533
  160    HA   CYS  24           HA       CYS  24   1.597   5.329   1.975
  161    HB2  CYS  24           1HB      CYS  24   3.595   6.301   2.842
  162    HB3  CYS  24           2HB      CYS  24   3.010   6.190   4.499
  163    H    ASP  25           H        ASP  25   0.575   3.457   2.127
  164    HA   ASP  25           HA       ASP  25  -0.403   2.594   4.770
  165    HB2  ASP  25           1HB      ASP  25  -2.157   3.297   3.036
  166    HB3  ASP  25           2HB      ASP  25  -1.706   1.836   2.161
  167    H    ALA  26           H        ALA  26   1.763   1.962   2.364
  168    HA   ALA  26           HA       ALA  26   1.706  -0.716   1.808
  169    HB1  ALA  26           1HB      ALA  26   3.578  -0.104   0.789
  170    HB2  ALA  26           2HB      ALA  26   3.676   1.358   1.771
  171    HB3  ALA  26           3HB      ALA  26   4.405  -0.141   2.347
  172    HA   PRO  27           HA       PRO  27   2.533  -3.085   5.409
  173    HB2  PRO  27           1HB      PRO  27   4.498  -4.797   4.650
  174    HB3  PRO  27           2HB      PRO  27   2.834  -4.926   4.068
  175    HG2  PRO  27           1HG      PRO  27   5.223  -3.720   2.726
  176    HG3  PRO  27           2HG      PRO  27   3.962  -4.761   2.041
  177    HD2  PRO  27           1HD      PRO  27   3.972  -2.074   1.707
  178    HD3  PRO  27           2HD      PRO  27   2.472  -3.018   1.809
  179    H    ILE  28           H        ILE  28   5.580  -2.063   3.872
  180    HA   ILE  28           HA       ILE  28   6.550  -1.200   6.496
  181    HB   ILE  28           HB       ILE  28   8.198  -2.894   4.616
  182   HG12  ILE  28          1HG1      ILE  28   6.439  -4.143   5.878
  183   HG13  ILE  28          2HG1      ILE  28   8.080  -4.628   6.290
  184   HG21  ILE  28          1HG2      ILE  28   9.840  -2.853   6.490
  185   HG22  ILE  28          2HG2      ILE  28   9.587  -1.288   5.718
  186   HG23  ILE  28          3HG2      ILE  28   8.837  -1.634   7.276
  187   HD11  ILE  28          1HD1      ILE  28   7.990  -3.402   8.340
  188   HD12  ILE  28          2HD1      ILE  28   6.429  -2.705   7.906
  189   HD13  ILE  28          3HD1      ILE  28   6.564  -4.432   8.233
  190    H    CYS  29           H        CYS  29   7.900   0.563   6.455
  191    HA   CYS  29           HA       CYS  29   8.250   1.830   3.821
  192    HB2  CYS  29           1HB      CYS  29   6.873   2.880   5.834
  193    HB3  CYS  29           2HB      CYS  29   8.476   3.396   6.351
  194    H    LEU  30           H        LEU  30  10.205   2.923   3.362
  195    HA   LEU  30           HA       LEU  30  12.479   2.081   5.037
  196    HB2  LEU  30           1HB      LEU  30  12.482   2.480   2.050
  197    HB3  LEU  30           2HB      LEU  30  13.825   1.910   3.039
  198    HG   LEU  30           HG       LEU  30  11.303   0.327   3.033
  199   HD11  LEU  30          1HD1      LEU  30  12.629  -0.887   1.043
  200   HD12  LEU  30          2HD1      LEU  30  13.033   0.792   0.689
  201   HD13  LEU  30          3HD1      LEU  30  11.344   0.291   0.778
  202   HD21  LEU  30          1HD2      LEU  30  14.111  -0.689   2.868
  203   HD22  LEU  30          2HD2      LEU  30  12.690  -1.439   3.594
  204   HD23  LEU  30          3HD2      LEU  30  13.474  -0.076   4.394
  205    H    TYR  31           H        TYR  31  11.078   4.599   3.032
  206    HA   TYR  31           HA       TYR  31  13.145   6.449   3.017
  207    HB2  TYR  31           1HB      TYR  31  10.802   6.510   1.883
  208    HB3  TYR  31           2HB      TYR  31  10.293   7.323   3.358
  209    HD1  TYR  31           2HD      TYR  31  13.392   7.587   1.285
  210    HD2  TYR  31           1HD      TYR  31   9.996   9.569   2.909
  211    HE1  TYR  31           2HE      TYR  31  14.216   9.722   0.384
  212    HE2  TYR  31           1HE      TYR  31  10.809  11.710   2.012
  213    HH   TYR  31           HH       TYR  31  13.117  11.971  -0.312
  214    H    GLU  32           H        GLU  32  14.274   7.077   4.738
  215    HA   GLU  32           HA       GLU  32  13.794   6.929   7.364
  216    HB2  GLU  32           1HB      GLU  32  15.878   7.819   6.524
  217    HB3  GLU  32           2HB      GLU  32  15.070   9.264   5.934
  218    HG2  GLU  32           1HG      GLU  32  16.032  10.019   7.874
  219    HG3  GLU  32           2HG      GLU  32  14.409   9.599   8.419
  220    H    GLN  33           H        GLN  33  12.561   9.498   5.266
  221    HA   GLN  33           HA       GLN  33  11.462  11.237   7.055
  222    HB2  GLN  33           1HB      GLN  33  11.366  11.087   4.410
  223    HB3  GLN  33           2HB      GLN  33   9.765  10.437   4.736
  224    HG2  GLN  33           1HG      GLN  33   9.919  12.920   4.307
  225    HG3  GLN  33           2HG      GLN  33   9.045  12.420   5.755
  226   HE21  GLN  33          1HE2      GLN  33  12.326  13.297   4.728
  227   HE22  GLN  33          2HE2      GLN  33  12.706  14.218   6.139
  228    H    GLY  34           H        GLY  34   9.883   8.299   5.796
  229    HA2  GLY  34           1HA      GLY  34   8.254   6.964   6.713
  230    HA3  GLY  34           2HA      GLY  34   8.655   7.679   8.267
  231    H    ARG  35           H        ARG  35   7.233   8.949   5.253
  232    HA   ARG  35           HA       ARG  35   4.679   9.375   6.468
  233    HB2  ARG  35           1HB      ARG  35   4.656  11.677   6.750
  234    HB3  ARG  35           2HB      ARG  35   6.268  11.257   7.313
  235    HG2  ARG  35           1HG      ARG  35   7.050  11.786   4.945
  236    HG3  ARG  35           2HG      ARG  35   5.469  12.541   4.726
  237    HD2  ARG  35           1HD      ARG  35   7.442  13.245   6.896
  238    HD3  ARG  35           2HD      ARG  35   7.228  14.145   5.395
  239    HE   ARG  35           HE       ARG  35   4.827  13.815   6.966
  240   HH11  ARG  35          2HH1      ARG  35   7.614  15.795   6.307
  241   HH12  ARG  35          1HH1      ARG  35   6.896  17.242   6.935
  242   HH21  ARG  35          2HH2      ARG  35   3.871  15.713   7.794
  243   HH22  ARG  35          1HH2      ARG  35   4.768  17.194   7.781
  244    H    ASP  36           H        ASP  36   3.504  11.164   4.903
  245    HA   ASP  36           HA       ASP  36   3.490   9.867   2.336
  246    HB2  ASP  36           1HB      ASP  36   1.715  11.688   1.871
  247    HB3  ASP  36           2HB      ASP  36   1.347  10.455   3.073
  248    H    SER  37           H        SER  37   5.964  10.980   2.693
  249    HA   SER  37           HA       SER  37   5.947  13.398   1.017
  250    HB2  SER  37           1HB      SER  37   7.164  13.188   3.361
  251    HB3  SER  37           2HB      SER  37   8.426  12.439   2.384
  252    HG   SER  37           HG       SER  37   8.868  14.591   2.386
  253    H    PHE  38           H        PHE  38   6.256  13.019  -1.067
  254    HA   PHE  38           HA       PHE  38   8.269  11.026  -1.850
  255    HB2  PHE  38           1HB      PHE  38   5.766  11.442  -3.465
  256    HB3  PHE  38           2HB      PHE  38   6.902  10.097  -3.521
  257    HD1  PHE  38           1HD      PHE  38   4.530  11.752  -1.169
  258    HD2  PHE  38           2HD      PHE  38   6.329   8.126  -2.486
  259    HE1  PHE  38           1HE      PHE  38   3.093  10.483   0.373
  260    HE2  PHE  38           2HE      PHE  38   4.894   6.851  -0.947
  261    HZ   PHE  38           HZ       PHE  38   3.273   8.029   0.485
  262    H    GLU  39           H        GLU  39   8.856  11.314  -4.242
  263    HA   GLU  39           HA       GLU  39   9.115  14.199  -4.776
  264    HB2  GLU  39           1HB      GLU  39  11.171  12.617  -4.318
  265    HB3  GLU  39           2HB      GLU  39  10.940  12.173  -6.003
  266    HG2  GLU  39           1HG      GLU  39  11.410  14.331  -6.760
  267    HG3  GLU  39           2HG      GLU  39  11.178  15.037  -5.162
  268    H    ASP  40           H        ASP  40   9.195  14.851  -7.037
  269    HA   ASP  40           HA       ASP  40   7.060  14.326  -8.543
  270    HB2  ASP  40           1HB      ASP  40   9.062  15.897  -9.023
  271    HB3  ASP  40           2HB      ASP  40   9.710  14.544  -9.947
  272    H    GLU  41           H        GLU  41  10.012  12.374  -8.580
  273    HA   GLU  41           HA       GLU  41   8.530  10.053  -9.398
  274    HB2  GLU  41           1HB      GLU  41  10.327  11.492 -11.309
  275    HB3  GLU  41           2HB      GLU  41  10.253   9.737 -11.362
  276    HG2  GLU  41           1HG      GLU  41   7.723  10.024 -11.522
  277    HG3  GLU  41           2HG      GLU  41   8.065  11.716 -11.879
  278    H    GLY  42           H        GLY  42  10.120   8.158  -9.765
  279    HA2  GLY  42           1HA      GLY  42  12.349   7.301  -9.277
  280    HA3  GLY  42           2HA      GLY  42  12.451   8.485  -7.983
  281    H    ARG  43           H        ARG  43  13.084   6.036  -7.256
  282    HA   ARG  43           HA       ARG  43  11.229   4.151  -6.589
  283    HB2  ARG  43           1HB      ARG  43  12.673   3.530  -4.713
  284    HB3  ARG  43           2HB      ARG  43  13.623   3.900  -6.145
  285    HG2  ARG  43           1HG      ARG  43  13.693   6.299  -5.028
  286    HG3  ARG  43           2HG      ARG  43  13.432   5.345  -3.566
  287    HD2  ARG  43           1HD      ARG  43  15.808   5.675  -3.959
  288    HD3  ARG  43           2HD      ARG  43  15.383   3.971  -4.122
  289    HE   ARG  43           HE       ARG  43  15.243   4.830  -6.659
  290   HH11  ARG  43          2HH1      ARG  43  17.673   5.223  -4.198
  291   HH12  ARG  43          1HH1      ARG  43  18.988   5.297  -5.323
  292   HH21  ARG  43          2HH2      ARG  43  16.965   4.925  -8.151
  293   HH22  ARG  43          1HH2      ARG  43  18.584   5.129  -7.572
  294    H    TRP  44           H        TRP  44  11.883   7.184  -4.907
  295    HA   TRP  44           HA       TRP  44   9.840   6.602  -2.914
  296    HB2  TRP  44           1HB      TRP  44  11.439   9.147  -3.192
  297    HB3  TRP  44           2HB      TRP  44  10.599   8.550  -1.764
  298    HD1  TRP  44           HD       TRP  44  13.958   8.966  -2.844
  299    HE1  TRP  44           1HE      TRP  44  15.564   7.258  -1.782
  300    HE3  TRP  44           3HE      TRP  44  10.532   5.558  -1.175
  301    HZ2  TRP  44           2HZ      TRP  44  15.401   4.792  -0.419
  302    HZ3  TRP  44           3HZ      TRP  44  11.339   3.551  -0.003
  303    HH2  TRP  44           HH       TRP  44  13.724   3.178   0.366
  304    H    ARG  45           H        ARG  45   8.732   6.697  -5.406
  305    HA   ARG  45           HA       ARG  45   7.507   9.354  -5.632
  306    HB2  ARG  45           1HB      ARG  45   6.854   8.750  -7.853
  307    HB3  ARG  45           2HB      ARG  45   8.543   8.301  -7.658
  308    HG2  ARG  45           1HG      ARG  45   7.971   5.992  -7.415
  309    HG3  ARG  45           2HG      ARG  45   6.249   6.377  -7.368
  310    HD2  ARG  45           1HD      ARG  45   6.438   7.271  -9.674
  311    HD3  ARG  45           2HD      ARG  45   8.120   6.743  -9.705
  312    HE   ARG  45           HE       ARG  45   6.824   4.473  -9.093
  313   HH11  ARG  45          2HH1      ARG  45   6.301   6.867 -11.565
  314   HH12  ARG  45          1HH1      ARG  45   5.633   5.740 -12.698
  315   HH21  ARG  45          2HH2      ARG  45   5.946   2.979 -10.576
  316   HH22  ARG  45          1HH2      ARG  45   5.431   3.529 -12.134
  317    H    LEU  46           H        LEU  46   5.411   9.694  -5.178
  318    HA   LEU  46           HA       LEU  46   3.941   7.795  -3.705
  319    HB2  LEU  46           1HB      LEU  46   3.802  10.423  -3.870
  320    HB3  LEU  46           2HB      LEU  46   2.568  10.056  -5.073
  321    HG   LEU  46           HG       LEU  46   2.476   8.994  -2.257
  322   HD11  LEU  46          1HD1      LEU  46   1.860  11.664  -3.288
  323   HD12  LEU  46          2HD1      LEU  46   2.135  11.118  -1.634
  324   HD13  LEU  46          3HD1      LEU  46   0.550  10.911  -2.378
  325   HD21  LEU  46          1HD2      LEU  46  -0.048   9.390  -3.528
  326   HD22  LEU  46          2HD2      LEU  46   0.684   7.891  -2.956
  327   HD23  LEU  46          3HD2      LEU  46   0.997   8.455  -4.598
  328    H    ILE  47           H        ILE  47   3.496   5.915  -4.754
  329    HA   ILE  47           HA       ILE  47   2.276   5.990  -7.399
  330    HB   ILE  47           HB       ILE  47   3.082   3.641  -5.681
  331   HG12  ILE  47          1HG1      ILE  47   4.360   4.844  -8.146
  332   HG13  ILE  47          2HG1      ILE  47   4.982   4.963  -6.504
  333   HG21  ILE  47          1HG2      ILE  47   1.820   2.393  -7.015
  334   HG22  ILE  47          2HG2      ILE  47   1.386   3.798  -7.988
  335   HG23  ILE  47          3HG2      ILE  47   2.842   2.878  -8.369
  336   HD11  ILE  47          1HD1      ILE  47   5.104   2.440  -6.515
  337   HD12  ILE  47          2HD1      ILE  47   4.805   2.533  -8.251
  338   HD13  ILE  47          3HD1      ILE  47   6.241   3.290  -7.562
  339    H    LEU  48           H        LEU  48   0.153   5.976  -7.689
  340    HA   LEU  48           HA       LEU  48  -1.571   5.191  -5.443
  341    HB2  LEU  48           1HB      LEU  48  -2.159   6.868  -7.878
  342    HB3  LEU  48           2HB      LEU  48  -3.336   6.449  -6.635
  343    HG   LEU  48           HG       LEU  48  -0.830   7.974  -5.986
  344   HD11  LEU  48          1HD1      LEU  48  -3.419   9.376  -6.419
  345   HD12  LEU  48          2HD1      LEU  48  -2.415   8.992  -7.818
  346   HD13  LEU  48          3HD1      LEU  48  -1.769   9.991  -6.516
  347   HD21  LEU  48          1HD2      LEU  48  -1.724   8.244  -3.939
  348   HD22  LEU  48          2HD2      LEU  48  -2.656   6.809  -4.368
  349   HD23  LEU  48          3HD2      LEU  48  -3.366   8.413  -4.561
  350    H    CYS  49           H        CYS  49  -3.243   3.733  -5.709
  351    HA   CYS  49           HA       CYS  49  -2.885   1.532  -7.297
  352    HB2  CYS  49           1HB      CYS  49  -4.442   1.606  -5.395
  353    HB3  CYS  49           2HB      CYS  49  -5.531   2.630  -6.323
  354    H    ALA  50           H        ALA  50  -3.913   0.732  -9.191
  355    HA   ALA  50           HA       ALA  50  -4.601   2.864 -11.095
  356    HB1  ALA  50           1HB      ALA  50  -2.796   0.753 -11.285
  357    HB2  ALA  50           2HB      ALA  50  -4.155   0.285 -12.308
  358    HB3  ALA  50           3HB      ALA  50  -3.329   1.818 -12.586
  359    H    THR  51           H        THR  51  -5.587  -0.370 -10.024
  360    HA   THR  51           HA       THR  51  -7.792  -0.730 -11.674
  361    HB   THR  51           HB       THR  51  -7.417  -1.660  -8.821
  362    HG1  THR  51           1HG      THR  51  -6.490  -2.506 -11.287
  363   HG21  THR  51          1HG2      THR  51  -9.778  -1.735  -9.481
  364   HG22  THR  51          2HG2      THR  51  -9.102  -3.358  -9.337
  365   HG23  THR  51          3HG2      THR  51  -9.345  -2.641 -10.930
  366    H    CYS  52           H        CYS  52  -7.608   0.841  -8.494
  367    HA   CYS  52           HA       CYS  52 -10.270   1.997  -9.011
  368    HB2  CYS  52           1HB      CYS  52 -10.782   1.912  -6.702
  369    HB3  CYS  52           2HB      CYS  52 -10.087   0.340  -7.083
  370    H    GLY  53           H        GLY  53  -7.128   2.536  -7.444
  371    HA2  GLY  53           1HA      GLY  53  -5.849   4.474  -7.447
  372    HA3  GLY  53           2HA      GLY  53  -7.140   5.289  -8.317
  373    H    SER  54           H        SER  54  -6.815   3.730  -5.124
  374    HA   SER  54           HA       SER  54  -7.914   6.195  -3.937
  375    HB2  SER  54           1HB      SER  54  -8.367   3.359  -2.977
  376    HB3  SER  54           2HB      SER  54  -9.030   4.821  -2.248
  377    HG   SER  54           HG       SER  54 -10.589   4.691  -3.632
  378    H    HIS  55           H        HIS  55  -5.909   3.328  -3.335
  379    HA   HIS  55           HA       HIS  55  -4.714   4.497  -0.984
  380    HB2  HIS  55           1HB      HIS  55  -4.083   1.972  -2.523
  381    HB3  HIS  55           2HB      HIS  55  -3.275   2.449  -1.033
  382    HD1  HIS  55           1HD      HIS  55  -4.154   0.382   0.230
  383    HD2  HIS  55           2HD      HIS  55  -7.147   2.839  -1.276
  384    HE1  HIS  55           1HE      HIS  55  -6.278  -0.395   1.329
  385    HE2  HIS  55           2HE      HIS  55  -8.088   1.051   0.339
  386    H    GLY  56           H        GLY  56  -2.490   5.027  -0.747
  387    HA2  GLY  56           1HA      GLY  56  -0.938   5.366  -3.205
  388    HA3  GLY  56           2HA      GLY  56  -1.326   6.814  -2.288
  389    H    THR  57           H        THR  57   1.069   4.716  -2.855
  390    HA   THR  57           HA       THR  57   2.428   5.414  -0.384
  391    HB   THR  57           HB       THR  57   1.281   3.164  -0.029
  392    HG1  THR  57           1HG      THR  57   3.430   4.065   0.905
  393   HG21  THR  57          1HG2      THR  57   1.612   1.506  -1.478
  394   HG22  THR  57          2HG2      THR  57   3.357   1.612  -1.238
  395   HG23  THR  57          3HG2      THR  57   2.575   2.596  -2.475
  396    H    HIS  58           H        HIS  58   4.765   4.608  -0.471
  397    HA   HIS  58           HA       HIS  58   5.966   5.582  -2.829
  398    HB2  HIS  58           1HB      HIS  58   7.313   3.851  -0.755
  399    HB3  HIS  58           2HB      HIS  58   8.063   5.045  -1.810
  400    HD2  HIS  58           2HD      HIS  58   8.301   7.517  -0.705
  401    HE1  HIS  58           1HE      HIS  58   5.673   6.929   2.573
  402    HE2  HIS  58           2HE      HIS  58   7.247   8.528   1.429
  403    H    ARG  59           H        ARG  59   7.915   4.092  -3.720
  404    HA   ARG  59           HA       ARG  59   6.569   1.983  -5.152
  405    HB2  ARG  59           1HB      ARG  59   8.296   3.637  -6.096
  406    HB3  ARG  59           2HB      ARG  59   9.505   2.622  -5.321
  407    HG2  ARG  59           1HG      ARG  59   7.516   1.304  -7.083
  408    HG3  ARG  59           2HG      ARG  59   8.782   2.275  -7.837
  409    HD2  ARG  59           1HD      ARG  59   9.195  -0.019  -5.922
  410    HD3  ARG  59           2HD      ARG  59   9.458  -0.060  -7.665
  411    HE   ARG  59           HE       ARG  59  11.011   2.003  -6.611
  412   HH11  ARG  59          2HH1      ARG  59  10.803  -1.469  -6.469
  413   HH12  ARG  59          1HH1      ARG  59  12.498  -1.690  -6.185
  414   HH21  ARG  59          2HH2      ARG  59  13.244   1.726  -6.237
  415   HH22  ARG  59          1HH2      ARG  59  13.885   0.128  -6.053
  416    H    ASP  60           H        ASP  60   9.739   1.987  -3.520
  417    HA   ASP  60           HA       ASP  60   9.845  -0.804  -3.214
  418    HB2  ASP  60           1HB      ASP  60  11.723   1.004  -3.038
  419    HB3  ASP  60           2HB      ASP  60  11.274   1.045  -1.335
  420    H    CYS  61           H        CYS  61   8.644   1.751  -1.114
  421    HA   CYS  61           HA       CYS  61   8.374   0.463   1.288
  422    HB2  CYS  61           1HB      CYS  61   7.771   2.828   0.886
  423    HB3  CYS  61           2HB      CYS  61   6.327   2.300   0.029
  424    H    SER  62           H        SER  62   6.232   0.246  -1.520
  425    HA   SER  62           HA       SER  62   4.466  -1.612  -0.174
  426    HB2  SER  62           1HB      SER  62   3.609  -1.712  -2.714
  427    HB3  SER  62           2HB      SER  62   3.173  -0.398  -1.621
  428    HG   SER  62           HG       SER  62   3.930   0.553  -3.458
  429    H    SER  63           H        SER  63   7.253  -2.377  -0.503
  430    HA   SER  63           HA       SER  63   8.594  -4.016  -1.435
  431    HB2  SER  63           1HB      SER  63   6.908  -4.993   0.364
  432    HB3  SER  63           2HB      SER  63   6.300  -5.887  -1.029
  433    HG   SER  63           HG       SER  63   8.924  -5.903   0.040
  434    H    LEU  64           H        LEU  64   7.539  -2.669  -3.541
  435    HA   LEU  64           HA       LEU  64   6.243  -4.508  -5.358
  436    HB2  LEU  64           1HB      LEU  64   7.233  -1.683  -5.610
  437    HB3  LEU  64           2HB      LEU  64   6.615  -2.588  -6.991
  438    HG   LEU  64           HG       LEU  64   5.021  -2.010  -4.497
  439   HD11  LEU  64          1HD1      LEU  64   4.603   0.027  -5.260
  440   HD12  LEU  64          2HD1      LEU  64   4.075  -0.634  -6.808
  441   HD13  LEU  64          3HD1      LEU  64   5.773  -0.231  -6.555
  442   HD21  LEU  64          1HD2      LEU  64   3.351  -3.188  -5.411
  443   HD22  LEU  64          2HD2      LEU  64   4.611  -3.920  -6.405
  444   HD23  LEU  64          3HD2      LEU  64   3.669  -2.566  -7.031
  445    H    ARG  65           H        ARG  65   7.299  -4.259  -7.745
  446    HA   ARG  65           HA       ARG  65   9.940  -5.483  -7.460
  447    HB2  ARG  65           1HB      ARG  65   7.747  -5.640  -9.457
  448    HB3  ARG  65           2HB      ARG  65   9.388  -5.828 -10.061
  449    HG2  ARG  65           1HG      ARG  65   8.338  -7.976  -9.545
  450    HG3  ARG  65           2HG      ARG  65   9.766  -7.681  -8.551
  451    HD2  ARG  65           1HD      ARG  65   8.319  -8.406  -6.941
  452    HD3  ARG  65           2HD      ARG  65   7.974  -6.677  -6.895
  453    HE   ARG  65           HE       ARG  65   6.308  -8.186  -8.703
  454   HH11  ARG  65          2HH1      ARG  65   6.710  -6.985  -5.460
  455   HH12  ARG  65          1HH1      ARG  65   5.019  -7.046  -5.088
  456   HH21  ARG  65          2HH2      ARG  65   4.079  -8.271  -8.226
  457   HH22  ARG  65          1HH2      ARG  65   3.524  -7.778  -6.662
  458    HA   PRO  66           HA       PRO  66  12.194  -2.168  -9.240
  459    HB2  PRO  66           1HB      PRO  66  13.958  -3.449 -10.859
  460    HB3  PRO  66           2HB      PRO  66  14.072  -3.485  -9.095
  461    HG2  PRO  66           1HG      PRO  66  12.940  -5.532 -10.963
  462    HG3  PRO  66           2HG      PRO  66  13.975  -5.765  -9.542
  463    HD2  PRO  66           1HD      PRO  66  11.297  -6.160  -9.474
  464    HD3  PRO  66           2HD      PRO  66  12.211  -5.574  -8.070
  465    H    ASN  67           H        ASN  67  11.424  -0.763 -10.678
  466    HA   ASN  67           HA       ASN  67  10.802   0.178 -12.658
  467    HB2  ASN  67           1HB      ASN  67  11.597  -2.406 -14.005
  468    HB3  ASN  67           2HB      ASN  67  11.481  -0.806 -14.732
  469   HD21  ASN  67          1HD2      ASN  67  13.445  -3.017 -13.047
  470   HD22  ASN  67          2HD2      ASN  67  14.849  -2.021 -12.906
  471    H    SER  68           H        SER  68   8.857  -0.944 -11.087
  472    HA   SER  68           HA       SER  68   7.156  -2.713 -12.547
  473    HB2  SER  68           1HB      SER  68   6.957  -2.746 -10.170
  474    HB3  SER  68           2HB      SER  68   6.720  -1.000 -10.097
  475    HG   SER  68           HG       SER  68   4.681  -1.498 -10.146
  476    H    LYS  69           H        LYS  69   4.963  -2.173 -13.248
  477    HA   LYS  69           HA       LYS  69   4.951   0.377 -14.674
  478    HB2  LYS  69           1HB      LYS  69   4.530  -1.729 -15.919
  479    HB3  LYS  69           2HB      LYS  69   3.090  -1.991 -14.944
  480    HG2  LYS  69           1HG      LYS  69   1.953  -0.208 -15.925
  481    HG3  LYS  69           2HG      LYS  69   3.437   0.510 -16.556
  482    HD2  LYS  69           1HD      LYS  69   2.615  -2.214 -17.467
  483    HD3  LYS  69           2HD      LYS  69   1.818  -0.793 -18.146
  484    HE2  LYS  69           1HE      LYS  69   3.554  -1.092 -19.628
  485    HE3  LYS  69           2HE      LYS  69   4.263   0.055 -18.492
  486    HZ1  LYS  69           1HZ      LYS  69   4.622  -2.779 -17.907
  487    HZ2  LYS  69           2HZ      LYS  69   5.687  -1.484 -17.682
  488    HZ3  LYS  69           3HZ      LYS  69   5.488  -2.158 -19.221
  489    H    LYS  70           H        LYS  70   2.422  -1.574 -13.085
  490    HA   LYS  70           HA       LYS  70   1.461   0.868 -11.767
  491    HB2  LYS  70           1HB      LYS  70  -0.819   0.399 -12.328
  492    HB3  LYS  70           2HB      LYS  70   0.111   0.378 -13.820
  493    HG2  LYS  70           1HG      LYS  70   0.021  -1.971 -13.963
  494    HG3  LYS  70           2HG      LYS  70  -0.546  -2.126 -12.299
  495    HD2  LYS  70           1HD      LYS  70  -2.557  -0.696 -13.154
  496    HD3  LYS  70           2HD      LYS  70  -2.037  -1.263 -14.743
  497    HE2  LYS  70           1HE      LYS  70  -3.720  -2.756 -13.905
  498    HE3  LYS  70           2HE      LYS  70  -2.168  -3.592 -13.892
  499    HZ1  LYS  70           1HZ      LYS  70  -3.617  -3.834 -11.851
  500    HZ2  LYS  70           2HZ      LYS  70  -3.230  -2.227 -11.493
  501    HZ3  LYS  70           3HZ      LYS  70  -2.007  -3.392 -11.581
  502    H    TRP  71           H        TRP  71   0.274   0.523  -9.828
  503    HA   TRP  71           HA       TRP  71   0.571  -2.181  -8.695
  504    HB2  TRP  71           1HB      TRP  71   2.188  -1.077  -7.478
  505    HB3  TRP  71           2HB      TRP  71   1.359   0.474  -7.583
  506    HD1  TRP  71           HD       TRP  71   1.259  -2.826  -5.600
  507    HE1  TRP  71           1HE      TRP  71   0.078  -2.384  -3.356
  508    HE3  TRP  71           3HE      TRP  71  -0.225   2.000  -6.401
  509    HZ2  TRP  71           2HZ      TRP  71  -1.302  -0.269  -2.094
  510    HZ3  TRP  71           3HZ      TRP  71  -1.472   3.161  -4.625
  511    HH2  TRP  71           HH       TRP  71  -1.998   2.048  -2.517
  512    H    GLU  72           H        GLU  72  -1.014  -2.849  -7.206
  513    HA   GLU  72           HA       GLU  72  -3.481  -1.237  -7.268
  514    HB2  GLU  72           1HB      GLU  72  -3.049  -4.204  -7.454
  515    HB3  GLU  72           2HB      GLU  72  -4.583  -3.555  -6.892
  516    HG2  GLU  72           1HG      GLU  72  -4.951  -2.433  -8.964
  517    HG3  GLU  72           2HG      GLU  72  -3.325  -2.823  -9.522
  518    H    CYS  73           H        CYS  73  -4.894  -1.428  -5.415
  519    HA   CYS  73           HA       CYS  73  -3.371  -1.570  -2.943
  520    HB2  CYS  73           1HB      CYS  73  -5.234  -0.457  -1.913
  521    HB3  CYS  73           2HB      CYS  73  -4.913   0.343  -3.448
  522    H    ASN  74           H        ASN  74  -4.736  -2.444  -0.999
  523    HA   ASN  74           HA       ASN  74  -4.935  -5.223  -1.298
  524    HB2  ASN  74           1HB      ASN  74  -4.469  -4.291   0.868
  525    HB3  ASN  74           2HB      ASN  74  -5.980  -3.385   0.862
  526   HD21  ASN  74          1HD2      ASN  74  -4.776  -5.543   2.612
  527   HD22  ASN  74          2HD2      ASN  74  -6.044  -6.707   2.769
  528    H    GLU  75           H        GLU  75  -7.524  -2.811  -0.858
  529    HA   GLU  75           HA       GLU  75  -9.746  -4.364  -0.917
  530    HB2  GLU  75           1HB      GLU  75  -9.688  -1.865  -0.768
  531    HB3  GLU  75           2HB      GLU  75  -9.466  -1.813  -2.511
  532    HG2  GLU  75           1HG      GLU  75 -11.613  -2.741  -2.900
  533    HG3  GLU  75           2HG      GLU  75 -11.820  -3.133  -1.194
  534    H    CYS  76           H        CYS  76  -7.799  -3.408  -3.707
  535    HA   CYS  76           HA       CYS  76  -9.524  -4.762  -5.579
  536    HB2  CYS  76           1HB      CYS  76  -6.821  -3.444  -5.866
  537    HB3  CYS  76           2HB      CYS  76  -7.667  -4.213  -7.205
  538    H    LEU  77           H        LEU  77  -6.131  -5.221  -4.572
  539    HA   LEU  77           HA       LEU  77  -5.599  -7.588  -5.854
  540    HB2  LEU  77           1HB      LEU  77  -4.685  -6.586  -3.170
  541    HB3  LEU  77           2HB      LEU  77  -4.051  -8.059  -3.901
  542    HG   LEU  77           HG       LEU  77  -3.867  -5.335  -5.179
  543   HD11  LEU  77          1HD1      LEU  77  -2.647  -5.571  -2.977
  544   HD12  LEU  77          2HD1      LEU  77  -1.660  -5.144  -4.374
  545   HD13  LEU  77          3HD1      LEU  77  -1.656  -6.799  -3.764
  546   HD21  LEU  77          1HD2      LEU  77  -3.374  -6.592  -6.959
  547   HD22  LEU  77          2HD2      LEU  77  -3.196  -8.056  -5.991
  548   HD23  LEU  77          3HD2      LEU  77  -1.849  -6.926  -6.137
  549    HA   PRO  78           HA       PRO  78  -8.126 -10.701  -4.055
  550    HB2  PRO  78           1HB      PRO  78  -6.533 -12.872  -4.403
  551    HB3  PRO  78           2HB      PRO  78  -7.385 -12.082  -5.735
  552    HG2  PRO  78           1HG      PRO  78  -4.529 -11.803  -4.882
  553    HG3  PRO  78           2HG      PRO  78  -5.199 -11.952  -6.517
  554    HD2  PRO  78           1HD      PRO  78  -4.445  -9.575  -5.462
  555    HD3  PRO  78           2HD      PRO  78  -5.788  -9.726  -6.614
  556    H    ALA  79           H        ALA  79  -7.966  -9.839  -1.877
  557    HA   ALA  79           HA       ALA  79  -6.945 -11.737  -0.033
  558    HB1  ALA  79           1HB      ALA  79  -4.809 -10.904  -0.186
  559    HB2  ALA  79           2HB      ALA  79  -5.356  -9.257  -0.503
  560    HB3  ALA  79           3HB      ALA  79  -5.460  -9.922   1.127
  561    H    SER  80           H        SER  80  -7.774 -11.452   2.032
  562    HA   SER  80           HA       SER  80  -9.956  -9.543   2.206
  563    HB2  SER  80           1HB      SER  80  -9.106 -11.875   3.924
  564    HB3  SER  80           2HB      SER  80 -10.415 -10.787   4.384
  565    HG   SER  80           HG       SER  80 -10.656 -12.874   2.903
  566    H    GLY  81           H        GLY  81 -10.239  -8.072   3.932
  567    HA2  GLY  81           1HA      GLY  81  -8.602  -7.610   6.088
  568    HA3  GLY  81           2HA      GLY  81  -7.819  -6.782   4.750
  569    HA   PRO  82           HA       PRO  82 -11.362  -4.271   6.735
  570    HB2  PRO  82           1HB      PRO  82  -9.880  -2.590   8.268
  571    HB3  PRO  82           2HB      PRO  82 -10.526  -4.122   8.869
  572    HG2  PRO  82           1HG      PRO  82  -7.771  -3.483   7.886
  573    HG3  PRO  82           2HG      PRO  82  -8.262  -4.441   9.296
  574    HD2  PRO  82           1HD      PRO  82  -7.483  -5.574   6.963
  575    HD3  PRO  82           2HD      PRO  82  -8.695  -6.316   8.028
  576    H    SER  83           H        SER  83 -11.992  -2.806   5.291
  577    HA   SER  83           HA       SER  83 -10.218  -1.535   3.485
  578    HB2  SER  83           1HB      SER  83 -12.241  -0.255   2.775
  579    HB3  SER  83           2HB      SER  83 -12.501  -1.999   2.820
  580    HG   SER  83           HG       SER  83 -13.905  -0.158   4.043
  581    H    SER  84           H        SER  84  -8.714  -0.521   4.937
  582    HA   SER  84           HA       SER  84  -9.732   1.841   6.349
  583    HB2  SER  84           1HB      SER  84  -7.089   0.382   6.525
  584    HB3  SER  84           2HB      SER  84  -7.435   1.886   7.378
  585    HG   SER  84           HG       SER  84  -7.812  -0.198   8.522
  586    H    GLY  85           H        GLY  85 -10.020   3.234   4.598
  587    HA2  GLY  85           1HA      GLY  85  -7.500   4.258   3.471
  588    HA3  GLY  85           2HA      GLY  85  -8.855   3.911   2.407
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1 -11.845  20.925  39.029
    2    HA2  GLY   1           1HA      GLY   1 -13.665  19.588  40.721
    3    HA3  GLY   1           2HA      GLY   1 -14.416  19.833  39.151
    4    H    SER   2           H        SER   2 -14.466  17.758  38.433
    5    HA   SER   2           HA       SER   2 -11.887  16.581  37.737
    6    HB2  SER   2           1HB      SER   2 -12.299  14.479  38.714
    7    HB3  SER   2           2HB      SER   2 -12.786  15.628  39.960
    8    HG   SER   2           HG       SER   2 -14.481  14.243  38.153
    9    H    SER   3           H        SER   3 -12.344  14.489  36.386
   10    HA   SER   3           HA       SER   3 -14.754  14.752  34.760
   11    HB2  SER   3           1HB      SER   3 -11.962  15.240  33.807
   12    HB3  SER   3           2HB      SER   3 -13.103  14.455  32.715
   13    HG   SER   3           HG       SER   3 -13.700  16.431  32.311
   14    H    GLY   4           H        GLY   4 -14.620  12.959  32.943
   15    HA2  GLY   4           1HA      GLY   4 -13.503  10.513  34.162
   16    HA3  GLY   4           2HA      GLY   4 -15.153  10.560  33.559
   17    H    SER   5           H        SER   5 -14.533   8.762  32.206
   18    HA   SER   5           HA       SER   5 -13.750   9.623  29.593
   19    HB2  SER   5           1HB      SER   5 -11.805   8.183  31.326
   20    HB3  SER   5           2HB      SER   5 -11.903   7.686  29.637
   21    HG   SER   5           HG       SER   5 -11.857  10.390  29.905
   22    H    SER   6           H        SER   6 -14.936   8.497  28.208
   23    HA   SER   6           HA       SER   6 -15.510   5.678  28.744
   24    HB2  SER   6           1HB      SER   6 -17.846   5.884  28.541
   25    HB3  SER   6           2HB      SER   6 -17.392   7.235  29.579
   26    HG   SER   6           HG       SER   6 -18.712   7.344  27.316
   27    H    GLY   7           H        GLY   7 -16.430   4.565  26.833
   28    HA2  GLY   7           1HA      GLY   7 -14.903   4.776  24.586
   29    HA3  GLY   7           2HA      GLY   7 -16.530   4.111  24.574
   30    H    GLU   8           H        GLU   8 -15.536   5.361  22.346
   31    HA   GLU   8           HA       GLU   8 -17.423   7.542  22.070
   32    HB2  GLU   8           1HB      GLU   8 -15.269   8.581  22.854
   33    HB3  GLU   8           2HB      GLU   8 -14.521   7.999  21.373
   34    HG2  GLU   8           1HG      GLU   8 -15.623   9.504  20.055
   35    HG3  GLU   8           2HG      GLU   8 -16.987   9.642  21.162
   36    H    LEU   9           H        LEU   9 -17.611   8.258  19.785
   37    HA   LEU   9           HA       LEU   9 -17.174   5.969  18.000
   38    HB2  LEU   9           1HB      LEU   9 -19.078   8.297  17.807
   39    HB3  LEU   9           2HB      LEU   9 -18.909   7.039  16.584
   40    HG   LEU   9           HG       LEU   9 -19.771   6.512  19.425
   41   HD11  LEU   9          1HD1      LEU   9 -21.902   6.109  17.648
   42   HD12  LEU   9          2HD1      LEU   9 -21.233   7.695  17.263
   43   HD13  LEU   9          3HD1      LEU   9 -21.761   7.336  18.907
   44   HD21  LEU   9          1HD2      LEU   9 -20.559   4.675  17.305
   45   HD22  LEU   9          2HD2      LEU   9 -19.838   4.347  18.881
   46   HD23  LEU   9          3HD2      LEU   9 -18.812   4.788  17.515
   47    H    GLU  10           H        GLU  10 -16.713   6.470  15.705
   48    HA   GLU  10           HA       GLU  10 -14.745   8.641  15.540
   49    HB2  GLU  10           1HB      GLU  10 -15.042   5.997  14.182
   50    HB3  GLU  10           2HB      GLU  10 -14.193   7.286  13.341
   51    HG2  GLU  10           1HG      GLU  10 -12.909   7.459  15.640
   52    HG3  GLU  10           2HG      GLU  10 -13.425   5.780  15.777
   53    HA   PRO  11           HA       PRO  11 -18.064  10.526  13.078
   54    HB2  PRO  11           1HB      PRO  11 -17.108  13.052  13.350
   55    HB3  PRO  11           2HB      PRO  11 -18.095  12.261  14.584
   56    HG2  PRO  11           1HG      PRO  11 -15.123  12.593  14.462
   57    HG3  PRO  11           2HG      PRO  11 -16.214  12.788  15.846
   58    HD2  PRO  11           1HD      PRO  11 -14.731  10.555  15.463
   59    HD3  PRO  11           2HD      PRO  11 -16.330  10.519  16.234
   60    H    GLY  12           H        GLY  12 -14.614  10.527  12.757
   61    HA2  GLY  12           1HA      GLY  12 -14.696  11.792  10.129
   62    HA3  GLY  12           2HA      GLY  12 -13.254  11.292  10.999
   63    H    ALA  13           H        ALA  13 -16.171   9.479  10.082
   64    HA   ALA  13           HA       ALA  13 -14.414   7.528   8.752
   65    HB1  ALA  13           1HB      ALA  13 -15.672   5.858   9.572
   66    HB2  ALA  13           2HB      ALA  13 -16.203   7.071  10.738
   67    HB3  ALA  13           3HB      ALA  13 -17.183   6.729   9.312
   68    H    PHE  14           H        PHE  14 -15.055   9.819   7.332
   69    HA   PHE  14           HA       PHE  14 -16.941   8.776   5.322
   70    HB2  PHE  14           1HB      PHE  14 -17.564  10.918   6.695
   71    HB3  PHE  14           2HB      PHE  14 -16.420  11.714   5.619
   72    HD1  PHE  14           1HD      PHE  14 -19.449   9.561   5.594
   73    HD2  PHE  14           2HD      PHE  14 -17.107  12.459   3.537
   74    HE1  PHE  14           1HE      PHE  14 -21.206   9.761   3.883
   75    HE2  PHE  14           2HE      PHE  14 -18.861  12.665   1.823
   76    HZ   PHE  14           HZ       PHE  14 -20.914  11.315   1.995
   77    H    SER  15           H        SER  15 -16.547   9.972   3.137
   78    HA   SER  15           HA       SER  15 -13.644  10.132   2.660
   79    HB2  SER  15           1HB      SER  15 -14.032   9.044   0.461
   80    HB3  SER  15           2HB      SER  15 -14.452   7.994   1.815
   81    HG   SER  15           HG       SER  15 -16.659   8.721   1.484
   82    H    GLU  16           H        GLU  16 -13.058  11.327   0.686
   83    HA   GLU  16           HA       GLU  16 -15.031  13.115  -0.435
   84    HB2  GLU  16           1HB      GLU  16 -13.840  15.170   0.216
   85    HB3  GLU  16           2HB      GLU  16 -14.477  14.308   1.609
   86    HG2  GLU  16           1HG      GLU  16 -12.398  14.836   2.369
   87    HG3  GLU  16           2HG      GLU  16 -12.080  13.254   1.661
   88    H    LEU  17           H        LEU  17 -13.984  14.626  -2.052
   89    HA   LEU  17           HA       LEU  17 -11.610  13.361  -3.251
   90    HB2  LEU  17           1HB      LEU  17 -13.971  14.519  -4.724
   91    HB3  LEU  17           2HB      LEU  17 -12.540  13.795  -5.455
   92    HG   LEU  17           HG       LEU  17 -14.446  12.262  -3.698
   93   HD11  LEU  17          1HD1      LEU  17 -15.762  12.973  -5.535
   94   HD12  LEU  17          2HD1      LEU  17 -15.271  11.315  -5.876
   95   HD13  LEU  17          3HD1      LEU  17 -14.459  12.657  -6.680
   96   HD21  LEU  17          1HD2      LEU  17 -12.072  11.458  -4.078
   97   HD22  LEU  17          2HD2      LEU  17 -12.521  11.241  -5.770
   98   HD23  LEU  17          3HD2      LEU  17 -13.360  10.334  -4.511
   99    H    TYR  18           H        TYR  18 -13.219  16.232  -2.288
  100    HA   TYR  18           HA       TYR  18 -12.333  18.291  -3.728
  101    HB2  TYR  18           1HB      TYR  18 -12.075  18.087  -0.721
  102    HB3  TYR  18           2HB      TYR  18 -12.034  19.590  -1.638
  103    HD1  TYR  18           2HD      TYR  18 -14.096  20.250  -2.958
  104    HD2  TYR  18           1HD      TYR  18 -14.121  17.129  -0.067
  105    HE1  TYR  18           2HE      TYR  18 -16.546  20.409  -2.815
  106    HE2  TYR  18           1HE      TYR  18 -16.571  17.278   0.083
  107    HH   TYR  18           HH       TYR  18 -18.462  18.073  -1.430
  108    H    GLN  19           H        GLN  19 -10.288  16.398  -1.548
  109    HA   GLN  19           HA       GLN  19  -7.933  17.716  -2.730
  110    HB2  GLN  19           1HB      GLN  19  -8.295  16.503   0.012
  111    HB3  GLN  19           2HB      GLN  19  -6.742  17.016  -0.633
  112    HG2  GLN  19           1HG      GLN  19  -7.786  19.304  -0.936
  113    HG3  GLN  19           2HG      GLN  19  -9.120  18.710   0.053
  114   HE21  GLN  19          1HE2      GLN  19  -7.057  20.816   0.487
  115   HE22  GLN  19          2HE2      GLN  19  -6.338  20.427   2.009
  116    H    ARG  20           H        ARG  20  -6.043  16.390  -3.059
  117    HA   ARG  20           HA       ARG  20  -6.610  13.960  -4.350
  118    HB2  ARG  20           1HB      ARG  20  -4.097  15.357  -3.518
  119    HB3  ARG  20           2HB      ARG  20  -4.008  13.705  -4.114
  120    HG2  ARG  20           1HG      ARG  20  -5.433  15.822  -5.676
  121    HG3  ARG  20           2HG      ARG  20  -3.679  15.643  -5.770
  122    HD2  ARG  20           1HD      ARG  20  -3.915  13.355  -6.509
  123    HD3  ARG  20           2HD      ARG  20  -5.663  13.435  -6.299
  124    HE   ARG  20           HE       ARG  20  -5.828  14.565  -8.295
  125   HH11  ARG  20          2HH1      ARG  20  -2.494  14.411  -7.303
  126   HH12  ARG  20          1HH1      ARG  20  -1.882  15.000  -8.813
  127   HH21  ARG  20          2HH2      ARG  20  -5.034  15.343 -10.287
  128   HH22  ARG  20          1HH2      ARG  20  -3.328  15.531 -10.509
  129    H    TYR  21           H        TYR  21  -6.204  11.823  -3.791
  130    HA   TYR  21           HA       TYR  21  -6.202  11.311  -0.914
  131    HB2  TYR  21           1HB      TYR  21  -7.984  10.287  -2.262
  132    HB3  TYR  21           2HB      TYR  21  -6.776   9.452  -3.232
  133    HD1  TYR  21           2HD      TYR  21  -5.059   8.012  -1.762
  134    HD2  TYR  21           1HD      TYR  21  -9.001   9.089  -0.578
  135    HE1  TYR  21           2HE      TYR  21  -5.096   6.122  -0.189
  136    HE2  TYR  21           1HE      TYR  21  -9.049   7.202   0.999
  137    HH   TYR  21           HH       TYR  21  -6.367   5.573   1.998
  138    H    ARG  22           H        ARG  22  -4.512  10.481   0.130
  139    HA   ARG  22           HA       ARG  22  -2.601   8.763  -1.150
  140    HB2  ARG  22           1HB      ARG  22  -0.656  10.295  -0.522
  141    HB3  ARG  22           2HB      ARG  22  -1.587  10.732  -1.949
  142    HG2  ARG  22           1HG      ARG  22  -2.519  12.573  -0.949
  143    HG3  ARG  22           2HG      ARG  22  -2.335  11.916   0.678
  144    HD2  ARG  22           1HD      ARG  22   0.013  12.343   0.664
  145    HD3  ARG  22           2HD      ARG  22  -0.016  12.754  -1.050
  146    HE   ARG  22           HE       ARG  22  -0.622  14.482   1.137
  147   HH11  ARG  22          2HH1      ARG  22  -1.375  13.803  -2.194
  148   HH12  ARG  22          1HH1      ARG  22  -1.859  15.428  -2.552
  149   HH21  ARG  22          2HH2      ARG  22  -1.257  16.625   0.678
  150   HH22  ARG  22          1HH2      ARG  22  -1.791  17.032  -0.918
  151    H    HIS  23           H        HIS  23  -2.586   7.238   0.376
  152    HA   HIS  23           HA       HIS  23  -1.656   7.950   3.040
  153    HB2  HIS  23           1HB      HIS  23  -4.009   8.052   3.424
  154    HB3  HIS  23           2HB      HIS  23  -4.290   6.576   2.505
  155    HD1  HIS  23           1HD      HIS  23  -3.378   4.327   3.659
  156    HD2  HIS  23           2HD      HIS  23  -3.595   7.683   6.098
  157    HE1  HIS  23           1HE      HIS  23  -3.262   3.455   6.015
  158    HE2  HIS  23           2HE      HIS  23  -3.481   5.496   7.474
  159    H    CYS  24           H        CYS  24   0.136   6.750   3.104
  160    HA   CYS  24           HA       CYS  24   0.847   4.540   1.722
  161    HB2  CYS  24           1HB      CYS  24   2.502   5.483   3.097
  162    HB3  CYS  24           2HB      CYS  24   1.503   5.354   4.541
  163    H    ASP  25           H        ASP  25  -0.648   2.979   1.319
  164    HA   ASP  25           HA       ASP  25  -1.684   1.496   3.646
  165    HB2  ASP  25           1HB      ASP  25  -2.936   2.298   1.077
  166    HB3  ASP  25           2HB      ASP  25  -3.341   0.695   1.685
  167    H    ALA  26           H        ALA  26   0.884   1.026   2.559
  168    HA   ALA  26           HA       ALA  26   0.668  -1.340   0.886
  169    HB1  ALA  26           1HB      ALA  26   3.315  -1.112   1.650
  170    HB2  ALA  26           2HB      ALA  26   2.597  -0.492   0.162
  171    HB3  ALA  26           3HB      ALA  26   2.752   0.558   1.571
  172    HA   PRO  27           HA       PRO  27   1.065  -4.432   3.975
  173    HB2  PRO  27           1HB      PRO  27   2.995  -6.080   3.011
  174    HB3  PRO  27           2HB      PRO  27   1.378  -5.978   2.305
  175    HG2  PRO  27           1HG      PRO  27   3.923  -4.685   1.405
  176    HG3  PRO  27           2HG      PRO  27   2.669  -5.481   0.436
  177    HD2  PRO  27           1HD      PRO  27   2.843  -2.789   0.667
  178    HD3  PRO  27           2HD      PRO  27   1.293  -3.632   0.470
  179    H    ILE  28           H        ILE  28   4.332  -3.507   2.869
  180    HA   ILE  28           HA       ILE  28   5.127  -3.268   5.691
  181    HB   ILE  28           HB       ILE  28   6.841  -4.470   3.514
  182   HG12  ILE  28          1HG1      ILE  28   4.949  -5.914   4.343
  183   HG13  ILE  28          2HG1      ILE  28   6.556  -6.584   4.602
  184   HG21  ILE  28          1HG2      ILE  28   8.482  -4.850   5.213
  185   HG22  ILE  28          2HG2      ILE  28   8.033  -3.146   5.258
  186   HG23  ILE  28          3HG2      ILE  28   7.394  -4.259   6.468
  187   HD11  ILE  28          1HD1      ILE  28   4.681  -6.563   6.481
  188   HD12  ILE  28          2HD1      ILE  28   6.401  -6.434   6.852
  189   HD13  ILE  28          3HD1      ILE  28   5.399  -4.984   6.801
  190    H    CYS  29           H        CYS  29   6.330  -1.514   6.194
  191    HA   CYS  29           HA       CYS  29   7.138   0.239   3.967
  192    HB2  CYS  29           1HB      CYS  29   5.227   0.914   5.659
  193    HB3  CYS  29           2HB      CYS  29   6.588   1.330   6.696
  194    H    LEU  30           H        LEU  30   9.176   1.037   3.945
  195    HA   LEU  30           HA       LEU  30  10.950   0.189   6.137
  196    HB2  LEU  30           1HB      LEU  30  11.762   0.852   3.317
  197    HB3  LEU  30           2HB      LEU  30  12.741   0.086   4.566
  198    HG   LEU  30           HG       LEU  30  10.272  -1.313   3.675
  199   HD11  LEU  30          1HD1      LEU  30  11.948  -2.395   1.942
  200   HD12  LEU  30          2HD1      LEU  30  12.645  -0.776   1.974
  201   HD13  LEU  30          3HD1      LEU  30  10.955  -0.998   1.525
  202   HD21  LEU  30          1HD2      LEU  30  13.005  -2.441   4.172
  203   HD22  LEU  30          2HD2      LEU  30  11.435  -3.234   4.303
  204   HD23  LEU  30          3HD2      LEU  30  11.922  -2.038   5.504
  205    H    TYR  31           H        TYR  31   9.836   2.862   4.230
  206    HA   TYR  31           HA       TYR  31  11.853   4.731   4.736
  207    HB2  TYR  31           1HB      TYR  31   9.727   4.849   3.206
  208    HB3  TYR  31           2HB      TYR  31   8.976   5.564   4.628
  209    HD1  TYR  31           2HD      TYR  31  12.108   5.923   2.613
  210    HD2  TYR  31           1HD      TYR  31   9.014   7.861   4.799
  211    HE1  TYR  31           2HE      TYR  31  13.059   8.110   2.009
  212    HE2  TYR  31           1HE      TYR  31   9.956  10.053   4.199
  213    HH   TYR  31           HH       TYR  31  13.051  10.402   2.797
  214    H    GLU  32           H        GLU  32  12.291   6.102   6.392
  215    HA   GLU  32           HA       GLU  32  11.541   5.417   8.995
  216    HB2  GLU  32           1HB      GLU  32  12.759   7.935   7.868
  217    HB3  GLU  32           2HB      GLU  32  12.512   7.688   9.590
  218    HG2  GLU  32           1HG      GLU  32  14.788   7.165   8.977
  219    HG3  GLU  32           2HG      GLU  32  13.946   5.713   9.515
  220    H    GLN  33           H        GLN  33  10.565   8.274   7.094
  221    HA   GLN  33           HA       GLN  33   8.824   9.458   8.825
  222    HB2  GLN  33           1HB      GLN  33   9.488   9.960   6.297
  223    HB3  GLN  33           2HB      GLN  33   7.920   9.221   5.997
  224    HG2  GLN  33           1HG      GLN  33   7.676  11.605   6.128
  225    HG3  GLN  33           2HG      GLN  33   6.886  10.856   7.515
  226   HE21  GLN  33          1HE2      GLN  33   9.963  12.305   6.531
  227   HE22  GLN  33          2HE2      GLN  33  10.297  13.052   8.052
  228    H    GLY  34           H        GLY  34   7.777   7.139   6.314
  229    HA2  GLY  34           1HA      GLY  34   6.290   5.346   6.606
  230    HA3  GLY  34           2HA      GLY  34   5.905   5.954   8.210
  231    H    ARG  35           H        ARG  35   5.135   8.528   7.697
  232    HA   ARG  35           HA       ARG  35   2.471   8.291   7.015
  233    HB2  ARG  35           1HB      ARG  35   2.324  10.575   7.273
  234    HB3  ARG  35           2HB      ARG  35   3.834  10.251   8.114
  235    HG2  ARG  35           1HG      ARG  35   4.949  10.752   5.846
  236    HG3  ARG  35           2HG      ARG  35   3.403  11.493   5.429
  237    HD2  ARG  35           1HD      ARG  35   4.650  12.229   8.023
  238    HD3  ARG  35           2HD      ARG  35   5.372  12.873   6.549
  239    HE   ARG  35           HE       ARG  35   2.796  13.475   6.187
  240   HH11  ARG  35          2HH1      ARG  35   4.882  13.882   8.943
  241   HH12  ARG  35          1HH1      ARG  35   4.057  15.290   9.524
  242   HH21  ARG  35          2HH2      ARG  35   1.700  15.327   6.942
  243   HH22  ARG  35          1HH2      ARG  35   2.246  16.110   8.386
  244    H    ASP  36           H        ASP  36   1.663  10.037   5.169
  245    HA   ASP  36           HA       ASP  36   2.207   8.659   2.711
  246    HB2  ASP  36           1HB      ASP  36   0.631  10.502   1.799
  247    HB3  ASP  36           2HB      ASP  36  -0.029   9.308   2.914
  248    H    SER  37           H        SER  37   4.569   9.736   3.566
  249    HA   SER  37           HA       SER  37   4.997  12.186   2.029
  250    HB2  SER  37           1HB      SER  37   6.544  10.737   4.147
  251    HB3  SER  37           2HB      SER  37   7.390  11.840   3.061
  252    HG   SER  37           HG       SER  37   5.054  12.836   4.127
  253    H    PHE  38           H        PHE  38   5.991  12.227   0.113
  254    HA   PHE  38           HA       PHE  38   7.702  10.023  -0.710
  255    HB2  PHE  38           1HB      PHE  38   5.493  10.859  -2.569
  256    HB3  PHE  38           2HB      PHE  38   6.494   9.412  -2.628
  257    HD1  PHE  38           1HD      PHE  38   3.666  11.040  -0.933
  258    HD2  PHE  38           2HD      PHE  38   5.917   7.458  -1.399
  259    HE1  PHE  38           1HE      PHE  38   1.916   9.789   0.260
  260    HE2  PHE  38           2HE      PHE  38   4.170   6.201  -0.207
  261    HZ   PHE  38           HZ       PHE  38   2.166   7.366   0.623
  262    H    GLU  39           H        GLU  39   8.861  10.494  -2.734
  263    HA   GLU  39           HA       GLU  39   9.390  13.371  -2.944
  264    HB2  GLU  39           1HB      GLU  39  11.166  11.448  -2.501
  265    HB3  GLU  39           2HB      GLU  39  11.134  11.339  -4.255
  266    HG2  GLU  39           1HG      GLU  39  12.828  12.829  -3.975
  267    HG3  GLU  39           2HG      GLU  39  11.463  13.937  -4.105
  268    H    ASP  40           H        ASP  40   9.838  14.280  -5.070
  269    HA   ASP  40           HA       ASP  40   7.874  14.229  -6.868
  270    HB2  ASP  40           1HB      ASP  40  10.104  15.556  -6.895
  271    HB3  ASP  40           2HB      ASP  40  10.685  14.255  -7.931
  272    H    GLU  41           H        GLU  41  10.589  11.948  -6.889
  273    HA   GLU  41           HA       GLU  41   8.981   9.897  -8.055
  274    HB2  GLU  41           1HB      GLU  41  10.271   9.614 -10.126
  275    HB3  GLU  41           2HB      GLU  41   9.440  11.163 -10.088
  276    HG2  GLU  41           1HG      GLU  41  11.602  12.175  -9.293
  277    HG3  GLU  41           2HG      GLU  41  12.364  10.630  -9.665
  278    H    GLY  42           H        GLY  42  10.325   7.904  -8.515
  279    HA2  GLY  42           1HA      GLY  42  12.539   6.863  -8.153
  280    HA3  GLY  42           2HA      GLY  42  12.654   7.838  -6.695
  281    H    ARG  43           H        ARG  43  13.082   5.744  -5.671
  282    HA   ARG  43           HA       ARG  43  11.246   3.644  -5.566
  283    HB2  ARG  43           1HB      ARG  43  12.369   3.028  -3.438
  284    HB3  ARG  43           2HB      ARG  43  13.497   3.361  -4.745
  285    HG2  ARG  43           1HG      ARG  43  13.644   5.721  -3.763
  286    HG3  ARG  43           2HG      ARG  43  12.876   5.026  -2.334
  287    HD2  ARG  43           1HD      ARG  43  15.156   4.868  -1.874
  288    HD3  ARG  43           2HD      ARG  43  14.728   3.255  -2.444
  289    HE   ARG  43           HE       ARG  43  15.689   5.011  -4.511
  290   HH11  ARG  43          2HH1      ARG  43  16.575   2.725  -2.040
  291   HH12  ARG  43          1HH1      ARG  43  18.084   2.307  -2.783
  292   HH21  ARG  43          2HH2      ARG  43  17.673   4.470  -5.500
  293   HH22  ARG  43          1HH2      ARG  43  18.707   3.302  -4.751
  294    H    TRP  44           H        TRP  44  11.602   6.459  -3.426
  295    HA   TRP  44           HA       TRP  44   9.170   5.736  -2.001
  296    HB2  TRP  44           1HB      TRP  44  10.857   8.205  -1.586
  297    HB3  TRP  44           2HB      TRP  44   9.725   7.465  -0.456
  298    HD1  TRP  44           HD       TRP  44  13.261   7.814  -0.840
  299    HE1  TRP  44           1HE      TRP  44  14.565   5.907   0.294
  300    HE3  TRP  44           3HE      TRP  44   9.441   4.471  -0.228
  301    HZ2  TRP  44           2HZ      TRP  44  14.044   3.326   1.312
  302    HZ3  TRP  44           3HZ      TRP  44   9.928   2.306   0.834
  303    HH2  TRP  44           HH       TRP  44  12.182   1.747   1.587
  304    H    ARG  45           H        ARG  45   8.626   6.234  -4.638
  305    HA   ARG  45           HA       ARG  45   7.618   8.973  -4.797
  306    HB2  ARG  45           1HB      ARG  45   7.236   8.548  -7.130
  307    HB3  ARG  45           2HB      ARG  45   8.845   7.966  -6.724
  308    HG2  ARG  45           1HG      ARG  45   7.944   5.675  -6.574
  309    HG3  ARG  45           2HG      ARG  45   6.369   6.291  -7.078
  310    HD2  ARG  45           1HD      ARG  45   8.921   6.489  -8.674
  311    HD3  ARG  45           2HD      ARG  45   7.634   5.315  -8.948
  312    HE   ARG  45           HE       ARG  45   6.477   7.838  -9.042
  313   HH11  ARG  45          2HH1      ARG  45   8.847   6.002 -10.811
  314   HH12  ARG  45          1HH1      ARG  45   8.525   6.792 -12.319
  315   HH21  ARG  45          2HH2      ARG  45   6.044   8.886 -11.021
  316   HH22  ARG  45          1HH2      ARG  45   6.931   8.433 -12.437
  317    H    LEU  46           H        LEU  46   5.511   9.501  -4.671
  318    HA   LEU  46           HA       LEU  46   3.664   7.720  -3.525
  319    HB2  LEU  46           1HB      LEU  46   3.763  10.337  -3.605
  320    HB3  LEU  46           2HB      LEU  46   2.760  10.127  -5.039
  321    HG   LEU  46           HG       LEU  46   2.022   8.996  -2.348
  322   HD11  LEU  46          1HD1      LEU  46   1.835  11.154  -1.728
  323   HD12  LEU  46          2HD1      LEU  46   0.341  11.071  -2.662
  324   HD13  LEU  46          3HD1      LEU  46   1.800  11.743  -3.390
  325   HD21  LEU  46          1HD2      LEU  46   0.604   9.388  -4.965
  326   HD22  LEU  46          2HD2      LEU  46  -0.275   9.175  -3.451
  327   HD23  LEU  46          3HD2      LEU  46   0.807   7.907  -4.030
  328    H    ILE  47           H        ILE  47   2.938   5.969  -4.551
  329    HA   ILE  47           HA       ILE  47   2.203   6.192  -7.389
  330    HB   ILE  47           HB       ILE  47   2.756   3.747  -5.705
  331   HG12  ILE  47          1HG1      ILE  47   4.238   4.980  -8.038
  332   HG13  ILE  47          2HG1      ILE  47   4.763   4.989  -6.357
  333   HG21  ILE  47          1HG2      ILE  47   2.625   3.186  -8.497
  334   HG22  ILE  47          2HG2      ILE  47   1.660   2.512  -7.185
  335   HG23  ILE  47          3HG2      ILE  47   1.132   3.983  -8.001
  336   HD11  ILE  47          1HD1      ILE  47   5.656   3.233  -8.133
  337   HD12  ILE  47          2HD1      ILE  47   5.461   2.839  -6.425
  338   HD13  ILE  47          3HD1      ILE  47   4.227   2.355  -7.588
  339    H    LEU  48           H        LEU  48   0.128   6.270  -7.920
  340    HA   LEU  48           HA       LEU  48  -1.882   5.645  -5.892
  341    HB2  LEU  48           1HB      LEU  48  -1.964   7.153  -8.489
  342    HB3  LEU  48           2HB      LEU  48  -3.430   6.701  -7.622
  343    HG   LEU  48           HG       LEU  48  -1.243   8.422  -6.459
  344   HD11  LEU  48          1HD1      LEU  48  -3.281  10.115  -6.779
  345   HD12  LEU  48          2HD1      LEU  48  -3.563   9.072  -8.173
  346   HD13  LEU  48          3HD1      LEU  48  -2.017   9.899  -7.990
  347   HD21  LEU  48          1HD2      LEU  48  -3.758   7.274  -5.461
  348   HD22  LEU  48          2HD2      LEU  48  -3.529   8.990  -5.121
  349   HD23  LEU  48          3HD2      LEU  48  -2.326   7.816  -4.584
  350    H    CYS  49           H        CYS  49  -3.199   3.934  -6.004
  351    HA   CYS  49           HA       CYS  49  -2.768   1.679  -7.402
  352    HB2  CYS  49           1HB      CYS  49  -4.463   1.906  -5.618
  353    HB3  CYS  49           2HB      CYS  49  -5.519   2.753  -6.743
  354    H    ALA  50           H        ALA  50  -3.680   0.664  -9.266
  355    HA   ALA  50           HA       ALA  50  -4.249   2.583 -11.417
  356    HB1  ALA  50           1HB      ALA  50  -2.512   0.355 -11.250
  357    HB2  ALA  50           2HB      ALA  50  -3.762  -0.028 -12.435
  358    HB3  ALA  50           3HB      ALA  50  -2.788   1.430 -12.621
  359    H    THR  51           H        THR  51  -5.233  -0.644 -10.273
  360    HA   THR  51           HA       THR  51  -7.341  -1.147 -11.951
  361    HB   THR  51           HB       THR  51  -7.160  -1.766  -8.997
  362    HG1  THR  51           1HG      THR  51  -6.580  -3.873  -9.934
  363   HG21  THR  51          1HG2      THR  51  -8.848  -3.468  -9.386
  364   HG22  THR  51          2HG2      THR  51  -8.959  -3.004 -11.084
  365   HG23  THR  51          3HG2      THR  51  -9.485  -1.884  -9.828
  366    H    CYS  52           H        CYS  52  -7.636   0.420  -8.755
  367    HA   CYS  52           HA       CYS  52 -10.176   1.595  -9.659
  368    HB2  CYS  52           1HB      CYS  52 -10.815   1.776  -7.360
  369    HB3  CYS  52           2HB      CYS  52 -10.181   0.151  -7.596
  370    H    GLY  53           H        GLY  53  -7.183   2.369  -7.904
  371    HA2  GLY  53           1HA      GLY  53  -5.939   4.332  -8.040
  372    HA3  GLY  53           2HA      GLY  53  -7.206   5.036  -9.033
  373    H    SER  54           H        SER  54  -7.493   3.588  -5.815
  374    HA   SER  54           HA       SER  54  -8.221   6.244  -4.769
  375    HB2  SER  54           1HB      SER  54 -10.170   4.613  -5.187
  376    HB3  SER  54           2HB      SER  54  -9.532   3.702  -3.819
  377    HG   SER  54           HG       SER  54 -10.797   5.051  -2.774
  378    H    HIS  55           H        HIS  55  -5.676   4.856  -4.658
  379    HA   HIS  55           HA       HIS  55  -5.323   4.914  -1.768
  380    HB2  HIS  55           1HB      HIS  55  -4.707   2.527  -3.497
  381    HB3  HIS  55           2HB      HIS  55  -3.859   2.807  -1.979
  382    HD1  HIS  55           1HD      HIS  55  -4.982   1.991   0.092
  383    HD2  HIS  55           2HD      HIS  55  -7.591   2.202  -3.135
  384    HE1  HIS  55           1HE      HIS  55  -7.125   0.945   0.890
  385    HE2  HIS  55           2HE      HIS  55  -8.660   1.007  -1.106
  386    H    GLY  56           H        GLY  56  -3.013   4.985  -1.150
  387    HA2  GLY  56           1HA      GLY  56  -1.154   5.696  -3.281
  388    HA3  GLY  56           2HA      GLY  56  -1.564   6.977  -2.149
  389    H    THR  57           H        THR  57   0.726   4.784  -2.830
  390    HA   THR  57           HA       THR  57   1.806   4.904  -0.137
  391    HB   THR  57           HB       THR  57   0.495   2.788  -0.180
  392    HG1  THR  57           1HG      THR  57   2.972   1.700  -0.049
  393   HG21  THR  57          1HG2      THR  57   2.039   2.421  -2.649
  394   HG22  THR  57          2HG2      THR  57   0.499   1.714  -2.158
  395   HG23  THR  57          3HG2      THR  57   2.013   1.013  -1.588
  396    H    HIS  58           H        HIS  58   4.062   3.903  -0.101
  397    HA   HIS  58           HA       HIS  58   5.561   5.038  -2.262
  398    HB2  HIS  58           1HB      HIS  58   6.736   3.269  -0.135
  399    HB3  HIS  58           2HB      HIS  58   7.474   4.636  -0.964
  400    HD2  HIS  58           2HD      HIS  58   7.280   7.007   0.366
  401    HE1  HIS  58           1HE      HIS  58   4.471   5.772   3.295
  402    HE2  HIS  58           2HE      HIS  58   5.925   7.657   2.471
  403    H    ARG  59           H        ARG  59   6.988   3.959  -3.676
  404    HA   ARG  59           HA       ARG  59   5.984   1.662  -4.895
  405    HB2  ARG  59           1HB      ARG  59   7.608   3.433  -5.819
  406    HB3  ARG  59           2HB      ARG  59   8.876   2.475  -5.067
  407    HG2  ARG  59           1HG      ARG  59   7.671   0.529  -6.413
  408    HG3  ARG  59           2HG      ARG  59   7.204   1.889  -7.437
  409    HD2  ARG  59           1HD      ARG  59   9.348   0.710  -8.065
  410    HD3  ARG  59           2HD      ARG  59   9.453   2.459  -7.872
  411    HE   ARG  59           HE       ARG  59  10.101   1.099  -5.458
  412   HH11  ARG  59          2HH1      ARG  59  11.360   1.982  -8.582
  413   HH12  ARG  59          1HH1      ARG  59  13.013   1.970  -8.064
  414   HH21  ARG  59          2HH2      ARG  59  12.274   1.080  -4.765
  415   HH22  ARG  59          1HH2      ARG  59  13.532   1.456  -5.893
  416    H    ASP  60           H        ASP  60   9.152   1.841  -3.269
  417    HA   ASP  60           HA       ASP  60   9.577  -0.884  -3.048
  418    HB2  ASP  60           1HB      ASP  60  10.612   1.519  -1.641
  419    HB3  ASP  60           2HB      ASP  60  10.895  -0.039  -0.869
  420    H    CYS  61           H        CYS  61   7.849   1.289  -0.869
  421    HA   CYS  61           HA       CYS  61   7.487  -0.442   1.287
  422    HB2  CYS  61           1HB      CYS  61   6.950   1.966   1.345
  423    HB3  CYS  61           2HB      CYS  61   5.582   1.680   0.275
  424    H    SER  62           H        SER  62   5.753  -0.176  -1.753
  425    HA   SER  62           HA       SER  62   3.711  -2.059  -0.943
  426    HB2  SER  62           1HB      SER  62   3.302  -1.851  -3.582
  427    HB3  SER  62           2HB      SER  62   2.747  -0.623  -2.444
  428    HG   SER  62           HG       SER  62   4.056   0.732  -3.354
  429    H    SER  63           H        SER  63   6.669  -2.742  -1.146
  430    HA   SER  63           HA       SER  63   8.024  -4.409  -1.938
  431    HB2  SER  63           1HB      SER  63   5.400  -5.624  -1.265
  432    HB3  SER  63           2HB      SER  63   6.525  -6.635  -2.172
  433    HG   SER  63           HG       SER  63   7.567  -5.247  -0.004
  434    H    LEU  64           H        LEU  64   7.414  -2.808  -4.012
  435    HA   LEU  64           HA       LEU  64   6.440  -4.458  -6.210
  436    HB2  LEU  64           1HB      LEU  64   7.314  -1.575  -6.122
  437    HB3  LEU  64           2HB      LEU  64   6.677  -2.394  -7.546
  438    HG   LEU  64           HG       LEU  64   5.138  -1.959  -4.988
  439   HD11  LEU  64          1HD1      LEU  64   4.841  -0.497  -7.603
  440   HD12  LEU  64          2HD1      LEU  64   5.724   0.139  -6.215
  441   HD13  LEU  64          3HD1      LEU  64   3.995  -0.182  -6.087
  442   HD21  LEU  64          1HD2      LEU  64   3.657  -2.428  -7.439
  443   HD22  LEU  64          2HD2      LEU  64   3.515  -3.209  -5.864
  444   HD23  LEU  64          3HD2      LEU  64   4.714  -3.778  -7.026
  445    H    ARG  65           H        ARG  65   7.813  -3.766  -8.358
  446    HA   ARG  65           HA       ARG  65  10.609  -4.470  -7.745
  447    HB2  ARG  65           1HB      ARG  65   8.693  -5.573  -9.733
  448    HB3  ARG  65           2HB      ARG  65  10.369  -5.409 -10.240
  449    HG2  ARG  65           1HG      ARG  65  11.128  -6.941  -8.678
  450    HG3  ARG  65           2HG      ARG  65   9.696  -6.762  -7.662
  451    HD2  ARG  65           1HD      ARG  65   8.378  -7.785  -9.559
  452    HD3  ARG  65           2HD      ARG  65   9.925  -8.175 -10.309
  453    HE   ARG  65           HE       ARG  65   9.613  -9.112  -7.593
  454   HH11  ARG  65          2HH1      ARG  65   9.232  -9.831 -10.978
  455   HH12  ARG  65          1HH1      ARG  65   9.252 -11.549 -10.748
  456   HH21  ARG  65          2HH2      ARG  65   9.640 -11.371  -7.278
  457   HH22  ARG  65          1HH2      ARG  65   9.483 -12.423  -8.643
  458    HA   PRO  66           HA       PRO  66  12.002  -1.024 -10.075
  459    HB2  PRO  66           1HB      PRO  66  14.144  -2.027 -11.408
  460    HB3  PRO  66           2HB      PRO  66  14.151  -1.727  -9.666
  461    HG2  PRO  66           1HG      PRO  66  13.732  -4.296 -11.144
  462    HG3  PRO  66           2HG      PRO  66  14.699  -3.987  -9.690
  463    HD2  PRO  66           1HD      PRO  66  12.227  -5.088  -9.589
  464    HD3  PRO  66           2HD      PRO  66  12.859  -4.040  -8.303
  465    H    ASN  67           H        ASN  67  10.706  -3.722 -11.618
  466    HA   ASN  67           HA       ASN  67  10.925  -2.512 -14.283
  467    HB2  ASN  67           1HB      ASN  67  10.484  -5.285 -13.289
  468    HB3  ASN  67           2HB      ASN  67   9.734  -4.840 -14.820
  469   HD21  ASN  67          1HD2      ASN  67  12.337  -6.266 -13.554
  470   HD22  ASN  67          2HD2      ASN  67  13.507  -5.935 -14.782
  471    H    SER  68           H        SER  68   8.548  -3.824 -12.002
  472    HA   SER  68           HA       SER  68   6.200  -3.591 -13.303
  473    HB2  SER  68           1HB      SER  68   6.903  -2.857 -10.470
  474    HB3  SER  68           2HB      SER  68   5.246  -2.729 -11.058
  475    HG   SER  68           HG       SER  68   6.806  -5.089 -11.247
  476    H    LYS  69           H        LYS  69   4.535  -1.923 -13.378
  477    HA   LYS  69           HA       LYS  69   5.621   0.810 -13.470
  478    HB2  LYS  69           1HB      LYS  69   4.316   1.234 -15.511
  479    HB3  LYS  69           2HB      LYS  69   5.513  -0.031 -15.755
  480    HG2  LYS  69           1HG      LYS  69   2.775  -0.856 -14.970
  481    HG3  LYS  69           2HG      LYS  69   3.024  -0.263 -16.614
  482    HD2  LYS  69           1HD      LYS  69   4.711  -2.424 -15.364
  483    HD3  LYS  69           2HD      LYS  69   3.252  -2.757 -16.301
  484    HE2  LYS  69           1HE      LYS  69   4.345  -1.344 -18.139
  485    HE3  LYS  69           2HE      LYS  69   5.836  -1.528 -17.216
  486    HZ1  LYS  69           1HZ      LYS  69   5.234  -3.212 -19.082
  487    HZ2  LYS  69           2HZ      LYS  69   4.267  -3.919 -17.887
  488    HZ3  LYS  69           3HZ      LYS  69   5.934  -3.762 -17.643
  489    H    LYS  70           H        LYS  70   2.896  -1.314 -12.964
  490    HA   LYS  70           HA       LYS  70   1.454   0.926 -11.704
  491    HB2  LYS  70           1HB      LYS  70  -0.621   0.132 -12.502
  492    HB3  LYS  70           2HB      LYS  70   0.459   0.077 -13.889
  493    HG2  LYS  70           1HG      LYS  70   0.717  -2.291 -13.678
  494    HG3  LYS  70           2HG      LYS  70  -0.169  -2.298 -12.151
  495    HD2  LYS  70           1HD      LYS  70  -2.132  -1.354 -13.458
  496    HD3  LYS  70           2HD      LYS  70  -1.225  -1.758 -14.917
  497    HE2  LYS  70           1HE      LYS  70  -1.033  -4.107 -13.772
  498    HE3  LYS  70           2HE      LYS  70  -2.447  -3.558 -12.874
  499    HZ1  LYS  70           1HZ      LYS  70  -3.756  -3.676 -14.685
  500    HZ2  LYS  70           2HZ      LYS  70  -2.601  -4.792 -15.213
  501    HZ3  LYS  70           3HZ      LYS  70  -2.539  -3.191 -15.756
  502    H    TRP  71           H        TRP  71   0.376   0.495  -9.785
  503    HA   TRP  71           HA       TRP  71   0.864  -2.162  -8.608
  504    HB2  TRP  71           1HB      TRP  71   2.364  -0.914  -7.378
  505    HB3  TRP  71           2HB      TRP  71   1.410   0.560  -7.511
  506    HD1  TRP  71           HD       TRP  71   1.562  -2.715  -5.495
  507    HE1  TRP  71           1HE      TRP  71   0.301  -2.360  -3.280
  508    HE3  TRP  71           3HE      TRP  71  -0.335   1.949  -6.380
  509    HZ2  TRP  71           2HZ      TRP  71  -1.288  -0.367  -2.068
  510    HZ3  TRP  71           3HZ      TRP  71  -1.716   3.009  -4.642
  511    HH2  TRP  71           HH       TRP  71  -2.182   1.874  -2.531
  512    H    GLU  72           H        GLU  72  -0.701  -2.946  -7.163
  513    HA   GLU  72           HA       GLU  72  -3.300  -1.574  -7.355
  514    HB2  GLU  72           1HB      GLU  72  -2.589  -4.496  -7.216
  515    HB3  GLU  72           2HB      GLU  72  -4.210  -3.921  -6.856
  516    HG2  GLU  72           1HG      GLU  72  -4.625  -3.301  -9.029
  517    HG3  GLU  72           2HG      GLU  72  -2.914  -3.129  -9.419
  518    H    CYS  73           H        CYS  73  -4.486  -1.198  -5.541
  519    HA   CYS  73           HA       CYS  73  -3.106  -1.185  -3.041
  520    HB2  CYS  73           1HB      CYS  73  -5.050  -0.096  -2.158
  521    HB3  CYS  73           2HB      CYS  73  -4.777   0.543  -3.776
  522    H    ASN  74           H        ASN  74  -4.373  -1.969  -1.025
  523    HA   ASN  74           HA       ASN  74  -4.397  -4.763  -1.041
  524    HB2  ASN  74           1HB      ASN  74  -4.018  -3.596   1.021
  525    HB3  ASN  74           2HB      ASN  74  -5.578  -2.787   0.916
  526   HD21  ASN  74          1HD2      ASN  74  -4.190  -6.047   0.996
  527   HD22  ASN  74          2HD2      ASN  74  -5.420  -6.732   1.997
  528    H    GLU  75           H        GLU  75  -7.146  -2.500  -0.884
  529    HA   GLU  75           HA       GLU  75  -9.248  -4.230  -0.794
  530    HB2  GLU  75           1HB      GLU  75  -9.232  -1.654  -0.936
  531    HB3  GLU  75           2HB      GLU  75  -9.298  -1.886  -2.677
  532    HG2  GLU  75           1HG      GLU  75 -11.398  -2.993  -2.531
  533    HG3  GLU  75           2HG      GLU  75 -11.301  -3.066  -0.773
  534    H    CYS  76           H        CYS  76  -7.411  -3.293  -3.672
  535    HA   CYS  76           HA       CYS  76  -8.999  -4.887  -5.449
  536    HB2  CYS  76           1HB      CYS  76  -6.335  -3.501  -5.781
  537    HB3  CYS  76           2HB      CYS  76  -7.133  -4.388  -7.076
  538    H    LEU  77           H        LEU  77  -5.605  -5.144  -4.373
  539    HA   LEU  77           HA       LEU  77  -4.816  -7.476  -5.443
  540    HB2  LEU  77           1HB      LEU  77  -4.421  -6.541  -2.610
  541    HB3  LEU  77           2HB      LEU  77  -3.574  -7.927  -3.295
  542    HG   LEU  77           HG       LEU  77  -3.385  -5.206  -4.548
  543   HD11  LEU  77          1HD1      LEU  77  -2.693  -5.510  -1.979
  544   HD12  LEU  77          2HD1      LEU  77  -1.811  -4.476  -3.102
  545   HD13  LEU  77          3HD1      LEU  77  -1.221  -6.101  -2.751
  546   HD21  LEU  77          1HD2      LEU  77  -1.003  -6.635  -4.755
  547   HD22  LEU  77          2HD2      LEU  77  -2.202  -6.374  -6.022
  548   HD23  LEU  77          3HD2      LEU  77  -2.276  -7.826  -5.022
  549    HA   PRO  78           HA       PRO  78  -7.392 -10.784  -4.139
  550    HB2  PRO  78           1HB      PRO  78  -5.612 -12.833  -4.090
  551    HB3  PRO  78           2HB      PRO  78  -6.207 -12.114  -5.591
  552    HG2  PRO  78           1HG      PRO  78  -3.632 -11.622  -4.147
  553    HG3  PRO  78           2HG      PRO  78  -3.919 -11.827  -5.884
  554    HD2  PRO  78           1HD      PRO  78  -3.582  -9.396  -4.740
  555    HD3  PRO  78           2HD      PRO  78  -4.628  -9.651  -6.152
  556    H    ALA  79           H        ALA  79  -8.162 -10.769  -2.114
  557    HA   ALA  79           HA       ALA  79  -6.438 -11.792   0.024
  558    HB1  ALA  79           1HB      ALA  79  -7.107  -9.102  -0.180
  559    HB2  ALA  79           2HB      ALA  79  -8.204  -9.746   1.041
  560    HB3  ALA  79           3HB      ALA  79  -6.461  -9.929   1.238
  561    H    SER  80           H        SER  80  -7.783 -12.298   2.025
  562    HA   SER  80           HA       SER  80  -9.980 -13.958   1.204
  563    HB2  SER  80           1HB      SER  80  -8.864 -13.386   3.960
  564    HB3  SER  80           2HB      SER  80 -10.056 -14.631   3.585
  565    HG   SER  80           HG       SER  80  -8.081 -15.619   3.571
  566    H    GLY  81           H        GLY  81  -9.651 -11.235   3.487
  567    HA2  GLY  81           1HA      GLY  81 -12.390 -10.435   2.826
  568    HA3  GLY  81           2HA      GLY  81 -12.023 -10.776   4.511
  569    HA   PRO  82           HA       PRO  82 -10.459  -6.460   2.932
  570    HB2  PRO  82           1HB      PRO  82 -12.722  -4.977   2.717
  571    HB3  PRO  82           2HB      PRO  82 -12.008  -5.844   1.352
  572    HG2  PRO  82           1HG      PRO  82 -14.303  -6.632   3.105
  573    HG3  PRO  82           2HG      PRO  82 -14.144  -6.763   1.344
  574    HD2  PRO  82           1HD      PRO  82 -13.772  -8.872   3.001
  575    HD3  PRO  82           2HD      PRO  82 -12.884  -8.688   1.475
  576    H    SER  83           H        SER  83 -10.912  -4.300   4.102
  577    HA   SER  83           HA       SER  83 -10.992  -4.860   6.913
  578    HB2  SER  83           1HB      SER  83 -10.515  -2.465   7.186
  579    HB3  SER  83           2HB      SER  83  -9.444  -3.186   5.984
  580    HG   SER  83           HG       SER  83 -10.763  -2.306   4.364
  581    H    SER  84           H        SER  84 -12.256  -3.183   8.320
  582    HA   SER  84           HA       SER  84 -15.056  -3.304   7.432
  583    HB2  SER  84           1HB      SER  84 -14.279  -4.482   9.580
  584    HB3  SER  84           2HB      SER  84 -14.142  -2.866  10.272
  585    HG   SER  84           HG       SER  84 -16.223  -4.074  10.509
  586    H    GLY  85           H        GLY  85 -16.483  -1.533   8.151
  587    HA2  GLY  85           1HA      GLY  85 -15.378   0.973   8.956
  588    HA3  GLY  85           2HA      GLY  85 -15.689   0.941   7.227
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1 -12.888 -20.719  35.860
    2    HA2  GLY   1           1HA      GLY   1 -11.974 -18.409  37.365
    3    HA3  GLY   1           2HA      GLY   1 -11.239 -18.606  35.781
    4    H    SER   2           H        SER   2 -12.225 -16.503  35.352
    5    HA   SER   2           HA       SER   2 -14.760 -16.830  34.024
    6    HB2  SER   2           1HB      SER   2 -16.033 -15.242  35.237
    7    HB3  SER   2           2HB      SER   2 -15.295 -16.270  36.465
    8    HG   SER   2           HG       SER   2 -13.886 -14.677  36.968
    9    H    SER   3           H        SER   3 -15.387 -14.834  32.834
   10    HA   SER   3           HA       SER   3 -13.390 -12.787  32.494
   11    HB2  SER   3           1HB      SER   3 -12.931 -13.249  30.131
   12    HB3  SER   3           2HB      SER   3 -12.436 -14.613  31.134
   13    HG   SER   3           HG       SER   3 -14.912 -15.099  30.498
   14    H    GLY   4           H        GLY   4 -14.045 -11.278  30.650
   15    HA2  GLY   4           1HA      GLY   4 -16.995 -11.107  30.608
   16    HA3  GLY   4           2HA      GLY   4 -15.930  -9.710  30.649
   17    H    SER   5           H        SER   5 -16.602  -8.736  28.786
   18    HA   SER   5           HA       SER   5 -15.498  -9.664  26.348
   19    HB2  SER   5           1HB      SER   5 -17.656 -11.078  26.691
   20    HB3  SER   5           2HB      SER   5 -18.501  -9.594  26.253
   21    HG   SER   5           HG       SER   5 -17.600  -9.656  24.262
   22    H    SER   6           H        SER   6 -16.116  -8.222  24.496
   23    HA   SER   6           HA       SER   6 -17.421  -5.739  25.073
   24    HB2  SER   6           1HB      SER   6 -15.400  -4.318  24.700
   25    HB3  SER   6           2HB      SER   6 -15.333  -5.245  26.198
   26    HG   SER   6           HG       SER   6 -13.919  -6.669  25.234
   27    H    GLY   7           H        GLY   7 -17.498  -4.312  23.207
   28    HA2  GLY   7           1HA      GLY   7 -17.605  -5.833  20.755
   29    HA3  GLY   7           2HA      GLY   7 -18.113  -4.165  20.974
   30    H    GLU   8           H        GLU   8 -16.735  -4.971  18.715
   31    HA   GLU   8           HA       GLU   8 -14.054  -3.824  19.136
   32    HB2  GLU   8           1HB      GLU   8 -15.084  -5.914  17.262
   33    HB3  GLU   8           2HB      GLU   8 -13.717  -4.925  16.765
   34    HG2  GLU   8           1HG      GLU   8 -13.753  -6.412  19.370
   35    HG3  GLU   8           2HG      GLU   8 -13.202  -7.149  17.866
   36    H    LEU   9           H        LEU   9 -13.347  -2.164  17.834
   37    HA   LEU   9           HA       LEU   9 -15.134  -0.263  16.962
   38    HB2  LEU   9           1HB      LEU   9 -12.296  -0.812  16.141
   39    HB3  LEU   9           2HB      LEU   9 -13.194   0.583  15.547
   40    HG   LEU   9           HG       LEU   9 -13.509   1.223  17.992
   41   HD11  LEU   9          1HD1      LEU   9 -11.597  -1.056  18.239
   42   HD12  LEU   9          2HD1      LEU   9 -12.979  -0.633  19.249
   43   HD13  LEU   9          3HD1      LEU   9 -11.491   0.307  19.354
   44   HD21  LEU   9          1HD2      LEU   9 -12.026   2.469  16.593
   45   HD22  LEU   9          2HD2      LEU   9 -10.785   1.220  16.703
   46   HD23  LEU   9          3HD2      LEU   9 -11.206   2.174  18.126
   47    H    GLU  10           H        GLU  10 -15.713   0.489  14.840
   48    HA   GLU  10           HA       GLU  10 -16.508  -1.660  13.111
   49    HB2  GLU  10           1HB      GLU  10 -16.928   1.303  13.156
   50    HB3  GLU  10           2HB      GLU  10 -17.267   0.411  11.680
   51    HG2  GLU  10           1HG      GLU  10 -18.449  -0.359  14.328
   52    HG3  GLU  10           2HG      GLU  10 -19.208   0.814  13.253
   53    HA   PRO  11           HA       PRO  11 -12.731  -1.496  10.731
   54    HB2  PRO  11           1HB      PRO  11 -13.404  -3.515   9.045
   55    HB3  PRO  11           2HB      PRO  11 -12.830  -3.791  10.694
   56    HG2  PRO  11           1HG      PRO  11 -15.632  -3.785   9.641
   57    HG3  PRO  11           2HG      PRO  11 -14.869  -4.906  10.783
   58    HD2  PRO  11           1HD      PRO  11 -16.490  -2.890  11.583
   59    HD3  PRO  11           2HD      PRO  11 -15.126  -3.465  12.564
   60    H    GLY  12           H        GLY  12 -15.956  -1.716   9.242
   61    HA2  GLY  12           1HA      GLY  12 -15.047  -0.612   6.742
   62    HA3  GLY  12           2HA      GLY  12 -16.712  -0.954   7.190
   63    H    ALA  13           H        ALA  13 -14.250   1.169   8.637
   64    HA   ALA  13           HA       ALA  13 -16.153   3.400   8.329
   65    HB1  ALA  13           1HB      ALA  13 -16.005   3.683  10.523
   66    HB2  ALA  13           2HB      ALA  13 -14.793   2.407  10.646
   67    HB3  ALA  13           3HB      ALA  13 -14.295   4.068  10.326
   68    H    PHE  14           H        PHE  14 -14.273   2.641   6.322
   69    HA   PHE  14           HA       PHE  14 -12.589   5.051   6.308
   70    HB2  PHE  14           1HB      PHE  14 -11.437   2.695   6.684
   71    HB3  PHE  14           2HB      PHE  14 -11.610   2.587   4.935
   72    HD1  PHE  14           2HD      PHE  14 -10.419   4.135   3.470
   73    HD2  PHE  14           1HD      PHE  14  -9.892   4.219   7.693
   74    HE1  PHE  14           2HE      PHE  14  -8.379   5.480   3.186
   75    HE2  PHE  14           1HE      PHE  14  -7.851   5.565   7.415
   76    HZ   PHE  14           HZ       PHE  14  -7.091   6.196   5.159
   77    H    SER  15           H        SER  15 -12.864   6.288   4.570
   78    HA   SER  15           HA       SER  15 -13.769   5.086   2.061
   79    HB2  SER  15           1HB      SER  15 -15.601   6.578   1.779
   80    HB3  SER  15           2HB      SER  15 -15.757   5.932   3.412
   81    HG   SER  15           HG       SER  15 -14.530   8.410   2.774
   82    H    GLU  16           H        GLU  16 -13.415   6.426   0.199
   83    HA   GLU  16           HA       GLU  16 -10.985   7.916   0.373
   84    HB2  GLU  16           1HB      GLU  16 -11.008   7.969  -1.960
   85    HB3  GLU  16           2HB      GLU  16 -11.842   6.468  -1.581
   86    HG2  GLU  16           1HG      GLU  16 -13.298   9.036  -2.120
   87    HG3  GLU  16           2HG      GLU  16 -12.855   7.901  -3.394
   88    H    LEU  17           H        LEU  17 -10.848  10.093  -0.815
   89    HA   LEU  17           HA       LEU  17 -13.111  11.801  -0.019
   90    HB2  LEU  17           1HB      LEU  17 -10.182  12.477   0.202
   91    HB3  LEU  17           2HB      LEU  17 -11.526  13.536   0.623
   92    HG   LEU  17           HG       LEU  17 -10.958  10.923   2.014
   93   HD11  LEU  17          1HD1      LEU  17  -9.589  13.442   2.213
   94   HD12  LEU  17          2HD1      LEU  17  -9.262  11.919   3.039
   95   HD13  LEU  17          3HD1      LEU  17 -10.413  13.065   3.727
   96   HD21  LEU  17          1HD2      LEU  17 -13.249  12.380   1.975
   97   HD22  LEU  17          2HD2      LEU  17 -12.414  13.089   3.357
   98   HD23  LEU  17          3HD2      LEU  17 -12.735  11.355   3.316
   99    H    TYR  18           H        TYR  18 -13.268  13.834  -1.196
  100    HA   TYR  18           HA       TYR  18 -13.175  13.512  -3.957
  101    HB2  TYR  18           1HB      TYR  18 -14.657  15.159  -3.315
  102    HB3  TYR  18           2HB      TYR  18 -13.547  15.849  -2.136
  103    HD1  TYR  18           1HD      TYR  18 -14.214  15.571  -5.776
  104    HD2  TYR  18           2HD      TYR  18 -12.196  17.695  -2.690
  105    HE1  TYR  18           1HE      TYR  18 -13.599  17.321  -7.391
  106    HE2  TYR  18           2HE      TYR  18 -11.576  19.451  -4.297
  107    HH   TYR  18           HH       TYR  18 -11.456  19.176  -7.366
  108    H    GLN  19           H        GLN  19 -11.115  15.682  -2.010
  109    HA   GLN  19           HA       GLN  19  -9.336  16.309  -4.087
  110    HB2  GLN  19           1HB      GLN  19  -9.078  16.411  -1.088
  111    HB3  GLN  19           2HB      GLN  19  -7.773  16.920  -2.152
  112    HG2  GLN  19           1HG      GLN  19  -9.541  18.445  -3.233
  113    HG3  GLN  19           2HG      GLN  19 -10.472  18.145  -1.766
  114   HE21  GLN  19          1HE2      GLN  19  -9.922  19.162   0.086
  115   HE22  GLN  19          2HE2      GLN  19  -8.631  20.301   0.223
  116    H    ARG  20           H        ARG  20  -6.919  15.799  -3.927
  117    HA   ARG  20           HA       ARG  20  -6.484  13.130  -4.522
  118    HB2  ARG  20           1HB      ARG  20  -5.004  15.242  -4.923
  119    HB3  ARG  20           2HB      ARG  20  -4.285  14.816  -3.376
  120    HG2  ARG  20           1HG      ARG  20  -2.873  13.717  -4.777
  121    HG3  ARG  20           2HG      ARG  20  -4.072  12.449  -4.512
  122    HD2  ARG  20           1HD      ARG  20  -5.028  12.741  -6.605
  123    HD3  ARG  20           2HD      ARG  20  -4.392  14.376  -6.776
  124    HE   ARG  20           HE       ARG  20  -2.384  12.306  -6.689
  125   HH11  ARG  20          2HH1      ARG  20  -4.494  14.211  -8.698
  126   HH12  ARG  20          1HH1      ARG  20  -3.539  13.998 -10.128
  127   HH21  ARG  20          2HH2      ARG  20  -1.119  12.017  -8.565
  128   HH22  ARG  20          1HH2      ARG  20  -1.620  12.749 -10.051
  129    H    TYR  21           H        TYR  21  -5.510  11.411  -3.414
  130    HA   TYR  21           HA       TYR  21  -5.628  11.629  -0.478
  131    HB2  TYR  21           1HB      TYR  21  -7.388  10.178  -1.248
  132    HB3  TYR  21           2HB      TYR  21  -6.271   9.281  -2.270
  133    HD1  TYR  21           1HD      TYR  21  -7.391   9.859   1.179
  134    HD2  TYR  21           2HD      TYR  21  -4.806   7.603  -1.337
  135    HE1  TYR  21           1HE      TYR  21  -6.991   8.277   3.019
  136    HE2  TYR  21           2HE      TYR  21  -4.400   6.014   0.496
  137    HH   TYR  21           HH       TYR  21  -6.276   5.762   3.161
  138    H    ARG  22           H        ARG  22  -3.551  11.921   0.110
  139    HA   ARG  22           HA       ARG  22  -1.555  10.028  -0.943
  140    HB2  ARG  22           1HB      ARG  22  -1.044  12.746   0.275
  141    HB3  ARG  22           2HB      ARG  22   0.148  11.686  -0.465
  142    HG2  ARG  22           1HG      ARG  22  -0.229  13.176  -2.158
  143    HG3  ARG  22           2HG      ARG  22  -1.390  11.911  -2.565
  144    HD2  ARG  22           1HD      ARG  22  -2.674  13.821  -2.754
  145    HD3  ARG  22           2HD      ARG  22  -3.024  13.303  -1.105
  146    HE   ARG  22           HE       ARG  22  -2.041  15.218  -0.345
  147   HH11  ARG  22          2HH1      ARG  22  -1.030  14.664  -3.629
  148   HH12  ARG  22          1HH1      ARG  22  -0.205  16.181  -3.769
  149   HH21  ARG  22          2HH2      ARG  22  -0.958  17.219  -0.516
  150   HH22  ARG  22          1HH2      ARG  22  -0.164  17.633  -1.997
  151    H    HIS  23           H        HIS  23  -1.901   8.403   0.566
  152    HA   HIS  23           HA       HIS  23  -0.750   8.927   3.189
  153    HB2  HIS  23           1HB      HIS  23  -3.568   8.015   2.721
  154    HB3  HIS  23           2HB      HIS  23  -2.696   7.461   4.148
  155    HD1  HIS  23           1HD      HIS  23  -2.634   9.016   6.103
  156    HD2  HIS  23           2HD      HIS  23  -3.853  10.911   2.613
  157    HE1  HIS  23           1HE      HIS  23  -3.361  11.318   6.807
  158    HE2  HIS  23           2HE      HIS  23  -4.175  12.416   4.692
  159    H    CYS  24           H        CYS  24   0.850   7.506   3.312
  160    HA   CYS  24           HA       CYS  24   1.236   5.267   1.756
  161    HB2  CYS  24           1HB      CYS  24   3.102   6.063   2.955
  162    HB3  CYS  24           2HB      CYS  24   2.250   5.996   4.494
  163    H    ASP  25           H        ASP  25  -0.045   3.562   1.538
  164    HA   ASP  25           HA       ASP  25  -1.198   2.360   3.970
  165    HB2  ASP  25           1HB      ASP  25  -2.970   3.398   2.655
  166    HB3  ASP  25           2HB      ASP  25  -2.441   2.529   1.217
  167    H    ALA  26           H        ALA  26   1.332   1.714   2.831
  168    HA   ALA  26           HA       ALA  26   0.968  -0.766   1.365
  169    HB1  ALA  26           1HB      ALA  26   3.665  -0.436   2.175
  170    HB2  ALA  26           2HB      ALA  26   2.971  -0.255   0.564
  171    HB3  ALA  26           3HB      ALA  26   3.059   1.134   1.647
  172    HA   PRO  27           HA       PRO  27   1.366  -3.630   4.666
  173    HB2  PRO  27           1HB      PRO  27   3.237  -5.396   3.800
  174    HB3  PRO  27           2HB      PRO  27   1.610  -5.307   3.115
  175    HG2  PRO  27           1HG      PRO  27   4.169  -4.152   2.076
  176    HG3  PRO  27           2HG      PRO  27   2.878  -4.986   1.192
  177    HD2  PRO  27           1HD      PRO  27   3.121  -2.290   1.214
  178    HD3  PRO  27           2HD      PRO  27   1.548  -3.106   1.108
  179    H    ILE  28           H        ILE  28   4.554  -2.618   3.455
  180    HA   ILE  28           HA       ILE  28   5.421  -2.214   6.218
  181    HB   ILE  28           HB       ILE  28   7.080  -3.748   4.214
  182   HG12  ILE  28          1HG1      ILE  28   5.137  -5.019   5.160
  183   HG13  ILE  28          2HG1      ILE  28   6.708  -5.699   5.572
  184   HG21  ILE  28          1HG2      ILE  28   7.679  -3.416   7.130
  185   HG22  ILE  28          2HG2      ILE  28   8.763  -3.874   5.818
  186   HG23  ILE  28          3HG2      ILE  28   8.194  -2.210   5.951
  187   HD11  ILE  28          1HD1      ILE  28   4.874  -5.507   7.383
  188   HD12  ILE  28          2HD1      ILE  28   6.538  -5.080   7.784
  189   HD13  ILE  28          3HD1      ILE  28   5.359  -3.813   7.448
  190    H    CYS  29           H        CYS  29   6.731  -0.481   6.495
  191    HA   CYS  29           HA       CYS  29   7.507   0.992   4.064
  192    HB2  CYS  29           1HB      CYS  29   5.808   1.926   5.870
  193    HB3  CYS  29           2HB      CYS  29   7.292   2.349   6.716
  194    H    LEU  30           H        LEU  30   9.526   2.050   4.021
  195    HA   LEU  30           HA       LEU  30  11.460   1.067   6.015
  196    HB2  LEU  30           1HB      LEU  30  12.064   1.643   3.123
  197    HB3  LEU  30           2HB      LEU  30  13.117   0.874   4.309
  198    HG   LEU  30           HG       LEU  30  10.541  -0.459   3.637
  199   HD11  LEU  30          1HD1      LEU  30  11.690  -1.617   1.752
  200   HD12  LEU  30          2HD1      LEU  30  12.965  -0.402   1.850
  201   HD13  LEU  30          3HD1      LEU  30  11.318   0.080   1.443
  202   HD21  LEU  30          1HD2      LEU  30  12.278  -1.194   5.377
  203   HD22  LEU  30          2HD2      LEU  30  13.260  -1.673   3.993
  204   HD23  LEU  30          3HD2      LEU  30  11.675  -2.405   4.245
  205    H    TYR  31           H        TYR  31  10.315   3.731   4.098
  206    HA   TYR  31           HA       TYR  31  12.420   5.538   4.430
  207    HB2  TYR  31           1HB      TYR  31  10.194   5.686   3.039
  208    HB3  TYR  31           2HB      TYR  31   9.581   6.489   4.480
  209    HD1  TYR  31           2HD      TYR  31  12.896   6.658   2.766
  210    HD2  TYR  31           1HD      TYR  31   9.411   8.750   4.024
  211    HE1  TYR  31           2HE      TYR  31  13.899   8.772   2.009
  212    HE2  TYR  31           1HE      TYR  31  10.404  10.870   3.268
  213    HH   TYR  31           HH       TYR  31  13.108  11.026   1.277
  214    H    GLU  32           H        GLU  32  13.318   6.040   6.319
  215    HA   GLU  32           HA       GLU  32  12.409   5.736   8.846
  216    HB2  GLU  32           1HB      GLU  32  13.931   7.549   9.534
  217    HB3  GLU  32           2HB      GLU  32  14.676   6.464   8.370
  218    HG2  GLU  32           1HG      GLU  32  14.409   8.046   6.609
  219    HG3  GLU  32           2HG      GLU  32  13.420   9.092   7.627
  220    H    GLN  33           H        GLN  33  11.540   8.299   6.630
  221    HA   GLN  33           HA       GLN  33  10.416  10.165   8.319
  222    HB2  GLN  33           1HB      GLN  33  10.619  10.005   5.672
  223    HB3  GLN  33           2HB      GLN  33   8.941   9.498   5.817
  224    HG2  GLN  33           1HG      GLN  33   8.629  11.728   5.586
  225    HG3  GLN  33           2HG      GLN  33   8.795  11.649   7.340
  226   HE21  GLN  33          1HE2      GLN  33  10.367  12.780   8.290
  227   HE22  GLN  33          2HE2      GLN  33  11.609  13.646   7.459
  228    H    GLY  34           H        GLY  34   8.642   7.518   6.700
  229    HA2  GLY  34           1HA      GLY  34   6.889   6.229   7.475
  230    HA3  GLY  34           2HA      GLY  34   7.125   6.943   9.063
  231    H    ARG  35           H        ARG  35   6.384   8.513   5.969
  232    HA   ARG  35           HA       ARG  35   3.660   9.044   6.768
  233    HB2  ARG  35           1HB      ARG  35   3.797  11.404   6.917
  234    HB3  ARG  35           2HB      ARG  35   5.091  10.783   7.933
  235    HG2  ARG  35           1HG      ARG  35   6.622  11.128   5.940
  236    HG3  ARG  35           2HG      ARG  35   5.300  12.052   5.223
  237    HD2  ARG  35           1HD      ARG  35   5.288  13.449   7.315
  238    HD3  ARG  35           2HD      ARG  35   6.775  12.626   7.785
  239    HE   ARG  35           HE       ARG  35   7.312  13.566   5.293
  240   HH11  ARG  35          2HH1      ARG  35   6.161  15.019   8.240
  241   HH12  ARG  35          1HH1      ARG  35   6.876  16.563   7.911
  242   HH21  ARG  35          2HH2      ARG  35   8.257  15.594   4.849
  243   HH22  ARG  35          1HH2      ARG  35   8.066  16.889   5.982
  244    H    ASP  36           H        ASP  36   2.872  10.928   5.075
  245    HA   ASP  36           HA       ASP  36   3.083   9.640   2.523
  246    HB2  ASP  36           1HB      ASP  36   1.552  11.470   1.772
  247    HB3  ASP  36           2HB      ASP  36   0.954  10.567   3.162
  248    H    SER  37           H        SER  37   5.605  10.396   3.180
  249    HA   SER  37           HA       SER  37   6.158  12.865   1.703
  250    HB2  SER  37           1HB      SER  37   7.181  12.149   4.042
  251    HB3  SER  37           2HB      SER  37   8.322  11.278   3.017
  252    HG   SER  37           HG       SER  37   7.985  14.003   3.390
  253    H    PHE  38           H        PHE  38   6.463  12.641  -0.406
  254    HA   PHE  38           HA       PHE  38   8.105  10.395  -1.355
  255    HB2  PHE  38           1HB      PHE  38   5.738  11.442  -2.903
  256    HB3  PHE  38           2HB      PHE  38   6.668   9.977  -3.200
  257    HD1  PHE  38           1HD      PHE  38   4.070  11.531  -1.152
  258    HD2  PHE  38           2HD      PHE  38   6.289   7.977  -1.905
  259    HE1  PHE  38           1HE      PHE  38   2.457  10.243   0.187
  260    HE2  PHE  38           2HE      PHE  38   4.679   6.684  -0.567
  261    HZ   PHE  38           HZ       PHE  38   2.759   7.817   0.480
  262    H    GLU  39           H        GLU  39   9.193  10.785  -3.387
  263    HA   GLU  39           HA       GLU  39   9.796  13.637  -3.751
  264    HB2  GLU  39           1HB      GLU  39  11.554  11.729  -3.208
  265    HB3  GLU  39           2HB      GLU  39  11.486  11.489  -4.948
  266    HG2  GLU  39           1HG      GLU  39  13.282  12.945  -4.582
  267    HG3  GLU  39           2HG      GLU  39  11.969  13.959  -5.176
  268    H    ASP  40           H        ASP  40  10.233  14.398  -5.940
  269    HA   ASP  40           HA       ASP  40   8.223  14.234  -7.700
  270    HB2  ASP  40           1HB      ASP  40  10.542  15.515  -7.789
  271    HB3  ASP  40           2HB      ASP  40  10.951  14.223  -8.914
  272    H    GLU  41           H        GLU  41  10.947  11.975  -7.577
  273    HA   GLU  41           HA       GLU  41   9.362   9.863  -8.666
  274    HB2  GLU  41           1HB      GLU  41  10.537   9.491 -10.723
  275    HB3  GLU  41           2HB      GLU  41   9.965  11.153 -10.720
  276    HG2  GLU  41           1HG      GLU  41  12.103  12.017 -10.380
  277    HG3  GLU  41           2HG      GLU  41  12.742  10.465  -9.840
  278    H    GLY  42           H        GLY  42  10.628   7.829  -8.881
  279    HA2  GLY  42           1HA      GLY  42  12.866   6.815  -8.444
  280    HA3  GLY  42           2HA      GLY  42  12.938   7.866  -7.037
  281    H    ARG  43           H        ARG  43  13.294   5.924  -5.797
  282    HA   ARG  43           HA       ARG  43  11.340   3.864  -5.660
  283    HB2  ARG  43           1HB      ARG  43  12.554   3.154  -3.628
  284    HB3  ARG  43           2HB      ARG  43  13.631   3.435  -4.989
  285    HG2  ARG  43           1HG      ARG  43  14.046   5.732  -4.016
  286    HG3  ARG  43           2HG      ARG  43  13.214   5.161  -2.569
  287    HD2  ARG  43           1HD      ARG  43  15.569   4.873  -2.247
  288    HD3  ARG  43           2HD      ARG  43  14.839   3.281  -2.454
  289    HE   ARG  43           HE       ARG  43  16.052   3.012  -4.378
  290   HH11  ARG  43          2HH1      ARG  43  16.106   6.366  -3.448
  291   HH12  ARG  43          1HH1      ARG  43  17.289   6.811  -4.634
  292   HH21  ARG  43          2HH2      ARG  43  17.609   3.584  -5.944
  293   HH22  ARG  43          1HH2      ARG  43  18.142   5.228  -6.054
  294    H    TRP  44           H        TRP  44  11.802   6.905  -4.003
  295    HA   TRP  44           HA       TRP  44   9.628   6.311  -2.142
  296    HB2  TRP  44           1HB      TRP  44  11.309   8.818  -2.297
  297    HB3  TRP  44           2HB      TRP  44  10.279   8.305  -0.964
  298    HD1  TRP  44           HD       TRP  44  13.782   8.433  -1.819
  299    HE1  TRP  44           1HE      TRP  44  15.166   6.749  -0.451
  300    HE3  TRP  44           3HE      TRP  44   9.981   5.507  -0.049
  301    HZ2  TRP  44           2HZ      TRP  44  14.708   4.480   1.165
  302    HZ3  TRP  44           3HZ      TRP  44  10.539   3.599   1.402
  303    HH2  TRP  44           HH       TRP  44  12.854   3.098   1.994
  304    H    ARG  45           H        ARG  45   9.061   6.601  -4.958
  305    HA   ARG  45           HA       ARG  45   7.815   9.204  -5.254
  306    HB2  ARG  45           1HB      ARG  45   7.383   8.599  -7.492
  307    HB3  ARG  45           2HB      ARG  45   8.960   7.911  -7.128
  308    HG2  ARG  45           1HG      ARG  45   8.144   5.741  -7.074
  309    HG3  ARG  45           2HG      ARG  45   6.479   6.270  -6.827
  310    HD2  ARG  45           1HD      ARG  45   7.882   7.063  -9.332
  311    HD3  ARG  45           2HD      ARG  45   7.307   5.404  -9.173
  312    HE   ARG  45           HE       ARG  45   5.305   7.346  -8.523
  313   HH11  ARG  45          2HH1      ARG  45   6.856   5.633 -11.127
  314   HH12  ARG  45          1HH1      ARG  45   5.505   5.779 -12.201
  315   HH21  ARG  45          2HH2      ARG  45   3.520   7.545  -9.928
  316   HH22  ARG  45          1HH2      ARG  45   3.608   6.867 -11.519
  317    H    LEU  46           H        LEU  46   5.629   9.612  -5.306
  318    HA   LEU  46           HA       LEU  46   3.976   7.863  -3.764
  319    HB2  LEU  46           1HB      LEU  46   3.965  10.461  -3.960
  320    HB3  LEU  46           2HB      LEU  46   2.911  10.168  -5.341
  321    HG   LEU  46           HG       LEU  46   2.302   9.092  -2.600
  322   HD11  LEU  46          1HD1      LEU  46   0.652  11.305  -3.220
  323   HD12  LEU  46          2HD1      LEU  46   2.330  11.820  -3.397
  324   HD13  LEU  46          3HD1      LEU  46   1.779  11.117  -1.876
  325   HD21  LEU  46          1HD2      LEU  46   0.557   9.671  -4.991
  326   HD22  LEU  46          2HD2      LEU  46   0.042   8.951  -3.465
  327   HD23  LEU  46          3HD2      LEU  46   1.151   8.077  -4.523
  328    H    ILE  47           H        ILE  47   3.128   6.072  -4.588
  329    HA   ILE  47           HA       ILE  47   2.250   6.078  -7.395
  330    HB   ILE  47           HB       ILE  47   2.861   3.738  -5.586
  331   HG12  ILE  47          1HG1      ILE  47   4.345   4.930  -7.935
  332   HG13  ILE  47          2HG1      ILE  47   4.886   4.879  -6.261
  333   HG21  ILE  47          1HG2      ILE  47   2.396   3.543  -8.533
  334   HG22  ILE  47          2HG2      ILE  47   2.287   2.290  -7.298
  335   HG23  ILE  47          3HG2      ILE  47   1.035   3.526  -7.412
  336   HD11  ILE  47          1HD1      ILE  47   6.062   3.209  -7.473
  337   HD12  ILE  47          2HD1      ILE  47   4.899   2.393  -6.427
  338   HD13  ILE  47          3HD1      ILE  47   4.567   2.565  -8.150
  339    H    LEU  48           H        LEU  48   0.147   6.109  -7.809
  340    HA   LEU  48           HA       LEU  48  -1.725   5.479  -5.636
  341    HB2  LEU  48           1HB      LEU  48  -1.983   7.153  -8.119
  342    HB3  LEU  48           2HB      LEU  48  -3.376   6.678  -7.149
  343    HG   LEU  48           HG       LEU  48  -1.056   8.348  -6.181
  344   HD11  LEU  48          1HD1      LEU  48  -3.271   9.907  -6.019
  345   HD12  LEU  48          2HD1      LEU  48  -3.593   9.005  -7.499
  346   HD13  LEU  48          3HD1      LEU  48  -2.110   9.948  -7.346
  347   HD21  LEU  48          1HD2      LEU  48  -2.990   8.752  -4.387
  348   HD22  LEU  48          2HD2      LEU  48  -1.785   7.476  -4.220
  349   HD23  LEU  48          3HD2      LEU  48  -3.387   7.098  -4.853
  350    H    CYS  49           H        CYS  49  -3.312   3.966  -5.865
  351    HA   CYS  49           HA       CYS  49  -2.948   1.746  -7.426
  352    HB2  CYS  49           1HB      CYS  49  -4.481   1.815  -5.512
  353    HB3  CYS  49           2HB      CYS  49  -5.586   2.838  -6.424
  354    H    ALA  50           H        ALA  50  -4.264   0.881  -9.208
  355    HA   ALA  50           HA       ALA  50  -4.844   2.985 -11.185
  356    HB1  ALA  50           1HB      ALA  50  -4.077   0.109 -11.674
  357    HB2  ALA  50           2HB      ALA  50  -4.335   1.346 -12.905
  358    HB3  ALA  50           3HB      ALA  50  -2.988   1.493 -11.776
  359    H    THR  51           H        THR  51  -5.893  -0.280 -10.212
  360    HA   THR  51           HA       THR  51  -8.168  -0.557 -11.698
  361    HB   THR  51           HB       THR  51  -7.810  -1.362  -8.805
  362    HG1  THR  51           1HG      THR  51  -7.524  -3.461 -10.140
  363   HG21  THR  51          1HG2      THR  51  -9.592  -2.861 -10.642
  364   HG22  THR  51          2HG2      THR  51 -10.186  -1.320 -10.025
  365   HG23  THR  51          3HG2      THR  51  -9.721  -2.598  -8.904
  366    H    CYS  52           H        CYS  52  -8.212   0.670  -8.344
  367    HA   CYS  52           HA       CYS  52 -10.702   2.091  -8.978
  368    HB2  CYS  52           1HB      CYS  52 -11.139   2.139  -6.611
  369    HB3  CYS  52           2HB      CYS  52 -10.686   0.496  -7.052
  370    H    GLY  53           H        GLY  53  -7.528   2.557  -7.463
  371    HA2  GLY  53           1HA      GLY  53  -6.197   4.457  -7.488
  372    HA3  GLY  53           2HA      GLY  53  -7.470   5.299  -8.361
  373    H    SER  54           H        SER  54  -7.598   3.658  -5.218
  374    HA   SER  54           HA       SER  54  -8.223   6.262  -3.987
  375    HB2  SER  54           1HB      SER  54  -9.752   5.007  -2.444
  376    HB3  SER  54           2HB      SER  54 -10.282   5.013  -4.126
  377    HG   SER  54           HG       SER  54  -9.254   2.916  -2.582
  378    H    HIS  55           H        HIS  55  -5.660   4.919  -4.167
  379    HA   HIS  55           HA       HIS  55  -5.000   4.945  -1.349
  380    HB2  HIS  55           1HB      HIS  55  -4.442   2.508  -3.053
  381    HB3  HIS  55           2HB      HIS  55  -3.813   2.775  -1.429
  382    HD1  HIS  55           1HD      HIS  55  -6.893   1.787  -3.275
  383    HD2  HIS  55           2HD      HIS  55  -5.689   2.446   0.647
  384    HE1  HIS  55           1HE      HIS  55  -8.728   0.840  -1.840
  385    HE2  HIS  55           2HE      HIS  55  -8.018   1.326   0.527
  386    H    GLY  56           H        GLY  56  -2.875   5.500  -0.947
  387    HA2  GLY  56           1HA      GLY  56  -1.090   5.767  -3.269
  388    HA3  GLY  56           2HA      GLY  56  -1.424   7.180  -2.278
  389    H    THR  57           H        THR  57   0.834   4.938  -2.841
  390    HA   THR  57           HA       THR  57   2.065   5.349  -0.242
  391    HB   THR  57           HB       THR  57   0.686   3.117  -0.307
  392    HG1  THR  57           1HG      THR  57   2.932   3.908   0.923
  393   HG21  THR  57          1HG2      THR  57   1.710   1.250  -1.264
  394   HG22  THR  57          2HG2      THR  57   3.257   2.075  -1.451
  395   HG23  THR  57          3HG2      THR  57   1.902   2.494  -2.498
  396    H    HIS  58           H        HIS  58   4.340   4.454  -0.227
  397    HA   HIS  58           HA       HIS  58   5.751   5.441  -2.459
  398    HB2  HIS  58           1HB      HIS  58   6.897   3.552  -0.408
  399    HB3  HIS  58           2HB      HIS  58   7.732   4.812  -1.312
  400    HD2  HIS  58           2HD      HIS  58   7.883   7.211  -0.032
  401    HE1  HIS  58           1HE      HIS  58   5.110   6.365   3.066
  402    HE2  HIS  58           2HE      HIS  58   6.723   8.053   2.122
  403    H    ARG  59           H        ARG  59   7.606   3.970  -3.407
  404    HA   ARG  59           HA       ARG  59   6.254   1.906  -4.896
  405    HB2  ARG  59           1HB      ARG  59   7.970   3.571  -5.812
  406    HB3  ARG  59           2HB      ARG  59   9.189   2.567  -5.039
  407    HG2  ARG  59           1HG      ARG  59   7.219   1.292  -6.872
  408    HG3  ARG  59           2HG      ARG  59   8.560   2.218  -7.550
  409    HD2  ARG  59           1HD      ARG  59   8.817  -0.076  -5.609
  410    HD3  ARG  59           2HD      ARG  59   9.087  -0.174  -7.349
  411    HE   ARG  59           HE       ARG  59  10.901   0.826  -5.384
  412   HH11  ARG  59          2HH1      ARG  59   9.896   1.140  -8.703
  413   HH12  ARG  59          1HH1      ARG  59  11.427   1.741  -9.246
  414   HH21  ARG  59          2HH2      ARG  59  12.921   1.616  -6.087
  415   HH22  ARG  59          1HH2      ARG  59  13.148   2.011  -7.757
  416    H    ASP  60           H        ASP  60   9.429   1.848  -3.277
  417    HA   ASP  60           HA       ASP  60   9.584  -0.931  -3.069
  418    HB2  ASP  60           1HB      ASP  60  11.264  -0.416  -1.209
  419    HB3  ASP  60           2HB      ASP  60  11.598   0.267  -2.798
  420    H    CYS  61           H        CYS  61   8.045   1.436  -1.016
  421    HA   CYS  61           HA       CYS  61   7.737  -0.073   1.316
  422    HB2  CYS  61           1HB      CYS  61   7.254   2.352   1.139
  423    HB3  CYS  61           2HB      CYS  61   5.823   1.978   0.183
  424    H    SER  62           H        SER  62   5.857  -0.003  -1.657
  425    HA   SER  62           HA       SER  62   3.836  -1.784  -0.607
  426    HB2  SER  62           1HB      SER  62   3.012  -0.218  -2.180
  427    HB3  SER  62           2HB      SER  62   4.323  -0.545  -3.314
  428    HG   SER  62           HG       SER  62   2.694  -2.689  -2.619
  429    H    SER  63           H        SER  63   6.811  -2.485  -1.006
  430    HA   SER  63           HA       SER  63   8.073  -4.269  -1.654
  431    HB2  SER  63           1HB      SER  63   6.083  -5.241  -0.195
  432    HB3  SER  63           2HB      SER  63   5.642  -6.005  -1.722
  433    HG   SER  63           HG       SER  63   7.080  -7.432  -1.164
  434    H    LEU  64           H        LEU  64   7.498  -2.750  -3.794
  435    HA   LEU  64           HA       LEU  64   6.535  -4.538  -5.904
  436    HB2  LEU  64           1HB      LEU  64   7.227  -1.606  -6.011
  437    HB3  LEU  64           2HB      LEU  64   6.529  -2.551  -7.325
  438    HG   LEU  64           HG       LEU  64   5.124  -2.151  -4.694
  439   HD11  LEU  64          1HD1      LEU  64   3.951  -0.589  -6.741
  440   HD12  LEU  64          2HD1      LEU  64   5.666  -0.185  -6.673
  441   HD13  LEU  64          3HD1      LEU  64   4.671  -0.050  -5.224
  442   HD21  LEU  64          1HD2      LEU  64   3.391  -3.244  -5.617
  443   HD22  LEU  64          2HD2      LEU  64   4.620  -3.910  -6.693
  444   HD23  LEU  64          3HD2      LEU  64   3.651  -2.527  -7.208
  445    H    ARG  65           H        ARG  65   7.820  -3.860  -8.099
  446    HA   ARG  65           HA       ARG  65  10.591  -4.639  -7.542
  447    HB2  ARG  65           1HB      ARG  65   8.702  -5.092  -9.787
  448    HB3  ARG  65           2HB      ARG  65  10.403  -4.927 -10.203
  449    HG2  ARG  65           1HG      ARG  65   9.719  -7.265  -9.884
  450    HG3  ARG  65           2HG      ARG  65  10.982  -6.765  -8.757
  451    HD2  ARG  65           1HD      ARG  65   9.591  -6.847  -6.945
  452    HD3  ARG  65           2HD      ARG  65   8.153  -6.484  -7.898
  453    HE   ARG  65           HE       ARG  65   7.880  -8.734  -8.310
  454   HH11  ARG  65          2HH1      ARG  65  10.982  -8.160  -6.837
  455   HH12  ARG  65          1HH1      ARG  65  11.299  -9.838  -6.544
  456   HH21  ARG  65          2HH2      ARG  65   8.286 -10.946  -7.930
  457   HH22  ARG  65          1HH2      ARG  65   9.765 -11.422  -7.167
  458    HA   PRO  66           HA       PRO  66  12.354  -0.871  -8.933
  459    HB2  PRO  66           1HB      PRO  66  14.475  -1.704 -10.408
  460    HB3  PRO  66           2HB      PRO  66  14.421  -1.831  -8.645
  461    HG2  PRO  66           1HG      PRO  66  13.881  -3.927 -10.713
  462    HG3  PRO  66           2HG      PRO  66  14.797  -4.057  -9.200
  463    HD2  PRO  66           1HD      PRO  66  12.247  -4.937  -9.438
  464    HD3  PRO  66           2HD      PRO  66  12.895  -4.284  -7.919
  465    H    ASN  67           H        ASN  67  11.061  -3.078 -11.178
  466    HA   ASN  67           HA       ASN  67  10.943  -0.961 -13.209
  467    HB2  ASN  67           1HB      ASN  67  11.975  -3.739 -13.518
  468    HB3  ASN  67           2HB      ASN  67  11.030  -3.066 -14.844
  469   HD21  ASN  67          1HD2      ASN  67  11.771  -1.117 -15.834
  470   HD22  ASN  67          2HD2      ASN  67  13.451  -0.716 -15.811
  471    H    SER  68           H        SER  68   8.947  -1.476 -11.375
  472    HA   SER  68           HA       SER  68   6.993  -3.280 -12.451
  473    HB2  SER  68           1HB      SER  68   6.976  -2.882 -10.074
  474    HB3  SER  68           2HB      SER  68   6.822  -1.142 -10.317
  475    HG   SER  68           HG       SER  68   4.768  -1.582 -11.298
  476    H    LYS  69           H        LYS  69   4.753  -2.480 -12.970
  477    HA   LYS  69           HA       LYS  69   4.947  -0.111 -14.709
  478    HB2  LYS  69           1HB      LYS  69   3.068  -2.469 -14.949
  479    HB3  LYS  69           2HB      LYS  69   3.185  -1.118 -16.070
  480    HG2  LYS  69           1HG      LYS  69   5.516  -1.783 -16.564
  481    HG3  LYS  69           2HG      LYS  69   5.297  -3.193 -15.524
  482    HD2  LYS  69           1HD      LYS  69   3.325  -2.714 -17.704
  483    HD3  LYS  69           2HD      LYS  69   4.921  -3.335 -18.134
  484    HE2  LYS  69           1HE      LYS  69   3.841  -5.310 -17.779
  485    HE3  LYS  69           2HE      LYS  69   4.402  -4.996 -16.138
  486    HZ1  LYS  69           1HZ      LYS  69   2.075  -5.640 -16.172
  487    HZ2  LYS  69           2HZ      LYS  69   1.703  -4.345 -17.194
  488    HZ3  LYS  69           3HZ      LYS  69   2.241  -4.050 -15.618
  489    H    LYS  70           H        LYS  70   2.513  -1.952 -12.860
  490    HA   LYS  70           HA       LYS  70   1.436   0.586 -11.869
  491    HB2  LYS  70           1HB      LYS  70  -0.826   0.004 -12.382
  492    HB3  LYS  70           2HB      LYS  70   0.109  -0.165 -13.862
  493    HG2  LYS  70           1HG      LYS  70  -0.147  -2.418 -13.935
  494    HG3  LYS  70           2HG      LYS  70  -0.218  -2.579 -12.178
  495    HD2  LYS  70           1HD      LYS  70  -2.441  -1.123 -13.489
  496    HD3  LYS  70           2HD      LYS  70  -2.362  -2.868 -13.749
  497    HE2  LYS  70           1HE      LYS  70  -3.756  -2.298 -11.816
  498    HE3  LYS  70           2HE      LYS  70  -2.345  -3.243 -11.347
  499    HZ1  LYS  70           1HZ      LYS  70  -2.968  -1.192  -9.966
  500    HZ2  LYS  70           2HZ      LYS  70  -2.283  -0.297 -11.227
  501    HZ3  LYS  70           3HZ      LYS  70  -1.342  -1.416 -10.376
  502    H    TRP  71           H        TRP  71   0.119   0.359  -9.950
  503    HA   TRP  71           HA       TRP  71   0.599  -2.162  -8.504
  504    HB2  TRP  71           1HB      TRP  71   2.065  -0.777  -7.379
  505    HB3  TRP  71           2HB      TRP  71   1.092   0.662  -7.667
  506    HD1  TRP  71           HD       TRP  71   1.041  -2.510  -5.446
  507    HE1  TRP  71           1HE      TRP  71  -0.183  -1.928  -3.258
  508    HE3  TRP  71           3HE      TRP  71  -0.399   2.266  -6.567
  509    HZ2  TRP  71           2HZ      TRP  71  -1.575   0.265  -2.154
  510    HZ3  TRP  71           3HZ      TRP  71  -1.674   3.537  -4.890
  511    HH2  TRP  71           HH       TRP  71  -2.249   2.556  -2.730
  512    H    GLU  72           H        GLU  72  -1.013  -2.867  -7.105
  513    HA   GLU  72           HA       GLU  72  -3.577  -1.429  -7.327
  514    HB2  GLU  72           1HB      GLU  72  -2.913  -4.332  -7.543
  515    HB3  GLU  72           2HB      GLU  72  -4.467  -3.875  -6.860
  516    HG2  GLU  72           1HG      GLU  72  -5.060  -2.695  -8.869
  517    HG3  GLU  72           2HG      GLU  72  -3.460  -2.983  -9.551
  518    H    CYS  73           H        CYS  73  -4.712  -1.039  -5.501
  519    HA   CYS  73           HA       CYS  73  -3.392  -1.210  -3.000
  520    HB2  CYS  73           1HB      CYS  73  -5.345  -0.178  -2.074
  521    HB3  CYS  73           2HB      CYS  73  -5.071   0.542  -3.657
  522    H    ASN  74           H        ASN  74  -4.343  -2.224  -1.046
  523    HA   ASN  74           HA       ASN  74  -4.462  -4.969  -1.227
  524    HB2  ASN  74           1HB      ASN  74  -4.255  -3.359   0.842
  525    HB3  ASN  74           2HB      ASN  74  -5.998  -3.591   0.943
  526   HD21  ASN  74          1HD2      ASN  74  -5.694  -4.616   2.956
  527   HD22  ASN  74          2HD2      ASN  74  -5.144  -6.251   3.048
  528    H    GLU  75           H        GLU  75  -7.253  -2.807  -0.699
  529    HA   GLU  75           HA       GLU  75  -9.316  -4.554  -0.727
  530    HB2  GLU  75           1HB      GLU  75  -9.512  -2.075  -0.547
  531    HB3  GLU  75           2HB      GLU  75  -9.305  -1.967  -2.290
  532    HG2  GLU  75           1HG      GLU  75 -11.668  -1.840  -1.439
  533    HG3  GLU  75           2HG      GLU  75 -11.361  -3.027  -2.707
  534    H    CYS  76           H        CYS  76  -7.592  -3.362  -3.580
  535    HA   CYS  76           HA       CYS  76  -9.226  -4.811  -5.433
  536    HB2  CYS  76           1HB      CYS  76  -6.580  -3.383  -5.707
  537    HB3  CYS  76           2HB      CYS  76  -7.370  -4.197  -7.054
  538    H    LEU  77           H        LEU  77  -5.806  -5.164  -4.473
  539    HA   LEU  77           HA       LEU  77  -5.029  -7.385  -5.743
  540    HB2  LEU  77           1HB      LEU  77  -4.615  -6.628  -2.870
  541    HB3  LEU  77           2HB      LEU  77  -3.862  -8.064  -3.561
  542    HG   LEU  77           HG       LEU  77  -3.443  -5.259  -4.589
  543   HD11  LEU  77          1HD1      LEU  77  -2.599  -5.897  -2.208
  544   HD12  LEU  77          2HD1      LEU  77  -1.519  -5.080  -3.338
  545   HD13  LEU  77          3HD1      LEU  77  -1.385  -6.821  -3.094
  546   HD21  LEU  77          1HD2      LEU  77  -3.044  -7.636  -5.874
  547   HD22  LEU  77          2HD2      LEU  77  -1.468  -7.346  -5.136
  548   HD23  LEU  77          3HD2      LEU  77  -2.175  -6.139  -6.211
  549    HA   PRO  78           HA       PRO  78  -7.588 -10.816  -4.767
  550    HB2  PRO  78           1HB      PRO  78  -5.795 -12.853  -4.855
  551    HB3  PRO  78           2HB      PRO  78  -6.366 -12.012  -6.302
  552    HG2  PRO  78           1HG      PRO  78  -3.823 -11.632  -4.768
  553    HG3  PRO  78           2HG      PRO  78  -4.073 -11.690  -6.523
  554    HD2  PRO  78           1HD      PRO  78  -3.776  -9.364  -5.170
  555    HD3  PRO  78           2HD      PRO  78  -4.792  -9.503  -6.620
  556    H    ALA  79           H        ALA  79  -5.526  -9.533  -2.595
  557    HA   ALA  79           HA       ALA  79  -4.840 -11.284  -0.663
  558    HB1  ALA  79           1HB      ALA  79  -4.807  -9.537   0.825
  559    HB2  ALA  79           2HB      ALA  79  -4.844  -8.663  -0.707
  560    HB3  ALA  79           3HB      ALA  79  -6.323  -8.859   0.233
  561    H    SER  80           H        SER  80  -5.794 -12.346   1.066
  562    HA   SER  80           HA       SER  80  -8.377 -13.388   0.639
  563    HB2  SER  80           1HB      SER  80  -6.727 -14.688   1.837
  564    HB3  SER  80           2HB      SER  80  -6.603 -13.454   3.091
  565    HG   SER  80           HG       SER  80  -7.977 -14.917   3.926
  566    H    GLY  81           H        GLY  81 -10.345 -12.921   1.511
  567    HA2  GLY  81           1HA      GLY  81 -11.127 -11.631   3.720
  568    HA3  GLY  81           2HA      GLY  81 -10.623 -10.287   2.707
  569    HA   PRO  82           HA       PRO  82 -14.781 -12.390   1.261
  570    HB2  PRO  82           1HB      PRO  82 -16.514 -12.288   3.349
  571    HB3  PRO  82           2HB      PRO  82 -15.510 -13.701   3.002
  572    HG2  PRO  82           1HG      PRO  82 -15.078 -11.514   5.001
  573    HG3  PRO  82           2HG      PRO  82 -14.853 -13.263   5.189
  574    HD2  PRO  82           1HD      PRO  82 -12.788 -11.568   4.747
  575    HD3  PRO  82           2HD      PRO  82 -12.798 -13.238   4.146
  576    H    SER  83           H        SER  83 -14.036  -9.673   3.266
  577    HA   SER  83           HA       SER  83 -16.121  -8.021   3.334
  578    HB2  SER  83           1HB      SER  83 -13.714  -7.439   3.866
  579    HB3  SER  83           2HB      SER  83 -13.504  -7.078   2.153
  580    HG   SER  83           HG       SER  83 -15.537  -5.711   2.638
  581    H    SER  84           H        SER  84 -14.116  -8.326   0.400
  582    HA   SER  84           HA       SER  84 -16.372  -8.257  -1.334
  583    HB2  SER  84           1HB      SER  84 -16.154  -5.832  -0.599
  584    HB3  SER  84           2HB      SER  84 -14.617  -5.801  -1.463
  585    HG   SER  84           HG       SER  84 -15.677  -5.621  -3.260
  586    H    GLY  85           H        GLY  85 -15.589  -7.922  -3.694
  587    HA2  GLY  85           1HA      GLY  85 -14.217  -8.582  -5.416
  588    HA3  GLY  85           2HA      GLY  85 -12.861  -8.347  -4.324
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1 -26.831 -17.215  29.745
    2    HA2  GLY   1           1HA      GLY   1 -29.431 -17.062  28.382
    3    HA3  GLY   1           2HA      GLY   1 -28.265 -15.754  28.513
    4    H    SER   2           H        SER   2 -28.565 -15.489  26.211
    5    HA   SER   2           HA       SER   2 -26.788 -17.269  24.704
    6    HB2  SER   2           1HB      SER   2 -28.384 -17.113  22.754
    7    HB3  SER   2           2HB      SER   2 -28.964 -18.081  24.109
    8    HG   SER   2           HG       SER   2 -29.619 -15.348  23.727
    9    H    SER   3           H        SER   3 -26.022 -16.301  22.675
   10    HA   SER   3           HA       SER   3 -25.894 -13.364  22.884
   11    HB2  SER   3           1HB      SER   3 -23.747 -14.593  23.314
   12    HB3  SER   3           2HB      SER   3 -23.814 -15.186  21.655
   13    HG   SER   3           HG       SER   3 -22.722 -13.396  21.328
   14    H    GLY   4           H        GLY   4 -26.578 -12.190  21.205
   15    HA2  GLY   4           1HA      GLY   4 -27.410 -13.632  18.786
   16    HA3  GLY   4           2HA      GLY   4 -27.994 -12.054  19.293
   17    H    SER   5           H        SER   5 -27.572 -11.150  17.260
   18    HA   SER   5           HA       SER   5 -24.767 -10.430  16.870
   19    HB2  SER   5           1HB      SER   5 -24.818 -10.925  14.494
   20    HB3  SER   5           2HB      SER   5 -25.232 -12.385  15.392
   21    HG   SER   5           HG       SER   5 -27.056 -10.607  14.136
   22    H    SER   6           H        SER   6 -24.804  -8.291  17.042
   23    HA   SER   6           HA       SER   6 -27.126  -6.747  16.308
   24    HB2  SER   6           1HB      SER   6 -25.545  -6.285  18.280
   25    HB3  SER   6           2HB      SER   6 -24.438  -5.619  17.079
   26    HG   SER   6           HG       SER   6 -27.063  -4.728  16.967
   27    H    GLY   7           H        GLY   7 -26.822  -4.724  14.970
   28    HA2  GLY   7           1HA      GLY   7 -26.162  -5.388  12.346
   29    HA3  GLY   7           2HA      GLY   7 -26.363  -3.748  12.945
   30    H    GLU   8           H        GLU   8 -24.632  -3.739  11.079
   31    HA   GLU   8           HA       GLU   8 -22.064  -3.458  12.428
   32    HB2  GLU   8           1HB      GLU   8 -20.844  -4.663  10.698
   33    HB3  GLU   8           2HB      GLU   8 -22.014  -5.722  11.472
   34    HG2  GLU   8           1HG      GLU   8 -22.543  -4.309   8.875
   35    HG3  GLU   8           2HG      GLU   8 -21.833  -5.919   8.977
   36    H    LEU   9           H        LEU   9 -20.424  -2.473  10.802
   37    HA   LEU   9           HA       LEU   9 -21.786  -0.227   9.521
   38    HB2  LEU   9           1HB      LEU   9 -19.545   0.803   9.468
   39    HB3  LEU   9           2HB      LEU   9 -20.079   0.374  11.091
   40    HG   LEU   9           HG       LEU   9 -18.658  -1.778  10.688
   41   HD11  LEU   9          1HD1      LEU   9 -18.143  -0.300   8.305
   42   HD12  LEU   9          2HD1      LEU   9 -17.529  -1.881   8.787
   43   HD13  LEU   9          3HD1      LEU   9 -16.654  -0.419   9.242
   44   HD21  LEU   9          1HD2      LEU   9 -18.054  -0.333  12.430
   45   HD22  LEU   9          2HD2      LEU   9 -17.637   0.974  11.322
   46   HD23  LEU   9          3HD2      LEU   9 -16.605  -0.453  11.431
   47    H    GLU  10           H        GLU  10 -21.248   0.471   7.404
   48    HA   GLU  10           HA       GLU  10 -20.286  -1.713   5.682
   49    HB2  GLU  10           1HB      GLU  10 -21.603  -0.758   3.901
   50    HB3  GLU  10           2HB      GLU  10 -22.624  -0.963   5.317
   51    HG2  GLU  10           1HG      GLU  10 -22.513   1.377   5.813
   52    HG3  GLU  10           2HG      GLU  10 -21.324   1.635   4.538
   53    HA   PRO  11           HA       PRO  11 -16.740   0.713   4.683
   54    HB2  PRO  11           1HB      PRO  11 -16.020  -0.576   2.405
   55    HB3  PRO  11           2HB      PRO  11 -15.776  -1.263   4.016
   56    HG2  PRO  11           1HG      PRO  11 -17.952  -1.808   2.034
   57    HG3  PRO  11           2HG      PRO  11 -17.047  -2.950   3.044
   58    HD2  PRO  11           1HD      PRO  11 -19.540  -2.105   3.677
   59    HD3  PRO  11           2HD      PRO  11 -18.329  -2.512   4.909
   60    H    GLY  12           H        GLY  12 -15.798   1.866   2.721
   61    HA2  GLY  12           1HA      GLY  12 -16.180   3.746   1.404
   62    HA3  GLY  12           2HA      GLY  12 -16.906   2.517   0.379
   63    H    ALA  13           H        ALA  13 -17.999   3.902   3.464
   64    HA   ALA  13           HA       ALA  13 -20.498   4.677   2.108
   65    HB1  ALA  13           1HB      ALA  13 -20.974   4.659   4.858
   66    HB2  ALA  13           2HB      ALA  13 -21.514   3.470   3.672
   67    HB3  ALA  13           3HB      ALA  13 -20.001   3.222   4.543
   68    H    PHE  14           H        PHE  14 -18.244   6.366   2.047
   69    HA   PHE  14           HA       PHE  14 -19.296   8.642   3.567
   70    HB2  PHE  14           1HB      PHE  14 -16.542   7.513   3.694
   71    HB3  PHE  14           2HB      PHE  14 -16.709   9.265   3.722
   72    HD1  PHE  14           2HD      PHE  14 -18.033  10.341   5.533
   73    HD2  PHE  14           1HD      PHE  14 -17.062   6.197   5.580
   74    HE1  PHE  14           2HE      PHE  14 -18.533  10.255   7.941
   75    HE2  PHE  14           1HE      PHE  14 -17.561   6.104   7.987
   76    HZ   PHE  14           HZ       PHE  14 -18.296   8.134   9.171
   77    H    SER  15           H        SER  15 -19.020  10.653   2.593
   78    HA   SER  15           HA       SER  15 -19.208  10.835  -0.130
   79    HB2  SER  15           1HB      SER  15 -19.725  12.673   1.465
   80    HB3  SER  15           2HB      SER  15 -17.995  12.950   1.665
   81    HG   SER  15           HG       SER  15 -19.541  13.255  -0.690
   82    H    GLU  16           H        GLU  16 -17.669  12.015  -1.631
   83    HA   GLU  16           HA       GLU  16 -15.253  10.509  -1.807
   84    HB2  GLU  16           1HB      GLU  16 -14.899  11.595  -3.887
   85    HB3  GLU  16           2HB      GLU  16 -16.634  11.341  -3.754
   86    HG2  GLU  16           1HG      GLU  16 -15.509  13.929  -2.826
   87    HG3  GLU  16           2HG      GLU  16 -15.634  13.633  -4.559
   88    H    LEU  17           H        LEU  17 -13.141  11.706  -2.327
   89    HA   LEU  17           HA       LEU  17 -12.592  13.476  -0.078
   90    HB2  LEU  17           1HB      LEU  17 -10.784  12.066  -2.031
   91    HB3  LEU  17           2HB      LEU  17 -10.211  13.125  -0.744
   92    HG   LEU  17           HG       LEU  17 -11.846  10.662  -0.188
   93   HD11  LEU  17          1HD1      LEU  17  -9.436  10.528  -1.422
   94   HD12  LEU  17          2HD1      LEU  17 -10.066   9.304  -0.321
   95   HD13  LEU  17          3HD1      LEU  17  -8.951  10.534   0.273
   96   HD21  LEU  17          1HD2      LEU  17 -11.022  12.786   1.399
   97   HD22  LEU  17          2HD2      LEU  17  -9.875  11.495   1.760
   98   HD23  LEU  17          3HD2      LEU  17 -11.607  11.217   1.953
   99    H    TYR  18           H        TYR  18 -12.747  13.521  -3.557
  100    HA   TYR  18           HA       TYR  18 -12.553  15.184  -5.097
  101    HB2  TYR  18           1HB      TYR  18 -14.186  16.156  -3.257
  102    HB3  TYR  18           2HB      TYR  18 -12.852  17.269  -2.978
  103    HD1  TYR  18           1HD      TYR  18 -14.357  15.797  -6.071
  104    HD2  TYR  18           2HD      TYR  18 -13.310  19.319  -3.926
  105    HE1  TYR  18           1HE      TYR  18 -15.115  17.170  -7.966
  106    HE2  TYR  18           2HE      TYR  18 -14.065  20.701  -5.815
  107    HH   TYR  18           HH       TYR  18 -14.721  19.420  -8.883
  108    H    GLN  19           H        GLN  19 -10.178  14.306  -3.516
  109    HA   GLN  19           HA       GLN  19  -8.368  16.330  -4.497
  110    HB2  GLN  19           1HB      GLN  19  -7.266  16.795  -2.420
  111    HB3  GLN  19           2HB      GLN  19  -8.982  17.111  -2.201
  112    HG2  GLN  19           1HG      GLN  19  -9.283  15.293  -0.825
  113    HG3  GLN  19           2HG      GLN  19  -7.876  14.445  -1.463
  114   HE21  GLN  19          1HE2      GLN  19  -8.167  14.516   1.190
  115   HE22  GLN  19          2HE2      GLN  19  -7.025  15.593   1.913
  116    H    ARG  20           H        ARG  20  -6.071  15.645  -4.245
  117    HA   ARG  20           HA       ARG  20  -5.751  12.972  -5.092
  118    HB2  ARG  20           1HB      ARG  20  -4.258  15.071  -5.501
  119    HB3  ARG  20           2HB      ARG  20  -3.482  14.598  -3.996
  120    HG2  ARG  20           1HG      ARG  20  -2.558  12.714  -4.899
  121    HG3  ARG  20           2HG      ARG  20  -3.824  12.545  -6.117
  122    HD2  ARG  20           1HD      ARG  20  -2.832  14.777  -7.038
  123    HD3  ARG  20           2HD      ARG  20  -1.406  14.298  -6.118
  124    HE   ARG  20           HE       ARG  20  -2.472  12.275  -7.891
  125   HH11  ARG  20          2HH1      ARG  20  -0.221  14.899  -7.479
  126   HH12  ARG  20          1HH1      ARG  20   0.820  14.379  -8.762
  127   HH21  ARG  20          2HH2      ARG  20  -1.109  11.581  -9.583
  128   HH22  ARG  20          1HH2      ARG  20   0.314  12.492  -9.959
  129    H    TYR  21           H        TYR  21  -5.574  11.157  -3.962
  130    HA   TYR  21           HA       TYR  21  -5.484  11.256  -1.077
  131    HB2  TYR  21           1HB      TYR  21  -6.985   9.671  -2.137
  132    HB3  TYR  21           2HB      TYR  21  -5.645   8.929  -3.003
  133    HD1  TYR  21           2HD      TYR  21  -3.722   7.985  -1.464
  134    HD2  TYR  21           1HD      TYR  21  -7.711   8.700  -0.168
  135    HE1  TYR  21           2HE      TYR  21  -3.397   6.402   0.390
  136    HE2  TYR  21           1HE      TYR  21  -7.397   7.119   1.690
  137    HH   TYR  21           HH       TYR  21  -4.279   5.505   2.221
  138    H    ARG  22           H        ARG  22  -3.656  11.313   0.032
  139    HA   ARG  22           HA       ARG  22  -1.341   9.806  -0.969
  140    HB2  ARG  22           1HB      ARG  22   0.101  11.686  -0.052
  141    HB3  ARG  22           2HB      ARG  22  -0.776  12.031  -1.537
  142    HG2  ARG  22           1HG      ARG  22  -2.218  13.497  -0.509
  143    HG3  ARG  22           2HG      ARG  22  -1.994  12.766   1.082
  144    HD2  ARG  22           1HD      ARG  22   0.204  13.719   1.269
  145    HD3  ARG  22           2HD      ARG  22   0.134  14.312  -0.390
  146    HE   ARG  22           HE       ARG  22  -1.188  16.068   0.314
  147   HH11  ARG  22          2HH1      ARG  22  -0.795  13.755   2.886
  148   HH12  ARG  22          1HH1      ARG  22  -1.462  14.797   4.100
  149   HH21  ARG  22          2HH2      ARG  22  -2.068  17.448   1.903
  150   HH22  ARG  22          1HH2      ARG  22  -2.187  16.896   3.539
  151    H    HIS  23           H        HIS  23  -1.631   8.159   0.508
  152    HA   HIS  23           HA       HIS  23  -0.762   8.753   3.207
  153    HB2  HIS  23           1HB      HIS  23  -3.368   8.868   3.020
  154    HB3  HIS  23           2HB      HIS  23  -3.259   7.111   2.962
  155    HD1  HIS  23           1HD      HIS  23  -2.469   5.900   5.117
  156    HD2  HIS  23           2HD      HIS  23  -2.848  10.019   5.506
  157    HE1  HIS  23           1HE      HIS  23  -2.386   6.352   7.590
  158    HE2  HIS  23           2HE      HIS  23  -2.704   8.841   7.805
  159    H    CYS  24           H        CYS  24   0.947   7.435   3.264
  160    HA   CYS  24           HA       CYS  24   1.438   5.161   1.828
  161    HB2  CYS  24           1HB      CYS  24   3.221   6.098   3.080
  162    HB3  CYS  24           2HB      CYS  24   2.338   5.945   4.596
  163    H    ASP  25           H        ASP  25   0.118   3.476   1.599
  164    HA   ASP  25           HA       ASP  25  -1.005   2.255   4.036
  165    HB2  ASP  25           1HB      ASP  25  -2.727   3.301   2.571
  166    HB3  ASP  25           2HB      ASP  25  -2.235   2.217   1.273
  167    H    ALA  26           H        ALA  26   1.549   1.644   2.967
  168    HA   ALA  26           HA       ALA  26   1.222  -0.897   1.570
  169    HB1  ALA  26           1HB      ALA  26   3.939  -0.446   2.194
  170    HB2  ALA  26           2HB      ALA  26   3.142  -0.313   0.626
  171    HB3  ALA  26           3HB      ALA  26   3.257   1.097   1.679
  172    HA   PRO  27           HA       PRO  27   1.915  -3.567   4.983
  173    HB2  PRO  27           1HB      PRO  27   3.816  -5.296   4.107
  174    HB3  PRO  27           2HB      PRO  27   2.154  -5.310   3.506
  175    HG2  PRO  27           1HG      PRO  27   4.603  -4.105   2.276
  176    HG3  PRO  27           2HG      PRO  27   3.307  -5.037   1.505
  177    HD2  PRO  27           1HD      PRO  27   3.431  -2.335   1.380
  178    HD3  PRO  27           2HD      PRO  27   1.892  -3.221   1.398
  179    H    ILE  28           H        ILE  28   5.085  -2.763   3.548
  180    HA   ILE  28           HA       ILE  28   6.055  -2.135   6.253
  181    HB   ILE  28           HB       ILE  28   7.624  -3.627   4.147
  182   HG12  ILE  28          1HG1      ILE  28   5.922  -5.023   5.251
  183   HG13  ILE  28          2HG1      ILE  28   7.551  -5.511   5.708
  184   HG21  ILE  28          1HG2      ILE  28   9.217  -2.373   5.264
  185   HG22  ILE  28          2HG2      ILE  28   8.353  -2.455   6.799
  186   HG23  ILE  28          3HG2      ILE  28   9.203  -3.875   6.188
  187   HD11  ILE  28          1HD1      ILE  28   6.778  -5.463   7.792
  188   HD12  ILE  28          2HD1      ILE  28   6.903  -3.708   7.660
  189   HD13  ILE  28          3HD1      ILE  28   5.364  -4.510   7.343
  190    H    CYS  29           H        CYS  29   7.299  -0.339   6.434
  191    HA   CYS  29           HA       CYS  29   7.805   1.168   3.954
  192    HB2  CYS  29           1HB      CYS  29   6.225   2.018   5.903
  193    HB3  CYS  29           2HB      CYS  29   7.756   2.508   6.622
  194    H    LEU  30           H        LEU  30   9.768   2.275   3.713
  195    HA   LEU  30           HA       LEU  30  11.906   1.409   5.547
  196    HB2  LEU  30           1HB      LEU  30  12.191   1.940   2.596
  197    HB3  LEU  30           2HB      LEU  30  13.422   1.306   3.685
  198    HG   LEU  30           HG       LEU  30  10.907  -0.249   3.338
  199   HD11  LEU  30          1HD1      LEU  30  11.173  -0.207   1.105
  200   HD12  LEU  30          2HD1      LEU  30  12.463  -1.362   1.437
  201   HD13  LEU  30          3HD1      LEU  30  12.845   0.344   1.205
  202   HD21  LEU  30          1HD2      LEU  30  12.969  -0.720   4.874
  203   HD22  LEU  30          2HD2      LEU  30  13.690  -1.324   3.382
  204   HD23  LEU  30          3HD2      LEU  30  12.196  -2.037   3.992
  205    H    TYR  31           H        TYR  31  10.706   3.961   3.434
  206    HA   TYR  31           HA       TYR  31  12.712   5.845   3.724
  207    HB2  TYR  31           1HB      TYR  31  10.592   5.945   2.282
  208    HB3  TYR  31           2HB      TYR  31   9.790   6.582   3.713
  209    HD1  TYR  31           2HD      TYR  31  13.184   7.244   2.304
  210    HD2  TYR  31           1HD      TYR  31   9.369   8.827   3.326
  211    HE1  TYR  31           2HE      TYR  31  13.976   9.502   1.737
  212    HE2  TYR  31           1HE      TYR  31  10.150  11.090   2.761
  213    HH   TYR  31           HH       TYR  31  13.480  11.778   2.123
  214    H    GLU  32           H        GLU  32  13.612   6.512   5.554
  215    HA   GLU  32           HA       GLU  32  12.925   6.264   8.109
  216    HB2  GLU  32           1HB      GLU  32  14.957   7.448   7.260
  217    HB3  GLU  32           2HB      GLU  32  13.969   8.882   7.021
  218    HG2  GLU  32           1HG      GLU  32  15.360   8.757   9.141
  219    HG3  GLU  32           2HG      GLU  32  13.663   9.204   9.309
  220    H    GLN  33           H        GLN  33  11.721   8.900   6.053
  221    HA   GLN  33           HA       GLN  33  10.215  10.278   7.916
  222    HB2  GLN  33           1HB      GLN  33  10.665  10.657   5.331
  223    HB3  GLN  33           2HB      GLN  33   9.085   9.900   5.182
  224    HG2  GLN  33           1HG      GLN  33   8.782  12.260   5.214
  225    HG3  GLN  33           2HG      GLN  33   8.182  11.609   6.739
  226   HE21  GLN  33          1HE2      GLN  33  10.507  13.628   5.208
  227   HE22  GLN  33          2HE2      GLN  33  11.232  14.256   6.645
  228    H    GLY  34           H        GLY  34   8.920   7.847   5.639
  229    HA2  GLY  34           1HA      GLY  34   7.421   6.117   6.129
  230    HA3  GLY  34           2HA      GLY  34   7.223   6.777   7.746
  231    H    ARG  35           H        ARG  35   6.462   9.362   7.222
  232    HA   ARG  35           HA       ARG  35   3.732   9.160   6.841
  233    HB2  ARG  35           1HB      ARG  35   3.652  11.470   6.999
  234    HB3  ARG  35           2HB      ARG  35   5.190  11.109   7.770
  235    HG2  ARG  35           1HG      ARG  35   6.120  11.467   5.337
  236    HG3  ARG  35           2HG      ARG  35   4.634  12.402   5.153
  237    HD2  ARG  35           1HD      ARG  35   6.331  12.865   7.556
  238    HD3  ARG  35           2HD      ARG  35   6.862  13.520   6.008
  239    HE   ARG  35           HE       ARG  35   5.087  15.007   6.046
  240   HH11  ARG  35          2HH1      ARG  35   4.841  12.735   8.672
  241   HH12  ARG  35          1HH1      ARG  35   3.608  13.627   9.501
  242   HH21  ARG  35          2HH2      ARG  35   3.465  16.191   7.128
  243   HH22  ARG  35          1HH2      ARG  35   2.826  15.592   8.621
  244    H    ASP  36           H        ASP  36   2.770  10.882   5.044
  245    HA   ASP  36           HA       ASP  36   3.078   9.442   2.567
  246    HB2  ASP  36           1HB      ASP  36   1.370  11.259   1.808
  247    HB3  ASP  36           2HB      ASP  36   0.857  10.017   2.947
  248    H    SER  37           H        SER  37   5.461  10.696   3.260
  249    HA   SER  37           HA       SER  37   5.643  13.060   1.547
  250    HB2  SER  37           1HB      SER  37   6.704  12.772   3.942
  251    HB3  SER  37           2HB      SER  37   7.985  11.952   3.048
  252    HG   SER  37           HG       SER  37   8.194  13.847   1.778
  253    H    PHE  38           H        PHE  38   6.066  12.735  -0.526
  254    HA   PHE  38           HA       PHE  38   8.027  10.668  -1.253
  255    HB2  PHE  38           1HB      PHE  38   5.670  11.297  -3.012
  256    HB3  PHE  38           2HB      PHE  38   6.730   9.892  -3.054
  257    HD1  PHE  38           1HD      PHE  38   4.215  11.578  -0.894
  258    HD2  PHE  38           2HD      PHE  38   6.062   7.922  -2.049
  259    HE1  PHE  38           1HE      PHE  38   2.607  10.333   0.491
  260    HE2  PHE  38           2HE      PHE  38   4.457   6.670  -0.667
  261    HZ   PHE  38           HZ       PHE  38   2.726   7.875   0.605
  262    H    GLU  39           H        GLU  39   8.826  11.014  -3.562
  263    HA   GLU  39           HA       GLU  39   9.308  13.892  -3.941
  264    HB2  GLU  39           1HB      GLU  39  11.385  13.252  -5.067
  265    HB3  GLU  39           2HB      GLU  39  11.319  12.595  -3.437
  266    HG2  GLU  39           1HG      GLU  39  10.640  10.424  -4.355
  267    HG3  GLU  39           2HG      GLU  39  10.760  11.089  -5.983
  268    H    ASP  40           H        ASP  40   9.849  14.462  -6.280
  269    HA   ASP  40           HA       ASP  40   7.605  14.057  -7.881
  270    HB2  ASP  40           1HB      ASP  40   9.550  15.837  -7.986
  271    HB3  ASP  40           2HB      ASP  40  10.236  14.705  -9.149
  272    H    GLU  41           H        GLU  41  10.758  12.450  -7.929
  273    HA   GLU  41           HA       GLU  41   9.563  10.185  -9.299
  274    HB2  GLU  41           1HB      GLU  41  11.744  11.881 -10.483
  275    HB3  GLU  41           2HB      GLU  41  11.598  10.178 -10.894
  276    HG2  GLU  41           1HG      GLU  41   9.493  10.491 -11.893
  277    HG3  GLU  41           2HG      GLU  41   9.313  12.098 -11.192
  278    H    GLY  42           H        GLY  42  10.641   8.249  -8.951
  279    HA2  GLY  42           1HA      GLY  42  12.881   7.267  -8.319
  280    HA3  GLY  42           2HA      GLY  42  12.841   8.412  -6.986
  281    H    ARG  43           H        ARG  43  13.188   5.802  -6.398
  282    HA   ARG  43           HA       ARG  43  11.100   4.097  -6.050
  283    HB2  ARG  43           1HB      ARG  43  12.232   3.318  -3.971
  284    HB3  ARG  43           2HB      ARG  43  13.317   3.485  -5.344
  285    HG2  ARG  43           1HG      ARG  43  13.699   5.880  -4.301
  286    HG3  ARG  43           2HG      ARG  43  13.175   5.055  -2.832
  287    HD2  ARG  43           1HD      ARG  43  15.518   4.845  -2.866
  288    HD3  ARG  43           2HD      ARG  43  14.899   3.280  -3.391
  289    HE   ARG  43           HE       ARG  43  15.761   3.664  -5.501
  290   HH11  ARG  43          2HH1      ARG  43  16.043   6.522  -3.533
  291   HH12  ARG  43          1HH1      ARG  43  17.107   7.333  -4.634
  292   HH21  ARG  43          2HH2      ARG  43  17.161   4.722  -6.959
  293   HH22  ARG  43          1HH2      ARG  43  17.741   6.309  -6.583
  294    H    TRP  44           H        TRP  44  11.810   6.973  -4.141
  295    HA   TRP  44           HA       TRP  44   9.582   6.490  -2.351
  296    HB2  TRP  44           1HB      TRP  44  11.230   9.011  -2.535
  297    HB3  TRP  44           2HB      TRP  44  10.308   8.414  -1.157
  298    HD1  TRP  44           HD       TRP  44  13.738   8.725  -2.193
  299    HE1  TRP  44           1HE      TRP  44  15.267   7.036  -0.995
  300    HE3  TRP  44           3HE      TRP  44  10.170   5.541  -0.384
  301    HZ2  TRP  44           2HZ      TRP  44  14.996   4.667   0.517
  302    HZ3  TRP  44           3HZ      TRP  44  10.888   3.588   0.928
  303    HH2  TRP  44           HH       TRP  44  13.252   3.161   1.367
  304    H    ARG  45           H        ARG  45   8.662   6.587  -4.925
  305    HA   ARG  45           HA       ARG  45   7.476   9.259  -5.218
  306    HB2  ARG  45           1HB      ARG  45   6.955   8.627  -7.506
  307    HB3  ARG  45           2HB      ARG  45   8.664   8.365  -7.184
  308    HG2  ARG  45           1HG      ARG  45   8.130   5.952  -6.787
  309    HG3  ARG  45           2HG      ARG  45   6.496   6.290  -7.361
  310    HD2  ARG  45           1HD      ARG  45   9.015   6.795  -8.939
  311    HD3  ARG  45           2HD      ARG  45   7.989   5.372  -9.113
  312    HE   ARG  45           HE       ARG  45   7.438   8.050 -10.064
  313   HH11  ARG  45          2HH1      ARG  45   6.171   4.889  -9.343
  314   HH12  ARG  45          1HH1      ARG  45   4.789   5.065 -10.373
  315   HH21  ARG  45          2HH2      ARG  45   5.623   8.294 -11.423
  316   HH22  ARG  45          1HH2      ARG  45   4.479   7.002 -11.557
  317    H    LEU  46           H        LEU  46   5.389   9.578  -4.789
  318    HA   LEU  46           HA       LEU  46   3.792   7.607  -3.587
  319    HB2  LEU  46           1HB      LEU  46   3.550  10.045  -3.244
  320    HB3  LEU  46           2HB      LEU  46   2.899  10.182  -4.876
  321    HG   LEU  46           HG       LEU  46   1.578   8.447  -2.812
  322   HD11  LEU  46          1HD1      LEU  46   1.519  10.443  -1.650
  323   HD12  LEU  46          2HD1      LEU  46   0.031  10.516  -2.593
  324   HD13  LEU  46          3HD1      LEU  46   1.453  11.418  -3.118
  325   HD21  LEU  46          1HD2      LEU  46  -0.395   9.354  -4.312
  326   HD22  LEU  46          2HD2      LEU  46   0.584   7.975  -4.814
  327   HD23  LEU  46          3HD2      LEU  46   0.908   9.576  -5.481
  328    H    ILE  47           H        ILE  47   3.114   5.846  -4.629
  329    HA   ILE  47           HA       ILE  47   2.219   6.075  -7.410
  330    HB   ILE  47           HB       ILE  47   2.847   3.649  -5.727
  331   HG12  ILE  47          1HG1      ILE  47   4.210   4.868  -8.138
  332   HG13  ILE  47          2HG1      ILE  47   4.816   4.880  -6.486
  333   HG21  ILE  47          1HG2      ILE  47   1.068   3.806  -7.872
  334   HG22  ILE  47          2HG2      ILE  47   2.551   3.127  -8.542
  335   HG23  ILE  47          3HG2      ILE  47   1.767   2.348  -7.168
  336   HD11  ILE  47          1HD1      ILE  47   5.239   2.570  -6.519
  337   HD12  ILE  47          2HD1      ILE  47   4.293   2.339  -7.990
  338   HD13  ILE  47          3HD1      ILE  47   5.835   3.192  -8.058
  339    H    LEU  48           H        LEU  48   0.129   6.153  -7.879
  340    HA   LEU  48           HA       LEU  48  -1.816   5.476  -5.798
  341    HB2  LEU  48           1HB      LEU  48  -2.083   7.023  -8.369
  342    HB3  LEU  48           2HB      LEU  48  -3.427   6.664  -7.286
  343    HG   LEU  48           HG       LEU  48  -1.019   8.194  -6.347
  344   HD11  LEU  48          1HD1      LEU  48  -1.849  10.200  -7.081
  345   HD12  LEU  48          2HD1      LEU  48  -3.497   9.592  -7.230
  346   HD13  LEU  48          3HD1      LEU  48  -2.284   9.153  -8.432
  347   HD21  LEU  48          1HD2      LEU  48  -3.233   7.152  -5.055
  348   HD22  LEU  48          2HD2      LEU  48  -3.632   8.856  -5.277
  349   HD23  LEU  48          3HD2      LEU  48  -2.149   8.399  -4.438
  350    H    CYS  49           H        CYS  49  -3.190   3.807  -5.964
  351    HA   CYS  49           HA       CYS  49  -2.795   1.616  -7.503
  352    HB2  CYS  49           1HB      CYS  49  -4.387   1.740  -5.609
  353    HB3  CYS  49           2HB      CYS  49  -5.513   2.623  -6.636
  354    H    ALA  50           H        ALA  50  -4.003   0.682  -9.309
  355    HA   ALA  50           HA       ALA  50  -4.574   2.724 -11.348
  356    HB1  ALA  50           1HB      ALA  50  -4.344   0.236 -12.604
  357    HB2  ALA  50           2HB      ALA  50  -3.165   1.548 -12.599
  358    HB3  ALA  50           3HB      ALA  50  -3.071   0.273 -11.384
  359    H    THR  51           H        THR  51  -5.660  -0.518 -10.333
  360    HA   THR  51           HA       THR  51  -7.928  -0.764 -11.853
  361    HB   THR  51           HB       THR  51  -7.627  -1.624  -8.969
  362    HG1  THR  51           1HG      THR  51  -6.038  -2.381 -10.604
  363   HG21  THR  51          1HG2      THR  51  -9.365  -3.202  -9.375
  364   HG22  THR  51          2HG2      THR  51  -9.401  -2.816 -11.096
  365   HG23  THR  51          3HG2      THR  51  -9.965  -1.635  -9.914
  366    H    CYS  52           H        CYS  52  -7.667   0.802  -8.669
  367    HA   CYS  52           HA       CYS  52 -10.271   2.082  -9.184
  368    HB2  CYS  52           1HB      CYS  52 -10.710   2.108  -6.854
  369    HB3  CYS  52           2HB      CYS  52 -10.104   0.493  -7.205
  370    H    GLY  53           H        GLY  53  -7.072   2.560  -7.712
  371    HA2  GLY  53           1HA      GLY  53  -5.729   4.441  -7.731
  372    HA3  GLY  53           2HA      GLY  53  -6.931   5.240  -8.733
  373    H    SER  54           H        SER  54  -7.147   3.846  -5.468
  374    HA   SER  54           HA       SER  54  -8.053   6.487  -4.522
  375    HB2  SER  54           1HB      SER  54  -9.290   5.206  -2.751
  376    HB3  SER  54           2HB      SER  54  -9.867   4.905  -4.390
  377    HG   SER  54           HG       SER  54  -7.919   3.245  -3.208
  378    H    HIS  55           H        HIS  55  -6.142   3.626  -3.752
  379    HA   HIS  55           HA       HIS  55  -5.161   4.731  -1.276
  380    HB2  HIS  55           1HB      HIS  55  -4.725   2.210  -2.814
  381    HB3  HIS  55           2HB      HIS  55  -3.514   2.683  -1.626
  382    HD1  HIS  55           1HD      HIS  55  -4.098   2.386   0.826
  383    HD2  HIS  55           2HD      HIS  55  -7.283   1.593  -1.721
  384    HE1  HIS  55           1HE      HIS  55  -5.867   1.333   2.270
  385    HE2  HIS  55           2HE      HIS  55  -7.751   0.784   0.691
  386    H    GLY  56           H        GLY  56  -2.742   4.829  -0.909
  387    HA2  GLY  56           1HA      GLY  56  -1.125   5.482  -3.218
  388    HA3  GLY  56           2HA      GLY  56  -1.545   6.865  -2.217
  389    H    THR  57           H        THR  57   0.834   4.736  -2.801
  390    HA   THR  57           HA       THR  57   2.081   5.251  -0.229
  391    HB   THR  57           HB       THR  57   0.818   2.969  -0.194
  392    HG1  THR  57           1HG      THR  57   2.800   3.892   1.108
  393   HG21  THR  57          1HG2      THR  57   2.353   2.519  -2.436
  394   HG22  THR  57          2HG2      THR  57   1.555   1.278  -1.469
  395   HG23  THR  57          3HG2      THR  57   3.246   1.678  -1.170
  396    H    HIS  58           H        HIS  58   4.396   4.390  -0.241
  397    HA   HIS  58           HA       HIS  58   5.725   5.425  -2.516
  398    HB2  HIS  58           1HB      HIS  58   6.982   3.644  -0.431
  399    HB3  HIS  58           2HB      HIS  58   7.753   4.905  -1.389
  400    HD2  HIS  58           2HD      HIS  58   7.744   7.392  -0.246
  401    HE1  HIS  58           1HE      HIS  58   5.201   6.467   3.021
  402    HE2  HIS  58           2HE      HIS  58   6.627   8.233   1.930
  403    H    ARG  59           H        ARG  59   7.549   4.096  -3.579
  404    HA   ARG  59           HA       ARG  59   6.303   1.930  -4.973
  405    HB2  ARG  59           1HB      ARG  59   7.994   3.657  -5.879
  406    HB3  ARG  59           2HB      ARG  59   9.221   2.631  -5.148
  407    HG2  ARG  59           1HG      ARG  59   7.214   1.400  -6.970
  408    HG3  ARG  59           2HG      ARG  59   8.541   2.340  -7.656
  409    HD2  ARG  59           1HD      ARG  59   8.803  -0.027  -5.804
  410    HD3  ARG  59           2HD      ARG  59   9.113  -0.027  -7.539
  411    HE   ARG  59           HE       ARG  59  10.691   1.922  -6.193
  412   HH11  ARG  59          2HH1      ARG  59  10.444  -1.486  -6.860
  413   HH12  ARG  59          1HH1      ARG  59  12.145  -1.773  -6.703
  414   HH21  ARG  59          2HH2      ARG  59  12.933   1.557  -5.983
  415   HH22  ARG  59          1HH2      ARG  59  13.560  -0.042  -6.203
  416    H    ASP  60           H        ASP  60   9.476   2.000  -3.350
  417    HA   ASP  60           HA       ASP  60   9.725  -0.772  -3.112
  418    HB2  ASP  60           1HB      ASP  60  11.352  -0.127  -1.199
  419    HB3  ASP  60           2HB      ASP  60  11.717   0.417  -2.834
  420    H    CYS  61           H        CYS  61   8.330   1.612  -0.917
  421    HA   CYS  61           HA       CYS  61   8.012   0.135   1.377
  422    HB2  CYS  61           1HB      CYS  61   7.391   2.519   1.139
  423    HB3  CYS  61           2HB      CYS  61   5.982   2.043   0.196
  424    H    SER  62           H        SER  62   6.022   0.078  -1.540
  425    HA   SER  62           HA       SER  62   4.195  -1.862  -0.409
  426    HB2  SER  62           1HB      SER  62   3.335  -0.160  -1.949
  427    HB3  SER  62           2HB      SER  62   4.405  -0.752  -3.219
  428    HG   SER  62           HG       SER  62   3.266  -2.834  -2.868
  429    H    SER  63           H        SER  63   7.011  -2.582  -0.623
  430    HA   SER  63           HA       SER  63   8.418  -4.161  -1.559
  431    HB2  SER  63           1HB      SER  63   6.625  -5.247   0.075
  432    HB3  SER  63           2HB      SER  63   6.133  -6.076  -1.401
  433    HG   SER  63           HG       SER  63   8.634  -6.380  -1.484
  434    H    LEU  64           H        LEU  64   7.530  -2.717  -3.652
  435    HA   LEU  64           HA       LEU  64   6.442  -4.546  -5.646
  436    HB2  LEU  64           1HB      LEU  64   7.148  -1.620  -5.794
  437    HB3  LEU  64           2HB      LEU  64   6.446  -2.552  -7.115
  438    HG   LEU  64           HG       LEU  64   5.080  -2.143  -4.460
  439   HD11  LEU  64          1HD1      LEU  64   4.969   0.005  -5.155
  440   HD12  LEU  64          2HD1      LEU  64   3.655  -0.630  -6.143
  441   HD13  LEU  64          3HD1      LEU  64   5.257  -0.407  -6.845
  442   HD21  LEU  64          1HD2      LEU  64   4.576  -3.831  -6.678
  443   HD22  LEU  64          2HD2      LEU  64   3.337  -2.575  -6.666
  444   HD23  LEU  64          3HD2      LEU  64   3.585  -3.583  -5.240
  445    H    ARG  65           H        ARG  65   7.526  -4.126  -7.935
  446    HA   ARG  65           HA       ARG  65  10.373  -4.751  -7.571
  447    HB2  ARG  65           1HB      ARG  65   8.344  -5.516  -9.645
  448    HB3  ARG  65           2HB      ARG  65  10.061  -5.577 -10.022
  449    HG2  ARG  65           1HG      ARG  65  10.441  -7.154  -8.237
  450    HG3  ARG  65           2HG      ARG  65   8.754  -7.029  -7.731
  451    HD2  ARG  65           1HD      ARG  65   7.980  -8.124  -9.654
  452    HD3  ARG  65           2HD      ARG  65   9.504  -7.884 -10.508
  453    HE   ARG  65           HE       ARG  65   9.517  -9.580  -8.131
  454   HH11  ARG  65          2HH1      ARG  65   9.633  -9.291 -11.598
  455   HH12  ARG  65          1HH1      ARG  65  10.248 -10.892 -11.842
  456   HH21  ARG  65          2HH2      ARG  65  10.326 -11.690  -8.438
  457   HH22  ARG  65          1HH2      ARG  65  10.641 -12.257 -10.044
  458    HA   PRO  66           HA       PRO  66  11.728  -1.140  -9.663
  459    HB2  PRO  66           1HB      PRO  66  13.846  -2.072 -11.081
  460    HB3  PRO  66           2HB      PRO  66  13.877  -1.878  -9.325
  461    HG2  PRO  66           1HG      PRO  66  13.424  -4.351 -10.949
  462    HG3  PRO  66           2HG      PRO  66  14.412  -4.135  -9.492
  463    HD2  PRO  66           1HD      PRO  66  11.935  -5.227  -9.424
  464    HD3  PRO  66           2HD      PRO  66  12.590  -4.262  -8.086
  465    H    ASN  67           H        ASN  67  10.338  -3.696 -11.324
  466    HA   ASN  67           HA       ASN  67  10.506  -2.297 -13.907
  467    HB2  ASN  67           1HB      ASN  67   9.461  -4.597 -14.675
  468    HB3  ASN  67           2HB      ASN  67  11.193  -4.444 -14.397
  469   HD21  ASN  67          1HD2      ASN  67   8.166  -5.514 -12.977
  470   HD22  ASN  67          2HD2      ASN  67   8.867  -6.663 -11.893
  471    H    SER  68           H        SER  68   8.299  -3.686 -11.546
  472    HA   SER  68           HA       SER  68   5.884  -3.539 -12.825
  473    HB2  SER  68           1HB      SER  68   6.177  -4.381 -10.522
  474    HB3  SER  68           2HB      SER  68   6.422  -2.728  -9.956
  475    HG   SER  68           HG       SER  68   4.117  -3.198 -11.426
  476    H    LYS  69           H        LYS  69   4.775  -1.979 -13.784
  477    HA   LYS  69           HA       LYS  69   5.558   0.801 -13.349
  478    HB2  LYS  69           1HB      LYS  69   5.322  -0.253 -15.662
  479    HB3  LYS  69           2HB      LYS  69   3.585  -0.224 -15.387
  480    HG2  LYS  69           1HG      LYS  69   3.595   2.171 -15.220
  481    HG3  LYS  69           2HG      LYS  69   5.358   2.208 -15.305
  482    HD2  LYS  69           1HD      LYS  69   3.709   0.998 -17.502
  483    HD3  LYS  69           2HD      LYS  69   4.031   2.733 -17.442
  484    HE2  LYS  69           1HE      LYS  69   6.238   0.702 -17.282
  485    HE3  LYS  69           2HE      LYS  69   5.611   1.270 -18.828
  486    HZ1  LYS  69           1HZ      LYS  69   7.610   2.446 -17.534
  487    HZ2  LYS  69           2HZ      LYS  69   6.313   3.334 -16.911
  488    HZ3  LYS  69           3HZ      LYS  69   6.571   3.274 -18.581
  489    H    LYS  70           H        LYS  70   2.687  -1.268 -13.240
  490    HA   LYS  70           HA       LYS  70   1.275   0.884 -11.804
  491    HB2  LYS  70           1HB      LYS  70  -0.816  -0.226 -12.505
  492    HB3  LYS  70           2HB      LYS  70   0.157   0.292 -13.876
  493    HG2  LYS  70           1HG      LYS  70   0.928  -1.967 -14.234
  494    HG3  LYS  70           2HG      LYS  70   0.069  -2.517 -12.793
  495    HD2  LYS  70           1HD      LYS  70  -1.469  -1.116 -14.926
  496    HD3  LYS  70           2HD      LYS  70  -0.977  -2.789 -15.198
  497    HE2  LYS  70           1HE      LYS  70  -2.249  -2.102 -12.600
  498    HE3  LYS  70           2HE      LYS  70  -3.275  -2.175 -14.032
  499    HZ1  LYS  70           1HZ      LYS  70  -1.478  -4.363 -13.139
  500    HZ2  LYS  70           2HZ      LYS  70  -2.582  -4.424 -14.419
  501    HZ3  LYS  70           3HZ      LYS  70  -3.140  -4.299 -12.827
  502    H    TRP  71           H        TRP  71   0.340   0.465  -9.845
  503    HA   TRP  71           HA       TRP  71   0.732  -2.238  -8.740
  504    HB2  TRP  71           1HB      TRP  71   2.343  -1.102  -7.546
  505    HB3  TRP  71           2HB      TRP  71   1.471   0.427  -7.618
  506    HD1  TRP  71           HD       TRP  71   1.583  -2.858  -5.631
  507    HE1  TRP  71           1HE      TRP  71   0.403  -2.485  -3.375
  508    HE3  TRP  71           3HE      TRP  71  -0.246   1.847  -6.440
  509    HZ2  TRP  71           2HZ      TRP  71  -1.105  -0.464  -2.106
  510    HZ3  TRP  71           3HZ      TRP  71  -1.548   2.929  -4.654
  511    HH2  TRP  71           HH       TRP  71  -1.968   1.795  -2.533
  512    H    GLU  72           H        GLU  72  -0.873  -3.046  -7.423
  513    HA   GLU  72           HA       GLU  72  -3.368  -1.487  -7.392
  514    HB2  GLU  72           1HB      GLU  72  -2.883  -4.466  -7.367
  515    HB3  GLU  72           2HB      GLU  72  -4.458  -3.747  -7.064
  516    HG2  GLU  72           1HG      GLU  72  -4.762  -3.146  -9.232
  517    HG3  GLU  72           2HG      GLU  72  -3.038  -2.941  -9.535
  518    H    CYS  73           H        CYS  73  -4.599  -1.348  -5.520
  519    HA   CYS  73           HA       CYS  73  -3.096  -1.525  -3.067
  520    HB2  CYS  73           1HB      CYS  73  -4.935  -0.368  -2.049
  521    HB3  CYS  73           2HB      CYS  73  -4.644   0.372  -3.619
  522    H    ASN  74           H        ASN  74  -4.332  -2.374  -1.073
  523    HA   ASN  74           HA       ASN  74  -4.590  -5.146  -1.300
  524    HB2  ASN  74           1HB      ASN  74  -4.107  -3.765   0.794
  525    HB3  ASN  74           2HB      ASN  74  -5.847  -3.512   0.902
  526   HD21  ASN  74          1HD2      ASN  74  -7.051  -5.732   0.503
  527   HD22  ASN  74          2HD2      ASN  74  -6.495  -7.013   1.520
  528    H    GLU  75           H        GLU  75  -7.136  -2.696  -0.821
  529    HA   GLU  75           HA       GLU  75  -9.369  -4.245  -0.766
  530    HB2  GLU  75           1HB      GLU  75  -8.879  -1.573  -2.053
  531    HB3  GLU  75           2HB      GLU  75 -10.470  -2.320  -2.094
  532    HG2  GLU  75           1HG      GLU  75  -9.093  -2.075   0.526
  533    HG3  GLU  75           2HG      GLU  75  -9.789  -0.629  -0.202
  534    H    CYS  76           H        CYS  76  -7.587  -3.249  -3.660
  535    HA   CYS  76           HA       CYS  76  -9.373  -4.564  -5.469
  536    HB2  CYS  76           1HB      CYS  76  -6.614  -3.385  -5.797
  537    HB3  CYS  76           2HB      CYS  76  -7.488  -4.145  -7.123
  538    H    LEU  77           H        LEU  77  -6.012  -5.234  -4.477
  539    HA   LEU  77           HA       LEU  77  -5.424  -7.515  -5.747
  540    HB2  LEU  77           1HB      LEU  77  -4.984  -6.796  -2.869
  541    HB3  LEU  77           2HB      LEU  77  -4.365  -8.302  -3.543
  542    HG   LEU  77           HG       LEU  77  -3.663  -5.576  -4.620
  543   HD11  LEU  77          1HD1      LEU  77  -2.433  -7.216  -2.448
  544   HD12  LEU  77          2HD1      LEU  77  -2.709  -5.476  -2.522
  545   HD13  LEU  77          3HD1      LEU  77  -1.417  -6.205  -3.476
  546   HD21  LEU  77          1HD2      LEU  77  -3.460  -7.881  -5.917
  547   HD22  LEU  77          2HD2      LEU  77  -1.981  -7.997  -4.963
  548   HD23  LEU  77          3HD2      LEU  77  -2.229  -6.624  -6.043
  549    HA   PRO  78           HA       PRO  78  -8.290 -10.705  -4.814
  550    HB2  PRO  78           1HB      PRO  78  -6.684 -12.894  -4.831
  551    HB3  PRO  78           2HB      PRO  78  -7.134 -12.021  -6.301
  552    HG2  PRO  78           1HG      PRO  78  -4.614 -11.851  -4.694
  553    HG3  PRO  78           2HG      PRO  78  -4.817 -11.906  -6.455
  554    HD2  PRO  78           1HD      PRO  78  -4.355  -9.600  -5.113
  555    HD3  PRO  78           2HD      PRO  78  -5.335  -9.664  -6.591
  556    H    ALA  79           H        ALA  79  -6.179  -9.592  -2.592
  557    HA   ALA  79           HA       ALA  79  -6.581 -11.711  -0.624
  558    HB1  ALA  79           1HB      ALA  79  -5.073  -9.121  -0.303
  559    HB2  ALA  79           2HB      ALA  79  -5.014 -10.531   0.756
  560    HB3  ALA  79           3HB      ALA  79  -4.357 -10.627  -0.878
  561    H    SER  80           H        SER  80  -8.893 -11.404  -0.487
  562    HA   SER  80           HA       SER  80  -9.608  -9.597   1.622
  563    HB2  SER  80           1HB      SER  80 -10.377  -9.014  -1.199
  564    HB3  SER  80           2HB      SER  80 -11.587  -8.740   0.054
  565    HG   SER  80           HG       SER  80  -9.427  -7.691   1.013
  566    H    GLY  81           H        GLY  81 -11.832  -9.923   2.362
  567    HA2  GLY  81           1HA      GLY  81 -13.370 -12.090   1.258
  568    HA3  GLY  81           2HA      GLY  81 -12.547 -12.523   2.749
  569    HA   PRO  82           HA       PRO  82 -16.680 -10.287   3.488
  570    HB2  PRO  82           1HB      PRO  82 -18.144 -12.434   4.275
  571    HB3  PRO  82           2HB      PRO  82 -18.058 -11.893   2.594
  572    HG2  PRO  82           1HG      PRO  82 -16.571 -14.110   3.948
  573    HG3  PRO  82           2HG      PRO  82 -17.339 -14.091   2.350
  574    HD2  PRO  82           1HD      PRO  82 -14.671 -13.769   2.690
  575    HD3  PRO  82           2HD      PRO  82 -15.568 -12.983   1.375
  576    H    SER  83           H        SER  83 -15.272 -13.066   5.207
  577    HA   SER  83           HA       SER  83 -16.045 -11.938   7.774
  578    HB2  SER  83           1HB      SER  83 -15.153 -14.017   8.724
  579    HB3  SER  83           2HB      SER  83 -16.272 -14.365   7.407
  580    HG   SER  83           HG       SER  83 -14.005 -14.206   6.221
  581    H    SER  84           H        SER  84 -14.298 -10.285   6.425
  582    HA   SER  84           HA       SER  84 -11.621 -10.476   6.661
  583    HB2  SER  84           1HB      SER  84 -11.510  -8.082   6.907
  584    HB3  SER  84           2HB      SER  84 -12.901  -8.456   5.889
  585    HG   SER  84           HG       SER  84 -12.839  -7.130   8.208
  586    H    GLY  85           H        GLY  85 -13.835  -9.692   9.324
  587    HA2  GLY  85           1HA      GLY  85 -12.056  -9.157  11.348
  588    HA3  GLY  85           2HA      GLY  85 -13.590  -9.978  11.594
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1 -26.742   3.634  37.964
    2    HA2  GLY   1           1HA      GLY   1 -28.397   2.392  36.495
    3    HA3  GLY   1           2HA      GLY   1 -29.094   3.980  36.214
    4    H    SER   2           H        SER   2 -27.861   5.546  35.043
    5    HA   SER   2           HA       SER   2 -26.637   6.189  33.235
    6    HB2  SER   2           1HB      SER   2 -24.752   4.450  34.778
    7    HB3  SER   2           2HB      SER   2 -24.265   5.031  33.186
    8    HG   SER   2           HG       SER   2 -23.629   6.649  34.443
    9    H    SER   3           H        SER   3 -28.528   4.235  32.691
   10    HA   SER   3           HA       SER   3 -27.485   2.036  31.237
   11    HB2  SER   3           1HB      SER   3 -30.196   3.376  31.116
   12    HB3  SER   3           2HB      SER   3 -29.802   1.851  30.323
   13    HG   SER   3           HG       SER   3 -30.416   2.339  32.923
   14    H    GLY   4           H        GLY   4 -27.982   1.721  28.858
   15    HA2  GLY   4           1HA      GLY   4 -28.198   3.932  27.112
   16    HA3  GLY   4           2HA      GLY   4 -26.502   3.526  27.328
   17    H    SER   5           H        SER   5 -27.148   3.310  24.859
   18    HA   SER   5           HA       SER   5 -27.021   0.503  24.297
   19    HB2  SER   5           1HB      SER   5 -29.505   0.962  24.561
   20    HB3  SER   5           2HB      SER   5 -29.383   1.982  23.128
   21    HG   SER   5           HG       SER   5 -28.303  -0.561  22.913
   22    H    SER   6           H        SER   6 -26.571   0.060  22.045
   23    HA   SER   6           HA       SER   6 -25.672   2.436  20.551
   24    HB2  SER   6           1HB      SER   6 -24.214  -0.104  21.181
   25    HB3  SER   6           2HB      SER   6 -23.870   0.731  19.666
   26    HG   SER   6           HG       SER   6 -23.461   1.594  22.310
   27    H    GLY   7           H        GLY   7 -25.232   1.856  18.183
   28    HA2  GLY   7           1HA      GLY   7 -27.549   0.318  17.229
   29    HA3  GLY   7           2HA      GLY   7 -26.703   1.563  16.322
   30    H    GLU   8           H        GLU   8 -26.278   0.352  14.513
   31    HA   GLU   8           HA       GLU   8 -24.221  -1.705  14.852
   32    HB2  GLU   8           1HB      GLU   8 -26.811  -2.011  13.350
   33    HB3  GLU   8           2HB      GLU   8 -25.398  -2.980  12.955
   34    HG2  GLU   8           1HG      GLU   8 -26.550  -4.354  14.392
   35    HG3  GLU   8           2HG      GLU   8 -25.397  -3.572  15.471
   36    H    LEU   9           H        LEU   9 -23.292  -2.307  12.622
   37    HA   LEU   9           HA       LEU   9 -22.547   0.172  11.330
   38    HB2  LEU   9           1HB      LEU   9 -20.897  -1.142  10.164
   39    HB3  LEU   9           2HB      LEU   9 -20.866  -1.526  11.884
   40    HG   LEU   9           HG       LEU   9 -22.363  -3.536  11.200
   41   HD11  LEU   9          1HD1      LEU   9 -22.095  -2.356   8.713
   42   HD12  LEU   9          2HD1      LEU   9 -22.667  -3.991   9.044
   43   HD13  LEU   9          3HD1      LEU   9 -20.967  -3.712   8.668
   44   HD21  LEU   9          1HD2      LEU   9 -20.206  -3.900  12.107
   45   HD22  LEU   9          2HD2      LEU   9 -19.414  -3.302  10.649
   46   HD23  LEU   9          3HD2      LEU   9 -20.283  -4.837  10.614
   47    H    GLU  10           H        GLU  10 -22.661   0.533   9.055
   48    HA   GLU  10           HA       GLU  10 -24.903  -0.891   7.779
   49    HB2  GLU  10           1HB      GLU  10 -24.020   1.976   7.666
   50    HB3  GLU  10           2HB      GLU  10 -24.968   1.285   6.356
   51    HG2  GLU  10           1HG      GLU  10 -25.773   1.481   9.248
   52    HG3  GLU  10           2HG      GLU  10 -26.412   2.426   7.905
   53    HA   PRO  11           HA       PRO  11 -21.652  -2.288   5.029
   54    HB2  PRO  11           1HB      PRO  11 -23.241  -3.981   3.621
   55    HB3  PRO  11           2HB      PRO  11 -22.585  -4.380   5.213
   56    HG2  PRO  11           1HG      PRO  11 -25.308  -3.373   4.486
   57    HG3  PRO  11           2HG      PRO  11 -24.856  -4.648   5.633
   58    HD2  PRO  11           1HD      PRO  11 -25.504  -2.140   6.422
   59    HD3  PRO  11           2HD      PRO  11 -24.322  -3.139   7.292
   60    H    GLY  12           H        GLY  12 -21.589  -2.585   2.558
   61    HA2  GLY  12           1HA      GLY  12 -21.590  -1.483   0.538
   62    HA3  GLY  12           2HA      GLY  12 -23.332  -1.445   0.767
   63    H    ALA  13           H        ALA  13 -20.746   0.212   2.552
   64    HA   ALA  13           HA       ALA  13 -22.063   2.761   1.883
   65    HB1  ALA  13           1HB      ALA  13 -20.199   2.587   4.186
   66    HB2  ALA  13           2HB      ALA  13 -21.667   3.544   3.984
   67    HB3  ALA  13           3HB      ALA  13 -21.780   1.821   4.346
   68    H    PHE  14           H        PHE  14 -20.983   3.523   0.146
   69    HA   PHE  14           HA       PHE  14 -18.047   3.524   0.215
   70    HB2  PHE  14           1HB      PHE  14 -20.027   3.799  -2.041
   71    HB3  PHE  14           2HB      PHE  14 -18.322   4.190  -2.240
   72    HD1  PHE  14           1HD      PHE  14 -20.668   1.463  -1.378
   73    HD2  PHE  14           2HD      PHE  14 -16.729   2.510  -2.607
   74    HE1  PHE  14           1HE      PHE  14 -20.183  -0.906  -1.831
   75    HE2  PHE  14           2HE      PHE  14 -16.239   0.142  -3.063
   76    HZ   PHE  14           HZ       PHE  14 -17.967  -1.569  -2.675
   77    H    SER  15           H        SER  15 -16.875   5.395   0.087
   78    HA   SER  15           HA       SER  15 -18.342   7.931  -0.074
   79    HB2  SER  15           1HB      SER  15 -17.021   8.826   1.822
   80    HB3  SER  15           2HB      SER  15 -18.055   7.483   2.308
   81    HG   SER  15           HG       SER  15 -15.312   7.675   2.269
   82    H    GLU  16           H        GLU  16 -17.476   9.144  -1.609
   83    HA   GLU  16           HA       GLU  16 -14.718   8.648  -2.443
   84    HB2  GLU  16           1HB      GLU  16 -16.874   8.853  -3.978
   85    HB3  GLU  16           2HB      GLU  16 -16.493  10.566  -3.879
   86    HG2  GLU  16           1HG      GLU  16 -15.547   9.394  -5.861
   87    HG3  GLU  16           2HG      GLU  16 -14.362  10.238  -4.867
   88    H    LEU  17           H        LEU  17 -13.495  10.654  -3.193
   89    HA   LEU  17           HA       LEU  17 -13.977  12.927  -1.394
   90    HB2  LEU  17           1HB      LEU  17 -11.254  11.761  -1.927
   91    HB3  LEU  17           2HB      LEU  17 -11.662  13.061  -0.809
   92    HG   LEU  17           HG       LEU  17 -12.771  10.304  -0.419
   93   HD11  LEU  17          1HD1      LEU  17 -10.897   9.650   0.867
   94   HD12  LEU  17          2HD1      LEU  17 -10.168  11.252   0.753
   95   HD13  LEU  17          3HD1      LEU  17 -10.264  10.223  -0.676
   96   HD21  LEU  17          1HD2      LEU  17 -13.649  12.274   0.844
   97   HD22  LEU  17          2HD2      LEU  17 -12.046  12.463   1.555
   98   HD23  LEU  17          3HD2      LEU  17 -12.977  10.995   1.857
   99    H    TYR  18           H        TYR  18 -13.064  14.932  -2.096
  100    HA   TYR  18           HA       TYR  18 -13.140  15.236  -4.951
  101    HB2  TYR  18           1HB      TYR  18 -13.321  17.505  -4.566
  102    HB3  TYR  18           2HB      TYR  18 -13.960  16.865  -3.056
  103    HD1  TYR  18           1HD      TYR  18 -11.024  18.438  -4.641
  104    HD2  TYR  18           2HD      TYR  18 -12.831  17.229  -0.984
  105    HE1  TYR  18           1HE      TYR  18  -9.344  19.728  -3.392
  106    HE2  TYR  18           2HE      TYR  18 -11.157  18.517   0.276
  107    HH   TYR  18           HH       TYR  18  -9.601  20.745  -0.478
  108    H    GLN  19           H        GLN  19 -10.679  15.633  -2.426
  109    HA   GLN  19           HA       GLN  19  -8.625  16.169  -4.404
  110    HB2  GLN  19           1HB      GLN  19  -7.126  16.362  -2.443
  111    HB3  GLN  19           2HB      GLN  19  -8.530  17.415  -2.333
  112    HG2  GLN  19           1HG      GLN  19  -9.600  15.880  -0.799
  113    HG3  GLN  19           2HG      GLN  19  -8.252  14.754  -0.954
  114   HE21  GLN  19          1HE2      GLN  19  -9.420  17.626   0.523
  115   HE22  GLN  19          2HE2      GLN  19  -8.064  17.911   1.554
  116    H    ARG  20           H        ARG  20  -6.685  14.900  -4.578
  117    HA   ARG  20           HA       ARG  20  -7.157  12.160  -4.907
  118    HB2  ARG  20           1HB      ARG  20  -4.512  13.603  -4.648
  119    HB3  ARG  20           2HB      ARG  20  -4.727  11.975  -5.278
  120    HG2  ARG  20           1HG      ARG  20  -6.319  13.116  -6.978
  121    HG3  ARG  20           2HG      ARG  20  -5.473  14.591  -6.506
  122    HD2  ARG  20           1HD      ARG  20  -3.323  13.288  -6.977
  123    HD3  ARG  20           2HD      ARG  20  -4.358  12.119  -7.796
  124    HE   ARG  20           HE       ARG  20  -5.096  14.359  -9.008
  125   HH11  ARG  20          2HH1      ARG  20  -1.919  13.187  -8.202
  126   HH12  ARG  20          1HH1      ARG  20  -1.148  13.969  -9.542
  127   HH21  ARG  20          2HH2      ARG  20  -4.093  15.393 -10.777
  128   HH22  ARG  20          1HH2      ARG  20  -2.385  15.224 -11.005
  129    H    TYR  21           H        TYR  21  -6.019  10.369  -3.849
  130    HA   TYR  21           HA       TYR  21  -5.921  10.790  -0.944
  131    HB2  TYR  21           1HB      TYR  21  -7.554   9.144  -1.594
  132    HB3  TYR  21           2HB      TYR  21  -6.375   8.294  -2.587
  133    HD1  TYR  21           2HD      TYR  21  -4.499   7.066  -1.478
  134    HD2  TYR  21           1HD      TYR  21  -7.739   8.716   0.732
  135    HE1  TYR  21           2HE      TYR  21  -3.919   5.630   0.433
  136    HE2  TYR  21           1HE      TYR  21  -7.168   7.286   2.649
  137    HH   TYR  21           HH       TYR  21  -5.522   5.966   3.536
  138    H    ARG  22           H        ARG  22  -3.914  11.158  -0.257
  139    HA   ARG  22           HA       ARG  22  -1.757   9.437  -1.294
  140    HB2  ARG  22           1HB      ARG  22  -1.383  12.226  -0.204
  141    HB3  ARG  22           2HB      ARG  22  -0.201  11.234  -1.048
  142    HG2  ARG  22           1HG      ARG  22  -1.311  11.501  -3.116
  143    HG3  ARG  22           2HG      ARG  22  -2.739  12.188  -2.339
  144    HD2  ARG  22           1HD      ARG  22  -1.157  14.037  -1.523
  145    HD3  ARG  22           2HD      ARG  22  -0.035  13.425  -2.737
  146    HE   ARG  22           HE       ARG  22  -2.545  14.816  -3.219
  147   HH11  ARG  22          2HH1      ARG  22   0.159  13.049  -4.515
  148   HH12  ARG  22          1HH1      ARG  22  -0.082  13.612  -6.136
  149   HH21  ARG  22          2HH2      ARG  22  -2.874  15.564  -5.349
  150   HH22  ARG  22          1HH2      ARG  22  -1.807  15.043  -6.609
  151    H    HIS  23           H        HIS  23  -1.878   7.887   0.303
  152    HA   HIS  23           HA       HIS  23  -0.708   8.631   2.843
  153    HB2  HIS  23           1HB      HIS  23  -3.114   8.942   3.265
  154    HB3  HIS  23           2HB      HIS  23  -3.419   7.288   2.740
  155    HD1  HIS  23           1HD      HIS  23  -3.423   5.577   4.533
  156    HD2  HIS  23           2HD      HIS  23  -1.385   9.015   5.669
  157    HE1  HIS  23           1HE      HIS  23  -2.810   5.229   6.948
  158    HE2  HIS  23           2HE      HIS  23  -1.653   7.358   7.637
  159    H    CYS  24           H        CYS  24   0.938   7.256   2.930
  160    HA   CYS  24           HA       CYS  24   1.424   4.986   1.565
  161    HB2  CYS  24           1HB      CYS  24   3.163   5.787   2.938
  162    HB3  CYS  24           2HB      CYS  24   2.169   5.714   4.389
  163    H    ASP  25           H        ASP  25   0.036   3.378   1.190
  164    HA   ASP  25           HA       ASP  25  -1.299   2.133   3.505
  165    HB2  ASP  25           1HB      ASP  25  -3.129   1.510   2.067
  166    HB3  ASP  25           2HB      ASP  25  -2.840   3.236   1.874
  167    H    ALA  26           H        ALA  26   1.334   1.478   2.667
  168    HA   ALA  26           HA       ALA  26   1.073  -1.059   1.243
  169    HB1  ALA  26           1HB      ALA  26   3.004  -0.338   0.395
  170    HB2  ALA  26           2HB      ALA  26   3.201   0.872   1.663
  171    HB3  ALA  26           3HB      ALA  26   3.729  -0.788   1.938
  172    HA   PRO  27           HA       PRO  27   1.445  -3.713   4.717
  173    HB2  PRO  27           1HB      PRO  27   3.330  -5.517   3.966
  174    HB3  PRO  27           2HB      PRO  27   1.706  -5.477   3.268
  175    HG2  PRO  27           1HG      PRO  27   4.266  -4.371   2.177
  176    HG3  PRO  27           2HG      PRO  27   2.984  -5.262   1.336
  177    HD2  PRO  27           1HD      PRO  27   3.213  -2.568   1.202
  178    HD3  PRO  27           2HD      PRO  27   1.645  -3.397   1.135
  179    H    ILE  28           H        ILE  28   4.709  -2.993   3.464
  180    HA   ILE  28           HA       ILE  28   5.546  -2.405   6.222
  181    HB   ILE  28           HB       ILE  28   7.178  -3.945   4.200
  182   HG12  ILE  28          1HG1      ILE  28   5.343  -5.238   5.286
  183   HG13  ILE  28          2HG1      ILE  28   6.948  -5.835   5.690
  184   HG21  ILE  28          1HG2      ILE  28   7.818  -2.757   6.864
  185   HG22  ILE  28          2HG2      ILE  28   8.641  -4.223   6.333
  186   HG23  ILE  28          3HG2      ILE  28   8.763  -2.747   5.375
  187   HD11  ILE  28          1HD1      ILE  28   6.814  -4.594   7.826
  188   HD12  ILE  28          2HD1      ILE  28   5.155  -4.154   7.420
  189   HD13  ILE  28          3HD1      ILE  28   5.586  -5.848   7.654
  190    H    CYS  29           H        CYS  29   6.878  -0.670   6.478
  191    HA   CYS  29           HA       CYS  29   7.585   0.813   4.031
  192    HB2  CYS  29           1HB      CYS  29   5.846   1.726   5.803
  193    HB3  CYS  29           2HB      CYS  29   7.308   2.193   6.667
  194    H    LEU  30           H        LEU  30   9.568   1.953   4.002
  195    HA   LEU  30           HA       LEU  30  11.527   1.001   5.987
  196    HB2  LEU  30           1HB      LEU  30  12.115   1.702   3.120
  197    HB3  LEU  30           2HB      LEU  30  13.197   0.939   4.283
  198    HG   LEU  30           HG       LEU  30  10.678  -0.465   3.521
  199   HD11  LEU  30          1HD1      LEU  30  12.581   0.383   1.610
  200   HD12  LEU  30          2HD1      LEU  30  11.222  -0.718   1.390
  201   HD13  LEU  30          3HD1      LEU  30  12.802  -1.351   1.851
  202   HD21  LEU  30          1HD2      LEU  30  11.626  -2.103   4.677
  203   HD22  LEU  30          2HD2      LEU  30  12.964  -1.023   5.069
  204   HD23  LEU  30          3HD2      LEU  30  13.052  -2.054   3.639
  205    H    TYR  31           H        TYR  31  10.480   3.668   3.947
  206    HA   TYR  31           HA       TYR  31  12.458   5.530   4.464
  207    HB2  TYR  31           1HB      TYR  31  10.264   5.629   2.995
  208    HB3  TYR  31           2HB      TYR  31   9.610   6.434   4.417
  209    HD1  TYR  31           2HD      TYR  31  12.901   6.599   2.644
  210    HD2  TYR  31           1HD      TYR  31   9.501   8.711   4.086
  211    HE1  TYR  31           2HE      TYR  31  13.909   8.716   1.901
  212    HE2  TYR  31           1HE      TYR  31  10.499  10.834   3.346
  213    HH   TYR  31           HH       TYR  31  13.586  10.905   1.608
  214    H    GLU  32           H        GLU  32  13.260   6.009   6.403
  215    HA   GLU  32           HA       GLU  32  12.261   5.639   8.881
  216    HB2  GLU  32           1HB      GLU  32  14.077   7.740   7.774
  217    HB3  GLU  32           2HB      GLU  32  13.557   7.864   9.449
  218    HG2  GLU  32           1HG      GLU  32  15.156   5.681   8.157
  219    HG3  GLU  32           2HG      GLU  32  15.622   6.743   9.484
  220    H    GLN  33           H        GLN  33  11.659   8.487   6.854
  221    HA   GLN  33           HA       GLN  33  10.271  10.104   8.560
  222    HB2  GLN  33           1HB      GLN  33  10.801  10.288   5.981
  223    HB3  GLN  33           2HB      GLN  33   9.152   9.699   5.819
  224    HG2  GLN  33           1HG      GLN  33   9.005  12.035   5.725
  225    HG3  GLN  33           2HG      GLN  33   8.464  11.591   7.343
  226   HE21  GLN  33          1HE2      GLN  33  10.030  13.895   5.842
  227   HE22  GLN  33          2HE2      GLN  33  11.222  14.328   7.015
  228    H    GLY  34           H        GLY  34   8.968   7.353   6.728
  229    HA2  GLY  34           1HA      GLY  34   7.032   6.145   6.978
  230    HA3  GLY  34           2HA      GLY  34   7.165   6.541   8.685
  231    H    ARG  35           H        ARG  35   6.367   8.308   5.689
  232    HA   ARG  35           HA       ARG  35   3.724   8.908   6.667
  233    HB2  ARG  35           1HB      ARG  35   3.926  11.266   6.835
  234    HB3  ARG  35           2HB      ARG  35   5.245  10.592   7.783
  235    HG2  ARG  35           1HG      ARG  35   6.693  10.925   5.722
  236    HG3  ARG  35           2HG      ARG  35   5.370  11.906   5.090
  237    HD2  ARG  35           1HD      ARG  35   6.597  12.406   7.787
  238    HD3  ARG  35           2HD      ARG  35   7.241  13.127   6.313
  239    HE   ARG  35           HE       ARG  35   4.463  13.616   6.515
  240   HH11  ARG  35          2HH1      ARG  35   7.519  14.585   7.873
  241   HH12  ARG  35          1HH1      ARG  35   6.972  16.172   8.304
  242   HH21  ARG  35          2HH2      ARG  35   3.732  15.701   7.078
  243   HH22  ARG  35          1HH2      ARG  35   4.817  16.805   7.853
  244    H    ASP  36           H        ASP  36   2.876  10.834   5.057
  245    HA   ASP  36           HA       ASP  36   2.941   9.595   2.467
  246    HB2  ASP  36           1HB      ASP  36   0.864  10.549   3.376
  247    HB3  ASP  36           2HB      ASP  36   1.598  12.151   3.373
  248    H    SER  37           H        SER  37   5.491  10.400   3.063
  249    HA   SER  37           HA       SER  37   5.922  12.861   1.522
  250    HB2  SER  37           1HB      SER  37   6.975  12.512   3.830
  251    HB3  SER  37           2HB      SER  37   8.029  11.333   3.049
  252    HG   SER  37           HG       SER  37   8.472  13.855   3.194
  253    H    PHE  38           H        PHE  38   6.635  12.775  -0.500
  254    HA   PHE  38           HA       PHE  38   8.242  10.514  -1.395
  255    HB2  PHE  38           1HB      PHE  38   5.838  11.360  -3.005
  256    HB3  PHE  38           2HB      PHE  38   6.852   9.938  -3.229
  257    HD1  PHE  38           1HD      PHE  38   4.474  11.495  -0.837
  258    HD2  PHE  38           2HD      PHE  38   6.235   7.906  -2.297
  259    HE1  PHE  38           1HE      PHE  38   2.916  10.176   0.537
  260    HE2  PHE  38           2HE      PHE  38   4.680   6.581  -0.927
  261    HZ   PHE  38           HZ       PHE  38   3.017   7.716   0.492
  262    H    GLU  39           H        GLU  39   9.203  10.889  -3.545
  263    HA   GLU  39           HA       GLU  39   9.697  13.761  -3.949
  264    HB2  GLU  39           1HB      GLU  39  11.550  11.944  -3.395
  265    HB3  GLU  39           2HB      GLU  39  11.473  11.676  -5.130
  266    HG2  GLU  39           1HG      GLU  39  13.216  13.223  -4.739
  267    HG3  GLU  39           2HG      GLU  39  11.873  14.125  -5.439
  268    H    ASP  40           H        ASP  40  10.122  14.460  -6.182
  269    HA   ASP  40           HA       ASP  40   8.110  14.249  -7.910
  270    HB2  ASP  40           1HB      ASP  40  10.443  15.469  -8.108
  271    HB3  ASP  40           2HB      ASP  40  10.828  14.099  -9.147
  272    H    GLU  41           H        GLU  41  10.804  11.945  -7.786
  273    HA   GLU  41           HA       GLU  41   9.131   9.813  -8.706
  274    HB2  GLU  41           1HB      GLU  41  10.260   9.312 -10.773
  275    HB3  GLU  41           2HB      GLU  41   9.676  10.969 -10.842
  276    HG2  GLU  41           1HG      GLU  41  11.932  11.765 -10.274
  277    HG3  GLU  41           2HG      GLU  41  12.502  10.097 -10.284
  278    H    GLY  42           H        GLY  42  10.539   7.781  -9.107
  279    HA2  GLY  42           1HA      GLY  42  12.737   6.778  -8.614
  280    HA3  GLY  42           2HA      GLY  42  12.803   7.831  -7.208
  281    H    ARG  43           H        ARG  43  13.169   5.923  -5.940
  282    HA   ARG  43           HA       ARG  43  11.248   3.829  -5.804
  283    HB2  ARG  43           1HB      ARG  43  12.477   3.087  -3.833
  284    HB3  ARG  43           2HB      ARG  43  13.590   3.518  -5.124
  285    HG2  ARG  43           1HG      ARG  43  13.725   5.806  -3.958
  286    HG3  ARG  43           2HG      ARG  43  13.014   4.972  -2.575
  287    HD2  ARG  43           1HD      ARG  43  15.370   4.908  -2.286
  288    HD3  ARG  43           2HD      ARG  43  14.867   3.288  -2.768
  289    HE   ARG  43           HE       ARG  43  15.532   4.332  -5.121
  290   HH11  ARG  43          2HH1      ARG  43  17.176   4.437  -2.055
  291   HH12  ARG  43          1HH1      ARG  43  18.757   4.520  -2.757
  292   HH21  ARG  43          2HH2      ARG  43  17.608   4.440  -6.059
  293   HH22  ARG  43          1HH2      ARG  43  19.002   4.523  -5.035
  294    H    TRP  44           H        TRP  44  11.881   6.703  -3.828
  295    HA   TRP  44           HA       TRP  44   9.601   6.142  -2.125
  296    HB2  TRP  44           1HB      TRP  44  11.289   8.645  -2.136
  297    HB3  TRP  44           2HB      TRP  44  10.295   8.017  -0.824
  298    HD1  TRP  44           HD       TRP  44  13.771   8.301  -1.682
  299    HE1  TRP  44           1HE      TRP  44  15.212   6.531  -0.493
  300    HE3  TRP  44           3HE      TRP  44  10.068   5.107  -0.193
  301    HZ2  TRP  44           2HZ      TRP  44  14.830   4.102   0.893
  302    HZ3  TRP  44           3HZ      TRP  44  10.690   3.082   1.059
  303    HH2  TRP  44           HH       TRP  44  13.022   2.592   1.589
  304    H    ARG  45           H        ARG  45   8.807   6.398  -4.752
  305    HA   ARG  45           HA       ARG  45   7.701   9.095  -5.009
  306    HB2  ARG  45           1HB      ARG  45   7.148   8.500  -7.278
  307    HB3  ARG  45           2HB      ARG  45   8.817   8.041  -6.966
  308    HG2  ARG  45           1HG      ARG  45   8.157   5.725  -6.687
  309    HG3  ARG  45           2HG      ARG  45   6.463   6.164  -6.918
  310    HD2  ARG  45           1HD      ARG  45   8.522   6.814  -8.996
  311    HD3  ARG  45           2HD      ARG  45   7.795   5.210  -8.916
  312    HE   ARG  45           HE       ARG  45   5.791   7.208  -8.911
  313   HH11  ARG  45          2HH1      ARG  45   8.076   5.620 -11.003
  314   HH12  ARG  45          1HH1      ARG  45   7.135   5.870 -12.436
  315   HH21  ARG  45          2HH2      ARG  45   4.543   7.543 -10.790
  316   HH22  ARG  45          1HH2      ARG  45   5.126   6.965 -12.314
  317    H    LEU  46           H        LEU  46   5.522   9.526  -5.027
  318    HA   LEU  46           HA       LEU  46   3.849   7.678  -3.613
  319    HB2  LEU  46           1HB      LEU  46   3.557   9.964  -3.105
  320    HB3  LEU  46           2HB      LEU  46   3.401  10.399  -4.806
  321    HG   LEU  46           HG       LEU  46   1.238   9.021  -4.763
  322   HD11  LEU  46          1HD1      LEU  46   0.190   9.069  -2.450
  323   HD12  LEU  46          2HD1      LEU  46   1.827   9.273  -1.829
  324   HD13  LEU  46          3HD1      LEU  46   1.407   7.828  -2.747
  325   HD21  LEU  46          1HD2      LEU  46   1.738  11.661  -4.466
  326   HD22  LEU  46          2HD2      LEU  46   0.832  11.333  -2.989
  327   HD23  LEU  46          3HD2      LEU  46   0.121  10.964  -4.560
  328    H    ILE  47           H        ILE  47   3.225   5.914  -4.719
  329    HA   ILE  47           HA       ILE  47   2.245   6.223  -7.463
  330    HB   ILE  47           HB       ILE  47   2.845   3.717  -5.887
  331   HG12  ILE  47          1HG1      ILE  47   4.323   4.964  -8.214
  332   HG13  ILE  47          2HG1      ILE  47   4.828   5.075  -6.532
  333   HG21  ILE  47          1HG2      ILE  47   2.575   3.565  -8.805
  334   HG22  ILE  47          2HG2      ILE  47   2.008   2.463  -7.552
  335   HG23  ILE  47          3HG2      ILE  47   1.080   3.911  -7.936
  336   HD11  ILE  47          1HD1      ILE  47   4.642   2.584  -8.204
  337   HD12  ILE  47          2HD1      ILE  47   6.106   3.376  -7.622
  338   HD13  ILE  47          3HD1      ILE  47   5.005   2.607  -6.479
  339    H    LEU  48           H        LEU  48   0.144   6.219  -7.915
  340    HA   LEU  48           HA       LEU  48  -1.746   5.557  -5.779
  341    HB2  LEU  48           1HB      LEU  48  -1.885   7.229  -8.251
  342    HB3  LEU  48           2HB      LEU  48  -3.368   6.614  -7.524
  343    HG   LEU  48           HG       LEU  48  -1.355   8.334  -6.080
  344   HD11  LEU  48          1HD1      LEU  48  -3.293   9.051  -8.047
  345   HD12  LEU  48          2HD1      LEU  48  -2.204  10.090  -7.129
  346   HD13  LEU  48          3HD1      LEU  48  -3.793   9.688  -6.480
  347   HD21  LEU  48          1HD2      LEU  48  -3.663   6.812  -5.254
  348   HD22  LEU  48          2HD2      LEU  48  -3.883   8.531  -4.925
  349   HD23  LEU  48          3HD2      LEU  48  -2.479   7.681  -4.277
  350    H    CYS  49           H        CYS  49  -3.313   4.015  -5.985
  351    HA   CYS  49           HA       CYS  49  -2.878   1.732  -7.421
  352    HB2  CYS  49           1HB      CYS  49  -4.488   1.871  -5.581
  353    HB3  CYS  49           2HB      CYS  49  -5.560   2.850  -6.578
  354    H    ALA  50           H        ALA  50  -4.052   0.767  -9.228
  355    HA   ALA  50           HA       ALA  50  -4.622   2.766 -11.314
  356    HB1  ALA  50           1HB      ALA  50  -2.662   1.138 -11.569
  357    HB2  ALA  50           2HB      ALA  50  -3.893  -0.093 -11.854
  358    HB3  ALA  50           3HB      ALA  50  -3.777   1.302 -12.927
  359    H    THR  51           H        THR  51  -5.615  -0.433 -10.121
  360    HA   THR  51           HA       THR  51  -7.775  -0.933 -11.737
  361    HB   THR  51           HB       THR  51  -7.599  -1.493  -8.769
  362    HG1  THR  51           1HG      THR  51  -7.096  -3.382 -10.796
  363   HG21  THR  51          1HG2      THR  51  -9.133  -3.189 -10.680
  364   HG22  THR  51          2HG2      THR  51  -9.863  -1.687 -10.114
  365   HG23  THR  51          3HG2      THR  51  -9.383  -2.926  -8.955
  366    H    CYS  52           H        CYS  52  -8.027   0.590  -8.515
  367    HA   CYS  52           HA       CYS  52 -10.533   1.847  -9.397
  368    HB2  CYS  52           1HB      CYS  52 -11.137   2.034  -7.080
  369    HB3  CYS  52           2HB      CYS  52 -10.583   0.386  -7.361
  370    H    GLY  53           H        GLY  53  -7.495   2.531  -7.693
  371    HA2  GLY  53           1HA      GLY  53  -6.212   4.478  -7.890
  372    HA3  GLY  53           2HA      GLY  53  -7.549   5.246  -8.734
  373    H    SER  54           H        SER  54  -7.660   3.628  -5.596
  374    HA   SER  54           HA       SER  54  -8.209   6.241  -4.350
  375    HB2  SER  54           1HB      SER  54  -9.647   3.616  -3.959
  376    HB3  SER  54           2HB      SER  54  -9.771   4.944  -2.806
  377    HG   SER  54           HG       SER  54 -11.390   4.762  -4.609
  378    H    HIS  55           H        HIS  55  -5.684   4.930  -4.478
  379    HA   HIS  55           HA       HIS  55  -5.086   4.840  -1.656
  380    HB2  HIS  55           1HB      HIS  55  -4.872   2.405  -3.404
  381    HB3  HIS  55           2HB      HIS  55  -3.791   2.622  -2.031
  382    HD1  HIS  55           1HD      HIS  55  -4.684   2.010   0.230
  383    HD2  HIS  55           2HD      HIS  55  -7.666   2.227  -2.654
  384    HE1  HIS  55           1HE      HIS  55  -6.760   1.127   1.341
  385    HE2  HIS  55           2HE      HIS  55  -8.530   1.189  -0.449
  386    H    GLY  56           H        GLY  56  -3.017   5.466  -1.217
  387    HA2  GLY  56           1HA      GLY  56  -1.151   5.678  -3.488
  388    HA3  GLY  56           2HA      GLY  56  -1.485   7.087  -2.493
  389    H    THR  57           H        THR  57   0.785   4.886  -3.030
  390    HA   THR  57           HA       THR  57   1.928   5.215  -0.382
  391    HB   THR  57           HB       THR  57   0.556   2.970  -0.592
  392    HG1  THR  57           1HG      THR  57   1.891   2.186   1.000
  393   HG21  THR  57          1HG2      THR  57   3.110   1.738  -1.374
  394   HG22  THR  57          2HG2      THR  57   2.245   2.552  -2.678
  395   HG23  THR  57          3HG2      THR  57   1.457   1.267  -1.765
  396    H    HIS  58           H        HIS  58   4.200   4.241  -0.334
  397    HA   HIS  58           HA       HIS  58   5.667   5.304  -2.521
  398    HB2  HIS  58           1HB      HIS  58   6.747   3.461  -0.388
  399    HB3  HIS  58           2HB      HIS  58   7.629   4.670  -1.316
  400    HD2  HIS  58           2HD      HIS  58   7.536   7.244  -0.304
  401    HE1  HIS  58           1HE      HIS  58   5.081   6.348   3.038
  402    HE2  HIS  58           2HE      HIS  58   6.446   8.116   1.874
  403    H    ARG  59           H        ARG  59   7.436   3.990  -3.606
  404    HA   ARG  59           HA       ARG  59   6.206   1.856  -5.046
  405    HB2  ARG  59           1HB      ARG  59   8.046   3.609  -5.766
  406    HB3  ARG  59           2HB      ARG  59   9.146   2.364  -5.189
  407    HG2  ARG  59           1HG      ARG  59   6.996   1.538  -7.055
  408    HG3  ARG  59           2HG      ARG  59   8.338   2.483  -7.705
  409    HD2  ARG  59           1HD      ARG  59   9.749   0.721  -6.307
  410    HD3  ARG  59           2HD      ARG  59   8.310  -0.262  -6.572
  411    HE   ARG  59           HE       ARG  59   9.051  -0.583  -8.694
  412   HH11  ARG  59          2HH1      ARG  59  10.292   2.466  -7.562
  413   HH12  ARG  59          1HH1      ARG  59  11.176   2.795  -9.015
  414   HH21  ARG  59          2HH2      ARG  59  10.210  -0.161 -10.613
  415   HH22  ARG  59          1HH2      ARG  59  11.127   1.300 -10.751
  416    H    ASP  60           H        ASP  60   9.284   1.884  -3.241
  417    HA   ASP  60           HA       ASP  60   9.512  -0.907  -3.077
  418    HB2  ASP  60           1HB      ASP  60  11.226   1.050  -2.584
  419    HB3  ASP  60           2HB      ASP  60  10.674   0.812  -0.928
  420    H    CYS  61           H        CYS  61   8.195   1.456  -0.785
  421    HA   CYS  61           HA       CYS  61   7.725  -0.087   1.415
  422    HB2  CYS  61           1HB      CYS  61   7.179   2.347   1.162
  423    HB3  CYS  61           2HB      CYS  61   5.727   1.880   0.283
  424    H    SER  62           H        SER  62   5.843  -0.003  -1.567
  425    HA   SER  62           HA       SER  62   3.901  -1.895  -0.554
  426    HB2  SER  62           1HB      SER  62   3.205  -0.113  -2.109
  427    HB3  SER  62           2HB      SER  62   4.267  -0.782  -3.347
  428    HG   SER  62           HG       SER  62   2.854  -2.800  -2.652
  429    H    SER  63           H        SER  63   6.704  -2.707  -0.673
  430    HA   SER  63           HA       SER  63   8.091  -4.318  -1.587
  431    HB2  SER  63           1HB      SER  63   6.321  -5.383   0.012
  432    HB3  SER  63           2HB      SER  63   5.668  -6.089  -1.467
  433    HG   SER  63           HG       SER  63   8.412  -6.304  -1.078
  434    H    LEU  64           H        LEU  64   7.249  -2.803  -3.683
  435    HA   LEU  64           HA       LEU  64   6.127  -4.517  -5.733
  436    HB2  LEU  64           1HB      LEU  64   7.098  -1.671  -5.730
  437    HB3  LEU  64           2HB      LEU  64   6.543  -2.492  -7.187
  438    HG   LEU  64           HG       LEU  64   4.843  -2.051  -4.735
  439   HD11  LEU  64          1HD1      LEU  64   4.243  -0.586  -7.207
  440   HD12  LEU  64          2HD1      LEU  64   5.704  -0.070  -6.365
  441   HD13  LEU  64          3HD1      LEU  64   4.154  -0.067  -5.524
  442   HD21  LEU  64          1HD2      LEU  64   3.292  -3.293  -5.733
  443   HD22  LEU  64          2HD2      LEU  64   4.542  -3.811  -6.864
  444   HD23  LEU  64          3HD2      LEU  64   3.501  -2.444  -7.265
  445    H    ARG  65           H        ARG  65   7.380  -4.064  -7.994
  446    HA   ARG  65           HA       ARG  65  10.127  -5.017  -7.525
  447    HB2  ARG  65           1HB      ARG  65   8.023  -5.783  -9.479
  448    HB3  ARG  65           2HB      ARG  65   9.687  -5.797 -10.047
  449    HG2  ARG  65           1HG      ARG  65   8.938  -7.989  -9.233
  450    HG3  ARG  65           2HG      ARG  65  10.311  -7.358  -8.321
  451    HD2  ARG  65           1HD      ARG  65   9.077  -7.025  -6.428
  452    HD3  ARG  65           2HD      ARG  65   7.581  -6.755  -7.321
  453    HE   ARG  65           HE       ARG  65   8.303  -9.419  -7.676
  454   HH11  ARG  65          2HH1      ARG  65   7.327  -7.296  -5.096
  455   HH12  ARG  65          1HH1      ARG  65   6.587  -8.555  -4.164
  456   HH21  ARG  65          2HH2      ARG  65   7.332 -11.086  -6.458
  457   HH22  ARG  65          1HH2      ARG  65   6.592 -10.711  -4.939
  458    HA   PRO  66           HA       PRO  66  11.848  -1.649  -9.746
  459    HB2  PRO  66           1HB      PRO  66  13.820  -2.833 -11.188
  460    HB3  PRO  66           2HB      PRO  66  13.910  -2.615  -9.436
  461    HG2  PRO  66           1HG      PRO  66  13.151  -5.049 -11.007
  462    HG3  PRO  66           2HG      PRO  66  14.187  -4.920  -9.573
  463    HD2  PRO  66           1HD      PRO  66  11.606  -5.729  -9.438
  464    HD3  PRO  66           2HD      PRO  66  12.393  -4.822  -8.130
  465    H    ASN  67           H        ASN  67  10.693  -4.389 -11.565
  466    HA   ASN  67           HA       ASN  67  10.534  -2.728 -13.989
  467    HB2  ASN  67           1HB      ASN  67  10.395  -5.739 -13.715
  468    HB3  ASN  67           2HB      ASN  67  10.291  -4.846 -15.229
  469   HD21  ASN  67          1HD2      ASN  67  12.340  -6.183 -12.860
  470   HD22  ASN  67          2HD2      ASN  67  13.846  -5.701 -13.557
  471    H    SER  68           H        SER  68   8.685  -2.207 -12.023
  472    HA   SER  68           HA       SER  68   6.235  -3.579 -12.876
  473    HB2  SER  68           1HB      SER  68   6.729  -3.475 -10.435
  474    HB3  SER  68           2HB      SER  68   6.637  -1.716 -10.523
  475    HG   SER  68           HG       SER  68   4.462  -1.982 -11.266
  476    H    LYS  69           H        LYS  69   4.504  -2.487 -13.732
  477    HA   LYS  69           HA       LYS  69   5.082   0.218 -14.706
  478    HB2  LYS  69           1HB      LYS  69   4.469  -1.668 -16.296
  479    HB3  LYS  69           2HB      LYS  69   2.852  -1.602 -15.610
  480    HG2  LYS  69           1HG      LYS  69   2.829   0.847 -16.255
  481    HG3  LYS  69           2HG      LYS  69   4.284   0.507 -17.194
  482    HD2  LYS  69           1HD      LYS  69   3.139  -0.985 -18.616
  483    HD3  LYS  69           2HD      LYS  69   1.754  -1.084 -17.527
  484    HE2  LYS  69           1HE      LYS  69   2.506   1.562 -18.675
  485    HE3  LYS  69           2HE      LYS  69   1.672   0.396 -19.700
  486    HZ1  LYS  69           1HZ      LYS  69   0.229   0.349 -17.409
  487    HZ2  LYS  69           2HZ      LYS  69  -0.174   1.224 -18.800
  488    HZ3  LYS  69           3HZ      LYS  69   0.653   1.982 -17.534
  489    H    LYS  70           H        LYS  70   2.416  -1.664 -13.285
  490    HA   LYS  70           HA       LYS  70   1.445   0.816 -12.040
  491    HB2  LYS  70           1HB      LYS  70  -0.834   0.282 -12.535
  492    HB3  LYS  70           2HB      LYS  70   0.067   0.205 -14.044
  493    HG2  LYS  70           1HG      LYS  70   0.087  -2.190 -13.981
  494    HG3  LYS  70           2HG      LYS  70  -0.631  -2.196 -12.369
  495    HD2  LYS  70           1HD      LYS  70  -2.622  -1.030 -13.352
  496    HD3  LYS  70           2HD      LYS  70  -1.911  -1.296 -14.946
  497    HE2  LYS  70           1HE      LYS  70  -2.355  -3.565 -13.034
  498    HE3  LYS  70           2HE      LYS  70  -3.650  -2.984 -14.080
  499    HZ1  LYS  70           1HZ      LYS  70  -1.667  -4.786 -14.731
  500    HZ2  LYS  70           2HZ      LYS  70  -1.264  -3.369 -15.561
  501    HZ3  LYS  70           3HZ      LYS  70  -2.784  -4.076 -15.785
  502    H    TRP  71           H        TRP  71   0.253   0.519 -10.081
  503    HA   TRP  71           HA       TRP  71   0.673  -2.111  -8.820
  504    HB2  TRP  71           1HB      TRP  71   2.219  -0.913  -7.626
  505    HB3  TRP  71           2HB      TRP  71   1.382   0.617  -7.871
  506    HD1  TRP  71           HD       TRP  71   1.240  -2.523  -5.641
  507    HE1  TRP  71           1HE      TRP  71   0.019  -1.908  -3.461
  508    HE3  TRP  71           3HE      TRP  71  -0.204   2.234  -6.834
  509    HZ2  TRP  71           2HZ      TRP  71  -1.373   0.302  -2.388
  510    HZ3  TRP  71           3HZ      TRP  71  -1.477   3.531  -5.176
  511    HH2  TRP  71           HH       TRP  71  -2.049   2.583  -3.000
  512    H    GLU  72           H        GLU  72  -0.930  -2.866  -7.459
  513    HA   GLU  72           HA       GLU  72  -3.457  -1.358  -7.554
  514    HB2  GLU  72           1HB      GLU  72  -2.961  -4.331  -7.341
  515    HB3  GLU  72           2HB      GLU  72  -4.547  -3.583  -7.203
  516    HG2  GLU  72           1HG      GLU  72  -4.635  -3.033  -9.435
  517    HG3  GLU  72           2HG      GLU  72  -2.882  -3.058  -9.618
  518    H    CYS  73           H        CYS  73  -4.766  -1.251  -5.706
  519    HA   CYS  73           HA       CYS  73  -3.301  -1.192  -3.232
  520    HB2  CYS  73           1HB      CYS  73  -5.225  -0.144  -2.297
  521    HB3  CYS  73           2HB      CYS  73  -5.051   0.498  -3.927
  522    H    ASN  74           H        ASN  74  -4.198  -2.169  -1.231
  523    HA   ASN  74           HA       ASN  74  -4.285  -4.928  -1.362
  524    HB2  ASN  74           1HB      ASN  74  -3.767  -3.910   0.726
  525    HB3  ASN  74           2HB      ASN  74  -5.287  -3.021   0.751
  526   HD21  ASN  74          1HD2      ASN  74  -3.770  -5.374   2.257
  527   HD22  ASN  74          2HD2      ASN  74  -5.085  -6.416   2.671
  528    H    GLU  75           H        GLU  75  -7.067  -2.796  -0.679
  529    HA   GLU  75           HA       GLU  75  -9.102  -4.583  -0.627
  530    HB2  GLU  75           1HB      GLU  75  -9.261  -2.071  -0.405
  531    HB3  GLU  75           2HB      GLU  75  -9.286  -1.989  -2.160
  532    HG2  GLU  75           1HG      GLU  75 -11.523  -1.868  -1.101
  533    HG3  GLU  75           2HG      GLU  75 -11.345  -3.181  -2.264
  534    H    CYS  76           H        CYS  76  -7.539  -3.305  -3.531
  535    HA   CYS  76           HA       CYS  76  -9.265  -4.668  -5.352
  536    HB2  CYS  76           1HB      CYS  76  -6.606  -3.281  -5.658
  537    HB3  CYS  76           2HB      CYS  76  -7.393  -4.095  -7.006
  538    H    LEU  77           H        LEU  77  -5.956  -5.251  -4.193
  539    HA   LEU  77           HA       LEU  77  -5.437  -7.559  -5.677
  540    HB2  LEU  77           1HB      LEU  77  -4.442  -6.737  -2.954
  541    HB3  LEU  77           2HB      LEU  77  -3.787  -8.084  -3.883
  542    HG   LEU  77           HG       LEU  77  -3.817  -5.344  -5.077
  543   HD11  LEU  77          1HD1      LEU  77  -2.015  -4.582  -3.919
  544   HD12  LEU  77          2HD1      LEU  77  -1.426  -6.201  -3.545
  545   HD13  LEU  77          3HD1      LEU  77  -2.784  -5.528  -2.645
  546   HD21  LEU  77          1HD2      LEU  77  -2.427  -6.234  -6.594
  547   HD22  LEU  77          2HD2      LEU  77  -3.042  -7.780  -6.010
  548   HD23  LEU  77          3HD2      LEU  77  -1.522  -7.141  -5.382
  549    HA   PRO  78           HA       PRO  78  -7.869 -10.738  -3.874
  550    HB2  PRO  78           1HB      PRO  78  -6.216 -12.875  -4.145
  551    HB3  PRO  78           2HB      PRO  78  -7.050 -12.126  -5.512
  552    HG2  PRO  78           1HG      PRO  78  -4.225 -11.766  -4.588
  553    HG3  PRO  78           2HG      PRO  78  -4.847 -11.955  -6.238
  554    HD2  PRO  78           1HD      PRO  78  -4.179  -9.545  -5.201
  555    HD3  PRO  78           2HD      PRO  78  -5.486  -9.745  -6.385
  556    H    ALA  79           H        ALA  79  -7.817  -9.874  -1.704
  557    HA   ALA  79           HA       ALA  79  -5.729 -10.639   0.111
  558    HB1  ALA  79           1HB      ALA  79  -8.422  -9.692   1.003
  559    HB2  ALA  79           2HB      ALA  79  -6.835  -9.387   1.712
  560    HB3  ALA  79           3HB      ALA  79  -7.302  -8.580   0.214
  561    H    SER  80           H        SER  80  -5.517 -12.552   1.050
  562    HA   SER  80           HA       SER  80  -7.172 -14.727   0.699
  563    HB2  SER  80           1HB      SER  80  -5.954 -15.792   2.531
  564    HB3  SER  80           2HB      SER  80  -4.842 -14.864   1.524
  565    HG   SER  80           HG       SER  80  -5.376 -14.600   4.147
  566    H    GLY  81           H        GLY  81  -9.222 -14.988   1.271
  567    HA2  GLY  81           1HA      GLY  81 -10.698 -15.468   3.171
  568    HA3  GLY  81           2HA      GLY  81 -10.051 -14.027   3.939
  569    HA   PRO  82           HA       PRO  82 -13.946 -13.213   1.281
  570    HB2  PRO  82           1HB      PRO  82 -15.830 -13.230   3.236
  571    HB3  PRO  82           2HB      PRO  82 -15.401 -14.668   2.302
  572    HG2  PRO  82           1HG      PRO  82 -14.505 -13.850   5.039
  573    HG3  PRO  82           2HG      PRO  82 -15.002 -15.449   4.456
  574    HD2  PRO  82           1HD      PRO  82 -12.403 -14.750   4.753
  575    HD3  PRO  82           2HD      PRO  82 -12.952 -15.875   3.494
  576    H    SER  83           H        SER  83 -14.991 -11.202   1.209
  577    HA   SER  83           HA       SER  83 -13.937  -9.225   3.117
  578    HB2  SER  83           1HB      SER  83 -14.293  -7.555   1.349
  579    HB3  SER  83           2HB      SER  83 -13.258  -8.865   0.779
  580    HG   SER  83           HG       SER  83 -15.471  -8.005  -0.324
  581    H    SER  84           H        SER  84 -15.392  -8.869   4.670
  582    HA   SER  84           HA       SER  84 -18.189  -9.187   4.346
  583    HB2  SER  84           1HB      SER  84 -16.435  -8.045   6.498
  584    HB3  SER  84           2HB      SER  84 -18.185  -7.845   6.590
  585    HG   SER  84           HG       SER  84 -17.167  -9.793   7.600
  586    H    GLY  85           H        GLY  85 -16.144  -6.285   4.655
  587    HA2  GLY  85           1HA      GLY  85 -18.422  -4.624   3.857
  588    HA3  GLY  85           2HA      GLY  85 -16.901  -4.043   4.518
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1 -25.011 -24.652  32.815
    2    HA2  GLY   1           1HA      GLY   1 -26.835 -24.803  30.647
    3    HA3  GLY   1           2HA      GLY   1 -26.280 -23.330  31.428
    4    H    SER   2           H        SER   2 -26.207 -22.288  29.390
    5    HA   SER   2           HA       SER   2 -23.882 -23.079  27.761
    6    HB2  SER   2           1HB      SER   2 -25.041 -22.255  25.774
    7    HB3  SER   2           2HB      SER   2 -26.012 -23.495  26.568
    8    HG   SER   2           HG       SER   2 -26.369 -20.684  26.699
    9    H    SER   3           H        SER   3 -23.052 -21.197  26.419
   10    HA   SER   3           HA       SER   3 -22.907 -18.836  28.160
   11    HB2  SER   3           1HB      SER   3 -20.834 -20.240  27.356
   12    HB3  SER   3           2HB      SER   3 -21.022 -19.300  25.876
   13    HG   SER   3           HG       SER   3 -19.686 -18.117  27.144
   14    H    GLY   4           H        GLY   4 -22.564 -16.723  27.001
   15    HA2  GLY   4           1HA      GLY   4 -24.756 -16.266  25.241
   16    HA3  GLY   4           2HA      GLY   4 -23.548 -15.084  25.719
   17    H    SER   5           H        SER   5 -23.903 -14.437  23.419
   18    HA   SER   5           HA       SER   5 -21.781 -15.549  21.805
   19    HB2  SER   5           1HB      SER   5 -24.037 -16.840  21.386
   20    HB3  SER   5           2HB      SER   5 -24.444 -15.409  20.440
   21    HG   SER   5           HG       SER   5 -22.833 -17.459  19.795
   22    H    SER   6           H        SER   6 -21.228 -14.215  19.997
   23    HA   SER   6           HA       SER   6 -22.002 -11.430  20.421
   24    HB2  SER   6           1HB      SER   6 -19.767 -12.611  18.754
   25    HB3  SER   6           2HB      SER   6 -20.039 -10.890  19.029
   26    HG   SER   6           HG       SER   6 -18.477 -12.138  20.438
   27    H    GLY   7           H        GLY   7 -22.120 -10.051  18.388
   28    HA2  GLY   7           1HA      GLY   7 -23.855 -11.446  16.456
   29    HA3  GLY   7           2HA      GLY   7 -23.936  -9.731  16.832
   30    H    GLU   8           H        GLU   8 -23.925 -10.055  14.296
   31    HA   GLU   8           HA       GLU   8 -21.138  -9.936  13.361
   32    HB2  GLU   8           1HB      GLU   8 -23.711 -10.663  11.989
   33    HB3  GLU   8           2HB      GLU   8 -22.300 -10.173  11.061
   34    HG2  GLU   8           1HG      GLU   8 -22.250 -12.514  11.104
   35    HG3  GLU   8           2HG      GLU   8 -21.034 -11.994  12.269
   36    H    LEU   9           H        LEU   9 -20.410  -8.203  12.167
   37    HA   LEU   9           HA       LEU   9 -22.114  -5.813  12.272
   38    HB2  LEU   9           1HB      LEU   9 -20.014  -4.546  12.056
   39    HB3  LEU   9           2HB      LEU   9 -20.056  -5.576  13.486
   40    HG   LEU   9           HG       LEU   9 -18.732  -6.622  11.033
   41   HD11  LEU   9          1HD1      LEU   9 -17.763  -4.462  11.070
   42   HD12  LEU   9          2HD1      LEU   9 -16.605  -5.545  11.842
   43   HD13  LEU   9          3HD1      LEU   9 -17.611  -4.483  12.827
   44   HD21  LEU   9          1HD2      LEU   9 -17.497  -6.855  13.682
   45   HD22  LEU   9          2HD2      LEU   9 -17.810  -8.088  12.460
   46   HD23  LEU   9          3HD2      LEU   9 -19.099  -7.580  13.553
   47    H    GLU  10           H        GLU  10 -21.548  -4.174  10.481
   48    HA   GLU  10           HA       GLU  10 -22.129  -5.432   7.975
   49    HB2  GLU  10           1HB      GLU  10 -21.609  -2.555   8.731
   50    HB3  GLU  10           2HB      GLU  10 -22.025  -3.069   7.102
   51    HG2  GLU  10           1HG      GLU  10 -24.041  -2.360   8.018
   52    HG3  GLU  10           2HG      GLU  10 -24.101  -4.117   8.144
   53    HA   PRO  11           HA       PRO  11 -18.020  -5.943   6.471
   54    HB2  PRO  11           1HB      PRO  11 -18.569  -6.063   3.815
   55    HB3  PRO  11           2HB      PRO  11 -18.930  -7.385   4.931
   56    HG2  PRO  11           1HG      PRO  11 -20.754  -5.277   3.839
   57    HG3  PRO  11           2HG      PRO  11 -21.048  -7.014   4.045
   58    HD2  PRO  11           1HD      PRO  11 -21.984  -5.162   5.784
   59    HD3  PRO  11           2HD      PRO  11 -21.514  -6.797   6.292
   60    H    GLY  12           H        GLY  12 -16.376  -4.855   5.288
   61    HA2  GLY  12           1HA      GLY  12 -15.307  -3.051   4.337
   62    HA3  GLY  12           2HA      GLY  12 -16.881  -2.462   3.821
   63    H    ALA  13           H        ALA  13 -18.256  -1.598   5.713
   64    HA   ALA  13           HA       ALA  13 -18.424   0.340   6.971
   65    HB1  ALA  13           1HB      ALA  13 -17.689  -1.919   8.429
   66    HB2  ALA  13           2HB      ALA  13 -16.704  -0.609   9.081
   67    HB3  ALA  13           3HB      ALA  13 -18.461  -0.457   9.044
   68    H    PHE  14           H        PHE  14 -16.379   0.669   5.059
   69    HA   PHE  14           HA       PHE  14 -14.754   2.642   6.441
   70    HB2  PHE  14           1HB      PHE  14 -13.674   0.157   5.220
   71    HB3  PHE  14           2HB      PHE  14 -12.782   1.645   4.921
   72    HD1  PHE  14           2HD      PHE  14 -12.350   3.105   7.082
   73    HD2  PHE  14           1HD      PHE  14 -13.141  -1.077   7.077
   74    HE1  PHE  14           2HE      PHE  14 -11.273   2.902   9.285
   75    HE2  PHE  14           1HE      PHE  14 -12.066  -1.287   9.280
   76    HZ   PHE  14           HZ       PHE  14 -11.129   0.704  10.386
   77    H    SER  15           H        SER  15 -14.921   4.455   5.319
   78    HA   SER  15           HA       SER  15 -15.134   4.286   2.385
   79    HB2  SER  15           1HB      SER  15 -16.494   6.335   4.149
   80    HB3  SER  15           2HB      SER  15 -16.658   6.176   2.400
   81    HG   SER  15           HG       SER  15 -17.901   4.445   2.652
   82    H    GLU  16           H        GLU  16 -14.810   6.710   1.517
   83    HA   GLU  16           HA       GLU  16 -12.498   7.896   2.883
   84    HB2  GLU  16           1HB      GLU  16 -11.311   8.116   0.744
   85    HB3  GLU  16           2HB      GLU  16 -11.598   6.431   1.154
   86    HG2  GLU  16           1HG      GLU  16 -13.146   6.143  -0.521
   87    HG3  GLU  16           2HG      GLU  16 -13.529   7.861  -0.608
   88    H    LEU  17           H        LEU  17 -11.886  10.028   1.707
   89    HA   LEU  17           HA       LEU  17 -14.347  11.576   1.494
   90    HB2  LEU  17           1HB      LEU  17 -11.501  12.562   1.543
   91    HB3  LEU  17           2HB      LEU  17 -12.962  13.519   1.777
   92    HG   LEU  17           HG       LEU  17 -12.174  11.318   3.667
   93   HD11  LEU  17          1HD1      LEU  17 -10.773  12.651   4.835
   94   HD12  LEU  17          2HD1      LEU  17 -11.631  14.128   4.396
   95   HD13  LEU  17          3HD1      LEU  17 -10.520  13.380   3.249
   96   HD21  LEU  17          1HD2      LEU  17 -13.826  13.787   4.142
   97   HD22  LEU  17          2HD2      LEU  17 -13.679  12.360   5.168
   98   HD23  LEU  17          3HD2      LEU  17 -14.517  12.251   3.620
   99    H    TYR  18           H        TYR  18 -14.054  13.560  -0.089
  100    HA   TYR  18           HA       TYR  18 -13.943  12.423  -2.721
  101    HB2  TYR  18           1HB      TYR  18 -14.419  15.250  -1.762
  102    HB3  TYR  18           2HB      TYR  18 -14.514  14.755  -3.448
  103    HD1  TYR  18           2HD      TYR  18 -15.959  12.295  -3.459
  104    HD2  TYR  18           1HD      TYR  18 -16.534  15.685  -0.952
  105    HE1  TYR  18           2HE      TYR  18 -18.313  11.655  -3.143
  106    HE2  TYR  18           1HE      TYR  18 -18.889  15.053  -0.628
  107    HH   TYR  18           HH       TYR  18 -20.186  12.050  -1.967
  108    H    GLN  19           H        GLN  19 -12.052  14.836  -0.935
  109    HA   GLN  19           HA       GLN  19 -10.315  15.680  -2.884
  110    HB2  GLN  19           1HB      GLN  19  -9.963  15.239   0.063
  111    HB3  GLN  19           2HB      GLN  19  -8.613  15.790  -0.920
  112    HG2  GLN  19           1HG      GLN  19 -10.064  17.683  -1.684
  113    HG3  GLN  19           2HG      GLN  19 -11.243  17.175  -0.476
  114   HE21  GLN  19          1HE2      GLN  19  -9.276  19.529  -0.925
  115   HE22  GLN  19          2HE2      GLN  19  -8.587  19.754   0.643
  116    H    ARG  20           H        ARG  20  -7.905  15.116  -2.977
  117    HA   ARG  20           HA       ARG  20  -7.620  12.537  -4.032
  118    HB2  ARG  20           1HB      ARG  20  -5.742  14.743  -3.319
  119    HB3  ARG  20           2HB      ARG  20  -5.069  13.154  -3.657
  120    HG2  ARG  20           1HG      ARG  20  -5.012  14.392  -5.675
  121    HG3  ARG  20           2HG      ARG  20  -6.298  13.194  -5.836
  122    HD2  ARG  20           1HD      ARG  20  -7.313  15.102  -6.650
  123    HD3  ARG  20           2HD      ARG  20  -7.828  15.101  -4.964
  124    HE   ARG  20           HE       ARG  20  -5.449  16.574  -5.196
  125   HH11  ARG  20          2HH1      ARG  20  -8.811  16.750  -6.083
  126   HH12  ARG  20          1HH1      ARG  20  -8.860  18.481  -6.066
  127   HH21  ARG  20          2HH2      ARG  20  -5.500  18.854  -5.170
  128   HH22  ARG  20          1HH2      ARG  20  -6.976  19.678  -5.547
  129    H    TYR  21           H        TYR  21  -6.345  10.757  -3.300
  130    HA   TYR  21           HA       TYR  21  -6.201  10.569  -0.363
  131    HB2  TYR  21           1HB      TYR  21  -7.921   9.109  -1.403
  132    HB3  TYR  21           2HB      TYR  21  -6.655   8.320  -2.336
  133    HD1  TYR  21           2HD      TYR  21  -4.619   7.460  -0.794
  134    HD2  TYR  21           1HD      TYR  21  -8.629   8.035   0.506
  135    HE1  TYR  21           2HE      TYR  21  -4.242   5.877   1.050
  136    HE2  TYR  21           1HE      TYR  21  -8.263   6.454   2.354
  137    HH   TYR  21           HH       TYR  21  -5.681   5.659   3.609
  138    H    ARG  22           H        ARG  22  -4.130  10.855   0.184
  139    HA   ARG  22           HA       ARG  22  -2.129   9.136  -1.107
  140    HB2  ARG  22           1HB      ARG  22  -0.489  11.050  -0.847
  141    HB3  ARG  22           2HB      ARG  22  -1.702  11.243  -2.106
  142    HG2  ARG  22           1HG      ARG  22  -3.024  12.650  -0.564
  143    HG3  ARG  22           2HG      ARG  22  -1.722  12.518   0.621
  144    HD2  ARG  22           1HD      ARG  22  -1.116  14.477  -0.369
  145    HD3  ARG  22           2HD      ARG  22  -0.271  13.351  -1.431
  146    HE   ARG  22           HE       ARG  22  -1.745  13.871  -3.128
  147   HH11  ARG  22          2HH1      ARG  22  -2.825  15.267  -0.127
  148   HH12  ARG  22          1HH1      ARG  22  -4.029  16.264  -0.873
  149   HH21  ARG  22          2HH2      ARG  22  -3.327  15.180  -4.122
  150   HH22  ARG  22          1HH2      ARG  22  -4.315  16.213  -3.145
  151    H    HIS  23           H        HIS  23  -2.061   7.725   0.612
  152    HA   HIS  23           HA       HIS  23  -0.645   8.696   2.960
  153    HB2  HIS  23           1HB      HIS  23  -3.089   8.834   3.500
  154    HB3  HIS  23           2HB      HIS  23  -3.192   7.093   3.255
  155    HD1  HIS  23           1HD      HIS  23  -2.625   9.553   5.821
  156    HD2  HIS  23           2HD      HIS  23  -1.396   5.644   5.133
  157    HE1  HIS  23           1HE      HIS  23  -1.832   8.695   8.048
  158    HE2  HIS  23           2HE      HIS  23  -1.014   6.358   7.589
  159    H    CYS  24           H        CYS  24   1.029   7.391   3.235
  160    HA   CYS  24           HA       CYS  24   1.567   5.078   1.869
  161    HB2  CYS  24           1HB      CYS  24   3.366   6.094   3.006
  162    HB3  CYS  24           2HB      CYS  24   2.522   6.058   4.550
  163    H    ASP  25           H        ASP  25   0.259   3.366   1.748
  164    HA   ASP  25           HA       ASP  25  -0.716   2.195   4.271
  165    HB2  ASP  25           1HB      ASP  25  -2.083   2.658   1.669
  166    HB3  ASP  25           2HB      ASP  25  -2.464   1.167   2.527
  167    H    ALA  26           H        ALA  26   1.806   1.657   2.983
  168    HA   ALA  26           HA       ALA  26   1.501  -0.937   1.711
  169    HB1  ALA  26           1HB      ALA  26   4.224  -0.384   2.266
  170    HB2  ALA  26           2HB      ALA  26   3.391  -0.350   0.712
  171    HB3  ALA  26           3HB      ALA  26   3.474   1.108   1.700
  172    HA   PRO  27           HA       PRO  27   2.347  -3.526   5.152
  173    HB2  PRO  27           1HB      PRO  27   4.244  -5.241   4.242
  174    HB3  PRO  27           2HB      PRO  27   2.563  -5.294   3.700
  175    HG2  PRO  27           1HG      PRO  27   4.948  -4.074   2.363
  176    HG3  PRO  27           2HG      PRO  27   3.641  -5.041   1.655
  177    HD2  PRO  27           1HD      PRO  27   3.716  -2.340   1.475
  178    HD3  PRO  27           2HD      PRO  27   2.194  -3.250   1.564
  179    H    ILE  28           H        ILE  28   5.460  -2.726   3.593
  180    HA   ILE  28           HA       ILE  28   6.510  -2.022   6.250
  181    HB   ILE  28           HB       ILE  28   7.967  -3.590   4.121
  182   HG12  ILE  28          1HG1      ILE  28   6.409  -4.925   5.478
  183   HG13  ILE  28          2HG1      ILE  28   8.082  -5.347   5.825
  184   HG21  ILE  28          1HG2      ILE  28   8.981  -1.815   6.097
  185   HG22  ILE  28          2HG2      ILE  28   9.426  -3.461   6.543
  186   HG23  ILE  28          3HG2      ILE  28   9.872  -2.825   4.960
  187   HD11  ILE  28          1HD1      ILE  28   6.029  -4.186   7.555
  188   HD12  ILE  28          2HD1      ILE  28   7.432  -5.177   7.955
  189   HD13  ILE  28          3HD1      ILE  28   7.623  -3.444   7.696
  190    H    CYS  29           H        CYS  29   7.663  -0.173   6.357
  191    HA   CYS  29           HA       CYS  29   8.088   1.279   3.831
  192    HB2  CYS  29           1HB      CYS  29   6.550   2.138   5.810
  193    HB3  CYS  29           2HB      CYS  29   8.091   2.673   6.472
  194    H    LEU  30           H        LEU  30  10.008   2.493   3.558
  195    HA   LEU  30           HA       LEU  30  12.229   1.637   5.295
  196    HB2  LEU  30           1HB      LEU  30  12.463   2.320   2.376
  197    HB3  LEU  30           2HB      LEU  30  13.677   1.573   3.412
  198    HG   LEU  30           HG       LEU  30  11.113   0.125   2.964
  199   HD11  LEU  30          1HD1      LEU  30  11.516   0.623   0.725
  200   HD12  LEU  30          2HD1      LEU  30  12.301  -0.939   0.954
  201   HD13  LEU  30          3HD1      LEU  30  13.267   0.536   0.920
  202   HD21  LEU  30          1HD2      LEU  30  13.803  -1.117   2.869
  203   HD22  LEU  30          2HD2      LEU  30  12.304  -1.708   3.587
  204   HD23  LEU  30          3HD2      LEU  30  13.256  -0.477   4.418
  205    H    TYR  31           H        TYR  31  10.756   4.237   3.477
  206    HA   TYR  31           HA       TYR  31  12.738   6.179   3.674
  207    HB2  TYR  31           1HB      TYR  31  10.475   6.242   2.428
  208    HB3  TYR  31           2HB      TYR  31   9.816   6.839   3.947
  209    HD1  TYR  31           2HD      TYR  31  12.464   7.545   1.425
  210    HD2  TYR  31           1HD      TYR  31   9.907   9.116   4.441
  211    HE1  TYR  31           2HE      TYR  31  13.167   9.824   0.825
  212    HE2  TYR  31           1HE      TYR  31  10.602  11.399   3.849
  213    HH   TYR  31           HH       TYR  31  11.668  12.414   1.375
  214    H    GLU  32           H        GLU  32  13.706   6.980   5.406
  215    HA   GLU  32           HA       GLU  32  13.340   6.531   8.003
  216    HB2  GLU  32           1HB      GLU  32  15.032   8.099   6.841
  217    HB3  GLU  32           2HB      GLU  32  13.855   9.368   7.150
  218    HG2  GLU  32           1HG      GLU  32  14.769   7.619   9.386
  219    HG3  GLU  32           2HG      GLU  32  15.790   8.944   8.827
  220    H    GLN  33           H        GLN  33  11.905   9.456   6.543
  221    HA   GLN  33           HA       GLN  33  10.330  10.260   8.629
  222    HB2  GLN  33           1HB      GLN  33  10.675  11.170   6.144
  223    HB3  GLN  33           2HB      GLN  33   9.108  10.404   5.920
  224    HG2  GLN  33           1HG      GLN  33   8.033  11.872   7.303
  225    HG3  GLN  33           2HG      GLN  33   9.484  12.222   8.240
  226   HE21  GLN  33          1HE2      GLN  33   9.300  14.426   8.078
  227   HE22  GLN  33          2HE2      GLN  33   9.537  15.286   6.599
  228    H    GLY  34           H        GLY  34   9.190   8.207   5.935
  229    HA2  GLY  34           1HA      GLY  34   7.869   6.264   6.177
  230    HA3  GLY  34           2HA      GLY  34   7.501   6.748   7.826
  231    H    ARG  35           H        ARG  35   6.750   9.458   7.130
  232    HA   ARG  35           HA       ARG  35   4.016   9.144   6.772
  233    HB2  ARG  35           1HB      ARG  35   3.867  11.472   6.732
  234    HB3  ARG  35           2HB      ARG  35   5.359  11.182   7.617
  235    HG2  ARG  35           1HG      ARG  35   6.694  11.850   5.827
  236    HG3  ARG  35           2HG      ARG  35   5.380  11.672   4.663
  237    HD2  ARG  35           1HD      ARG  35   4.438  13.678   5.213
  238    HD3  ARG  35           2HD      ARG  35   5.015  13.615   6.878
  239    HE   ARG  35           HE       ARG  35   7.300  13.949   5.545
  240   HH11  ARG  35          2HH1      ARG  35   4.228  15.563   5.254
  241   HH12  ARG  35          1HH1      ARG  35   4.919  17.064   4.734
  242   HH21  ARG  35          2HH2      ARG  35   8.221  15.920   4.861
  243   HH22  ARG  35          1HH2      ARG  35   7.190  17.266   4.510
  244    H    ASP  36           H        ASP  36   3.008  10.710   4.870
  245    HA   ASP  36           HA       ASP  36   3.342   9.129   2.497
  246    HB2  ASP  36           1HB      ASP  36   1.754  11.655   2.469
  247    HB3  ASP  36           2HB      ASP  36   1.386  10.089   1.751
  248    H    SER  37           H        SER  37   5.753  10.285   3.001
  249    HA   SER  37           HA       SER  37   6.010  12.666   1.352
  250    HB2  SER  37           1HB      SER  37   7.766  11.188   3.248
  251    HB3  SER  37           2HB      SER  37   8.553  12.104   1.963
  252    HG   SER  37           HG       SER  37   6.649  13.136   3.801
  253    H    PHE  38           H        PHE  38   6.639  12.684  -0.711
  254    HA   PHE  38           HA       PHE  38   8.123  10.445  -1.824
  255    HB2  PHE  38           1HB      PHE  38   5.618  11.329  -3.236
  256    HB3  PHE  38           2HB      PHE  38   6.578   9.879  -3.508
  257    HD1  PHE  38           1HD      PHE  38   4.122  11.486  -1.299
  258    HD2  PHE  38           2HD      PHE  38   6.246   7.910  -2.205
  259    HE1  PHE  38           1HE      PHE  38   2.621  10.222   0.186
  260    HE2  PHE  38           2HE      PHE  38   4.748   6.641  -0.723
  261    HZ   PHE  38           HZ       PHE  38   2.932   7.796   0.474
  262    H    GLU  39           H        GLU  39   8.877  10.894  -4.048
  263    HA   GLU  39           HA       GLU  39   9.313  13.782  -4.409
  264    HB2  GLU  39           1HB      GLU  39  11.397  13.260  -5.468
  265    HB3  GLU  39           2HB      GLU  39  11.322  12.360  -3.960
  266    HG2  GLU  39           1HG      GLU  39  10.431  10.430  -5.415
  267    HG3  GLU  39           2HG      GLU  39  11.087  11.356  -6.764
  268    H    ASP  40           H        ASP  40   9.661  14.472  -6.698
  269    HA   ASP  40           HA       ASP  40   7.445  14.132  -8.257
  270    HB2  ASP  40           1HB      ASP  40   9.449  15.770  -8.504
  271    HB3  ASP  40           2HB      ASP  40  10.120  14.534  -9.563
  272    H    GLU  41           H        GLU  41  10.409  12.213  -8.319
  273    HA   GLU  41           HA       GLU  41   9.022   9.967  -9.423
  274    HB2  GLU  41           1HB      GLU  41  10.831  11.615 -11.146
  275    HB3  GLU  41           2HB      GLU  41  10.782   9.872 -11.370
  276    HG2  GLU  41           1HG      GLU  41   8.244  10.158 -11.543
  277    HG3  GLU  41           2HG      GLU  41   8.590  11.873 -11.757
  278    H    GLY  42           H        GLY  42  10.088   8.061  -9.042
  279    HA2  GLY  42           1HA      GLY  42  12.508   7.173  -8.863
  280    HA3  GLY  42           2HA      GLY  42  12.599   8.316  -7.532
  281    H    ARG  43           H        ARG  43  13.193   5.928  -6.753
  282    HA   ARG  43           HA       ARG  43  11.318   4.003  -6.221
  283    HB2  ARG  43           1HB      ARG  43  12.675   3.384  -4.267
  284    HB3  ARG  43           2HB      ARG  43  13.677   3.735  -5.669
  285    HG2  ARG  43           1HG      ARG  43  14.076   6.006  -4.743
  286    HG3  ARG  43           2HG      ARG  43  13.198   5.516  -3.292
  287    HD2  ARG  43           1HD      ARG  43  15.722   4.271  -4.375
  288    HD3  ARG  43           2HD      ARG  43  15.586   5.290  -2.943
  289    HE   ARG  43           HE       ARG  43  13.872   3.102  -2.635
  290   HH11  ARG  43          2HH1      ARG  43  17.278   3.799  -2.807
  291   HH12  ARG  43          1HH1      ARG  43  17.736   2.458  -1.810
  292   HH21  ARG  43          2HH2      ARG  43  14.462   1.332  -1.321
  293   HH22  ARG  43          1HH2      ARG  43  16.133   1.055  -0.966
  294    H    TRP  44           H        TRP  44  11.809   7.060  -4.556
  295    HA   TRP  44           HA       TRP  44   9.688   6.427  -2.648
  296    HB2  TRP  44           1HB      TRP  44  11.313   8.967  -2.790
  297    HB3  TRP  44           2HB      TRP  44  10.383   8.355  -1.425
  298    HD1  TRP  44           HD       TRP  44  13.789   8.817  -2.184
  299    HE1  TRP  44           1HE      TRP  44  15.323   7.060  -1.095
  300    HE3  TRP  44           3HE      TRP  44  10.282   5.280  -1.035
  301    HZ2  TRP  44           2HZ      TRP  44  15.078   4.512   0.093
  302    HZ3  TRP  44           3HZ      TRP  44  11.014   3.210   0.077
  303    HH2  TRP  44           HH       TRP  44  13.363   2.836   0.628
  304    H    ARG  45           H        ARG  45   8.763   6.592  -5.232
  305    HA   ARG  45           HA       ARG  45   7.572   9.254  -5.496
  306    HB2  ARG  45           1HB      ARG  45   7.000   8.647  -7.737
  307    HB3  ARG  45           2HB      ARG  45   8.667   8.158  -7.468
  308    HG2  ARG  45           1HG      ARG  45   8.045   5.870  -7.256
  309    HG3  ARG  45           2HG      ARG  45   6.329   6.282  -7.235
  310    HD2  ARG  45           1HD      ARG  45   8.101   6.950  -9.567
  311    HD3  ARG  45           2HD      ARG  45   7.305   5.383  -9.420
  312    HE   ARG  45           HE       ARG  45   5.561   7.678  -9.182
  313   HH11  ARG  45          2HH1      ARG  45   6.973   5.300 -11.296
  314   HH12  ARG  45          1HH1      ARG  45   5.748   5.462 -12.511
  315   HH21  ARG  45          2HH2      ARG  45   3.942   7.900 -10.773
  316   HH22  ARG  45          1HH2      ARG  45   4.025   6.942 -12.213
  317    H    LEU  46           H        LEU  46   5.444   9.642  -5.209
  318    HA   LEU  46           HA       LEU  46   3.875   7.815  -3.742
  319    HB2  LEU  46           1HB      LEU  46   3.756  10.389  -3.870
  320    HB3  LEU  46           2HB      LEU  46   2.729  10.120  -5.276
  321    HG   LEU  46           HG       LEU  46   2.056   8.834  -2.659
  322   HD11  LEU  46          1HD1      LEU  46   1.284  10.707  -1.697
  323   HD12  LEU  46          2HD1      LEU  46   0.741  11.393  -3.228
  324   HD13  LEU  46          3HD1      LEU  46   2.436  11.519  -2.758
  325   HD21  LEU  46          1HD2      LEU  46  -0.018   9.945  -4.400
  326   HD22  LEU  46          2HD2      LEU  46   0.100   8.357  -3.642
  327   HD23  LEU  46          3HD2      LEU  46   0.957   8.681  -5.149
  328    H    ILE  47           H        ILE  47   3.120   5.978  -4.567
  329    HA   ILE  47           HA       ILE  47   2.108   5.969  -7.327
  330    HB   ILE  47           HB       ILE  47   2.923   3.668  -5.549
  331   HG12  ILE  47          1HG1      ILE  47   4.152   4.812  -8.067
  332   HG13  ILE  47          2HG1      ILE  47   4.810   4.948  -6.440
  333   HG21  ILE  47          1HG2      ILE  47   1.713   2.328  -6.836
  334   HG22  ILE  47          2HG2      ILE  47   1.141   3.713  -7.763
  335   HG23  ILE  47          3HG2      ILE  47   2.614   2.875  -8.249
  336   HD11  ILE  47          1HD1      ILE  47   6.045   3.252  -7.458
  337   HD12  ILE  47          2HD1      ILE  47   4.879   2.404  -6.441
  338   HD13  ILE  47          3HD1      ILE  47   4.613   2.520  -8.181
  339    H    LEU  48           H        LEU  48  -0.012   5.980  -7.633
  340    HA   LEU  48           HA       LEU  48  -1.762   5.166  -5.414
  341    HB2  LEU  48           1HB      LEU  48  -2.188   7.028  -7.737
  342    HB3  LEU  48           2HB      LEU  48  -3.508   6.457  -6.717
  343    HG   LEU  48           HG       LEU  48  -1.145   7.917  -5.572
  344   HD11  LEU  48          1HD1      LEU  48  -3.623   9.432  -6.020
  345   HD12  LEU  48          2HD1      LEU  48  -2.689   9.064  -7.470
  346   HD13  LEU  48          3HD1      LEU  48  -1.938   9.941  -6.137
  347   HD21  LEU  48          1HD2      LEU  48  -2.312   7.957  -3.644
  348   HD22  LEU  48          2HD2      LEU  48  -3.116   6.551  -4.342
  349   HD23  LEU  48          3HD2      LEU  48  -3.864   8.144  -4.460
  350    H    CYS  49           H        CYS  49  -3.221   3.562  -5.660
  351    HA   CYS  49           HA       CYS  49  -2.968   1.470  -7.303
  352    HB2  CYS  49           1HB      CYS  49  -4.614   1.548  -5.487
  353    HB3  CYS  49           2HB      CYS  49  -5.624   2.633  -6.437
  354    H    ALA  50           H        ALA  50  -3.942   0.710  -9.249
  355    HA   ALA  50           HA       ALA  50  -4.416   2.869 -11.182
  356    HB1  ALA  50           1HB      ALA  50  -4.122   0.719 -12.749
  357    HB2  ALA  50           2HB      ALA  50  -2.762   1.679 -12.167
  358    HB3  ALA  50           3HB      ALA  50  -3.198   0.181 -11.346
  359    H    THR  51           H        THR  51  -5.686  -0.295 -10.185
  360    HA   THR  51           HA       THR  51  -7.849  -0.469 -11.910
  361    HB   THR  51           HB       THR  51  -7.680  -1.431  -9.047
  362    HG1  THR  51           1HG      THR  51  -6.737  -3.187  -9.880
  363   HG21  THR  51          1HG2      THR  51  -9.594  -2.660  -9.347
  364   HG22  THR  51          2HG2      THR  51  -9.409  -2.724 -11.100
  365   HG23  THR  51          3HG2      THR  51  -9.987  -1.248 -10.327
  366    H    CYS  52           H        CYS  52  -7.893   0.767  -8.560
  367    HA   CYS  52           HA       CYS  52 -10.370   2.213  -9.215
  368    HB2  CYS  52           1HB      CYS  52 -10.872   2.224  -6.860
  369    HB3  CYS  52           2HB      CYS  52 -10.449   0.579  -7.323
  370    H    GLY  53           H        GLY  53  -7.224   2.564  -7.615
  371    HA2  GLY  53           1HA      GLY  53  -5.848   4.429  -7.549
  372    HA3  GLY  53           2HA      GLY  53  -7.066   5.318  -8.452
  373    H    SER  54           H        SER  54  -6.966   3.720  -5.264
  374    HA   SER  54           HA       SER  54  -7.952   6.242  -4.099
  375    HB2  SER  54           1HB      SER  54  -9.599   4.311  -4.129
  376    HB3  SER  54           2HB      SER  54  -8.522   3.484  -3.004
  377    HG   SER  54           HG       SER  54 -10.398   5.091  -2.335
  378    H    HIS  55           H        HIS  55  -6.105   3.282  -3.441
  379    HA   HIS  55           HA       HIS  55  -4.921   4.387  -1.057
  380    HB2  HIS  55           1HB      HIS  55  -4.421   1.839  -2.600
  381    HB3  HIS  55           2HB      HIS  55  -3.532   2.274  -1.143
  382    HD1  HIS  55           1HD      HIS  55  -4.405   0.815   0.652
  383    HD2  HIS  55           2HD      HIS  55  -7.453   2.322  -1.734
  384    HE1  HIS  55           1HE      HIS  55  -6.543   0.020   1.711
  385    HE2  HIS  55           2HE      HIS  55  -8.370   0.872   0.201
  386    H    GLY  56           H        GLY  56  -2.808   5.065  -0.771
  387    HA2  GLY  56           1HA      GLY  56  -1.130   5.275  -3.178
  388    HA3  GLY  56           2HA      GLY  56  -1.498   6.728  -2.260
  389    H    THR  57           H        THR  57   0.872   4.624  -2.795
  390    HA   THR  57           HA       THR  57   2.160   5.224  -0.262
  391    HB   THR  57           HB       THR  57   0.951   2.944  -0.096
  392    HG1  THR  57           1HG      THR  57   2.340   2.741   1.478
  393   HG21  THR  57          1HG2      THR  57   1.543   1.269  -1.452
  394   HG22  THR  57          2HG2      THR  57   3.258   1.559  -1.164
  395   HG23  THR  57          3HG2      THR  57   2.409   2.461  -2.419
  396    H    HIS  58           H        HIS  58   4.489   4.389  -0.301
  397    HA   HIS  58           HA       HIS  58   5.774   5.423  -2.588
  398    HB2  HIS  58           1HB      HIS  58   7.048   3.606  -0.544
  399    HB3  HIS  58           2HB      HIS  58   7.828   4.848  -1.519
  400    HD2  HIS  58           2HD      HIS  58   7.989   7.288  -0.321
  401    HE1  HIS  58           1HE      HIS  58   5.333   6.509   2.893
  402    HE2  HIS  58           2HE      HIS  58   6.890   8.185   1.841
  403    H    ARG  59           H        ARG  59   7.683   3.996  -3.552
  404    HA   ARG  59           HA       ARG  59   6.363   1.897  -5.020
  405    HB2  ARG  59           1HB      ARG  59   8.141   3.657  -5.833
  406    HB3  ARG  59           2HB      ARG  59   9.291   2.456  -5.259
  407    HG2  ARG  59           1HG      ARG  59   7.111   1.544  -7.053
  408    HG3  ARG  59           2HG      ARG  59   8.428   2.489  -7.751
  409    HD2  ARG  59           1HD      ARG  59   8.676  -0.078  -6.188
  410    HD3  ARG  59           2HD      ARG  59   8.928   0.128  -7.921
  411    HE   ARG  59           HE       ARG  59  10.667   1.864  -6.624
  412   HH11  ARG  59          2HH1      ARG  59  10.134  -1.566  -6.889
  413   HH12  ARG  59          1HH1      ARG  59  11.799  -1.976  -6.643
  414   HH21  ARG  59          2HH2      ARG  59  12.862   1.337  -6.298
  415   HH22  ARG  59          1HH2      ARG  59  13.350  -0.324  -6.306
  416    H    ASP  60           H        ASP  60   9.531   1.943  -3.381
  417    HA   ASP  60           HA       ASP  60   9.742  -0.849  -3.179
  418    HB2  ASP  60           1HB      ASP  60  11.561   0.978  -2.917
  419    HB3  ASP  60           2HB      ASP  60  11.057   1.024  -1.230
  420    H    CYS  61           H        CYS  61   8.369   1.562  -1.022
  421    HA   CYS  61           HA       CYS  61   8.113   0.111   1.314
  422    HB2  CYS  61           1HB      CYS  61   7.524   2.512   1.042
  423    HB3  CYS  61           2HB      CYS  61   6.067   2.030   0.180
  424    H    SER  62           H        SER  62   6.114   0.019  -1.585
  425    HA   SER  62           HA       SER  62   4.251  -1.856  -0.394
  426    HB2  SER  62           1HB      SER  62   3.523  -1.849  -2.977
  427    HB3  SER  62           2HB      SER  62   3.042  -0.576  -1.856
  428    HG   SER  62           HG       SER  62   4.372   0.787  -2.805
  429    H    SER  63           H        SER  63   7.060  -2.619  -0.639
  430    HA   SER  63           HA       SER  63   8.424  -4.251  -1.534
  431    HB2  SER  63           1HB      SER  63   7.694  -6.366  -0.876
  432    HB3  SER  63           2HB      SER  63   6.701  -5.304   0.122
  433    HG   SER  63           HG       SER  63   5.449  -6.925  -0.882
  434    H    LEU  64           H        LEU  64   7.355  -2.748  -3.615
  435    HA   LEU  64           HA       LEU  64   6.274  -4.529  -5.614
  436    HB2  LEU  64           1HB      LEU  64   7.131  -1.649  -5.644
  437    HB3  LEU  64           2HB      LEU  64   6.614  -2.495  -7.102
  438    HG   LEU  64           HG       LEU  64   4.894  -2.139  -4.650
  439   HD11  LEU  64          1HD1      LEU  64   5.667  -0.155  -6.409
  440   HD12  LEU  64          2HD1      LEU  64   4.244  -0.135  -5.368
  441   HD13  LEU  64          3HD1      LEU  64   4.108  -0.689  -7.036
  442   HD21  LEU  64          1HD2      LEU  64   4.637  -3.987  -6.602
  443   HD22  LEU  64          2HD2      LEU  64   3.734  -2.645  -7.307
  444   HD23  LEU  64          3HD2      LEU  64   3.279  -3.280  -5.725
  445    H    ARG  65           H        ARG  65   7.449  -4.029  -7.922
  446    HA   ARG  65           HA       ARG  65  10.211  -4.967  -7.535
  447    HB2  ARG  65           1HB      ARG  65   8.083  -5.631  -9.506
  448    HB3  ARG  65           2HB      ARG  65   9.747  -5.644 -10.076
  449    HG2  ARG  65           1HG      ARG  65   8.771  -7.193  -7.688
  450    HG3  ARG  65           2HG      ARG  65   8.903  -7.853  -9.319
  451    HD2  ARG  65           1HD      ARG  65  11.258  -7.592  -9.332
  452    HD3  ARG  65           2HD      ARG  65  11.223  -6.593  -7.879
  453    HE   ARG  65           HE       ARG  65  11.082  -8.501  -6.595
  454   HH11  ARG  65          2HH1      ARG  65  10.639  -9.292  -9.956
  455   HH12  ARG  65          1HH1      ARG  65  10.761 -11.002  -9.704
  456   HH21  ARG  65          2HH2      ARG  65  11.245 -10.750  -6.250
  457   HH22  ARG  65          1HH2      ARG  65  11.105 -11.830  -7.596
  458    HA   PRO  66           HA       PRO  66  11.924  -1.529  -9.653
  459    HB2  PRO  66           1HB      PRO  66  13.818  -2.664 -11.233
  460    HB3  PRO  66           2HB      PRO  66  13.976  -2.546  -9.476
  461    HG2  PRO  66           1HG      PRO  66  13.114  -4.874 -11.148
  462    HG3  PRO  66           2HG      PRO  66  14.205  -4.844  -9.751
  463    HD2  PRO  66           1HD      PRO  66  11.616  -5.615  -9.562
  464    HD3  PRO  66           2HD      PRO  66  12.467  -4.796  -8.237
  465    H    ASN  67           H        ASN  67  10.229  -3.908 -11.364
  466    HA   ASN  67           HA       ASN  67  10.339  -2.348 -13.857
  467    HB2  ASN  67           1HB      ASN  67  10.988  -4.671 -14.164
  468    HB3  ASN  67           2HB      ASN  67   9.503  -5.218 -13.390
  469   HD21  ASN  67          1HD2      ASN  67   7.478  -4.651 -14.456
  470   HD22  ASN  67          2HD2      ASN  67   7.442  -4.566 -16.181
  471    H    SER  68           H        SER  68   8.098  -4.059 -11.696
  472    HA   SER  68           HA       SER  68   5.682  -3.547 -12.812
  473    HB2  SER  68           1HB      SER  68   6.616  -3.710  -9.990
  474    HB3  SER  68           2HB      SER  68   4.988  -3.090 -10.268
  475    HG   SER  68           HG       SER  68   5.826  -5.617 -10.308
  476    H    LYS  69           H        LYS  69   4.913  -1.758 -13.703
  477    HA   LYS  69           HA       LYS  69   5.711   0.854 -12.697
  478    HB2  LYS  69           1HB      LYS  69   5.536   0.119 -15.191
  479    HB3  LYS  69           2HB      LYS  69   3.815   0.415 -14.982
  480    HG2  LYS  69           1HG      LYS  69   4.299   2.723 -14.320
  481    HG3  LYS  69           2HG      LYS  69   6.022   2.422 -14.561
  482    HD2  LYS  69           1HD      LYS  69   5.516   3.333 -16.592
  483    HD3  LYS  69           2HD      LYS  69   5.172   1.638 -16.947
  484    HE2  LYS  69           1HE      LYS  69   3.056   3.515 -15.935
  485    HE3  LYS  69           2HE      LYS  69   3.434   3.378 -17.652
  486    HZ1  LYS  69           1HZ      LYS  69   3.143   0.818 -17.011
  487    HZ2  LYS  69           2HZ      LYS  69   1.868   1.785 -17.557
  488    HZ3  LYS  69           3HZ      LYS  69   2.068   1.507 -15.900
  489    H    LYS  70           H        LYS  70   2.730  -0.994 -13.243
  490    HA   LYS  70           HA       LYS  70   1.232   0.995 -11.696
  491    HB2  LYS  70           1HB      LYS  70  -0.775  -0.202 -12.513
  492    HB3  LYS  70           2HB      LYS  70   0.238   0.395 -13.821
  493    HG2  LYS  70           1HG      LYS  70   0.943  -1.725 -14.418
  494    HG3  LYS  70           2HG      LYS  70   0.545  -2.412 -12.842
  495    HD2  LYS  70           1HD      LYS  70  -1.658  -1.280 -14.495
  496    HD3  LYS  70           2HD      LYS  70  -0.977  -2.842 -14.957
  497    HE2  LYS  70           1HE      LYS  70  -1.441  -3.720 -12.736
  498    HE3  LYS  70           2HE      LYS  70  -2.065  -2.151 -12.229
  499    HZ1  LYS  70           1HZ      LYS  70  -3.292  -4.175 -13.939
  500    HZ2  LYS  70           2HZ      LYS  70  -3.606  -2.556 -14.315
  501    HZ3  LYS  70           3HZ      LYS  70  -4.001  -3.161 -12.785
  502    H    TRP  71           H        TRP  71   0.259   0.538  -9.775
  503    HA   TRP  71           HA       TRP  71   0.667  -2.168  -8.684
  504    HB2  TRP  71           1HB      TRP  71   2.170  -1.049  -7.367
  505    HB3  TRP  71           2HB      TRP  71   1.337   0.493  -7.541
  506    HD1  TRP  71           HD       TRP  71   1.132  -2.783  -5.520
  507    HE1  TRP  71           1HE      TRP  71  -0.149  -2.305  -3.339
  508    HE3  TRP  71           3HE      TRP  71  -0.271   2.045  -6.445
  509    HZ2  TRP  71           2HZ      TRP  71  -1.568  -0.165  -2.167
  510    HZ3  TRP  71           3HZ      TRP  71  -1.589   3.237  -4.743
  511    HH2  TRP  71           HH       TRP  71  -2.223   2.153  -2.649
  512    H    GLU  72           H        GLU  72  -0.923  -2.958  -7.269
  513    HA   GLU  72           HA       GLU  72  -3.489  -1.522  -7.437
  514    HB2  GLU  72           1HB      GLU  72  -2.839  -4.460  -7.348
  515    HB3  GLU  72           2HB      GLU  72  -4.449  -3.859  -6.980
  516    HG2  GLU  72           1HG      GLU  72  -4.884  -3.282  -9.135
  517    HG3  GLU  72           2HG      GLU  72  -3.191  -2.968  -9.511
  518    H    CYS  73           H        CYS  73  -4.746  -1.263  -5.621
  519    HA   CYS  73           HA       CYS  73  -3.360  -1.265  -3.114
  520    HB2  CYS  73           1HB      CYS  73  -5.258  -0.145  -2.235
  521    HB3  CYS  73           2HB      CYS  73  -5.075   0.449  -3.882
  522    H    ASN  74           H        ASN  74  -4.626  -2.095  -1.120
  523    HA   ASN  74           HA       ASN  74  -4.669  -4.895  -1.221
  524    HB2  ASN  74           1HB      ASN  74  -4.229  -3.987   0.892
  525    HB3  ASN  74           2HB      ASN  74  -5.597  -2.882   0.807
  526   HD21  ASN  74          1HD2      ASN  74  -7.061  -3.394   2.251
  527   HD22  ASN  74          2HD2      ASN  74  -7.563  -4.992   2.676
  528    H    GLU  75           H        GLU  75  -7.344  -2.557  -1.072
  529    HA   GLU  75           HA       GLU  75  -9.494  -4.250  -0.922
  530    HB2  GLU  75           1HB      GLU  75  -9.429  -1.678  -1.030
  531    HB3  GLU  75           2HB      GLU  75  -9.508  -1.880  -2.774
  532    HG2  GLU  75           1HG      GLU  75 -11.710  -1.477  -1.908
  533    HG3  GLU  75           2HG      GLU  75 -11.609  -3.130  -2.513
  534    H    CYS  76           H        CYS  76  -7.667  -3.336  -3.812
  535    HA   CYS  76           HA       CYS  76  -9.322  -4.895  -5.571
  536    HB2  CYS  76           1HB      CYS  76  -6.677  -3.489  -5.955
  537    HB3  CYS  76           2HB      CYS  76  -7.487  -4.381  -7.239
  538    H    LEU  77           H        LEU  77  -5.951  -5.178  -4.444
  539    HA   LEU  77           HA       LEU  77  -5.357  -7.623  -5.615
  540    HB2  LEU  77           1HB      LEU  77  -4.379  -6.431  -3.027
  541    HB3  LEU  77           2HB      LEU  77  -3.678  -7.864  -3.778
  542    HG   LEU  77           HG       LEU  77  -3.777  -5.165  -5.115
  543   HD11  LEU  77          1HD1      LEU  77  -1.206  -5.418  -4.530
  544   HD12  LEU  77          2HD1      LEU  77  -1.864  -6.309  -3.158
  545   HD13  LEU  77          3HD1      LEU  77  -2.343  -4.634  -3.432
  546   HD21  LEU  77          1HD2      LEU  77  -2.470  -7.795  -5.725
  547   HD22  LEU  77          2HD2      LEU  77  -1.846  -6.282  -6.382
  548   HD23  LEU  77          3HD2      LEU  77  -3.491  -6.796  -6.760
  549    HA   PRO  78           HA       PRO  78  -7.617 -10.684  -3.425
  550    HB2  PRO  78           1HB      PRO  78  -5.861 -12.755  -3.457
  551    HB3  PRO  78           2HB      PRO  78  -6.736 -12.214  -4.895
  552    HG2  PRO  78           1HG      PRO  78  -3.929 -11.610  -4.046
  553    HG3  PRO  78           2HG      PRO  78  -4.547 -12.024  -5.656
  554    HD2  PRO  78           1HD      PRO  78  -3.995  -9.478  -4.917
  555    HD3  PRO  78           2HD      PRO  78  -5.295  -9.881  -6.058
  556    H    ALA  79           H        ALA  79  -7.370 -12.318  -1.588
  557    HA   ALA  79           HA       ALA  79  -5.320 -11.784   0.362
  558    HB1  ALA  79           1HB      ALA  79  -7.860 -11.325   1.675
  559    HB2  ALA  79           2HB      ALA  79  -6.372 -10.380   1.732
  560    HB3  ALA  79           3HB      ALA  79  -7.532 -10.118   0.431
  561    H    SER  80           H        SER  80  -6.004 -12.939   2.526
  562    HA   SER  80           HA       SER  80  -6.687 -15.650   1.760
  563    HB2  SER  80           1HB      SER  80  -6.085 -16.155   4.160
  564    HB3  SER  80           2HB      SER  80  -4.790 -15.426   3.211
  565    HG   SER  80           HG       SER  80  -5.057 -14.462   5.295
  566    H    GLY  81           H        GLY  81  -8.727 -16.308   1.750
  567    HA2  GLY  81           1HA      GLY  81 -10.654 -16.911   3.101
  568    HA3  GLY  81           2HA      GLY  81 -10.508 -15.354   3.902
  569    HA   PRO  82           HA       PRO  82 -13.694 -15.191   0.447
  570    HB2  PRO  82           1HB      PRO  82 -15.813 -14.559   2.023
  571    HB3  PRO  82           2HB      PRO  82 -15.348 -16.226   1.662
  572    HG2  PRO  82           1HG      PRO  82 -14.769 -14.583   4.096
  573    HG3  PRO  82           2HG      PRO  82 -15.274 -16.279   3.985
  574    HD2  PRO  82           1HD      PRO  82 -12.701 -15.551   4.407
  575    HD3  PRO  82           2HD      PRO  82 -13.143 -17.014   3.504
  576    H    SER  83           H        SER  83 -13.618 -13.312  -0.595
  577    HA   SER  83           HA       SER  83 -13.277 -10.836   0.918
  578    HB2  SER  83           1HB      SER  83 -11.825 -11.530  -1.103
  579    HB3  SER  83           2HB      SER  83 -13.214 -11.063  -2.084
  580    HG   SER  83           HG       SER  83 -12.964  -9.056  -0.556
  581    H    SER  84           H        SER  84 -15.362 -12.201  -1.610
  582    HA   SER  84           HA       SER  84 -17.060 -10.004  -1.928
  583    HB2  SER  84           1HB      SER  84 -17.275 -12.930  -2.476
  584    HB3  SER  84           2HB      SER  84 -18.751 -11.967  -2.532
  585    HG   SER  84           HG       SER  84 -17.888 -11.911  -4.562
  586    H    GLY  85           H        GLY  85 -18.487  -9.091  -0.611
  587    HA2  GLY  85           1HA      GLY  85 -20.551  -9.862   0.759
  588    HA3  GLY  85           2HA      GLY  85 -19.316 -10.571   1.790
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1 -56.057  10.915   2.274
    2    HA2  GLY   1           1HA      GLY   1 -53.689  11.465   0.731
    3    HA3  GLY   1           2HA      GLY   1 -53.524  11.899   2.426
    4    H    SER   2           H        SER   2 -51.809  10.076   1.521
    5    HA   SER   2           HA       SER   2 -52.636   7.678   2.949
    6    HB2  SER   2           1HB      SER   2 -51.588   7.577   0.109
    7    HB3  SER   2           2HB      SER   2 -51.875   6.178   1.144
    8    HG   SER   2           HG       SER   2 -54.117   7.318   1.248
    9    H    SER   3           H        SER   3 -50.685   6.092   3.008
   10    HA   SER   3           HA       SER   3 -48.147   7.558   3.107
   11    HB2  SER   3           1HB      SER   3 -47.656   6.525   5.330
   12    HB3  SER   3           2HB      SER   3 -48.987   7.681   5.374
   13    HG   SER   3           HG       SER   3 -49.582   5.830   6.493
   14    H    GLY   4           H        GLY   4 -46.337   5.890   3.759
   15    HA2  GLY   4           1HA      GLY   4 -46.818   3.197   2.813
   16    HA3  GLY   4           2HA      GLY   4 -45.843   4.180   1.731
   17    H    SER   5           H        SER   5 -44.188   2.553   2.120
   18    HA   SER   5           HA       SER   5 -42.730   3.088   4.624
   19    HB2  SER   5           1HB      SER   5 -43.133   0.466   3.186
   20    HB3  SER   5           2HB      SER   5 -41.832   0.708   4.351
   21    HG   SER   5           HG       SER   5 -44.423   1.425   5.107
   22    H    SER   6           H        SER   6 -40.353   2.407   4.389
   23    HA   SER   6           HA       SER   6 -39.383   3.322   1.761
   24    HB2  SER   6           1HB      SER   6 -38.529   3.967   4.543
   25    HB3  SER   6           2HB      SER   6 -37.279   3.881   3.302
   26    HG   SER   6           HG       SER   6 -39.009   5.851   3.780
   27    H    GLY   7           H        GLY   7 -36.941   2.662   1.513
   28    HA2  GLY   7           1HA      GLY   7 -36.812  -0.231   2.090
   29    HA3  GLY   7           2HA      GLY   7 -36.127   0.526   0.660
   30    H    GLU   8           H        GLU   8 -34.188  -0.674   1.342
   31    HA   GLU   8           HA       GLU   8 -32.792   0.481   3.638
   32    HB2  GLU   8           1HB      GLU   8 -32.421  -1.980   1.976
   33    HB3  GLU   8           2HB      GLU   8 -31.053  -1.333   2.870
   34    HG2  GLU   8           1HG      GLU   8 -32.504  -1.421   4.927
   35    HG3  GLU   8           2HG      GLU   8 -33.663  -2.337   3.965
   36    H    LEU   9           H        LEU   9 -30.282   0.618   3.182
   37    HA   LEU   9           HA       LEU   9 -30.007   2.470   0.930
   38    HB2  LEU   9           1HB      LEU   9 -28.246   1.996   3.331
   39    HB3  LEU   9           2HB      LEU   9 -27.930   3.181   2.065
   40    HG   LEU   9           HG       LEU   9 -30.350   4.020   2.804
   41   HD11  LEU   9          1HD1      LEU   9 -30.874   2.483   4.484
   42   HD12  LEU   9          2HD1      LEU   9 -30.332   3.916   5.357
   43   HD13  LEU   9          3HD1      LEU   9 -29.249   2.537   5.168
   44   HD21  LEU   9          1HD2      LEU   9 -29.177   5.603   4.337
   45   HD22  LEU   9          2HD2      LEU   9 -28.431   5.444   2.747
   46   HD23  LEU   9          3HD2      LEU   9 -27.719   4.630   4.141
   47    H    GLU  10           H        GLU  10 -28.410   2.268  -0.620
   48    HA   GLU  10           HA       GLU  10 -27.687  -0.322  -1.404
   49    HB2  GLU  10           1HB      GLU  10 -26.443   0.696  -3.161
   50    HB3  GLU  10           2HB      GLU  10 -27.853   1.708  -2.884
   51    HG2  GLU  10           1HG      GLU  10 -25.080   2.250  -1.849
   52    HG3  GLU  10           2HG      GLU  10 -25.830   3.026  -3.242
   53    HA   PRO  11           HA       PRO  11 -24.226  -1.094   1.246
   54    HB2  PRO  11           1HB      PRO  11 -23.325  -3.318  -0.025
   55    HB3  PRO  11           2HB      PRO  11 -24.754  -3.318   1.014
   56    HG2  PRO  11           1HG      PRO  11 -24.583  -3.183  -1.971
   57    HG3  PRO  11           2HG      PRO  11 -25.685  -4.131  -0.956
   58    HD2  PRO  11           1HD      PRO  11 -26.426  -1.810  -2.137
   59    HD3  PRO  11           2HD      PRO  11 -27.077  -2.335  -0.571
   60    H    GLY  12           H        GLY  12 -23.696  -1.495  -2.267
   61    HA2  GLY  12           1HA      GLY  12 -20.907  -0.785  -2.017
   62    HA3  GLY  12           2HA      GLY  12 -21.766  -1.143  -3.508
   63    H    ALA  13           H        ALA  13 -21.861   1.345  -0.951
   64    HA   ALA  13           HA       ALA  13 -22.270   3.363  -3.046
   65    HB1  ALA  13           1HB      ALA  13 -23.402   2.981  -0.460
   66    HB2  ALA  13           2HB      ALA  13 -22.538   4.519  -0.480
   67    HB3  ALA  13           3HB      ALA  13 -23.797   4.199  -1.673
   68    H    PHE  14           H        PHE  14 -20.128   3.594  -3.723
   69    HA   PHE  14           HA       PHE  14 -18.071   4.258  -1.797
   70    HB2  PHE  14           1HB      PHE  14 -18.102   3.967  -4.796
   71    HB3  PHE  14           2HB      PHE  14 -16.694   4.582  -3.937
   72    HD1  PHE  14           1HD      PHE  14 -19.094   1.766  -3.427
   73    HD2  PHE  14           2HD      PHE  14 -15.038   3.023  -3.712
   74    HE1  PHE  14           1HE      PHE  14 -18.353  -0.542  -3.003
   75    HE2  PHE  14           2HE      PHE  14 -14.290   0.718  -3.289
   76    HZ   PHE  14           HZ       PHE  14 -15.948  -1.069  -2.935
   77    H    SER  15           H        SER  15 -16.672   6.206  -2.234
   78    HA   SER  15           HA       SER  15 -18.149   8.493  -3.300
   79    HB2  SER  15           1HB      SER  15 -17.142   8.252  -0.465
   80    HB3  SER  15           2HB      SER  15 -17.472   9.810  -1.221
   81    HG   SER  15           HG       SER  15 -19.366   7.707  -1.045
   82    H    GLU  16           H        GLU  16 -16.627  10.540  -2.971
   83    HA   GLU  16           HA       GLU  16 -13.824   9.832  -3.375
   84    HB2  GLU  16           1HB      GLU  16 -15.276  10.013  -5.587
   85    HB3  GLU  16           2HB      GLU  16 -15.015  11.734  -5.339
   86    HG2  GLU  16           1HG      GLU  16 -12.669  11.497  -5.505
   87    HG3  GLU  16           2HG      GLU  16 -12.770   9.740  -5.409
   88    H    LEU  17           H        LEU  17 -12.471  11.880  -3.608
   89    HA   LEU  17           HA       LEU  17 -13.618  14.041  -1.968
   90    HB2  LEU  17           1HB      LEU  17 -10.743  13.179  -1.844
   91    HB3  LEU  17           2HB      LEU  17 -11.603  14.262  -0.752
   92    HG   LEU  17           HG       LEU  17 -12.509  11.432  -0.936
   93   HD11  LEU  17          1HD1      LEU  17 -10.619  11.586   1.150
   94   HD12  LEU  17          2HD1      LEU  17  -9.819  12.149  -0.317
   95   HD13  LEU  17          3HD1      LEU  17 -10.582  10.559  -0.284
   96   HD21  LEU  17          1HD2      LEU  17 -13.835  12.689   0.489
   97   HD22  LEU  17          2HD2      LEU  17 -12.471  13.629   1.096
   98   HD23  LEU  17          3HD2      LEU  17 -12.677  11.950   1.595
   99    H    TYR  18           H        TYR  18 -12.348  16.103  -2.152
  100    HA   TYR  18           HA       TYR  18 -11.914  16.666  -4.959
  101    HB2  TYR  18           1HB      TYR  18 -11.654  18.612  -2.670
  102    HB3  TYR  18           2HB      TYR  18 -11.987  18.967  -4.361
  103    HD1  TYR  18           1HD      TYR  18 -13.420  17.490  -1.284
  104    HD2  TYR  18           2HD      TYR  18 -14.205  18.980  -5.191
  105    HE1  TYR  18           1HE      TYR  18 -15.833  17.445  -0.809
  106    HE2  TYR  18           2HE      TYR  18 -16.620  18.940  -4.727
  107    HH   TYR  18           HH       TYR  18 -17.867  18.266  -1.534
  108    H    GLN  19           H        GLN  19 -10.062  16.933  -1.936
  109    HA   GLN  19           HA       GLN  19  -7.660  17.746  -3.256
  110    HB2  GLN  19           1HB      GLN  19  -8.062  16.658  -0.465
  111    HB3  GLN  19           2HB      GLN  19  -6.605  17.443  -1.057
  112    HG2  GLN  19           1HG      GLN  19  -9.318  18.699  -0.725
  113    HG3  GLN  19           2HG      GLN  19  -7.888  18.987   0.264
  114   HE21  GLN  19          1HE2      GLN  19  -9.577  19.792  -2.592
  115   HE22  GLN  19          2HE2      GLN  19  -8.465  20.969  -3.193
  116    H    ARG  20           H        ARG  20  -5.874  16.561  -3.802
  117    HA   ARG  20           HA       ARG  20  -6.194  13.930  -4.641
  118    HB2  ARG  20           1HB      ARG  20  -4.339  15.783  -5.117
  119    HB3  ARG  20           2HB      ARG  20  -3.460  14.856  -3.909
  120    HG2  ARG  20           1HG      ARG  20  -2.767  13.830  -5.828
  121    HG3  ARG  20           2HG      ARG  20  -4.154  12.824  -5.404
  122    HD2  ARG  20           1HD      ARG  20  -4.651  13.209  -7.591
  123    HD3  ARG  20           2HD      ARG  20  -5.426  14.624  -6.880
  124    HE   ARG  20           HE       ARG  20  -2.673  14.988  -7.701
  125   HH11  ARG  20          2HH1      ARG  20  -6.038  15.272  -8.546
  126   HH12  ARG  20          1HH1      ARG  20  -5.762  16.451  -9.786
  127   HH21  ARG  20          2HH2      ARG  20  -2.296  16.539  -9.330
  128   HH22  ARG  20          1HH2      ARG  20  -3.633  17.170 -10.232
  129    H    TYR  21           H        TYR  21  -6.141  12.027  -3.640
  130    HA   TYR  21           HA       TYR  21  -5.669  11.921  -0.798
  131    HB2  TYR  21           1HB      TYR  21  -7.512  10.653  -1.838
  132    HB3  TYR  21           2HB      TYR  21  -6.340   9.700  -2.741
  133    HD1  TYR  21           2HD      TYR  21  -4.705   8.259  -1.433
  134    HD2  TYR  21           1HD      TYR  21  -8.135  10.043   0.344
  135    HE1  TYR  21           2HE      TYR  21  -4.565   6.659   0.430
  136    HE2  TYR  21           1HE      TYR  21  -8.003   8.449   2.212
  137    HH   TYR  21           HH       TYR  21  -5.731   6.970   3.212
  138    H    ARG  22           H        ARG  22  -3.879  11.266   0.212
  139    HA   ARG  22           HA       ARG  22  -1.975   9.507  -1.061
  140    HB2  ARG  22           1HB      ARG  22  -0.080  11.009  -0.924
  141    HB3  ARG  22           2HB      ARG  22  -1.328  11.731  -1.930
  142    HG2  ARG  22           1HG      ARG  22  -2.018  12.838   0.378
  143    HG3  ARG  22           2HG      ARG  22  -0.309  12.562   0.723
  144    HD2  ARG  22           1HD      ARG  22  -0.046  13.623  -1.695
  145    HD3  ARG  22           2HD      ARG  22  -1.589  14.360  -1.265
  146    HE   ARG  22           HE       ARG  22  -0.501  15.679   0.267
  147   HH11  ARG  22          2HH1      ARG  22   1.625  13.135  -0.795
  148   HH12  ARG  22          1HH1      ARG  22   3.025  13.806  -0.027
  149   HH21  ARG  22          2HH2      ARG  22   1.335  16.573   1.283
  150   HH22  ARG  22          1HH2      ARG  22   2.859  15.761   1.156
  151    H    HIS  23           H        HIS  23  -1.900   8.063   0.552
  152    HA   HIS  23           HA       HIS  23  -0.749   8.883   3.079
  153    HB2  HIS  23           1HB      HIS  23  -3.576   7.995   2.796
  154    HB3  HIS  23           2HB      HIS  23  -2.667   7.382   4.175
  155    HD1  HIS  23           1HD      HIS  23  -5.071   9.675   3.877
  156    HD2  HIS  23           2HD      HIS  23  -1.102  10.126   5.018
  157    HE1  HIS  23           1HE      HIS  23  -4.994  11.800   5.219
  158    HE2  HIS  23           2HE      HIS  23  -2.568  12.097   5.827
  159    H    CYS  24           H        CYS  24   0.879   7.513   3.318
  160    HA   CYS  24           HA       CYS  24   1.301   5.154   1.967
  161    HB2  CYS  24           1HB      CYS  24   3.139   6.151   3.093
  162    HB3  CYS  24           2HB      CYS  24   2.316   6.088   4.648
  163    H    ASP  25           H        ASP  25   0.129   3.363   1.932
  164    HA   ASP  25           HA       ASP  25  -0.931   2.326   4.474
  165    HB2  ASP  25           1HB      ASP  25  -2.351   2.737   1.872
  166    HB3  ASP  25           2HB      ASP  25  -2.818   1.385   2.899
  167    H    ALA  26           H        ALA  26   1.491   1.724   2.858
  168    HA   ALA  26           HA       ALA  26   1.051  -0.847   1.656
  169    HB1  ALA  26           1HB      ALA  26   2.992  -0.385   0.692
  170    HB2  ALA  26           2HB      ALA  26   3.121   1.078   1.670
  171    HB3  ALA  26           3HB      ALA  26   3.803  -0.438   2.258
  172    HA   PRO  27           HA       PRO  27   1.735  -3.587   5.015
  173    HB2  PRO  27           1HB      PRO  27   3.548  -5.371   4.066
  174    HB3  PRO  27           2HB      PRO  27   1.871  -5.317   3.510
  175    HG2  PRO  27           1HG      PRO  27   4.328  -4.184   2.230
  176    HG3  PRO  27           2HG      PRO  27   2.979  -5.059   1.482
  177    HD2  PRO  27           1HD      PRO  27   3.198  -2.361   1.388
  178    HD3  PRO  27           2HD      PRO  27   1.629  -3.191   1.437
  179    H    ILE  28           H        ILE  28   4.878  -2.823   3.505
  180    HA   ILE  28           HA       ILE  28   5.961  -2.366   6.205
  181    HB   ILE  28           HB       ILE  28   7.432  -3.675   3.914
  182   HG12  ILE  28          1HG1      ILE  28   5.761  -5.142   5.015
  183   HG13  ILE  28          2HG1      ILE  28   7.414  -5.688   5.277
  184   HG21  ILE  28          1HG2      ILE  28   8.292  -2.529   6.496
  185   HG22  ILE  28          2HG2      ILE  28   8.997  -4.081   6.050
  186   HG23  ILE  28          3HG2      ILE  28   9.171  -2.693   4.976
  187   HD11  ILE  28          1HD1      ILE  28   6.015  -5.855   7.287
  188   HD12  ILE  28          2HD1      ILE  28   7.396  -4.780   7.510
  189   HD13  ILE  28          3HD1      ILE  28   5.786  -4.107   7.253
  190    H    CYS  29           H        CYS  29   7.136  -0.550   6.478
  191    HA   CYS  29           HA       CYS  29   7.726   1.056   4.077
  192    HB2  CYS  29           1HB      CYS  29   5.858   1.810   5.765
  193    HB3  CYS  29           2HB      CYS  29   7.228   2.335   6.738
  194    H    LEU  30           H        LEU  30   9.820   1.361   3.760
  195    HA   LEU  30           HA       LEU  30  11.705   0.867   5.916
  196    HB2  LEU  30           1HB      LEU  30  12.341   1.632   3.079
  197    HB3  LEU  30           2HB      LEU  30  13.393   0.838   4.248
  198    HG   LEU  30           HG       LEU  30  10.906  -0.569   3.417
  199   HD11  LEU  30          1HD1      LEU  30  13.067   0.211   1.601
  200   HD12  LEU  30          2HD1      LEU  30  11.436  -0.361   1.251
  201   HD13  LEU  30          3HD1      LEU  30  12.715  -1.518   1.621
  202   HD21  LEU  30          1HD2      LEU  30  11.977  -1.937   4.853
  203   HD22  LEU  30          2HD2      LEU  30  13.549  -1.190   4.565
  204   HD23  LEU  30          3HD2      LEU  30  12.908  -2.370   3.420
  205    H    TYR  31           H        TYR  31  10.520   3.523   3.966
  206    HA   TYR  31           HA       TYR  31  12.462   5.443   4.516
  207    HB2  TYR  31           1HB      TYR  31  10.370   5.517   2.951
  208    HB3  TYR  31           2HB      TYR  31   9.560   6.186   4.363
  209    HD1  TYR  31           2HD      TYR  31  12.667   6.687   2.346
  210    HD2  TYR  31           1HD      TYR  31   9.564   8.480   4.640
  211    HE1  TYR  31           2HE      TYR  31  13.549   8.914   1.788
  212    HE2  TYR  31           1HE      TYR  31  10.437  10.712   4.088
  213    HH   TYR  31           HH       TYR  31  12.361  11.798   3.318
  214    H    GLU  32           H        GLU  32  13.177   6.033   6.449
  215    HA   GLU  32           HA       GLU  32  12.219   5.569   8.914
  216    HB2  GLU  32           1HB      GLU  32  13.548   8.124   7.998
  217    HB3  GLU  32           2HB      GLU  32  13.367   7.645   9.680
  218    HG2  GLU  32           1HG      GLU  32  14.670   5.584   9.152
  219    HG3  GLU  32           2HG      GLU  32  14.976   6.259   7.552
  220    H    GLN  33           H        GLN  33  11.618   8.714   7.337
  221    HA   GLN  33           HA       GLN  33   9.826   9.800   9.054
  222    HB2  GLN  33           1HB      GLN  33  10.180   9.966   6.112
  223    HB3  GLN  33           2HB      GLN  33   8.678  10.606   6.766
  224    HG2  GLN  33           1HG      GLN  33  10.631  12.214   6.471
  225    HG3  GLN  33           2HG      GLN  33   9.770  12.240   8.009
  226   HE21  GLN  33          1HE2      GLN  33  12.713  11.373   6.381
  227   HE22  GLN  33          2HE2      GLN  33  13.668  11.134   7.800
  228    H    GLY  34           H        GLY  34   9.183   7.272   6.689
  229    HA2  GLY  34           1HA      GLY  34   7.309   5.997   6.285
  230    HA3  GLY  34           2HA      GLY  34   7.144   6.028   8.034
  231    H    ARG  35           H        ARG  35   6.963   8.982   6.220
  232    HA   ARG  35           HA       ARG  35   4.094   9.127   6.853
  233    HB2  ARG  35           1HB      ARG  35   4.302  11.476   7.011
  234    HB3  ARG  35           2HB      ARG  35   5.705  10.824   7.848
  235    HG2  ARG  35           1HG      ARG  35   7.018  11.191   5.751
  236    HG3  ARG  35           2HG      ARG  35   5.614  12.039   5.099
  237    HD2  ARG  35           1HD      ARG  35   5.723  13.526   7.137
  238    HD3  ARG  35           2HD      ARG  35   7.283  12.785   7.491
  239    HE   ARG  35           HE       ARG  35   7.621  13.615   4.965
  240   HH11  ARG  35          2HH1      ARG  35   6.375  15.219   7.792
  241   HH12  ARG  35          1HH1      ARG  35   6.909  16.791   7.296
  242   HH21  ARG  35          2HH2      ARG  35   8.329  15.679   4.300
  243   HH22  ARG  35          1HH2      ARG  35   8.019  17.052   5.309
  244    H    ASP  36           H        ASP  36   3.213  11.091   5.261
  245    HA   ASP  36           HA       ASP  36   3.041   9.799   2.711
  246    HB2  ASP  36           1HB      ASP  36   1.600  11.810   2.144
  247    HB3  ASP  36           2HB      ASP  36   1.050  10.830   3.500
  248    H    SER  37           H        SER  37   5.665  10.379   3.051
  249    HA   SER  37           HA       SER  37   6.221  12.829   1.554
  250    HB2  SER  37           1HB      SER  37   8.534  12.511   2.184
  251    HB3  SER  37           2HB      SER  37   7.531  12.302   3.619
  252    HG   SER  37           HG       SER  37   7.694   9.929   2.614
  253    H    PHE  38           H        PHE  38   7.017  12.862  -0.484
  254    HA   PHE  38           HA       PHE  38   8.064  10.502  -1.753
  255    HB2  PHE  38           1HB      PHE  38   5.536  11.677  -2.911
  256    HB3  PHE  38           2HB      PHE  38   6.392  10.232  -3.440
  257    HD1  PHE  38           2HD      PHE  38   6.223   8.156  -2.188
  258    HD2  PHE  38           1HD      PHE  38   4.087  11.639  -0.994
  259    HE1  PHE  38           2HE      PHE  38   4.802   6.779  -0.727
  260    HE2  PHE  38           1HE      PHE  38   2.663  10.267   0.470
  261    HZ   PHE  38           HZ       PHE  38   3.019   7.834   0.604
  262    H    GLU  39           H        GLU  39   9.186  10.950  -3.646
  263    HA   GLU  39           HA       GLU  39   9.573  13.813  -4.179
  264    HB2  GLU  39           1HB      GLU  39  11.469  12.089  -3.508
  265    HB3  GLU  39           2HB      GLU  39  11.438  11.735  -5.229
  266    HG2  GLU  39           1HG      GLU  39  11.723  14.221  -5.606
  267    HG3  GLU  39           2HG      GLU  39  12.078  14.339  -3.883
  268    H    ASP  40           H        ASP  40   9.982  14.463  -6.413
  269    HA   ASP  40           HA       ASP  40   8.017  14.064  -8.173
  270    HB2  ASP  40           1HB      ASP  40  10.156  15.518  -8.383
  271    HB3  ASP  40           2HB      ASP  40  10.821  14.137  -9.251
  272    H    GLU  41           H        GLU  41  10.845  11.956  -7.873
  273    HA   GLU  41           HA       GLU  41   9.343   9.734  -8.925
  274    HB2  GLU  41           1HB      GLU  41  11.710  10.839 -10.440
  275    HB3  GLU  41           2HB      GLU  41  11.050   9.231 -10.699
  276    HG2  GLU  41           1HG      GLU  41   8.875  10.278 -11.273
  277    HG3  GLU  41           2HG      GLU  41   9.652  11.855 -11.152
  278    H    GLY  42           H        GLY  42  10.998   7.786  -9.200
  279    HA2  GLY  42           1HA      GLY  42  13.055   6.822  -8.340
  280    HA3  GLY  42           2HA      GLY  42  12.931   7.920  -6.974
  281    H    ARG  43           H        ARG  43  13.299   5.782  -5.864
  282    HA   ARG  43           HA       ARG  43  11.264   3.819  -5.814
  283    HB2  ARG  43           1HB      ARG  43  12.376   3.037  -3.741
  284    HB3  ARG  43           2HB      ARG  43  13.501   3.285  -5.069
  285    HG2  ARG  43           1HG      ARG  43  13.954   5.571  -4.051
  286    HG3  ARG  43           2HG      ARG  43  13.099   4.977  -2.626
  287    HD2  ARG  43           1HD      ARG  43  15.309   4.491  -2.128
  288    HD3  ARG  43           2HD      ARG  43  14.719   2.967  -2.789
  289    HE   ARG  43           HE       ARG  43  15.793   4.462  -4.888
  290   HH11  ARG  43          2HH1      ARG  43  16.843   2.863  -1.979
  291   HH12  ARG  43          1HH1      ARG  43  18.432   2.526  -2.583
  292   HH21  ARG  43          2HH2      ARG  43  17.882   4.025  -5.693
  293   HH22  ARG  43          1HH2      ARG  43  19.022   3.189  -4.695
  294    H    TRP  44           H        TRP  44  11.860   6.717  -3.903
  295    HA   TRP  44           HA       TRP  44   9.568   6.175  -2.195
  296    HB2  TRP  44           1HB      TRP  44  11.264   8.670  -2.200
  297    HB3  TRP  44           2HB      TRP  44  10.265   8.039  -0.894
  298    HD1  TRP  44           HD       TRP  44  13.738   8.365  -1.676
  299    HE1  TRP  44           1HE      TRP  44  15.180   6.588  -0.499
  300    HE3  TRP  44           3HE      TRP  44  10.052   5.086  -0.338
  301    HZ2  TRP  44           2HZ      TRP  44  14.805   4.122   0.822
  302    HZ3  TRP  44           3HZ      TRP  44  10.678   3.041   0.880
  303    HH2  TRP  44           HH       TRP  44  13.005   2.571   1.446
  304    H    ARG  45           H        ARG  45   8.662   6.337  -4.712
  305    HA   ARG  45           HA       ARG  45   7.613   9.064  -5.033
  306    HB2  ARG  45           1HB      ARG  45   7.073   8.430  -7.326
  307    HB3  ARG  45           2HB      ARG  45   8.773   8.135  -6.988
  308    HG2  ARG  45           1HG      ARG  45   8.270   5.751  -6.650
  309    HG3  ARG  45           2HG      ARG  45   6.584   6.069  -7.063
  310    HD2  ARG  45           1HD      ARG  45   8.767   6.878  -8.939
  311    HD3  ARG  45           2HD      ARG  45   8.229   5.200  -8.886
  312    HE   ARG  45           HE       ARG  45   6.734   7.486  -9.871
  313   HH11  ARG  45          2HH1      ARG  45   6.708   4.134  -8.932
  314   HH12  ARG  45          1HH1      ARG  45   5.255   3.767  -9.803
  315   HH21  ARG  45          2HH2      ARG  45   4.821   7.015 -11.021
  316   HH22  ARG  45          1HH2      ARG  45   4.184   5.406 -10.991
  317    H    LEU  46           H        LEU  46   5.462   9.482  -4.949
  318    HA   LEU  46           HA       LEU  46   3.772   7.639  -3.616
  319    HB2  LEU  46           1HB      LEU  46   3.453   9.979  -3.274
  320    HB3  LEU  46           2HB      LEU  46   3.223  10.255  -4.999
  321    HG   LEU  46           HG       LEU  46   1.130   8.802  -4.771
  322   HD11  LEU  46          1HD1      LEU  46   2.092   8.803  -2.041
  323   HD12  LEU  46          2HD1      LEU  46   0.844   7.815  -2.799
  324   HD13  LEU  46          3HD1      LEU  46   0.440   9.409  -2.160
  325   HD21  LEU  46          1HD2      LEU  46   0.063  10.749  -4.857
  326   HD22  LEU  46          2HD2      LEU  46   1.592  11.535  -4.465
  327   HD23  LEU  46          3HD2      LEU  46   0.463  11.110  -3.178
  328    H    ILE  47           H        ILE  47   3.066   5.844  -4.575
  329    HA   ILE  47           HA       ILE  47   2.253   5.955  -7.393
  330    HB   ILE  47           HB       ILE  47   2.843   3.592  -5.611
  331   HG12  ILE  47          1HG1      ILE  47   4.274   4.782  -7.995
  332   HG13  ILE  47          2HG1      ILE  47   4.850   4.738  -6.332
  333   HG21  ILE  47          1HG2      ILE  47   1.185   3.726  -7.904
  334   HG22  ILE  47          2HG2      ILE  47   2.660   2.871  -8.353
  335   HG23  ILE  47          3HG2      ILE  47   1.688   2.300  -6.996
  336   HD11  ILE  47          1HD1      ILE  47   4.619   2.498  -8.299
  337   HD12  ILE  47          2HD1      ILE  47   6.029   3.043  -7.390
  338   HD13  ILE  47          3HD1      ILE  47   4.723   2.192  -6.565
  339    H    LEU  48           H        LEU  48   0.167   6.180  -7.815
  340    HA   LEU  48           HA       LEU  48  -1.803   5.502  -5.768
  341    HB2  LEU  48           1HB      LEU  48  -1.903   7.122  -8.292
  342    HB3  LEU  48           2HB      LEU  48  -3.371   6.636  -7.445
  343    HG   LEU  48           HG       LEU  48  -1.174   8.269  -6.182
  344   HD11  LEU  48          1HD1      LEU  48  -3.404   9.043  -7.943
  345   HD12  LEU  48          2HD1      LEU  48  -1.881   9.865  -7.604
  346   HD13  LEU  48          3HD1      LEU  48  -3.222   9.991  -6.466
  347   HD21  LEU  48          1HD2      LEU  48  -3.588   7.004  -5.222
  348   HD22  LEU  48          2HD2      LEU  48  -3.627   8.748  -4.963
  349   HD23  LEU  48          3HD2      LEU  48  -2.292   7.790  -4.320
  350    H    CYS  49           H        CYS  49  -3.332   3.946  -5.992
  351    HA   CYS  49           HA       CYS  49  -2.903   1.703  -7.509
  352    HB2  CYS  49           1HB      CYS  49  -4.444   1.704  -5.634
  353    HB3  CYS  49           2HB      CYS  49  -5.537   2.786  -6.491
  354    H    ALA  50           H        ALA  50  -4.093   0.791  -9.320
  355    HA   ALA  50           HA       ALA  50  -4.728   2.850 -11.324
  356    HB1  ALA  50           1HB      ALA  50  -2.814   1.322 -11.792
  357    HB2  ALA  50           2HB      ALA  50  -3.959  -0.019 -11.833
  358    HB3  ALA  50           3HB      ALA  50  -4.085   1.285 -13.014
  359    H    THR  51           H        THR  51  -5.786  -0.287 -10.057
  360    HA   THR  51           HA       THR  51  -8.003  -0.727 -11.650
  361    HB   THR  51           HB       THR  51  -7.707  -1.364  -8.708
  362    HG1  THR  51           1HG      THR  51  -7.214  -3.496  -9.736
  363   HG21  THR  51          1HG2      THR  51  -9.402  -3.073  -9.085
  364   HG22  THR  51          2HG2      THR  51  -9.560  -2.568 -10.768
  365   HG23  THR  51          3HG2      THR  51 -10.045  -1.477  -9.470
  366    H    CYS  52           H        CYS  52  -7.860   1.043  -8.563
  367    HA   CYS  52           HA       CYS  52 -10.426   2.305  -9.280
  368    HB2  CYS  52           1HB      CYS  52 -10.990   2.441  -6.951
  369    HB3  CYS  52           2HB      CYS  52 -10.517   0.780  -7.289
  370    H    GLY  53           H        GLY  53  -7.333   2.773  -7.600
  371    HA2  GLY  53           1HA      GLY  53  -5.958   4.645  -7.650
  372    HA3  GLY  53           2HA      GLY  53  -7.176   5.478  -8.605
  373    H    SER  54           H        SER  54  -7.121   4.034  -5.344
  374    HA   SER  54           HA       SER  54  -8.107   6.613  -4.312
  375    HB2  SER  54           1HB      SER  54  -9.298   5.316  -2.562
  376    HB3  SER  54           2HB      SER  54  -9.865   4.930  -4.186
  377    HG   SER  54           HG       SER  54  -9.529   2.967  -3.418
  378    H    HIS  55           H        HIS  55  -6.289   3.677  -3.487
  379    HA   HIS  55           HA       HIS  55  -5.168   4.814  -1.109
  380    HB2  HIS  55           1HB      HIS  55  -4.655   2.297  -2.674
  381    HB3  HIS  55           2HB      HIS  55  -3.614   2.759  -1.331
  382    HD1  HIS  55           1HD      HIS  55  -4.441   0.586  -0.099
  383    HD2  HIS  55           2HD      HIS  55  -7.379   3.438  -0.806
  384    HE1  HIS  55           1HE      HIS  55  -6.377  -0.064   1.369
  385    HE2  HIS  55           2HE      HIS  55  -8.173   1.627   0.861
  386    H    GLY  56           H        GLY  56  -2.758   4.926  -0.803
  387    HA2  GLY  56           1HA      GLY  56  -1.172   5.489  -3.154
  388    HA3  GLY  56           2HA      GLY  56  -1.577   6.912  -2.205
  389    H    THR  57           H        THR  57   0.783   4.739  -2.729
  390    HA   THR  57           HA       THR  57   2.074   5.364  -0.205
  391    HB   THR  57           HB       THR  57   0.818   3.146   0.064
  392    HG1  THR  57           1HG      THR  57   2.266   2.946   1.583
  393   HG21  THR  57          1HG2      THR  57   2.199   2.551  -2.306
  394   HG22  THR  57          2HG2      THR  57   1.228   1.453  -1.326
  395   HG23  THR  57          3HG2      THR  57   2.964   1.584  -1.046
  396    H    HIS  58           H        HIS  58   4.381   4.507  -0.208
  397    HA   HIS  58           HA       HIS  58   5.721   5.457  -2.480
  398    HB2  HIS  58           1HB      HIS  58   6.910   3.552  -0.466
  399    HB3  HIS  58           2HB      HIS  58   7.739   4.789  -1.407
  400    HD2  HIS  58           2HD      HIS  58   7.928   7.224  -0.184
  401    HE1  HIS  58           1HE      HIS  58   5.324   6.404   3.063
  402    HE2  HIS  58           2HE      HIS  58   6.878   8.087   2.016
  403    H    ARG  59           H        ARG  59   7.602   3.911  -3.392
  404    HA   ARG  59           HA       ARG  59   6.174   1.880  -4.886
  405    HB2  ARG  59           1HB      ARG  59   7.875   3.569  -5.833
  406    HB3  ARG  59           2HB      ARG  59   9.103   2.513  -5.148
  407    HG2  ARG  59           1HG      ARG  59   7.036   1.268  -6.866
  408    HG3  ARG  59           2HG      ARG  59   8.256   2.277  -7.646
  409    HD2  ARG  59           1HD      ARG  59   9.028   0.138  -5.693
  410    HD3  ARG  59           2HD      ARG  59   8.718  -0.246  -7.386
  411    HE   ARG  59           HE       ARG  59  10.527   1.906  -7.219
  412   HH11  ARG  59          2HH1      ARG  59  10.342  -1.525  -6.659
  413   HH12  ARG  59          1HH1      ARG  59  12.025  -1.797  -6.965
  414   HH21  ARG  59          2HH2      ARG  59  12.745   1.560  -7.624
  415   HH22  ARG  59          1HH2      ARG  59  13.391  -0.042  -7.513
  416    H    ASP  60           H        ASP  60   9.383   1.858  -3.328
  417    HA   ASP  60           HA       ASP  60   9.546  -0.937  -3.139
  418    HB2  ASP  60           1HB      ASP  60  10.966   1.295  -1.699
  419    HB3  ASP  60           2HB      ASP  60  11.312  -0.397  -1.350
  420    H    CYS  61           H        CYS  61   8.000   1.423  -1.129
  421    HA   CYS  61           HA       CYS  61   7.845  -0.016   1.277
  422    HB2  CYS  61           1HB      CYS  61   7.304   2.384   1.082
  423    HB3  CYS  61           2HB      CYS  61   5.867   1.977   0.150
  424    H    SER  62           H        SER  62   5.764   0.010  -1.577
  425    HA   SER  62           HA       SER  62   3.900  -1.862  -0.398
  426    HB2  SER  62           1HB      SER  62   3.501   0.047  -2.210
  427    HB3  SER  62           2HB      SER  62   3.879  -1.268  -3.322
  428    HG   SER  62           HG       SER  62   2.235  -2.390  -1.764
  429    H    SER  63           H        SER  63   6.738  -2.619  -0.779
  430    HA   SER  63           HA       SER  63   8.036  -4.299  -1.650
  431    HB2  SER  63           1HB      SER  63   6.249  -5.358  -0.060
  432    HB3  SER  63           2HB      SER  63   5.586  -6.030  -1.550
  433    HG   SER  63           HG       SER  63   7.101  -7.466  -1.458
  434    H    LEU  64           H        LEU  64   7.489  -2.817  -3.734
  435    HA   LEU  64           HA       LEU  64   6.307  -4.517  -5.809
  436    HB2  LEU  64           1HB      LEU  64   7.087  -1.606  -5.814
  437    HB3  LEU  64           2HB      LEU  64   6.455  -2.467  -7.216
  438    HG   LEU  64           HG       LEU  64   4.896  -2.262  -4.656
  439   HD11  LEU  64          1HD1      LEU  64   3.836  -0.449  -6.498
  440   HD12  LEU  64          2HD1      LEU  64   5.569  -0.128  -6.461
  441   HD13  LEU  64          3HD1      LEU  64   4.632  -0.082  -4.968
  442   HD21  LEU  64          1HD2      LEU  64   3.019  -2.460  -6.370
  443   HD22  LEU  64          2HD2      LEU  64   3.995  -3.899  -6.074
  444   HD23  LEU  64          3HD2      LEU  64   4.274  -2.926  -7.518
  445    H    ARG  65           H        ARG  65   7.484  -4.042  -8.050
  446    HA   ARG  65           HA       ARG  65  10.278  -4.827  -7.619
  447    HB2  ARG  65           1HB      ARG  65   8.226  -5.458  -9.658
  448    HB3  ARG  65           2HB      ARG  65   9.875  -5.293 -10.248
  449    HG2  ARG  65           1HG      ARG  65   9.311  -7.611  -9.712
  450    HG3  ARG  65           2HG      ARG  65  10.630  -7.003  -8.710
  451    HD2  ARG  65           1HD      ARG  65   9.372  -7.014  -6.805
  452    HD3  ARG  65           2HD      ARG  65   7.863  -6.730  -7.671
  453    HE   ARG  65           HE       ARG  65   9.067  -9.322  -8.112
  454   HH11  ARG  65          2HH1      ARG  65   6.826  -7.434  -6.233
  455   HH12  ARG  65          1HH1      ARG  65   5.908  -8.806  -5.708
  456   HH21  ARG  65          2HH2      ARG  65   7.866 -11.137  -7.428
  457   HH22  ARG  65          1HH2      ARG  65   6.501 -10.912  -6.388
  458    HA   PRO  66           HA       PRO  66  11.987  -1.224  -9.447
  459    HB2  PRO  66           1HB      PRO  66  13.937  -2.208 -11.059
  460    HB3  PRO  66           2HB      PRO  66  14.053  -2.219  -9.295
  461    HG2  PRO  66           1HG      PRO  66  13.270  -4.429 -11.157
  462    HG3  PRO  66           2HG      PRO  66  14.327  -4.486  -9.735
  463    HD2  PRO  66           1HD      PRO  66  11.748  -5.310  -9.668
  464    HD3  PRO  66           2HD      PRO  66  12.554  -4.579  -8.265
  465    H    ASN  67           H        ASN  67  11.720   0.136 -11.159
  466    HA   ASN  67           HA       ASN  67  10.731   0.926 -13.059
  467    HB2  ASN  67           1HB      ASN  67  11.408  -0.494 -15.141
  468    HB3  ASN  67           2HB      ASN  67  12.661   0.328 -14.215
  469   HD21  ASN  67          1HD2      ASN  67  11.224  -2.725 -15.021
  470   HD22  ASN  67          2HD2      ASN  67  12.485  -3.718 -14.381
  471    H    SER  68           H        SER  68   8.976  -0.587 -11.503
  472    HA   SER  68           HA       SER  68   7.594  -2.571 -12.967
  473    HB2  SER  68           1HB      SER  68   7.437  -2.225 -10.486
  474    HB3  SER  68           2HB      SER  68   6.461  -0.790 -10.798
  475    HG   SER  68           HG       SER  68   4.823  -2.072 -10.989
  476    H    LYS  69           H        LYS  69   4.998  -2.025 -13.104
  477    HA   LYS  69           HA       LYS  69   4.846   0.215 -15.011
  478    HB2  LYS  69           1HB      LYS  69   4.471  -2.229 -15.778
  479    HB3  LYS  69           2HB      LYS  69   2.924  -2.096 -14.953
  480    HG2  LYS  69           1HG      LYS  69   2.275  -1.476 -17.033
  481    HG3  LYS  69           2HG      LYS  69   2.754   0.107 -16.414
  482    HD2  LYS  69           1HD      LYS  69   4.895  -1.497 -17.661
  483    HD3  LYS  69           2HD      LYS  69   3.631  -0.917 -18.748
  484    HE2  LYS  69           1HE      LYS  69   4.198   1.271 -18.459
  485    HE3  LYS  69           2HE      LYS  69   4.762   1.020 -16.808
  486    HZ1  LYS  69           1HZ      LYS  69   6.827   0.882 -17.550
  487    HZ2  LYS  69           2HZ      LYS  69   6.293   1.200 -19.123
  488    HZ3  LYS  69           3HZ      LYS  69   6.424  -0.397 -18.581
  489    H    LYS  70           H        LYS  70   2.491  -1.684 -13.124
  490    HA   LYS  70           HA       LYS  70   1.518   0.797 -11.907
  491    HB2  LYS  70           1HB      LYS  70  -0.834   0.088 -12.346
  492    HB3  LYS  70           2HB      LYS  70   0.061   0.517 -13.799
  493    HG2  LYS  70           1HG      LYS  70   0.172  -1.668 -14.537
  494    HG3  LYS  70           2HG      LYS  70  -0.087  -2.335 -12.923
  495    HD2  LYS  70           1HD      LYS  70  -2.250  -0.687 -14.132
  496    HD3  LYS  70           2HD      LYS  70  -2.004  -2.324 -14.746
  497    HE2  LYS  70           1HE      LYS  70  -2.357  -1.652 -11.829
  498    HE3  LYS  70           2HE      LYS  70  -3.677  -2.135 -12.893
  499    HZ1  LYS  70           1HZ      LYS  70  -1.276  -3.825 -12.623
  500    HZ2  LYS  70           2HZ      LYS  70  -2.836  -4.265 -13.106
  501    HZ3  LYS  70           3HZ      LYS  70  -2.521  -3.916 -11.481
  502    H    TRP  71           H        TRP  71   0.277   0.478  -9.978
  503    HA   TRP  71           HA       TRP  71   0.600  -2.198  -8.787
  504    HB2  TRP  71           1HB      TRP  71   2.171  -1.083  -7.544
  505    HB3  TRP  71           2HB      TRP  71   1.379   0.478  -7.745
  506    HD1  TRP  71           HD       TRP  71   1.205  -2.700  -5.589
  507    HE1  TRP  71           1HE      TRP  71  -0.051  -2.137  -3.414
  508    HE3  TRP  71           3HE      TRP  71  -0.279   2.060  -6.718
  509    HZ2  TRP  71           2HZ      TRP  71  -1.482   0.038  -2.322
  510    HZ3  TRP  71           3HZ      TRP  71  -1.589   3.313  -5.054
  511    HH2  TRP  71           HH       TRP  71  -2.177   2.321  -2.902
  512    H    GLU  72           H        GLU  72  -1.011  -2.886  -7.357
  513    HA   GLU  72           HA       GLU  72  -3.499  -1.313  -7.482
  514    HB2  GLU  72           1HB      GLU  72  -3.066  -4.298  -7.391
  515    HB3  GLU  72           2HB      GLU  72  -4.635  -3.547  -7.132
  516    HG2  GLU  72           1HG      GLU  72  -4.857  -2.921  -9.320
  517    HG3  GLU  72           2HG      GLU  72  -3.117  -2.865  -9.595
  518    H    CYS  73           H        CYS  73  -4.731  -1.054  -5.641
  519    HA   CYS  73           HA       CYS  73  -3.336  -1.052  -3.170
  520    HB2  CYS  73           1HB      CYS  73  -5.420  -0.235  -2.207
  521    HB3  CYS  73           2HB      CYS  73  -5.096   0.588  -3.729
  522    H    ASN  74           H        ASN  74  -4.631  -1.954  -1.160
  523    HA   ASN  74           HA       ASN  74  -4.394  -4.759  -1.257
  524    HB2  ASN  74           1HB      ASN  74  -4.117  -3.328   0.789
  525    HB3  ASN  74           2HB      ASN  74  -5.868  -3.146   0.832
  526   HD21  ASN  74          1HD2      ASN  74  -3.516  -4.668   2.319
  527   HD22  ASN  74          2HD2      ASN  74  -4.276  -6.168   2.717
  528    H    GLU  75           H        GLU  75  -7.336  -2.848  -0.591
  529    HA   GLU  75           HA       GLU  75  -9.228  -4.787  -0.692
  530    HB2  GLU  75           1HB      GLU  75 -10.828  -3.110  -1.387
  531    HB3  GLU  75           2HB      GLU  75  -9.680  -2.391  -0.266
  532    HG2  GLU  75           1HG      GLU  75  -8.672  -1.118  -1.900
  533    HG3  GLU  75           2HG      GLU  75  -9.216  -2.173  -3.204
  534    H    CYS  76           H        CYS  76  -7.519  -3.394  -3.416
  535    HA   CYS  76           HA       CYS  76  -9.165  -4.684  -5.394
  536    HB2  CYS  76           1HB      CYS  76  -6.615  -3.093  -5.487
  537    HB3  CYS  76           2HB      CYS  76  -7.201  -3.943  -6.913
  538    H    LEU  77           H        LEU  77  -5.802  -5.097  -4.288
  539    HA   LEU  77           HA       LEU  77  -4.994  -7.211  -5.793
  540    HB2  LEU  77           1HB      LEU  77  -4.491  -6.539  -2.918
  541    HB3  LEU  77           2HB      LEU  77  -3.774  -7.975  -3.646
  542    HG   LEU  77           HG       LEU  77  -3.357  -5.179  -4.693
  543   HD11  LEU  77          1HD1      LEU  77  -1.988  -4.827  -2.984
  544   HD12  LEU  77          2HD1      LEU  77  -0.988  -6.153  -3.576
  545   HD13  LEU  77          3HD1      LEU  77  -2.242  -6.463  -2.375
  546   HD21  LEU  77          1HD2      LEU  77  -1.460  -6.228  -5.857
  547   HD22  LEU  77          2HD2      LEU  77  -3.010  -6.911  -6.348
  548   HD23  LEU  77          3HD2      LEU  77  -1.967  -7.799  -5.237
  549    HA   PRO  78           HA       PRO  78  -7.418 -10.755  -4.885
  550    HB2  PRO  78           1HB      PRO  78  -5.567 -12.738  -4.999
  551    HB3  PRO  78           2HB      PRO  78  -6.151 -11.886  -6.433
  552    HG2  PRO  78           1HG      PRO  78  -3.631 -11.463  -4.873
  553    HG3  PRO  78           2HG      PRO  78  -3.867 -11.494  -6.630
  554    HD2  PRO  78           1HD      PRO  78  -3.647  -9.187  -5.230
  555    HD3  PRO  78           2HD      PRO  78  -4.648  -9.326  -6.690
  556    H    ALA  79           H        ALA  79  -5.396  -9.462  -2.675
  557    HA   ALA  79           HA       ALA  79  -5.244 -11.626  -0.784
  558    HB1  ALA  79           1HB      ALA  79  -4.633  -9.561   0.744
  559    HB2  ALA  79           2HB      ALA  79  -3.491 -10.205  -0.436
  560    HB3  ALA  79           3HB      ALA  79  -4.436  -8.766  -0.818
  561    H    SER  80           H        SER  80  -6.460 -11.936   1.049
  562    HA   SER  80           HA       SER  80  -9.167 -11.258   0.979
  563    HB2  SER  80           1HB      SER  80  -9.204 -12.083   3.355
  564    HB3  SER  80           2HB      SER  80  -8.452 -13.196   2.213
  565    HG   SER  80           HG       SER  80  -7.367 -12.570   4.359
  566    H    GLY  81           H        GLY  81  -6.670 -10.045   3.228
  567    HA2  GLY  81           1HA      GLY  81  -6.618  -7.540   3.405
  568    HA3  GLY  81           2HA      GLY  81  -8.358  -7.651   3.618
  569    HA   PRO  82           HA       PRO  82  -5.944  -9.141   7.593
  570    HB2  PRO  82           1HB      PRO  82  -3.799  -7.550   8.081
  571    HB3  PRO  82           2HB      PRO  82  -3.686  -9.065   7.179
  572    HG2  PRO  82           1HG      PRO  82  -3.835  -6.257   6.153
  573    HG3  PRO  82           2HG      PRO  82  -2.803  -7.592   5.611
  574    HD2  PRO  82           1HD      PRO  82  -5.058  -6.869   4.299
  575    HD3  PRO  82           2HD      PRO  82  -4.483  -8.548   4.355
  576    H    SER  83           H        SER  83  -6.142  -8.184   9.670
  577    HA   SER  83           HA       SER  83  -7.380  -5.512   9.616
  578    HB2  SER  83           1HB      SER  83  -7.909  -7.955  11.281
  579    HB3  SER  83           2HB      SER  83  -8.348  -6.358  11.887
  580    HG   SER  83           HG       SER  83  -9.119  -6.941   9.287
  581    H    SER  84           H        SER  84  -5.554  -4.272   9.941
  582    HA   SER  84           HA       SER  84  -4.648  -4.064  12.651
  583    HB2  SER  84           1HB      SER  84  -2.803  -5.143  10.528
  584    HB3  SER  84           2HB      SER  84  -2.181  -4.273  11.930
  585    HG   SER  84           HG       SER  84  -3.697  -6.668  11.909
  586    H    GLY  85           H        GLY  85  -3.623  -2.098  13.083
  587    HA2  GLY  85           1HA      GLY  85  -2.890  -0.324  10.923
  588    HA3  GLY  85           2HA      GLY  85  -4.367   0.139  11.755