*HEADER    TRANSCRIPTION                           03-APR-07   2YSP              
*TITLE     SOLUTION STRUCTURE OF THE C2H2 TYPE ZINC FINGER (REGION 507-          
*TITLE    2 539) OF HUMAN ZINC FINGER PROTEIN 224                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER PROTEIN 224;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-C2H2;                                                   
*COMPND   5 SYNONYM: ZINC FINGER PROTEIN 27, ZINC FINGER PROTEIN 233,            
*COMPND   6 ZINC FINGER PROTEIN 255, BONE MARROW ZINC FINGER 2, BMZF-2,          
*COMPND   7 ZINC FINGER PROTEIN KOX22;                                           
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: ZNF224, BMZF2, KOX22, ZNF233, ZNF255, ZNF27;                   
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P061225-43;                               
*SOURCE   8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
*KEYWDS    ZF-C2H2, STRUCTURAL GENOMICS, NPPSFA, NATIONAL PROJECT ON             
*KEYWDS   2 PROTEIN STRUCTURAL AND FUNCTIONAL ANALYSES, RIKEN                    
*KEYWDS   3 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI,                     
*KEYWDS   4 TRANSCRIPTION                                                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    M.TAKAHASHI, K.KUWASAKO, K.TSUDA, W.TANABE, T.HARADA,                 
*AUTHOR   2 S.WATANABE, N.TOCHIO, Y.MUTO, T.KIGAWA, S.YOKOYAMA, RIKEN            
*AUTHOR   3 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI)                     
*REVDAT   1   12-MAY-09 2YSP    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.
**************************************************************

  26  PHE PHI -92.4 -32.4
  26  PHE PSI -66.0  -6.0
  27  ASN PHI -95.3 -35.3
  27  ASN PSI -69.4  -9.4
  28  LEU PHI -94.9 -34.9
  28  LEU PSI -71.6 -11.6
  29  ASP PHI -92.4 -32.4
  29  ASP PSI -69.9  -9.9
  30  MET PHI -99.0 -39.0
  30  MET PSI -66.0  -6.0
  31  HIS PHI -94.0 -34.0
  31  HIS PSI -71.9 -11.9
  32  GLN PHI -94.7 -34.7
  32  GLN PSI -72.0 -12.0
  18  CYSS CHI1  40.0  80.0
  34  VAL  CHI1 160.0 200.0
15 CYSS SG   181 ZN   ZN   2.19  5.00E+00
15 CYSS CB   181 ZN   ZN   3.25  5.00E+00
18 CYSS SG   181 ZN   ZN   2.19  5.00E+00
18 CYSS CB   181 ZN   ZN   3.25  5.00E+00
31 HIS NE2   181 ZN   ZN   1.90  5.00E+00
35 HIS NE2   181 ZN   ZN   1.90  5.00E+00
15 CYSS SG  18 CYSS SG   3.56  5.00E+00
15 CYSS SG  31 HIS NE2   3.32  5.00E+00
15 CYSS SG  35 HIS NE2   3.32  5.00E+00
18 CYSS SG  31 HIS NE2   3.32  5.00E+00
18 CYSS SG  35 HIS NE2   3.32  5.00E+00
31 HIS NE2  35 HIS NE2   3.00  5.00E+00
15 CYSS HN  21 GLY HN    4.00
15 CYSS HN  20 LYS HN    3.00
15 CYSS SG   181 ZN   ZN   2.39  5.00E+00
15 CYSS CB   181 ZN   ZN   3.51  5.00E+00
18 CYSS SG   181 ZN   ZN   2.39  5.00E+00
18 CYSS CB   181 ZN   ZN   3.51  5.00E+00
31 HIS NE2   181 ZN   ZN   2.10  5.00E+00
35 HIS NE2   181 ZN   ZN   2.10  5.00E+00
15 CYSS SG  18 CYSS SG   3.96  5.00E+00
15 CYSS SG  31 HIS NE2   3.72  5.00E+00
15 CYSS SG  35 HIS NE2   3.72  5.00E+00
18 CYSS SG  31 HIS NE2   3.72  5.00E+00
18 CYSS SG  35 HIS NE2   3.72  5.00E+00
31 HIS NE2  35 HIS NE2   3.60  5.00E+00
13 TYR  HA  14 LYS  HN   2.8 
 25 LYS  HN     25 LYS  HB2     3.88 #SUP  0.99  #QF  0.99
 25 LYS  HN     25 LYS  HB3     3.88 #SUP  0.96  #QF  0.96
 27 ASN  HB2    28 LEU  HN      4.58 #SUP  0.67  #QF  0.36
 27 ASN  HB3    28 LEU  HN      4.58 #SUP  0.67  #QF  0.36
 28 LEU  HN     28 LEU  HB3     3.53 #SUP  0.99  #QF  0.99
 28 LEU  HN     28 LEU  HB2     3.74 #SUP  0.98  #QF  0.98
 15 CYSS HB3    20 LYS  HN      3.92 #SUP  0.60  #QF  0.60
 28 LEU  HB3    29 ASP  HN      3.76 #SUP  0.94  #QF  0.94
 17 LYS  HN     17 LYS  HB3     3.97 #SUP  0.93  #QF  0.88
 17 LYS  HN     17 LYS  HG3     4.39 #SUP  0.93  #QF  0.88
 31 HIS  HN     31 HIS  HB3     3.41 #SUP  0.99  #QF  0.99
 31 HIS  HN     31 HIS  HB2     3.65 #SUP  0.97  #QF  0.97
 26 PHE  HN     26 PHE  HB3     3.89 #SUP  0.97  #QF  0.97
 11 LYS  HB2    22 TYR  HN      4.73 #SUP  0.52  #QF  0.32
 11 LYS  HB3    22 TYR  HN      4.73 #SUP  0.52  #QF  0.32
 33 LYS  HN     33 LYS  HB3     3.91 #SUP  0.96  #QF  0.96
 35 HIS  HN     35 HIS  HB3     4.13 #SUP  0.91  #QF  0.91
 31 HIS  HB3    32 GLN  HN      4.00 #SUP  0.84  #QF  0.84
 32 GLN  HN     32 GLN  HG2     4.28 #SUP  0.94  #QF  0.85
 32 GLN  HN     32 GLN  HG3     4.28 #SUP  0.94  #QF  0.85
 32 GLN  HN     32 GLN  HB2     3.59 #SUP  0.99  #QF  0.92
 22 TYR  HB2    24 SER  HN      4.59 #SUP  0.74  #QF  0.74
 20 LYS  HB2    21 GLY  HN      4.19 #SUP  0.76  #QF  0.76
 13 TYR  HA     14 LYS  HN      3.31 #SUP  0.91  #QF  0.91
 21 GLY  HA1    22 TYR  HN      3.33 #SUP  0.96  #QF  0.96
 35 HIS  HN     36 THR  HN      4.52 #SUP  0.55  #QF  0.55
 33 LYS  HN     34 VAL  HN      3.95 #SUP  0.59  #QF  0.59
 32 GLN  HN     33 LYS  HN      3.97 #SUP  0.55  #QF  0.55
 34 VAL  HN     35 HIS  HN      3.85 #SUP  0.60  #QF  0.60
 28 LEU  HN     29 ASP  HN      3.74 #SUP  0.56  #QF  0.56
 31 HIS  HN     32 GLN  HN      3.80 #SUP  0.57  #QF  0.57
 26 PHE  HN     27 ASN  HN      4.16 #SUP  0.75  #QF  0.75
 29 ASP  HN     30 MET  HN      3.69 #SUP  0.61  #QF  0.61
 17 LYS  HN     18 CYSS HN      3.57 #SUP  0.59  #QF  0.59
 16 GLU  HN     17 LYS  HN      4.26 #SUP  0.63  #QF  0.63
 33 LYS  HN     33 LYS  HG2     4.31 #SUP  0.98  #QF  0.98
 30 MET  HN     31 HIS  HN      3.78 #SUP  0.50  #QF  0.50
 27 ASN  HA     30 MET  HN      4.14 #SUP  0.85  #QF  0.25
 30 MET  HN     30 MET  HG2     4.21 #SUP  0.82  #QF  0.82
 29 ASP  HN     29 ASP  HB2     4.06 #SUP  0.98  #QF  0.98
 26 PHE  HN     26 PHE  HB2     3.89 #SUP  0.99  #QF  0.99
 15 CYSS HB3    19 GLY  HN      4.11 #SUP  0.88  #QF  0.47
 18 CYSS HN     19 GLY  HN      3.32 #SUP  0.57  #QF  0.57
 13 TYR  HN     13 TYR  HB2     3.52 #SUP  0.72  #QF  0.72
 15 CYSS HB2    20 LYS  HN      4.58 #SUP  0.98  #QF  0.98
 13 TYR  HB3    14 LYS  HN      4.67 #SUP  0.87  #QF  0.87
 15 CYSS HB2    19 GLY  HN      4.97 #SUP  0.91  #QF  0.67
 29 ASP  HN     31 HIS  HB3     5.50 #SUP  0.88  #QF  0.79
 28 LEU  HG     29 ASP  HN      4.72 #SUP  0.99  #QF  0.99
 32 GLN  HB2    33 LYS  HN      4.60 #SUP  0.98  #QF  0.85
 15 CYSS HN     20 LYS  HN      5.05 #SUP  0.92  #QF  0.92
 18 CYSS HN     19 GLY  HA1     4.89 #SUP  0.63  #QF  0.63
 18 CYSS HN     19 GLY  HA2     4.89 #SUP  0.79  #QF  0.79
 22 TYR  QD     28 LEU  HB2     4.45 #SUP  0.99  #QF  0.99
 28 LEU  HB2    29 ASP  HN      4.43 #SUP  0.80  #QF  0.80
 29 ASP  HB2    30 MET  HN      4.40 #SUP  0.63  #QF  0.63
 29 ASP  HN     29 ASP  HB3     4.06 #SUP  0.73  #QF  0.73
 29 ASP  HB3    30 MET  HN      4.40 #SUP  0.65  #QF  0.65
 14 LYS  HN     14 LYS  HB2     4.12 #SUP  0.65  #QF  0.65
 14 LYS  HN     14 LYS  HB3     4.12 #SUP  0.65  #QF  0.65
 24 SER  HB2    27 ASN  HN      4.52 #SUP  0.85  #QF  0.85
 24 SER  HB3    27 ASN  HN      4.52 #SUP  0.80  #QF  0.80
 20 LYS  HB3    21 GLY  HN      4.19 #SUP  0.94  #QF  0.94
 20 LYS  HB3    22 TYR  QE      4.40 #SUP  0.76  #QF  0.76
 18 CYSS HB2    35 HIS  HE1     3.79 #SUP  0.88  #QF  0.88
 33 LYS  HN     33 LYS  HB2     3.91 #SUP  0.71  #QF  0.71
 17 LYS  HN     17 LYS  HB2     3.97 #SUP  0.67  #QF  0.67
 30 MET  HN     30 MET  HG3     4.21 #SUP  0.61  #QF  0.61
 34 VAL  HN     34 VAL  HB      3.83 #SUP  0.76  #QF  0.76
 15 CYSS HN     15 CYSS HB3     3.32 #SUP  0.69  #QF  0.69
 15 CYSS HB3    18 CYSS HN      3.61 #SUP  0.34  #QF  0.34
 15 CYSS HB3    31 HIS  HD2     4.44 #SUP  1.00
 15 CYSS HN     15 CYSS HB2     3.37 #SUP  0.70  #QF  0.70
 15 CYSS HB2    18 CYSS HN      4.75 #SUP  0.66  #QF  0.66
 26 PHE  HA     29 ASP  HN      4.56 #SUP  0.65  #QF  0.65
 26 PHE  HA     26 PHE  QD      3.94 #SUP  0.97  #QF  0.97
 35 HIS  HN     35 HIS  HB2     4.13 #SUP  0.77  #QF  0.77
 22 TYR  QE     31 HIS  HB3     4.70 #SUP  0.99  #QF  0.99
 31 HIS  HD2    32 GLN  HA      4.18 #SUP  0.73  #QF  0.73
 32 GLN  HA     35 HIS  HD2     3.50 #SUP  0.94  #QF  0.94
 20 LYS  HA     21 GLY  HN      2.90 #SUP  0.59  #QF  0.59
 25 LYS  HA     28 LEU  HN      4.45 #SUP  0.88  #QF  0.88
 28 LEU  HA     31 HIS  HN      3.75 #SUP  0.91  #QF  0.91
 29 ASP  HA     32 GLN  HN      4.40 #SUP  0.46  #QF  0.46
 17 LYS  HN     17 LYS  HG2     4.39 #SUP  0.66  #QF  0.66
 33 LYS  HN     33 LYS  HG3     4.31 #SUP  0.71  #QF  0.71
 15 CYSS HN     28 LEU  QD1     4.23 #SUP  0.72  #QF  0.72
 34 VAL  HN     34 VAL  QG2     3.79 #SUP  0.89  #QF  0.89
 34 VAL  QG2    35 HIS  HN      4.89 #SUP  0.84  #QF  0.84
 34 VAL  HN     34 VAL  QG1     3.79 #SUP  0.97  #QF  0.97
 34 VAL  QG1    35 HIS  HN      4.89 #SUP  0.58  #QF  0.58
 26 PHE  QE     30 MET  QE      4.46 #SUP  0.71  #QF  0.49
 26 PHE  HZ     30 MET  QE      4.92 #SUP  0.71  #QF  0.49
 14 LYS  HA     28 LEU  QD1     4.46 #SUP  0.97  #QF  0.97
 28 LEU  QD1    31 HIS  HB3     4.13 #SUP  0.99  #QF  0.99
 15 CYSS HB2    28 LEU  QD1     3.23 #SUP  0.89  #QF  0.89
 28 LEU  HB3    28 LEU  QD1     4.21 #SUP  1.00
 22 TYR  HB2    28 LEU  HB2     4.23 #SUP  0.95  #QF  0.75
 25 LYS  HA     28 LEU  HB2     4.72 #SUP  0.95  #QF  0.75
 22 TYR  HB3    28 LEU  HB2     4.23 #SUP  0.77  #QF  0.77
 17 LYS  HD2    35 HIS  HB2     5.50 #SUP  0.96  #QF  0.69
 17 LYS  HA     17 LYS  HG3     3.89 #SUP  0.50  #QF  0.50
 33 LYS  HA     36 THR  QG2     4.44 #SUP  0.88  #QF  0.88
 11 LYS  HB2    12 PRO  HD2     5.50 #SUP  0.98  #QF  0.73
 11 LYS  HB3    12 PRO  HD2     5.50 #SUP  0.98  #QF  0.73
 33 LYS  HA     33 LYS  HD2     5.50 #SUP  1.00  #QF  0.44
 33 LYS  HA     33 LYS  HD3     5.50 #SUP  1.00  #QF  0.44
 13 TYR  HB3    28 LEU  HB3     4.30 #SUP  0.99  #QF  0.99
 13 TYR  HB2    28 LEU  HB3     5.32 #SUP  0.94  #QF  0.59
 30 MET  HA     30 MET  HG2     4.23 #SUP  1.00
 13 TYR  HB2    14 LYS  HA      5.46 #SUP  0.82  #QF  0.69
 13 TYR  HB2    23 ASN  HA      5.50 #SUP  0.82  #QF  0.69
 39 ARG  HA     40 PRO  HD2     3.62 #SUP  0.97  #QF  0.97
 39 ARG  HA     40 PRO  HD3     3.62 #SUP  0.98  #QF  0.98
 12 PRO  HD2    23 ASN  HA      4.25 #SUP  1.00
 11 LYS  HA     12 PRO  HD2     3.30 #SUP  0.95  #QF  0.95
 14 LYS  HA     15 CYSS HN      3.02 #SUP  0.57  #QF  0.57
 13 TYR  HN     13 TYR  QD      4.10 #SUP  0.77  #QF  0.77
 22 TYR  HN     22 TYR  QD      3.85 #SUP  0.64  #QF  0.64
 22 TYR  QE     31 HIS  HD2     4.44 #SUP  0.85  #QF  0.85
 18 CYSS HB3    35 HIS  HE1     3.79 #SUP  0.95  #QF  0.95
 34 VAL  QG2    35 HIS  HE1     5.47 #SUP  0.53  #QF  0.53
 34 VAL  QG1    35 HIS  HE1     5.47 #SUP  0.77  #QF  0.77
 31 HIS  HE1    34 VAL  QG1     4.30 #SUP  0.55  #QF  0.55
 31 HIS  HE1    34 VAL  QG2     4.30 #SUP  0.61  #QF  0.61
 13 TYR  QD     23 ASN  HA      4.43 #SUP  0.73  #QF  0.73
 13 TYR  HA     13 TYR  QD      3.59 #SUP  0.97  #QF  0.97
 13 TYR  QD     25 LYS  HA      4.47 #SUP  0.99  #QF  0.99
 13 TYR  QD     28 LEU  QD2     3.85 #SUP  0.98  #QF  0.98
 21 GLY  HA1    22 TYR  QD      4.11 #SUP  0.88  #QF  0.88
 22 TYR  HA     22 TYR  QD      3.82 #SUP  1.00
 22 TYR  QD     28 LEU  HA      4.06 #SUP  1.00
 22 TYR  QD     28 LEU  QD1     3.41 #SUP  0.99  #QF  0.99
 32 GLN  HG2    35 HIS  HD2     5.50 #SUP  0.92  #QF  0.84
 32 GLN  HG3    35 HIS  HD2     5.50 #SUP  0.92  #QF  0.84
 32 GLN  HB3    35 HIS  HD2     4.96 #SUP  0.81  #QF  0.81
 17 LYS  HD2    35 HIS  HD2     5.50 #SUP  0.95  #QF  0.82
 17 LYS  HD3    35 HIS  HD2     5.50 #SUP  0.95  #QF  0.82
 31 HIS  HB3    31 HIS  HD2     3.86 #SUP  0.99  #QF  0.99
 15 CYSS HB2    31 HIS  HD2     3.26 #SUP  0.79  #QF  0.79
 28 LEU  QD1    31 HIS  HD2     3.58 #SUP  1.00
 13 TYR  QE     24 SER  HA      3.84 #SUP  0.66  #QF  0.66
 15 CYSS HB2    22 TYR  QE      4.15 #SUP  0.94  #QF  0.60
 22 TYR  QE     31 HIS  HB2     4.46 #SUP  0.94  #QF  0.60
 20 LYS  HB2    22 TYR  QE      4.40 #SUP  0.83  #QF  0.78
 22 TYR  QE     28 LEU  QD1     4.17 #SUP  1.00
 11 LYS  HB2    21 GLY  HA1     5.50 #SUP  0.97  #QF  0.83
 11 LYS  HB3    21 GLY  HA1     5.50 #SUP  0.97  #QF  0.83
 11 LYS  HA     23 ASN  HA      4.29 #SUP  0.98  #QF  0.98
 28 LEU  HB3    28 LEU  QD2     3.39 #SUP  1.00  #QF  0.99
 13 TYR  HB3    28 LEU  HB2     3.96 #SUP  1.00
 13 TYR  HB3    28 LEU  QD2     3.41 #SUP  1.00  #QF  0.99
 13 TYR  HB2    28 LEU  HB2     4.15 #SUP  0.99  #QF  0.99
 13 TYR  HB2    28 LEU  QD2     4.04 #SUP  1.00
 13 TYR  HB2    28 LEU  QD1     4.56 #SUP  1.00
 28 LEU  HG     32 GLN  HG2     4.88 #SUP  0.94  #QF  0.85
 28 LEU  HG     32 GLN  HG3     4.88 #SUP  0.94  #QF  0.85
 28 LEU  QD1    32 GLN  HG2     4.74 #SUP  0.92  #QF  0.89
 28 LEU  QD1    32 GLN  HG3     4.74 #SUP  0.92  #QF  0.89
 28 LEU  QD1    31 HIS  HB2     4.79 #SUP  1.00
 11 LYS  HB2    21 GLY  HA2     4.22 #SUP  0.91  #QF  0.75
 11 LYS  HB3    21 GLY  HA2     4.22 #SUP  0.91  #QF  0.75
 15 CYSS HB3    28 LEU  QD1     4.08 #SUP  0.99  #QF  0.99
 17 LYS  HD3    35 HIS  HB2     5.50 #SUP  0.98  #QF  0.82
 17 LYS  HD2    35 HIS  HB3     5.50 #SUP  0.96  #QF  0.76
 17 LYS  HD3    35 HIS  HB3     5.50 #SUP  0.96  #QF  0.76
 25 LYS  HA     28 LEU  HB3     3.49 #SUP  0.98  #QF  0.98
 25 LYS  HA     28 LEU  QD2     4.28 #SUP  0.98  #QF  0.98
 28 LEU  HA     31 HIS  HB2     3.94 #SUP  0.98  #QF  0.98
 28 LEU  HA     28 LEU  HG      4.16 #SUP  1.00
 28 LEU  HA     28 LEU  QD1     3.21 #SUP  0.99  #QF  0.99
  8 THR  HA      8 THR  QG2     4.06 #SUP  0.96  #QF  0.96
 15 CYSS HA     28 LEU  QD1     3.27 #SUP  0.97  #QF  0.97
 32 GLN  HA     32 GLN  HG2     4.21 #SUP  0.99  #QF  0.98
 32 GLN  HA     32 GLN  HG3     4.21 #SUP  0.99  #QF  0.98
 20 LYS  HA     20 LYS  HG2     3.86 #SUP  1.00  #QF  0.99
 20 LYS  HA     20 LYS  HG3     3.86 #SUP  0.91  #QF  0.91
 17 LYS  HA     17 LYS  HG2     3.89 #SUP  0.80  #QF  0.59
 29 ASP  HA     32 GLN  HG2     5.16 #SUP  0.95  #QF  0.81
 29 ASP  HA     32 GLN  HG3     5.16 #SUP  0.95  #QF  0.81
 28 LEU  HG     29 ASP  HA      4.31 #SUP  0.98  #QF  0.98
 34 VAL  HA     34 VAL  QG2     3.73 #SUP  0.99  #QF  0.99
 34 VAL  HA     34 VAL  QG1     3.73 #SUP  0.99  #QF  0.99
 31 HIS  HA     34 VAL  QG2     4.80 #SUP  0.97  #QF  0.97
 31 HIS  HB3    32 GLN  HA      5.09 #SUP  0.97  #QF  0.95
 28 LEU  HA     31 HIS  HB3     3.47 #SUP  0.98  #QF  0.98
 11 LYS  HA     12 PRO  HD3     3.30 #SUP  0.89  #QF  0.89
 36 THR  HA     36 THR  QG2     3.37 #SUP  0.99  #QF  0.63
 30 MET  HA     30 MET  QE      4.65 #SUP  0.84  #QF  0.84
 29 ASP  HA     32 GLN  HB2     3.89 #SUP  0.62  #QF  0.62
 28 LEU  HB2    28 LEU  QD2     3.78 #SUP  1.00  #QF  0.99
 28 LEU  HB2    28 LEU  QD1     3.94 #SUP  1.00  #QF  0.99
 13 TYR  QD     28 LEU  HB2     4.16 #SUP  0.80  #QF  0.80
 12 PRO  HD3    23 ASN  HA      4.25 #SUP  0.98  #QF  0.98
 11 LYS  HB2    12 PRO  HD3     5.50 #SUP  0.99  #QF  0.76
 11 LYS  HB3    12 PRO  HD3     5.50 #SUP  0.99  #QF  0.76
 11 LYS  HE2    21 GLY  HA2     5.50 #SUP  0.76  #QF  0.54
 11 LYS  HE3    21 GLY  HA2     5.50 #SUP  0.76  #QF  0.54
 13 TYR  HA     28 LEU  QD2     4.62 #SUP  0.98  #QF  0.98
 13 TYR  QE     25 LYS  HA      5.00 #SUP  0.99  #QF  0.99
 13 TYR  HB3    14 LYS  HA      5.11 #SUP  1.00  #QF  0.69
 14 LYS  HA     15 CYSS HB2     4.54 #SUP  0.95  #QF  0.95
 17 LYS  HA     17 LYS  HD2     4.64 #SUP  0.91  #QF  0.70
 17 LYS  HA     17 LYS  HD3     4.64 #SUP  0.91  #QF  0.70
 17 LYS  HB2    35 HIS  HE1     4.38 #SUP  0.65  #QF  0.65
 17 LYS  HB3    35 HIS  HE1     4.38 #SUP  0.68  #QF  0.68
 20 LYS  HA     20 LYS  HD2     5.34 #SUP  1.00
 20 LYS  HA     20 LYS  HD3     5.34 #SUP  1.00
 15 CYSS HN     21 GLY  HA1     4.76 #SUP  0.20  #QF  0.20
 22 TYR  HB2    28 LEU  HB3     5.15 #SUP  1.00
 22 TYR  HB3    24 SER  HN      4.59 #SUP  0.80  #QF  0.80
 22 TYR  HB3    28 LEU  HB3     5.15 #SUP  1.00
 25 LYS  HA     29 ASP  HN      4.75 #SUP  0.68  #QF  0.68
 13 TYR  HB2    25 LYS  HA      4.80 #SUP  0.95  #QF  0.95
 26 PHE  QD     27 ASN  HA      4.79 #SUP  0.35  #QF  0.35
 22 TYR  QE     28 LEU  HA      4.91 #SUP  1.00
 22 TYR  QD     28 LEU  HB3     5.24 #SUP  0.96  #QF  0.96
 30 MET  HA     33 LYS  HN      5.29 #SUP  0.81  #QF  0.81
 30 MET  HA     30 MET  HG3     4.23 #SUP  0.96  #QF  0.96
 30 MET  HA     33 LYS  HE2     5.50 #SUP  0.94  #QF  0.80
 30 MET  HA     33 LYS  HE3     5.50 #SUP  0.94  #QF  0.80
 31 HIS  HA     34 VAL  QG1     4.80 #SUP  0.95  #QF  0.95
 30 MET  HB2    31 HIS  HA      5.50 #SUP  0.76  #QF  0.57
 30 MET  HB3    31 HIS  HA      5.50 #SUP  0.76  #QF  0.57
 31 HIS  HA     33 LYS  HN      4.99 #SUP  0.77  #QF  0.77
 31 HIS  HA     34 VAL  HN      4.73 #SUP  0.72  #QF  0.72
 22 TYR  QD     31 HIS  HB3     5.34 #SUP  0.99  #QF  0.98
 31 HIS  HB3    33 LYS  HN      5.50 #SUP  0.99  #QF  0.98
 31 HIS  HB2    32 GLN  HN      4.66 #SUP  0.87  #QF  0.87
 31 HIS  HD2    32 GLN  HN      4.90 #SUP  0.76  #QF  0.76
 31 HIS  HB2    31 HIS  HE1     5.03 #SUP  0.67  #QF  0.67
 32 GLN  HA     34 VAL  HN      4.62 #SUP  0.64  #QF  0.64
 32 GLN  HB2    33 LYS  HA      5.44 #SUP  0.96  #QF  0.81
 32 GLN  HB3    33 LYS  HA      5.50 #SUP  0.96  #QF  0.81
 33 LYS  HN     33 LYS  HD2     5.50 #SUP  0.95  #QF  0.78
 33 LYS  HN     33 LYS  HD3     5.50 #SUP  0.95  #QF  0.78
 34 VAL  HB     35 HIS  HN      4.93 #SUP  0.98  #QF  0.98
 18 CYSS HA     35 HIS  HE1     5.07 #SUP  0.98  #QF  0.98
 36 THR  HN     36 THR  QG2     4.85 #SUP  0.98  #QF  0.98
 11 LYS  HA     11 LYS  QG      3.51 
 11 LYS  QB     12 PRO  QD      3.84 
 11 LYS  QB     21 GLY  HA1     4.68 
 11 LYS  QB     21 GLY  HA2     3.60 
 11 LYS  QB     22 TYR  HN      4.05 
 11 LYS  QG     21 GLY  HA1     4.56 
 11 LYS  QG     21 GLY  HA2     4.33 
 11 LYS  QE     21 GLY  HA2     4.80 
 12 PRO  QB     13 TYR  HN      4.05 
 12 PRO  QG     13 TYR  HN      3.69 
 12 PRO  QG     13 TYR  HB2     5.11 
 12 PRO  QG     13 TYR  QD      3.71 
 12 PRO  QG     23 ASN  HA      4.23 
 12 PRO  QD     13 TYR  HN      4.09 
 12 PRO  QD     13 TYR  QD      4.50 
 12 PRO  QD     23 ASN  HA      3.40 
 13 TYR  HB2    22 TYR  QB      4.56 
 13 TYR  HB3    22 TYR  QB      4.34 
 13 TYR  QE     25 LYS  QB      4.51 
 13 TYR  QE     25 LYS  QG      4.96 
 13 TYR  QE     25 LYS  QD      4.69 
 14 LYS  HN     14 LYS  QG      4.31 
 14 LYS  QB     15 CYSS HN      4.18 
 15 CYSS HB2    20 LYS  QB      4.55 
 15 CYSS HB3    20 LYS  QB      4.16 
 17 LYS  HN     17 LYS  QG      3.84 
 17 LYS  HA     17 LYS  QG      3.33 
 17 LYS  HA     17 LYS  QD      4.05 
 17 LYS  QB     18 CYSS HN      3.58 
 17 LYS  QB     35 HIS  QB      4.44 
 17 LYS  QB     35 HIS  HD2     4.26 
 17 LYS  QG     35 HIS  QB      4.71 
 17 LYS  QD     35 HIS  QB      4.27 
 17 LYS  QD     35 HIS  HD2     4.75 
 18 CYSS HN     19 GLY  QA      4.24 
 18 CYSS QB     35 HIS  HE1     3.15 
 20 LYS  HN     20 LYS  QB      3.30 
 20 LYS  HN     20 LYS  QG      5.12 
 20 LYS  HA     20 LYS  QG      3.36 
 20 LYS  HA     20 LYS  QD      4.57 
 20 LYS  QB     20 LYS  QE      4.76 
 20 LYS  QB     21 GLY  HN      3.54 
 20 LYS  QB     22 TYR  QD      4.45 
 20 LYS  QB     22 TYR  QE      3.71 
 20 LYS  QG     21 GLY  HN      4.36 
 22 TYR  HN     22 TYR  QB      3.54 
 22 TYR  QB     24 SER  HN      3.76 
 22 TYR  QB     27 ASN  QB      3.99 
 22 TYR  QB     28 LEU  HN      4.36 
 22 TYR  QB     28 LEU  HA      4.39 
 22 TYR  QB     28 LEU  HB2     3.58 
 22 TYR  QB     28 LEU  HB3     4.38 
 22 TYR  QB     28 LEU  QD1     4.35 
 22 TYR  QB     28 LEU  QD2     5.34 
 22 TYR  QD     27 ASN  QB      4.06 
 24 SER  HN     27 ASN  QB      3.95 
 24 SER  QB     25 LYS  HN      3.89 
 24 SER  QB     26 PHE  QB      4.22 
 24 SER  QB     27 ASN  QB      4.24 
 25 LYS  HN     25 LYS  QG      4.96 
 25 LYS  HA     25 LYS  QG      3.53 
 25 LYS  HA     25 LYS  QD      4.45 
 25 LYS  QB     25 LYS  QD      3.27 
 25 LYS  QB     25 LYS  QE      4.72 
 25 LYS  QB     26 PHE  HN      4.20 
 26 PHE  HA     29 ASP  QB      3.32 
 26 PHE  QB     27 ASN  HN      3.59 
 26 PHE  QE     30 MET  QG      5.34 
 26 PHE  HZ     30 MET  QG      4.59 
 27 ASN  HN     27 ASN  QB      3.59 
 27 ASN  HA     30 MET  QB      3.42 
 27 ASN  HA     30 MET  QG      4.57 
 27 ASN  QB     28 LEU  HN      3.74 
 28 LEU  HB3    29 ASP  QB      5.34 
 28 LEU  HG     32 GLN  QG      4.07 
 28 LEU  QD1    32 GLN  QG      3.87 
 28 LEU  QD1    32 GLN  QE2     3.98 
 29 ASP  HN     29 ASP  QB      3.35 
 29 ASP  HA     32 GLN  QG      4.45 
 29 ASP  QB     30 MET  HN      3.74 
 30 MET  HN     30 MET  QB      3.59 
 30 MET  HN     30 MET  QG      3.62 
 30 MET  HA     30 MET  QG      3.69 
 30 MET  HA     33 LYS  QG      3.87 
 30 MET  HA     33 LYS  QE      4.83 
 30 MET  QB     30 MET  QG      2.34 
 30 MET  QB     31 HIS  HN      3.95 
 31 HIS  HA     34 VAL  QQG     4.21 
 31 HIS  HD2    32 GLN  QG      4.03 
 31 HIS  HE1    34 VAL  QQG     3.71 
 32 GLN  HN     32 GLN  QG      3.53 
 32 GLN  HA     32 GLN  QG      3.44 
 32 GLN  HA     35 HIS  QB      5.28 
 32 GLN  QG     32 GLN  QE2     3.22 
 33 LYS  HN     33 LYS  QB      3.28 
 33 LYS  HN     33 LYS  QG      3.59 
 33 LYS  HA     33 LYS  QG      3.51 
 34 VAL  HN     34 VAL  QQG     3.24 
 34 VAL  HA     34 VAL  QQG     3.13 
 34 VAL  QQG    35 HIS  HN      4.20 
 34 VAL  QQG    35 HIS  HD2     5.40 
 34 VAL  QQG    35 HIS  HE1     4.72 
 35 HIS  HN     35 HIS  QB      3.50 
 35 HIS  QB     35 HIS  HD2     3.37 
 35 HIS  QB     36 THR  HA      4.91 
 39 ARG  HA     40 PRO  QD      3.16 
 39 ARG  QB     40 PRO  QD      4.26 
 39 ARG  QG     40 PRO  QD      5.18 
 42 GLY  QA     43 PRO  QD      3.17 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1   3.593 -29.824 -10.031
    2    HA2  GLY   1           1HA      GLY   1   5.384 -28.542 -10.719
    3    HA3  GLY   1           2HA      GLY   1   4.257 -27.529 -11.608
    4    H    SER   2           H        SER   2   3.068 -25.894 -10.390
    5    HA   SER   2           HA       SER   2   4.407 -25.086  -7.901
    6    HB2  SER   2           1HB      SER   2   3.757 -23.249 -10.220
    7    HB3  SER   2           2HB      SER   2   4.420 -22.745  -8.666
    8    HG   SER   2           HG       SER   2   6.081 -24.515  -9.357
    9    H    SER   3           H        SER   3   3.144 -23.918  -6.439
   10    HA   SER   3           HA       SER   3   0.441 -23.173  -7.056
   11    HB2  SER   3           1HB      SER   3  -0.614 -24.707  -5.413
   12    HB3  SER   3           2HB      SER   3   0.098 -25.569  -6.776
   13    HG   SER   3           HG       SER   3   0.742 -26.625  -4.945
   14    H    GLY   4           H        GLY   4  -0.580 -22.008  -5.350
   15    HA2  GLY   4           1HA      GLY   4   0.760 -21.609  -2.840
   16    HA3  GLY   4           2HA      GLY   4   0.971 -20.256  -3.941
   17    H    SER   5           H        SER   5  -0.150 -19.101  -2.175
   18    HA   SER   5           HA       SER   5  -2.964 -19.643  -1.814
   19    HB2  SER   5           1HB      SER   5  -1.007 -17.683  -0.688
   20    HB3  SER   5           2HB      SER   5  -2.729 -17.322  -0.569
   21    HG   SER   5           HG       SER   5  -1.229 -19.294   0.684
   22    H    SER   6           H        SER   6  -4.615 -18.737  -2.869
   23    HA   SER   6           HA       SER   6  -4.092 -17.087  -5.155
   24    HB2  SER   6           1HB      SER   6  -6.554 -17.178  -5.477
   25    HB3  SER   6           2HB      SER   6  -5.841 -18.776  -5.262
   26    HG   SER   6           HG       SER   6  -7.618 -17.406  -3.670
   27    H    GLY   7           H        GLY   7  -5.997 -16.621  -2.173
   28    HA2  GLY   7           1HA      GLY   7  -5.555 -14.479  -0.983
   29    HA3  GLY   7           2HA      GLY   7  -5.658 -13.709  -2.559
   30    H    THR   8           H        THR   8  -7.598 -15.861  -0.482
   31    HA   THR   8           HA       THR   8 -10.081 -15.512  -1.515
   32    HB   THR   8           HB       THR   8 -11.005 -15.778   0.769
   33    HG1  THR   8           HG1      THR   8  -9.803 -15.375   2.478
   34   HG21  THR   8          3HG2      THR   8 -10.558 -17.869  -0.015
   35   HG22  THR   8          1HG2      THR   8  -9.398 -17.843   1.313
   36   HG23  THR   8          2HG2      THR   8  -8.862 -17.506  -0.333
   37    H    GLY   9           H        GLY   9  -8.582 -13.353   0.899
   38    HA2  GLY   9           1HA      GLY   9 -10.719 -11.487   0.913
   39    HA3  GLY   9           2HA      GLY   9  -9.096 -11.201   1.523
   40    H    GLU  10           H        GLU  10 -10.306  -9.117   0.380
   41    HA   GLU  10           HA       GLU  10  -9.085  -8.942  -2.297
   42    HB2  GLU  10           1HB      GLU  10 -11.635  -8.765  -2.107
   43    HB3  GLU  10           2HB      GLU  10 -11.353  -7.210  -1.337
   44    HG2  GLU  10           1HG      GLU  10 -10.156  -6.450  -3.339
   45    HG3  GLU  10           2HG      GLU  10 -10.493  -7.999  -4.111
   46    H    LYS  11           H        LYS  11  -7.412  -7.617  -2.449
   47    HA   LYS  11           HA       LYS  11  -7.082  -5.526  -0.402
   48    HB2  LYS  11           1HB      LYS  11  -5.064  -7.079  -2.017
   49    HB3  LYS  11           2HB      LYS  11  -4.640  -5.623  -1.125
   50    HG2  LYS  11           1HG      LYS  11  -4.085  -7.236   0.394
   51    HG3  LYS  11           2HG      LYS  11  -5.747  -6.892   0.878
   52    HD2  LYS  11           1HD      LYS  11  -5.789  -9.187   0.806
   53    HD3  LYS  11           2HD      LYS  11  -6.307  -8.800  -0.836
   54    HE2  LYS  11           1HE      LYS  11  -4.248  -9.367  -1.751
   55    HE3  LYS  11           2HE      LYS  11  -3.406  -9.194  -0.212
   56    HZ1  LYS  11           3HZ      LYS  11  -5.469 -11.257  -0.407
   57    HZ2  LYS  11           1HZ      LYS  11  -4.016 -11.259   0.461
   58    HZ3  LYS  11           2HZ      LYS  11  -4.005 -11.540  -1.207
   59    HA   PRO  12           HA       PRO  12  -7.936  -3.226  -4.308
   60    HB2  PRO  12           1HB      PRO  12  -9.354  -1.257  -3.089
   61    HB3  PRO  12           2HB      PRO  12 -10.079  -2.785  -3.606
   62    HG2  PRO  12           1HG      PRO  12  -9.156  -1.951  -0.883
   63    HG3  PRO  12           2HG      PRO  12 -10.632  -2.817  -1.347
   64    HD2  PRO  12           1HD      PRO  12  -8.462  -4.079  -0.333
   65    HD3  PRO  12           2HD      PRO  12  -9.543  -4.841  -1.518
   66    H    TYR  13           H        TYR  13  -6.244  -2.676  -1.428
   67    HA   TYR  13           HA       TYR  13  -4.920  -0.339  -2.623
   68    HB2  TYR  13           1HB      TYR  13  -5.604  -0.640   0.308
   69    HB3  TYR  13           2HB      TYR  13  -4.721   0.700  -0.415
   70    HD1  TYR  13           HD2      TYR  13  -6.272   1.320  -2.796
   71    HD2  TYR  13           HD1      TYR  13  -7.612   0.217   1.089
   72    HE1  TYR  13           HE2      TYR  13  -8.390   2.505  -3.195
   73    HE2  TYR  13           HE1      TYR  13  -9.734   1.398   0.700
   74    HH   TYR  13           HH       TYR  13 -11.018   2.419  -0.831
   75    H    LYS  14           H        LYS  14  -2.888  -0.869  -3.028
   76    HA   LYS  14           HA       LYS  14  -1.495  -2.661  -1.148
   77    HB2  LYS  14           1HB      LYS  14  -1.793  -3.746  -3.297
   78    HB3  LYS  14           2HB      LYS  14  -1.119  -2.352  -4.131
   79    HG2  LYS  14           1HG      LYS  14   1.046  -2.809  -3.402
   80    HG3  LYS  14           2HG      LYS  14   0.484  -3.870  -2.107
   81    HD2  LYS  14           1HD      LYS  14  -0.469  -5.297  -4.070
   82    HD3  LYS  14           2HD      LYS  14   0.704  -4.405  -5.042
   83    HE2  LYS  14           1HE      LYS  14   1.608  -5.652  -2.493
   84    HE3  LYS  14           2HE      LYS  14   1.330  -6.692  -3.889
   85    HZ1  LYS  14           3HZ      LYS  14   3.653  -5.757  -3.574
   86    HZ2  LYS  14           1HZ      LYS  14   3.017  -4.271  -4.072
   87    HZ3  LYS  14           2HZ      LYS  14   2.971  -5.602  -5.114
   88    H    CYS  15           H        CYS  15   0.744  -2.259  -0.770
   89    HA   CYS  15           HA       CYS  15   1.523   0.537  -1.284
   90    HB2  CYS  15           1HB      CYS  15   1.043  -0.212   1.130
   91    HB3  CYS  15           2HB      CYS  15   2.544  -1.125   1.011
   92    H    GLU  16           H        GLU  16   2.552  -0.040  -3.252
   93    HA   GLU  16           HA       GLU  16   4.384  -2.033  -3.704
   94    HB2  GLU  16           1HB      GLU  16   4.371   0.798  -4.756
   95    HB3  GLU  16           2HB      GLU  16   5.415  -0.471  -5.382
   96    HG2  GLU  16           1HG      GLU  16   3.245  -1.784  -5.768
   97    HG3  GLU  16           2HG      GLU  16   2.438  -0.231  -5.558
   98    H    LYS  17           H        LYS  17   4.841   0.993  -1.998
   99    HA   LYS  17           HA       LYS  17   7.545   1.288  -1.890
  100    HB2  LYS  17           1HB      LYS  17   5.356   1.796   0.059
  101    HB3  LYS  17           2HB      LYS  17   7.007   1.882   0.660
  102    HG2  LYS  17           1HG      LYS  17   6.393   4.075   0.046
  103    HG3  LYS  17           2HG      LYS  17   7.492   3.493  -1.207
  104    HD2  LYS  17           1HD      LYS  17   5.785   4.488  -2.431
  105    HD3  LYS  17           2HD      LYS  17   5.333   2.782  -2.441
  106    HE2  LYS  17           1HE      LYS  17   3.661   3.110  -0.820
  107    HE3  LYS  17           2HE      LYS  17   4.292   4.692  -0.369
  108    HZ1  LYS  17           3HZ      LYS  17   2.655   5.413  -1.702
  109    HZ2  LYS  17           1HZ      LYS  17   2.537   3.956  -2.553
  110    HZ3  LYS  17           2HZ      LYS  17   3.743   5.073  -2.951
  111    H    CYS  18           H        CYS  18   5.613  -0.870   0.172
  112    HA   CYS  18           HA       CYS  18   8.106  -2.249   0.922
  113    HB2  CYS  18           1HB      CYS  18   6.680  -3.125   2.860
  114    HB3  CYS  18           2HB      CYS  18   7.151  -1.430   2.915
  115    H    GLY  19           H        GLY  19   4.649  -2.827   0.273
  116    HA2  GLY  19           1HA      GLY  19   4.176  -4.498  -1.496
  117    HA3  GLY  19           2HA      GLY  19   5.412  -5.496  -0.745
  118    H    LYS  20           H        LYS  20   2.895  -3.620   0.878
  119    HA   LYS  20           HA       LYS  20   1.737  -6.158   1.831
  120    HB2  LYS  20           1HB      LYS  20   3.035  -4.759   3.529
  121    HB3  LYS  20           2HB      LYS  20   1.736  -3.581   3.395
  122    HG2  LYS  20           1HG      LYS  20   1.127  -4.816   5.249
  123    HG3  LYS  20           2HG      LYS  20   0.184  -5.563   3.958
  124    HD2  LYS  20           1HD      LYS  20   1.524  -7.455   3.901
  125    HD3  LYS  20           2HD      LYS  20   2.892  -6.630   4.652
  126    HE2  LYS  20           1HE      LYS  20   1.275  -6.422   6.691
  127    HE3  LYS  20           2HE      LYS  20   0.427  -7.756   5.910
  128    HZ1  LYS  20           3HZ      LYS  20   2.533  -8.999   5.921
  129    HZ2  LYS  20           1HZ      LYS  20   2.003  -8.614   7.481
  130    HZ3  LYS  20           2HZ      LYS  20   3.266  -7.737   6.777
  131    H    GLY  21           H        GLY  21  -0.491  -6.312   1.971
  132    HA2  GLY  21           1HA      GLY  21  -1.944  -4.374   0.345
  133    HA3  GLY  21           2HA      GLY  21  -2.527  -5.951   0.855
  134    H    TYR  22           H        TYR  22  -4.050  -3.588   0.989
  135    HA   TYR  22           HA       TYR  22  -4.621  -3.565   3.844
  136    HB2  TYR  22           1HB      TYR  22  -3.893  -1.113   2.252
  137    HB3  TYR  22           2HB      TYR  22  -4.876  -1.012   3.708
  138    HD1  TYR  22           HD2      TYR  22  -1.541  -1.823   2.385
  139    HD2  TYR  22           HD1      TYR  22  -3.905  -1.313   5.885
  140    HE1  TYR  22           HE2      TYR  22   0.502  -1.795   3.754
  141    HE2  TYR  22           HE1      TYR  22  -1.869  -1.283   7.264
  142    HH   TYR  22           HH       TYR  22   0.379  -1.159   7.227
  143    H    ASN  23           H        ASN  23  -6.725  -3.858   4.112
  144    HA   ASN  23           HA       ASN  23  -8.529  -3.386   1.867
  145    HB2  ASN  23           1HB      ASN  23  -9.384  -4.602   4.472
  146    HB3  ASN  23           2HB      ASN  23  -9.993  -4.909   2.848
  147   HD21  ASN  23          1HD2      ASN  23  -8.380  -6.284   5.270
  148   HD22  ASN  23          2HD2      ASN  23  -7.371  -7.384   4.399
  149    H    SER  24           H        SER  24  -7.567  -1.066   3.095
  150    HA   SER  24           HA       SER  24 -10.047   0.205   3.785
  151    HB2  SER  24           1HB      SER  24  -7.921  -0.225   5.873
  152    HB3  SER  24           2HB      SER  24  -9.019   1.152   5.959
  153    HG   SER  24           HG       SER  24 -10.311  -0.216   6.890
  154    H    LYS  25           H        LYS  25  -9.957   1.972   2.582
  155    HA   LYS  25           HA       LYS  25  -7.631   3.081   1.494
  156    HB2  LYS  25           1HB      LYS  25  -9.007   4.828   0.660
  157    HB3  LYS  25           2HB      LYS  25 -10.005   3.379   0.671
  158    HG2  LYS  25           1HG      LYS  25 -10.094   5.166   3.043
  159    HG3  LYS  25           2HG      LYS  25 -10.904   5.686   1.563
  160    HD2  LYS  25           1HD      LYS  25 -12.088   3.481   1.537
  161    HD3  LYS  25           2HD      LYS  25 -11.393   3.153   3.127
  162    HE2  LYS  25           1HE      LYS  25 -12.475   5.203   3.981
  163    HE3  LYS  25           2HE      LYS  25 -13.221   5.442   2.402
  164    HZ1  LYS  25           3HZ      LYS  25 -13.839   3.469   4.470
  165    HZ2  LYS  25           1HZ      LYS  25 -14.037   3.000   2.857
  166    HZ3  LYS  25           2HZ      LYS  25 -14.881   4.336   3.458
  167    H    PHE  26           H        PHE  26  -9.049   3.458   4.594
  168    HA   PHE  26           HA       PHE  26  -7.748   5.982   5.159
  169    HB2  PHE  26           1HB      PHE  26  -9.785   5.805   6.285
  170    HB3  PHE  26           2HB      PHE  26  -9.514   4.119   6.712
  171    HD1  PHE  26           HD1      PHE  26  -7.970   3.541   8.544
  172    HD2  PHE  26           HD2      PHE  26  -9.008   7.573   7.665
  173    HE1  PHE  26           HE1      PHE  26  -7.146   4.232  10.757
  174    HE2  PHE  26           HE2      PHE  26  -8.186   8.271   9.876
  175    HZ   PHE  26           HZ       PHE  26  -7.252   6.600  11.425
  176    H    ASN  27           H        ASN  27  -7.474   2.617   6.279
  177    HA   ASN  27           HA       ASN  27  -5.365   2.927   8.049
  178    HB2  ASN  27           1HB      ASN  27  -6.666   0.843   7.794
  179    HB3  ASN  27           2HB      ASN  27  -5.892   0.560   6.237
  180   HD21  ASN  27          1HD2      ASN  27  -5.896  -0.997   8.746
  181   HD22  ASN  27          2HD2      ASN  27  -4.230  -1.230   9.141
  182    H    LEU  28           H        LEU  28  -5.257   2.283   4.559
  183    HA   LEU  28           HA       LEU  28  -2.502   2.032   4.267
  184    HB2  LEU  28           1HB      LEU  28  -3.940   1.461   2.461
  185    HB3  LEU  28           2HB      LEU  28  -4.605   3.092   2.395
  186    HG   LEU  28           HG       LEU  28  -2.140   3.750   1.800
  187   HD11  LEU  28          1HD1      LEU  28  -2.188   0.945   0.725
  188   HD12  LEU  28          2HD1      LEU  28  -1.370   1.376   2.226
  189   HD13  LEU  28          3HD1      LEU  28  -0.861   2.106   0.703
  190   HD21  LEU  28          3HD2      LEU  28  -2.756   3.005  -0.653
  191   HD22  LEU  28          1HD2      LEU  28  -3.663   4.270   0.177
  192   HD23  LEU  28          2HD2      LEU  28  -4.309   2.631   0.097
  193    H    ASP  29           H        ASP  29  -4.518   4.910   4.432
  194    HA   ASP  29           HA       ASP  29  -2.722   6.842   3.588
  195    HB2  ASP  29           1HB      ASP  29  -5.216   7.024   4.362
  196    HB3  ASP  29           2HB      ASP  29  -4.508   7.373   5.937
  197    H    MET  30           H        MET  30  -3.368   6.006   6.999
  198    HA   MET  30           HA       MET  30  -1.298   7.425   8.141
  199    HB2  MET  30           1HB      MET  30  -2.757   4.937   8.946
  200    HB3  MET  30           2HB      MET  30  -1.390   5.487   9.905
  201    HG2  MET  30           1HG      MET  30  -2.465   7.554  10.393
  202    HG3  MET  30           2HG      MET  30  -3.756   7.216   9.243
  203    HE1  MET  30           3HE      MET  30  -1.848   6.211  12.181
  204    HE2  MET  30           1HE      MET  30  -3.090   6.280  13.432
  205    HE3  MET  30           2HE      MET  30  -2.638   4.730  12.722
  206    H    HIS  31           H        HIS  31  -1.233   4.246   6.640
  207    HA   HIS  31           HA       HIS  31   1.401   3.565   7.461
  208    HB2  HIS  31           1HB      HIS  31  -0.213   1.866   6.735
  209    HB3  HIS  31           2HB      HIS  31  -0.221   2.554   5.114
  210    HD1  HIS  31           HD1      HIS  31   2.183   0.860   7.512
  211    HD2  HIS  31           HD2      HIS  31   1.656   1.510   3.442
  212    HE1  HIS  31           HE1      HIS  31   3.967  -0.501   6.377
  213    H    GLN  32           H        GLN  32   0.059   5.168   4.621
  214    HA   GLN  32           HA       GLN  32   2.303   5.200   2.987
  215    HB2  GLN  32           1HB      GLN  32  -0.000   7.103   3.311
  216    HB3  GLN  32           2HB      GLN  32   1.289   7.433   2.161
  217    HG2  GLN  32           1HG      GLN  32   0.832   5.309   1.041
  218    HG3  GLN  32           2HG      GLN  32  -0.468   4.989   2.188
  219   HE21  GLN  32          1HE2      GLN  32  -2.436   5.772   1.780
  220   HE22  GLN  32          2HE2      GLN  32  -2.829   6.846   0.486
  221    H    LYS  33           H        LYS  33   1.606   7.021   5.856
  222    HA   LYS  33           HA       LYS  33   3.702   8.961   5.403
  223    HB2  LYS  33           1HB      LYS  33   1.867   8.401   7.731
  224    HB3  LYS  33           2HB      LYS  33   3.140   9.613   7.801
  225    HG2  LYS  33           1HG      LYS  33   2.094  10.701   5.806
  226    HG3  LYS  33           2HG      LYS  33   0.745   9.576   5.983
  227    HD2  LYS  33           1HD      LYS  33   1.656  11.281   8.277
  228    HD3  LYS  33           2HD      LYS  33   0.547  11.911   7.056
  229    HE2  LYS  33           1HE      LYS  33   0.092   9.413   8.685
  230    HE3  LYS  33           2HE      LYS  33  -0.606  10.992   9.044
  231    HZ1  LYS  33           3HZ      LYS  33  -1.256  10.579   6.439
  232    HZ2  LYS  33           1HZ      LYS  33  -2.284  10.339   7.761
  233    HZ3  LYS  33           2HZ      LYS  33  -1.421   9.037   7.114
  234    H    VAL  34           H        VAL  34   4.574   6.254   5.336
  235    HA   VAL  34           HA       VAL  34   6.330   6.209   7.705
  236    HB   VAL  34           HB       VAL  34   5.126   3.882   6.212
  237   HG11  VAL  34          1HG1      VAL  34   7.480   3.413   6.599
  238   HG12  VAL  34          2HG1      VAL  34   7.303   3.844   8.301
  239   HG13  VAL  34          3HG1      VAL  34   6.473   2.427   7.658
  240   HG21  VAL  34          3HG2      VAL  34   4.014   3.360   8.192
  241   HG22  VAL  34          1HG2      VAL  34   5.094   4.353   9.172
  242   HG23  VAL  34          2HG2      VAL  34   3.906   5.119   8.117
  243    H    HIS  35           H        HIS  35   6.016   5.596   4.252
  244    HA   HIS  35           HA       HIS  35   8.881   5.141   3.986
  245    HB2  HIS  35           1HB      HIS  35   6.914   5.296   1.713
  246    HB3  HIS  35           2HB      HIS  35   8.448   4.433   1.780
  247    HD1  HIS  35           HD1      HIS  35   8.473   2.193   3.172
  248    HD2  HIS  35           HD2      HIS  35   4.719   3.878   2.595
  249    HE1  HIS  35           HE1      HIS  35   6.827   0.381   3.746
  250    H    THR  36           H        THR  36   7.966   7.734   4.867
  251    HA   THR  36           HA       THR  36   8.075   9.578   2.691
  252    HB   THR  36           HB       THR  36   8.700  10.297   5.545
  253    HG1  THR  36           HG1      THR  36   6.820   9.134   5.736
  254   HG21  THR  36          3HG2      THR  36   8.448  11.782   3.214
  255   HG22  THR  36          1HG2      THR  36   8.408  12.406   4.862
  256   HG23  THR  36          2HG2      THR  36   6.903  12.004   4.034
  257    H    GLY  37           H        GLY  37  10.404   8.611   5.207
  258    HA2  GLY  37           1HA      GLY  37  12.532  10.192   4.790
  259    HA3  GLY  37           2HA      GLY  37  12.714   8.461   5.032
  260    H    GLU  38           H        GLU  38  14.035  10.641   3.284
  261    HA   GLU  38           HA       GLU  38  13.588   9.672   0.605
  262    HB2  GLU  38           1HB      GLU  38  15.319  11.761   1.858
  263    HB3  GLU  38           2HB      GLU  38  15.729  11.176   0.251
  264    HG2  GLU  38           1HG      GLU  38  12.950  12.088   0.843
  265    HG3  GLU  38           2HG      GLU  38  14.222  13.265   0.522
  266    H    ARG  39           H        ARG  39  14.110   7.436   0.939
  267    HA   ARG  39           HA       ARG  39  16.446   6.379   1.933
  268    HB2  ARG  39           1HB      ARG  39  14.481   5.501  -0.121
  269    HB3  ARG  39           2HB      ARG  39  16.011   4.636  -0.046
  270    HG2  ARG  39           1HG      ARG  39  15.445   4.540   2.523
  271    HG3  ARG  39           2HG      ARG  39  13.797   4.757   1.930
  272    HD2  ARG  39           1HD      ARG  39  13.979   2.462   1.940
  273    HD3  ARG  39           2HD      ARG  39  14.443   2.841   0.282
  274    HE   ARG  39           HE       ARG  39  16.754   2.810   1.852
  275   HH11  ARG  39          1HH1      ARG  39  14.312   0.615   0.695
  276   HH12  ARG  39          2HH1      ARG  39  15.367  -0.759   0.684
  277   HH21  ARG  39          1HH2      ARG  39  18.153   1.009   1.842
  278   HH22  ARG  39          2HH2      ARG  39  17.552  -0.534   1.338
  279    HA   PRO  40           HA       PRO  40  19.754   7.383  -0.768
  280    HB2  PRO  40           1HB      PRO  40  21.165   5.065  -0.848
  281    HB3  PRO  40           2HB      PRO  40  21.112   6.108   0.577
  282    HG2  PRO  40           1HG      PRO  40  19.565   3.612  -0.001
  283    HG3  PRO  40           2HG      PRO  40  20.353   4.116   1.505
  284    HD2  PRO  40           1HD      PRO  40  17.689   4.374   1.099
  285    HD3  PRO  40           2HD      PRO  40  18.618   5.514   2.094
  286    H    SER  41           H        SER  41  17.401   5.162  -1.672
  287    HA   SER  41           HA       SER  41  18.594   4.570  -4.270
  288    HB2  SER  41           1HB      SER  41  17.488   2.717  -3.159
  289    HB3  SER  41           2HB      SER  41  16.003   3.655  -2.998
  290    HG   SER  41           HG       SER  41  16.364   2.066  -4.872
  291    H    GLY  42           H        GLY  42  17.690   5.200  -6.235
  292    HA2  GLY  42           1HA      GLY  42  16.504   7.778  -6.272
  293    HA3  GLY  42           2HA      GLY  42  16.752   6.736  -7.665
  294    HA   PRO  43           HA       PRO  43  12.207   6.881  -6.060
  295    HB2  PRO  43           1HB      PRO  43  11.241   9.057  -7.365
  296    HB3  PRO  43           2HB      PRO  43  11.903   9.134  -5.728
  297    HG2  PRO  43           1HG      PRO  43  13.205   9.827  -8.333
  298    HG3  PRO  43           2HG      PRO  43  13.260  10.697  -6.789
  299    HD2  PRO  43           1HD      PRO  43  15.275   9.097  -7.633
  300    HD3  PRO  43           2HD      PRO  43  14.872   9.300  -5.916
  301    H    SER  44           H        SER  44  10.225   7.323  -7.762
  302    HA   SER  44           HA       SER  44  11.028   6.185 -10.350
  303    HB2  SER  44           1HB      SER  44   8.979   4.717 -10.228
  304    HB3  SER  44           2HB      SER  44  10.260   4.290  -9.094
  305    HG   SER  44           HG       SER  44   8.888   5.901  -7.713
  306    H    SER  45           H        SER  45   8.691   7.979  -8.451
  307    HA   SER  45           HA       SER  45   7.899   9.450 -10.828
  308    HB2  SER  45           1HB      SER  45   6.290   7.576 -10.736
  309    HB3  SER  45           2HB      SER  45   5.844   8.052  -9.097
  310    HG   SER  45           HG       SER  45   4.966   9.029 -11.445
  311    H    GLY  46           H        GLY  46   7.798  11.547 -10.362
  312    HA2  GLY  46           1HA      GLY  46   6.984  12.375  -7.664
  313    HA3  GLY  46           2HA      GLY  46   8.533  12.929  -8.282
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1  16.663 -19.665  -6.695
    2    HA2  GLY   1           1HA      GLY   1  14.283 -19.729  -6.770
    3    HA3  GLY   1           2HA      GLY   1  14.761 -21.390  -6.448
    4    H    SER   2           H        SER   2  12.873 -18.841  -5.414
    5    HA   SER   2           HA       SER   2  11.908 -20.287  -3.158
    6    HB2  SER   2           1HB      SER   2  14.006 -19.267  -2.225
    7    HB3  SER   2           2HB      SER   2  13.306 -17.678  -2.535
    8    HG   SER   2           HG       SER   2  11.811 -19.539  -1.075
    9    H    SER   3           H        SER   3  10.034 -19.315  -2.209
   10    HA   SER   3           HA       SER   3   8.961 -17.002  -3.669
   11    HB2  SER   3           1HB      SER   3   7.663 -19.692  -3.280
   12    HB3  SER   3           2HB      SER   3   6.700 -18.240  -3.555
   13    HG   SER   3           HG       SER   3   7.606 -18.010  -5.545
   14    H    GLY   4           H        GLY   4   6.915 -16.169  -2.570
   15    HA2  GLY   4           1HA      GLY   4   6.242 -16.726   0.067
   16    HA3  GLY   4           2HA      GLY   4   7.546 -15.550   0.127
   17    H    SER   5           H        SER   5   4.207 -16.075  -0.470
   18    HA   SER   5           HA       SER   5   3.753 -13.455  -1.617
   19    HB2  SER   5           1HB      SER   5   2.402 -15.500  -2.227
   20    HB3  SER   5           2HB      SER   5   1.683 -15.420  -0.618
   21    HG   SER   5           HG       SER   5   0.309 -14.199  -1.694
   22    H    SER   6           H        SER   6   2.358 -11.866  -0.637
   23    HA   SER   6           HA       SER   6   2.671 -11.802   2.284
   24    HB2  SER   6           1HB      SER   6   2.119  -9.498   0.398
   25    HB3  SER   6           2HB      SER   6   2.502  -9.382   2.116
   26    HG   SER   6           HG       SER   6   4.174  -9.543   0.026
   27    H    GLY   7           H        GLY   7   0.851 -12.922   2.933
   28    HA2  GLY   7           1HA      GLY   7  -1.347 -13.176   3.543
   29    HA3  GLY   7           2HA      GLY   7  -1.535 -11.462   3.206
   30    H    THR   8           H        THR   8  -2.372 -14.581   2.265
   31    HA   THR   8           HA       THR   8  -2.839 -14.132  -0.510
   32    HB   THR   8           HB       THR   8  -4.261 -16.191  -0.361
   33    HG1  THR   8           HG1      THR   8  -5.000 -16.554   1.594
   34   HG21  THR   8          3HG2      THR   8  -1.584 -16.540   0.981
   35   HG22  THR   8          1HG2      THR   8  -1.770 -16.208  -0.740
   36   HG23  THR   8          2HG2      THR   8  -2.431 -17.691  -0.051
   37    H    GLY   9           H        GLY   9  -4.981 -14.141  -1.531
   38    HA2  GLY   9           1HA      GLY   9  -7.415 -13.860  -1.125
   39    HA3  GLY   9           2HA      GLY   9  -6.967 -12.705   0.122
   40    H    GLU  10           H        GLU  10  -8.361 -11.206  -1.005
   41    HA   GLU  10           HA       GLU  10  -6.956  -9.914  -3.243
   42    HB2  GLU  10           1HB      GLU  10  -9.892 -10.549  -3.020
   43    HB3  GLU  10           2HB      GLU  10  -9.293  -9.285  -4.086
   44    HG2  GLU  10           1HG      GLU  10  -7.849 -10.995  -5.182
   45    HG3  GLU  10           2HG      GLU  10  -8.657 -12.221  -4.207
   46    H    LYS  11           H        LYS  11  -6.500  -7.856  -2.851
   47    HA   LYS  11           HA       LYS  11  -8.128  -6.409  -0.865
   48    HB2  LYS  11           1HB      LYS  11  -5.936  -5.084  -0.502
   49    HB3  LYS  11           2HB      LYS  11  -6.089  -6.676   0.229
   50    HG2  LYS  11           1HG      LYS  11  -4.843  -7.612  -1.715
   51    HG3  LYS  11           2HG      LYS  11  -4.572  -5.958  -2.268
   52    HD2  LYS  11           1HD      LYS  11  -3.673  -5.638   0.185
   53    HD3  LYS  11           2HD      LYS  11  -3.445  -7.386   0.094
   54    HE2  LYS  11           1HE      LYS  11  -2.248  -6.925  -2.120
   55    HE3  LYS  11           2HE      LYS  11  -2.211  -5.239  -1.606
   56    HZ1  LYS  11           3HZ      LYS  11  -0.598  -7.436  -0.741
   57    HZ2  LYS  11           1HZ      LYS  11  -1.302  -6.618   0.562
   58    HZ3  LYS  11           2HZ      LYS  11  -0.347  -5.774  -0.549
   59    HA   PRO  12           HA       PRO  12  -8.900  -3.433  -4.016
   60    HB2  PRO  12           1HB      PRO  12  -9.501  -1.296  -2.453
   61    HB3  PRO  12           2HB      PRO  12 -10.596  -2.667  -2.668
   62    HG2  PRO  12           1HG      PRO  12  -8.716  -2.080  -0.414
   63    HG3  PRO  12           2HG      PRO  12 -10.385  -2.676  -0.353
   64    HD2  PRO  12           1HD      PRO  12  -8.243  -4.308  -0.066
   65    HD3  PRO  12           2HD      PRO  12  -9.760  -4.846  -0.817
   66    H    TYR  13           H        TYR  13  -6.795  -2.459  -1.327
   67    HA   TYR  13           HA       TYR  13  -5.333  -0.703  -3.183
   68    HB2  TYR  13           1HB      TYR  13  -5.304  -0.647  -0.159
   69    HB3  TYR  13           2HB      TYR  13  -4.545   0.518  -1.238
   70    HD1  TYR  13           HD2      TYR  13  -6.467   1.288  -3.144
   71    HD2  TYR  13           HD1      TYR  13  -7.116   0.257   0.933
   72    HE1  TYR  13           HE2      TYR  13  -8.521   2.641  -3.135
   73    HE2  TYR  13           HE1      TYR  13  -9.172   1.606   0.953
   74    HH   TYR  13           HH       TYR  13 -10.882   2.382  -0.995
   75    H    LYS  14           H        LYS  14  -2.939  -0.432  -2.303
   76    HA   LYS  14           HA       LYS  14  -1.664  -2.669  -1.146
   77    HB2  LYS  14           1HB      LYS  14  -0.552  -3.610  -3.098
   78    HB3  LYS  14           2HB      LYS  14  -2.298  -3.743  -3.268
   79    HG2  LYS  14           1HG      LYS  14  -2.220  -1.667  -4.674
   80    HG3  LYS  14           2HG      LYS  14  -0.460  -1.802  -4.643
   81    HD2  LYS  14           1HD      LYS  14  -0.462  -3.760  -5.891
   82    HD3  LYS  14           2HD      LYS  14  -2.140  -4.132  -5.487
   83    HE2  LYS  14           1HE      LYS  14  -1.553  -1.653  -7.030
   84    HE3  LYS  14           2HE      LYS  14  -1.472  -3.205  -7.863
   85    HZ1  LYS  14           3HZ      LYS  14  -3.794  -3.433  -6.571
   86    HZ2  LYS  14           1HZ      LYS  14  -3.654  -2.844  -8.150
   87    HZ3  LYS  14           2HZ      LYS  14  -3.775  -1.766  -6.853
   88    H    CYS  15           H        CYS  15   0.113  -1.860  -0.262
   89    HA   CYS  15           HA       CYS  15   1.092   0.720  -0.915
   90    HB2  CYS  15           1HB      CYS  15   1.208  -0.513   1.338
   91    HB3  CYS  15           2HB      CYS  15   2.616  -1.335   0.675
   92    H    GLU  16           H        GLU  16   2.142   1.147  -2.742
   93    HA   GLU  16           HA       GLU  16   3.741  -0.870  -4.062
   94    HB2  GLU  16           1HB      GLU  16   4.021   0.800  -5.826
   95    HB3  GLU  16           2HB      GLU  16   2.327   0.628  -5.388
   96    HG2  GLU  16           1HG      GLU  16   2.494   2.895  -5.506
   97    HG3  GLU  16           2HG      GLU  16   2.854   2.642  -3.799
   98    H    LYS  17           H        LYS  17   4.684  -0.072  -1.490
   99    HA   LYS  17           HA       LYS  17   7.280   1.085  -2.259
  100    HB2  LYS  17           1HB      LYS  17   5.633   1.655   0.203
  101    HB3  LYS  17           2HB      LYS  17   7.350   2.025   0.105
  102    HG2  LYS  17           1HG      LYS  17   6.900   3.474  -1.836
  103    HG3  LYS  17           2HG      LYS  17   5.175   3.146  -1.651
  104    HD2  LYS  17           1HD      LYS  17   5.291   4.081   0.642
  105    HD3  LYS  17           2HD      LYS  17   6.982   4.498   0.353
  106    HE2  LYS  17           1HE      LYS  17   6.433   6.106  -1.248
  107    HE3  LYS  17           2HE      LYS  17   4.817   5.446  -1.491
  108    HZ1  LYS  17           3HZ      LYS  17   4.012   6.494   0.340
  109    HZ2  LYS  17           1HZ      LYS  17   5.227   7.599  -0.064
  110    HZ3  LYS  17           2HZ      LYS  17   5.488   6.468   1.166
  111    H    CYS  18           H        CYS  18   5.508  -1.013  -0.037
  112    HA   CYS  18           HA       CYS  18   8.020  -2.472   0.462
  113    HB2  CYS  18           1HB      CYS  18   7.042  -3.136   2.654
  114    HB3  CYS  18           2HB      CYS  18   7.316  -1.403   2.512
  115    H    GLY  19           H        GLY  19   4.484  -2.780   0.254
  116    HA2  GLY  19           1HA      GLY  19   3.667  -4.487  -1.337
  117    HA3  GLY  19           2HA      GLY  19   4.897  -5.555  -0.677
  118    H    LYS  20           H        LYS  20   2.638  -3.395   1.002
  119    HA   LYS  20           HA       LYS  20   1.713  -5.710   2.552
  120    HB2  LYS  20           1HB      LYS  20   1.955  -2.792   3.106
  121    HB3  LYS  20           2HB      LYS  20   0.671  -3.677   3.919
  122    HG2  LYS  20           1HG      LYS  20   3.482  -4.692   3.986
  123    HG3  LYS  20           2HG      LYS  20   2.960  -3.410   5.082
  124    HD2  LYS  20           1HD      LYS  20   1.361  -4.797   6.109
  125    HD3  LYS  20           2HD      LYS  20   1.443  -5.991   4.812
  126    HE2  LYS  20           1HE      LYS  20   2.594  -6.806   6.788
  127    HE3  LYS  20           2HE      LYS  20   3.741  -6.536   5.477
  128    HZ1  LYS  20           3HZ      LYS  20   4.877  -5.430   7.038
  129    HZ2  LYS  20           1HZ      LYS  20   3.532  -5.225   8.043
  130    HZ3  LYS  20           2HZ      LYS  20   3.785  -4.173   6.743
  131    H    GLY  21           H        GLY  21  -0.650  -5.403   3.357
  132    HA2  GLY  21           1HA      GLY  21  -2.318  -4.483   1.101
  133    HA3  GLY  21           2HA      GLY  21  -2.583  -6.051   1.850
  134    H    TYR  22           H        TYR  22  -3.996  -3.242   1.634
  135    HA   TYR  22           HA       TYR  22  -5.071  -3.380   4.355
  136    HB2  TYR  22           1HB      TYR  22  -4.361  -0.766   3.012
  137    HB3  TYR  22           2HB      TYR  22  -5.011  -0.980   4.634
  138    HD1  TYR  22           HD1      TYR  22  -3.578  -2.167   6.358
  139    HD2  TYR  22           HD2      TYR  22  -2.042  -0.812   2.629
  140    HE1  TYR  22           HE1      TYR  22  -1.294  -2.280   7.264
  141    HE2  TYR  22           HE2      TYR  22   0.246  -0.922   3.524
  142    HH   TYR  22           HH       TYR  22   0.893  -1.365   6.863
  143    H    ASN  23           H        ASN  23  -7.212  -3.503   4.323
  144    HA   ASN  23           HA       ASN  23  -8.665  -3.220   1.873
  145    HB2  ASN  23           1HB      ASN  23  -9.710  -3.649   4.681
  146    HB3  ASN  23           2HB      ASN  23 -10.615  -3.885   3.188
  147   HD21  ASN  23          1HD2      ASN  23  -8.428  -5.236   5.422
  148   HD22  ASN  23          2HD2      ASN  23  -8.201  -6.757   4.634
  149    H    SER  24           H        SER  24  -8.441  -1.390   4.890
  150    HA   SER  24           HA       SER  24 -10.332   0.595   3.931
  151    HB2  SER  24           1HB      SER  24  -8.935   0.061   6.517
  152    HB3  SER  24           2HB      SER  24  -9.515   1.696   6.199
  153    HG   SER  24           HG       SER  24 -11.330   0.904   6.922
  154    H    LYS  25           H        LYS  25  -9.773   2.340   2.822
  155    HA   LYS  25           HA       LYS  25  -7.190   2.893   1.955
  156    HB2  LYS  25           1HB      LYS  25  -8.111   5.127   1.296
  157    HB3  LYS  25           2HB      LYS  25  -9.063   3.758   0.738
  158    HG2  LYS  25           1HG      LYS  25 -10.716   5.133   1.496
  159    HG3  LYS  25           2HG      LYS  25 -10.400   4.188   2.953
  160    HD2  LYS  25           1HD      LYS  25 -10.359   6.299   3.834
  161    HD3  LYS  25           2HD      LYS  25  -8.656   6.116   3.407
  162    HE2  LYS  25           1HE      LYS  25 -10.595   7.279   1.446
  163    HE3  LYS  25           2HE      LYS  25  -9.922   8.280   2.731
  164    HZ1  LYS  25           3HZ      LYS  25  -7.729   7.084   1.743
  165    HZ2  LYS  25           1HZ      LYS  25  -8.277   8.615   1.275
  166    HZ3  LYS  25           2HZ      LYS  25  -8.664   7.257   0.344
  167    H    PHE  26           H        PHE  26  -8.930   4.043   4.776
  168    HA   PHE  26           HA       PHE  26  -7.297   6.173   5.518
  169    HB2  PHE  26           1HB      PHE  26  -9.484   5.569   6.572
  170    HB3  PHE  26           2HB      PHE  26  -8.670   4.245   7.399
  171    HD1  PHE  26           HD2      PHE  26  -8.742   7.928   7.044
  172    HD2  PHE  26           HD1      PHE  26  -7.510   4.604   9.399
  173    HE1  PHE  26           HE2      PHE  26  -8.126   9.455   8.871
  174    HE2  PHE  26           HE1      PHE  26  -6.893   6.126  11.231
  175    HZ   PHE  26           HZ       PHE  26  -7.199   8.556  10.968
  176    H    ASN  27           H        ASN  27  -6.986   2.717   6.219
  177    HA   ASN  27           HA       ASN  27  -4.814   2.855   7.973
  178    HB2  ASN  27           1HB      ASN  27  -5.815   0.724   6.103
  179    HB3  ASN  27           2HB      ASN  27  -4.345   0.480   7.042
  180   HD21  ASN  27          1HD2      ASN  27  -4.576   0.901   9.412
  181   HD22  ASN  27          2HD2      ASN  27  -6.031   0.358  10.170
  182    H    LEU  28           H        LEU  28  -4.829   2.321   4.451
  183    HA   LEU  28           HA       LEU  28  -2.030   2.276   4.151
  184    HB2  LEU  28           1HB      LEU  28  -3.564   1.403   2.468
  185    HB3  LEU  28           2HB      LEU  28  -4.166   3.031   2.161
  186    HG   LEU  28           HG       LEU  28  -1.625   3.479   1.582
  187   HD11  LEU  28          1HD1      LEU  28  -0.697   1.497   0.397
  188   HD12  LEU  28          2HD1      LEU  28  -1.963   0.519   1.138
  189   HD13  LEU  28          3HD1      LEU  28  -0.763   1.322   2.151
  190   HD21  LEU  28          3HD2      LEU  28  -3.146   1.966  -0.486
  191   HD22  LEU  28          1HD2      LEU  28  -2.248   3.478  -0.626
  192   HD23  LEU  28          2HD2      LEU  28  -3.828   3.459   0.159
  193    H    ASP  29           H        ASP  29  -4.300   4.875   3.236
  194    HA   ASP  29           HA       ASP  29  -2.680   6.872   2.508
  195    HB2  ASP  29           1HB      ASP  29  -4.937   7.445   2.572
  196    HB3  ASP  29           2HB      ASP  29  -5.125   6.922   4.243
  197    H    MET  30           H        MET  30  -3.154   5.814   5.844
  198    HA   MET  30           HA       MET  30  -1.412   7.839   6.918
  199    HB2  MET  30           1HB      MET  30  -2.730   5.405   8.117
  200    HB3  MET  30           2HB      MET  30  -1.655   6.451   9.035
  201    HG2  MET  30           1HG      MET  30  -3.225   8.350   8.291
  202    HG3  MET  30           2HG      MET  30  -4.355   7.054   7.905
  203    HE1  MET  30           3HE      MET  30  -2.375   8.918  10.726
  204    HE2  MET  30           1HE      MET  30  -3.917   9.638  10.263
  205    HE3  MET  30           2HE      MET  30  -3.708   8.968  11.881
  206    H    HIS  31           H        HIS  31  -1.229   4.281   6.704
  207    HA   HIS  31           HA       HIS  31   1.284   3.842   7.660
  208    HB2  HIS  31           1HB      HIS  31   0.013   1.948   7.047
  209    HB3  HIS  31           2HB      HIS  31  -0.193   2.518   5.394
  210    HD1  HIS  31           HD1      HIS  31   2.407   1.003   7.668
  211    HD2  HIS  31           HD2      HIS  31   1.769   1.737   3.628
  212    HE1  HIS  31           HE1      HIS  31   4.245  -0.220   6.464
  213    H    GLN  32           H        GLN  32   0.433   5.517   4.782
  214    HA   GLN  32           HA       GLN  32   2.721   5.194   3.226
  215    HB2  GLN  32           1HB      GLN  32   0.730   7.423   3.507
  216    HB3  GLN  32           2HB      GLN  32   2.121   7.597   2.446
  217    HG2  GLN  32           1HG      GLN  32   1.393   5.475   1.318
  218    HG3  GLN  32           2HG      GLN  32  -0.095   5.580   2.257
  219   HE21  GLN  32          1HE2      GLN  32  -1.469   5.905   0.573
  220   HE22  GLN  32          2HE2      GLN  32  -1.457   7.321  -0.415
  221    H    LYS  33           H        LYS  33   2.060   7.448   5.868
  222    HA   LYS  33           HA       LYS  33   4.371   9.008   5.663
  223    HB2  LYS  33           1HB      LYS  33   3.865   9.820   7.810
  224    HB3  LYS  33           2HB      LYS  33   2.305   9.385   7.126
  225    HG2  LYS  33           1HG      LYS  33   2.130   7.464   8.457
  226    HG3  LYS  33           2HG      LYS  33   3.843   7.502   8.882
  227    HD2  LYS  33           1HD      LYS  33   3.564   9.243  10.385
  228    HD3  LYS  33           2HD      LYS  33   2.065   9.788   9.629
  229    HE2  LYS  33           1HE      LYS  33   0.792   8.235  10.718
  230    HE3  LYS  33           2HE      LYS  33   2.111   7.071  10.828
  231    HZ1  LYS  33           3HZ      LYS  33   1.213   8.712  12.829
  232    HZ2  LYS  33           1HZ      LYS  33   2.662   9.429  12.329
  233    HZ3  LYS  33           2HZ      LYS  33   2.647   7.815  12.834
  234    H    VAL  34           H        VAL  34   4.012   5.750   6.549
  235    HA   VAL  34           HA       VAL  34   6.096   5.422   8.403
  236    HB   VAL  34           HB       VAL  34   5.111   3.442   6.343
  237   HG11  VAL  34          1HG1      VAL  34   5.939   1.787   8.078
  238   HG12  VAL  34          2HG1      VAL  34   7.176   2.641   7.155
  239   HG13  VAL  34          3HG1      VAL  34   6.807   3.137   8.807
  240   HG21  VAL  34          3HG2      VAL  34   3.444   4.477   8.006
  241   HG22  VAL  34          1HG2      VAL  34   3.512   2.719   7.880
  242   HG23  VAL  34          2HG2      VAL  34   4.299   3.538   9.229
  243    H    HIS  35           H        HIS  35   6.077   5.280   4.862
  244    HA   HIS  35           HA       HIS  35   8.953   4.850   4.798
  245    HB2  HIS  35           1HB      HIS  35   7.152   5.299   2.422
  246    HB3  HIS  35           2HB      HIS  35   8.716   4.490   2.462
  247    HD1  HIS  35           HD1      HIS  35   8.738   2.109   3.697
  248    HD2  HIS  35           HD2      HIS  35   4.994   3.660   2.780
  249    HE1  HIS  35           HE1      HIS  35   7.147   0.167   3.859
  250    H    THR  36           H        THR  36   9.508   6.881   5.805
  251    HA   THR  36           HA       THR  36   9.584   9.070   3.849
  252    HB   THR  36           HB       THR  36   7.821   9.656   5.426
  253    HG1  THR  36           HG1      THR  36   8.753  11.522   4.958
  254   HG21  THR  36          3HG2      THR  36   8.114   9.786   7.759
  255   HG22  THR  36          1HG2      THR  36   9.866   9.634   7.632
  256   HG23  THR  36          2HG2      THR  36   8.833   8.243   7.300
  257    H    GLY  37           H        GLY  37  11.657   9.413   3.398
  258    HA2  GLY  37           1HA      GLY  37  13.729   8.698   5.295
  259    HA3  GLY  37           2HA      GLY  37  13.969   9.279   3.653
  260    H    GLU  38           H        GLU  38  12.736  11.678   3.613
  261    HA   GLU  38           HA       GLU  38  13.884  13.205   5.844
  262    HB2  GLU  38           1HB      GLU  38  14.331  13.672   2.900
  263    HB3  GLU  38           2HB      GLU  38  14.591  14.927   4.103
  264    HG2  GLU  38           1HG      GLU  38  16.703  14.076   3.865
  265    HG3  GLU  38           2HG      GLU  38  16.107  13.149   5.240
  266    H    ARG  39           H        ARG  39  12.228  14.205   6.771
  267    HA   ARG  39           HA       ARG  39  10.256  15.538   5.039
  268    HB2  ARG  39           1HB      ARG  39   9.248  13.534   6.033
  269    HB3  ARG  39           2HB      ARG  39   9.695  14.098   7.638
  270    HG2  ARG  39           1HG      ARG  39   8.091  15.758   7.647
  271    HG3  ARG  39           2HG      ARG  39   7.976  15.798   5.887
  272    HD2  ARG  39           1HD      ARG  39   6.947  13.546   5.950
  273    HD3  ARG  39           2HD      ARG  39   6.978  13.615   7.712
  274    HE   ARG  39           HE       ARG  39   5.076  14.843   5.995
  275   HH11  ARG  39          1HH1      ARG  39   6.786  15.266   8.998
  276   HH12  ARG  39          2HH1      ARG  39   5.561  16.267   9.705
  277   HH21  ARG  39          1HH2      ARG  39   3.457  16.160   6.915
  278   HH22  ARG  39          2HH2      ARG  39   3.668  16.774   8.520
  279    HA   PRO  40           HA       PRO  40  12.210  18.642   7.843
  280    HB2  PRO  40           1HB      PRO  40  12.318  20.595   5.960
  281    HB3  PRO  40           2HB      PRO  40  13.574  19.364   6.140
  282    HG2  PRO  40           1HG      PRO  40  11.302  19.481   4.194
  283    HG3  PRO  40           2HG      PRO  40  12.993  19.027   3.914
  284    HD2  PRO  40           1HD      PRO  40  11.021  17.194   4.198
  285    HD3  PRO  40           2HD      PRO  40  12.688  16.893   4.731
  286    H    SER  41           H        SER  41  10.941  19.806   9.136
  287    HA   SER  41           HA       SER  41   8.514  21.033   8.007
  288    HB2  SER  41           1HB      SER  41   7.685  19.205   9.266
  289    HB3  SER  41           2HB      SER  41   8.830  19.486  10.577
  290    HG   SER  41           HG       SER  41   6.988  21.493   9.910
  291    H    GLY  42           H        GLY  42  10.984  21.132  10.534
  292    HA2  GLY  42           1HA      GLY  42  11.665  22.848  11.921
  293    HA3  GLY  42           2HA      GLY  42  11.609  23.772  10.427
  294    HA   PRO  43           HA       PRO  43   7.427  24.466  12.809
  295    HB2  PRO  43           1HB      PRO  43   7.517  23.886  15.460
  296    HB3  PRO  43           2HB      PRO  43   7.005  22.716  14.237
  297    HG2  PRO  43           1HG      PRO  43   9.661  23.006  15.587
  298    HG3  PRO  43           2HG      PRO  43   8.742  21.532  15.230
  299    HD2  PRO  43           1HD      PRO  43  10.824  22.356  13.707
  300    HD3  PRO  43           2HD      PRO  43   9.434  21.484  13.032
  301    H    SER  44           H        SER  44   6.820  26.062  14.593
  302    HA   SER  44           HA       SER  44   8.501  28.295  14.458
  303    HB2  SER  44           1HB      SER  44   6.982  29.333  16.064
  304    HB3  SER  44           2HB      SER  44   6.062  28.420  14.868
  305    HG   SER  44           HG       SER  44   5.265  27.332  16.464
  306    H    SER  45           H        SER  45   7.921  26.026  17.131
  307    HA   SER  45           HA       SER  45  10.540  26.756  18.227
  308    HB2  SER  45           1HB      SER  45   8.000  26.566  19.866
  309    HB3  SER  45           2HB      SER  45   9.622  26.814  20.513
  310    HG   SER  45           HG       SER  45   9.501  28.696  18.863
  311    H    GLY  46           H        GLY  46  11.362  25.158  19.789
  312    HA2  GLY  46           1HA      GLY  46  11.493  22.612  18.862
  313    HA3  GLY  46           2HA      GLY  46  11.694  23.007  20.563
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1  -3.663 -28.503  -1.164
    2    HA2  GLY   1           1HA      GLY   1  -3.214 -25.887   0.034
    3    HA3  GLY   1           2HA      GLY   1  -1.824 -26.620  -0.752
    4    H    SER   2           H        SER   2  -5.280 -26.470  -1.600
    5    HA   SER   2           HA       SER   2  -5.102 -26.399  -4.299
    6    HB2  SER   2           1HB      SER   2  -7.254 -26.403  -3.190
    7    HB3  SER   2           2HB      SER   2  -6.978 -24.777  -2.563
    8    HG   SER   2           HG       SER   2  -8.025 -24.249  -4.323
    9    H    SER   3           H        SER   3  -5.298 -24.621  -5.865
   10    HA   SER   3           HA       SER   3  -3.178 -22.994  -6.065
   11    HB2  SER   3           1HB      SER   3  -6.004 -22.379  -6.951
   12    HB3  SER   3           2HB      SER   3  -4.595 -21.452  -7.466
   13    HG   SER   3           HG       SER   3  -4.595 -24.241  -7.770
   14    H    GLY   4           H        GLY   4  -6.264 -21.964  -4.601
   15    HA2  GLY   4           1HA      GLY   4  -5.291 -20.650  -2.413
   16    HA3  GLY   4           2HA      GLY   4  -5.162 -19.466  -3.706
   17    H    SER   5           H        SER   5  -7.042 -20.354  -1.223
   18    HA   SER   5           HA       SER   5  -9.616 -19.966  -2.526
   19    HB2  SER   5           1HB      SER   5  -9.025 -20.344   0.418
   20    HB3  SER   5           2HB      SER   5 -10.595 -20.485  -0.373
   21    HG   SER   5           HG       SER   5  -8.364 -22.201  -0.540
   22    H    SER   6           H        SER   6  -9.362 -17.803  -3.220
   23    HA   SER   6           HA       SER   6 -10.041 -15.865  -1.174
   24    HB2  SER   6           1HB      SER   6  -7.471 -15.778  -2.724
   25    HB3  SER   6           2HB      SER   6  -8.250 -14.279  -2.219
   26    HG   SER   6           HG       SER   6  -7.471 -16.415  -0.518
   27    H    GLY   7           H        GLY   7 -11.600 -14.586  -1.920
   28    HA2  GLY   7           1HA      GLY   7 -12.414 -14.742  -4.667
   29    HA3  GLY   7           2HA      GLY   7 -13.168 -13.774  -3.409
   30    H    THR   8           H        THR   8 -12.612 -13.025  -6.153
   31    HA   THR   8           HA       THR   8 -10.347 -11.329  -6.289
   32    HB   THR   8           HB       THR   8 -12.895 -11.163  -7.910
   33    HG1  THR   8           HG1      THR   8 -10.471 -12.437  -8.660
   34   HG21  THR   8          3HG2      THR   8 -10.512  -9.564  -7.868
   35   HG22  THR   8          1HG2      THR   8 -11.956  -9.381  -8.863
   36   HG23  THR   8          2HG2      THR   8 -10.634 -10.413  -9.409
   37    H    GLY   9           H        GLY   9 -10.292  -9.970  -4.502
   38    HA2  GLY   9           1HA      GLY   9 -10.916  -7.468  -4.435
   39    HA3  GLY   9           2HA      GLY   9 -12.540  -8.094  -4.193
   40    H    GLU  10           H        GLU  10  -9.281  -8.670  -2.854
   41    HA   GLU  10           HA       GLU  10 -10.510  -8.694  -0.177
   42    HB2  GLU  10           1HB      GLU  10  -9.314 -10.788  -1.091
   43    HB3  GLU  10           2HB      GLU  10  -7.828  -9.885  -0.833
   44    HG2  GLU  10           1HG      GLU  10  -8.666 -11.494   0.998
   45    HG3  GLU  10           2HG      GLU  10  -8.046  -9.910   1.458
   46    H    LYS  11           H        LYS  11  -7.539  -7.781  -1.910
   47    HA   LYS  11           HA       LYS  11  -7.160  -5.630   0.069
   48    HB2  LYS  11           1HB      LYS  11  -5.025  -7.137  -1.453
   49    HB3  LYS  11           2HB      LYS  11  -4.740  -5.811  -0.333
   50    HG2  LYS  11           1HG      LYS  11  -6.207  -8.231   0.607
   51    HG3  LYS  11           2HG      LYS  11  -4.450  -8.281   0.440
   52    HD2  LYS  11           1HD      LYS  11  -4.179  -6.478   1.981
   53    HD3  LYS  11           2HD      LYS  11  -5.915  -6.158   2.000
   54    HE2  LYS  11           1HE      LYS  11  -5.330  -7.329   4.010
   55    HE3  LYS  11           2HE      LYS  11  -6.262  -8.414   2.980
   56    HZ1  LYS  11           3HZ      LYS  11  -4.593  -9.848   2.993
   57    HZ2  LYS  11           1HZ      LYS  11  -3.748  -8.855   4.070
   58    HZ3  LYS  11           2HZ      LYS  11  -3.516  -8.685   2.403
   59    HA   PRO  12           HA       PRO  12  -7.851  -3.673  -4.061
   60    HB2  PRO  12           1HB      PRO  12  -9.363  -1.639  -3.088
   61    HB3  PRO  12           2HB      PRO  12 -10.037  -3.215  -3.521
   62    HG2  PRO  12           1HG      PRO  12  -9.285  -2.152  -0.825
   63    HG3  PRO  12           2HG      PRO  12 -10.720  -3.077  -1.302
   64    HD2  PRO  12           1HD      PRO  12  -8.597  -4.217  -0.068
   65    HD3  PRO  12           2HD      PRO  12  -9.597  -5.089  -1.247
   66    H    TYR  13           H        TYR  13  -6.734  -2.526  -0.962
   67    HA   TYR  13           HA       TYR  13  -5.299  -0.329  -2.301
   68    HB2  TYR  13           1HB      TYR  13  -6.230  -0.620   0.557
   69    HB3  TYR  13           2HB      TYR  13  -5.111   0.634   0.033
   70    HD1  TYR  13           HD2      TYR  13  -5.873   2.409  -1.506
   71    HD2  TYR  13           HD1      TYR  13  -8.571  -0.478   0.072
   72    HE1  TYR  13           HE2      TYR  13  -7.769   3.839  -2.147
   73    HE2  TYR  13           HE1      TYR  13 -10.474   0.943  -0.566
   74    HH   TYR  13           HH       TYR  13 -11.086   2.991  -1.281
   75    H    LYS  14           H        LYS  14  -3.487  -1.471  -2.932
   76    HA   LYS  14           HA       LYS  14  -1.891  -2.707  -0.792
   77    HB2  LYS  14           1HB      LYS  14  -0.770  -3.987  -2.482
   78    HB3  LYS  14           2HB      LYS  14  -2.501  -4.131  -2.756
   79    HG2  LYS  14           1HG      LYS  14  -2.138  -2.159  -4.407
   80    HG3  LYS  14           2HG      LYS  14  -0.448  -2.667  -4.351
   81    HD2  LYS  14           1HD      LYS  14  -1.079  -4.909  -5.054
   82    HD3  LYS  14           2HD      LYS  14  -2.783  -4.450  -5.046
   83    HE2  LYS  14           1HE      LYS  14  -1.946  -4.409  -7.310
   84    HE3  LYS  14           2HE      LYS  14  -2.303  -2.765  -6.784
   85    HZ1  LYS  14           3HZ      LYS  14   0.122  -3.798  -7.740
   86    HZ2  LYS  14           1HZ      LYS  14   0.356  -3.314  -6.136
   87    HZ3  LYS  14           2HZ      LYS  14  -0.232  -2.211  -7.275
   88    H    CYS  15           H        CYS  15   0.474  -2.424  -0.949
   89    HA   CYS  15           HA       CYS  15   1.147   0.271  -1.934
   90    HB2  CYS  15           1HB      CYS  15   1.144  -0.010   0.557
   91    HB3  CYS  15           2HB      CYS  15   2.436  -1.193   0.377
   92    H    GLU  16           H        GLU  16   3.180   0.601  -2.882
   93    HA   GLU  16           HA       GLU  16   4.400  -1.853  -3.941
   94    HB2  GLU  16           1HB      GLU  16   4.329   0.980  -4.967
   95    HB3  GLU  16           2HB      GLU  16   5.414  -0.233  -5.631
   96    HG2  GLU  16           1HG      GLU  16   2.407  -0.325  -5.607
   97    HG3  GLU  16           2HG      GLU  16   3.450  -0.061  -7.003
   98    H    LYS  17           H        LYS  17   5.066   1.099  -2.193
   99    HA   LYS  17           HA       LYS  17   7.836   1.174  -2.291
  100    HB2  LYS  17           1HB      LYS  17   5.782   2.103  -0.350
  101    HB3  LYS  17           2HB      LYS  17   7.453   2.069   0.196
  102    HG2  LYS  17           1HG      LYS  17   8.127   3.577  -1.518
  103    HG3  LYS  17           2HG      LYS  17   6.554   3.464  -2.313
  104    HD2  LYS  17           1HD      LYS  17   6.627   4.361   0.521
  105    HD3  LYS  17           2HD      LYS  17   7.178   5.489  -0.719
  106    HE2  LYS  17           1HE      LYS  17   4.963   6.020  -0.701
  107    HE3  LYS  17           2HE      LYS  17   4.931   4.720  -1.891
  108    HZ1  LYS  17           3HZ      LYS  17   4.639   3.397   0.443
  109    HZ2  LYS  17           1HZ      LYS  17   3.369   3.852  -0.578
  110    HZ3  LYS  17           2HZ      LYS  17   3.780   4.822   0.744
  111    H    CYS  18           H        CYS  18   5.727  -0.639  -0.093
  112    HA   CYS  18           HA       CYS  18   8.093  -2.089   0.888
  113    HB2  CYS  18           1HB      CYS  18   6.541  -2.798   2.762
  114    HB3  CYS  18           2HB      CYS  18   6.959  -1.089   2.724
  115    H    GLY  19           H        GLY  19   4.734  -2.544  -0.179
  116    HA2  GLY  19           1HA      GLY  19   4.223  -4.276  -1.783
  117    HA3  GLY  19           2HA      GLY  19   5.497  -5.250  -1.064
  118    H    LYS  20           H        LYS  20   2.971  -3.445   0.624
  119    HA   LYS  20           HA       LYS  20   2.000  -6.005   1.710
  120    HB2  LYS  20           1HB      LYS  20   2.341  -3.290   2.899
  121    HB3  LYS  20           2HB      LYS  20   1.024  -4.295   3.489
  122    HG2  LYS  20           1HG      LYS  20   2.784  -4.741   4.943
  123    HG3  LYS  20           2HG      LYS  20   2.798  -6.106   3.824
  124    HD2  LYS  20           1HD      LYS  20   4.542  -4.862   2.501
  125    HD3  LYS  20           2HD      LYS  20   4.624  -3.709   3.835
  126    HE2  LYS  20           1HE      LYS  20   6.347  -5.190   4.314
  127    HE3  LYS  20           2HE      LYS  20   5.021  -5.789   5.309
  128    HZ1  LYS  20           3HZ      LYS  20   5.823  -7.692   4.315
  129    HZ2  LYS  20           1HZ      LYS  20   6.141  -6.933   2.837
  130    HZ3  LYS  20           2HZ      LYS  20   4.547  -7.282   3.283
  131    H    GLY  21           H        GLY  21  -0.369  -5.718   2.569
  132    HA2  GLY  21           1HA      GLY  21  -1.930  -4.346   0.468
  133    HA3  GLY  21           2HA      GLY  21  -2.335  -5.961   1.030
  134    H    TYR  22           H        TYR  22  -4.141  -3.815   1.048
  135    HA   TYR  22           HA       TYR  22  -4.784  -3.762   3.881
  136    HB2  TYR  22           1HB      TYR  22  -4.431  -1.238   2.253
  137    HB3  TYR  22           2HB      TYR  22  -5.216  -1.299   3.827
  138    HD1  TYR  22           HD1      TYR  22  -3.814  -2.236   5.788
  139    HD2  TYR  22           HD2      TYR  22  -2.130  -0.909   2.113
  140    HE1  TYR  22           HE1      TYR  22  -1.632  -1.967   6.892
  141    HE2  TYR  22           HE2      TYR  22   0.057  -0.637   3.206
  142    HH   TYR  22           HH       TYR  22   1.160  -0.655   5.147
  143    H    ASN  23           H        ASN  23  -6.958  -3.647   4.289
  144    HA   ASN  23           HA       ASN  23  -8.698  -4.137   2.039
  145    HB2  ASN  23           1HB      ASN  23 -10.439  -4.215   3.990
  146    HB3  ASN  23           2HB      ASN  23  -9.257  -5.510   3.827
  147   HD21  ASN  23          1HD2      ASN  23  -9.679  -5.910   6.074
  148   HD22  ASN  23          2HD2      ASN  23  -8.877  -4.967   7.279
  149    H    SER  24           H        SER  24  -8.343  -1.651   4.539
  150    HA   SER  24           HA       SER  24 -10.342  -0.005   3.160
  151    HB2  SER  24           1HB      SER  24  -9.255  -0.058   5.948
  152    HB3  SER  24           2HB      SER  24  -9.908   1.453   5.316
  153    HG   SER  24           HG       SER  24 -11.417  -0.018   6.436
  154    H    LYS  25           H        LYS  25  -9.853   2.385   3.123
  155    HA   LYS  25           HA       LYS  25  -7.271   2.760   1.871
  156    HB2  LYS  25           1HB      LYS  25  -8.123   4.975   1.265
  157    HB3  LYS  25           2HB      LYS  25  -9.272   3.715   0.834
  158    HG2  LYS  25           1HG      LYS  25 -10.347   4.265   3.130
  159    HG3  LYS  25           2HG      LYS  25  -9.444   5.775   2.988
  160    HD2  LYS  25           1HD      LYS  25 -11.187   4.781   0.756
  161    HD3  LYS  25           2HD      LYS  25 -11.855   5.713   2.098
  162    HE2  LYS  25           1HE      LYS  25  -9.518   6.656   0.455
  163    HE3  LYS  25           2HE      LYS  25 -11.191   7.024   0.036
  164    HZ1  LYS  25           3HZ      LYS  25  -9.634   7.922   2.374
  165    HZ2  LYS  25           1HZ      LYS  25 -11.325   7.898   2.427
  166    HZ3  LYS  25           2HZ      LYS  25 -10.529   8.845   1.274
  167    H    PHE  26           H        PHE  26  -9.051   4.186   4.600
  168    HA   PHE  26           HA       PHE  26  -7.383   6.086   5.520
  169    HB2  PHE  26           1HB      PHE  26  -9.529   5.028   6.586
  170    HB3  PHE  26           2HB      PHE  26  -8.372   4.073   7.509
  171    HD1  PHE  26           HD2      PHE  26  -8.932   7.634   6.538
  172    HD2  PHE  26           HD1      PHE  26  -7.756   4.878   9.561
  173    HE1  PHE  26           HE2      PHE  26  -8.673   9.494   8.128
  174    HE2  PHE  26           HE1      PHE  26  -7.496   6.733  11.156
  175    HZ   PHE  26           HZ       PHE  26  -7.954   9.045  10.441
  176    H    ASN  27           H        ASN  27  -7.003   2.622   6.255
  177    HA   ASN  27           HA       ASN  27  -4.723   2.736   7.798
  178    HB2  ASN  27           1HB      ASN  27  -5.444   0.620   5.757
  179    HB3  ASN  27           2HB      ASN  27  -4.282   0.422   7.066
  180   HD21  ASN  27          1HD2      ASN  27  -6.031  -1.413   7.175
  181   HD22  ASN  27          2HD2      ASN  27  -7.288  -1.122   8.325
  182    H    LEU  28           H        LEU  28  -4.923   2.455   4.258
  183    HA   LEU  28           HA       LEU  28  -2.145   2.445   3.794
  184    HB2  LEU  28           1HB      LEU  28  -3.788   1.712   2.140
  185    HB3  LEU  28           2HB      LEU  28  -4.384   3.365   1.996
  186    HG   LEU  28           HG       LEU  28  -2.023   3.958   1.210
  187   HD11  LEU  28          1HD1      LEU  28  -0.564   2.279   1.505
  188   HD12  LEU  28          2HD1      LEU  28  -1.218   1.685  -0.021
  189   HD13  LEU  28          3HD1      LEU  28  -1.823   1.044   1.507
  190   HD21  LEU  28          3HD2      LEU  28  -2.550   3.400  -1.064
  191   HD22  LEU  28          1HD2      LEU  28  -4.047   3.810  -0.225
  192   HD23  LEU  28          2HD2      LEU  28  -3.649   2.121  -0.543
  193    H    ASP  29           H        ASP  29  -4.523   5.086   3.696
  194    HA   ASP  29           HA       ASP  29  -2.954   7.176   2.885
  195    HB2  ASP  29           1HB      ASP  29  -5.241   7.007   4.818
  196    HB3  ASP  29           2HB      ASP  29  -4.411   8.542   4.579
  197    H    MET  30           H        MET  30  -3.353   6.048   6.241
  198    HA   MET  30           HA       MET  30  -1.427   7.858   7.297
  199    HB2  MET  30           1HB      MET  30  -2.841   5.435   8.364
  200    HB3  MET  30           2HB      MET  30  -1.538   6.181   9.280
  201    HG2  MET  30           1HG      MET  30  -3.850   7.801   8.291
  202    HG3  MET  30           2HG      MET  30  -3.959   6.867   9.781
  203    HE1  MET  30           3HE      MET  30  -4.582   9.778  10.150
  204    HE2  MET  30           1HE      MET  30  -4.296   8.702  11.517
  205    HE3  MET  30           2HE      MET  30  -3.504  10.276  11.454
  206    H    HIS  31           H        HIS  31  -1.339   4.323   6.815
  207    HA   HIS  31           HA       HIS  31   1.176   3.703   7.572
  208    HB2  HIS  31           1HB      HIS  31   0.014   1.877   6.767
  209    HB3  HIS  31           2HB      HIS  31  -0.520   2.722   5.317
  210    HD1  HIS  31           HD1      HIS  31   2.835   1.565   6.714
  211    HD2  HIS  31           HD2      HIS  31   0.741   1.783   3.132
  212    HE1  HIS  31           HE1      HIS  31   4.345   0.530   4.989
  213    H    GLN  32           H        GLN  32   0.299   5.135   4.444
  214    HA   GLN  32           HA       GLN  32   2.636   5.143   3.088
  215    HB2  GLN  32           1HB      GLN  32   0.528   7.259   3.360
  216    HB3  GLN  32           2HB      GLN  32   1.948   7.550   2.364
  217    HG2  GLN  32           1HG      GLN  32   1.347   5.329   1.223
  218    HG3  GLN  32           2HG      GLN  32  -0.226   5.530   1.992
  219   HE21  GLN  32          1HE2      GLN  32  -1.268   5.748   0.016
  220   HE22  GLN  32          2HE2      GLN  32  -1.130   7.176  -0.946
  221    H    LYS  33           H        LYS  33   1.754   7.527   5.578
  222    HA   LYS  33           HA       LYS  33   3.980   9.131   5.537
  223    HB2  LYS  33           1HB      LYS  33   2.145   8.258   7.734
  224    HB3  LYS  33           2HB      LYS  33   3.559   9.226   8.129
  225    HG2  LYS  33           1HG      LYS  33   2.771  10.921   6.481
  226    HG3  LYS  33           2HG      LYS  33   1.290   9.977   6.301
  227    HD2  LYS  33           1HD      LYS  33   2.200  10.819   9.023
  228    HD3  LYS  33           2HD      LYS  33   1.367  11.973   7.979
  229    HE2  LYS  33           1HE      LYS  33   0.260   9.240   8.561
  230    HE3  LYS  33           2HE      LYS  33  -0.063  10.626   9.601
  231    HZ1  LYS  33           3HZ      LYS  33  -1.355  11.621   8.031
  232    HZ2  LYS  33           1HZ      LYS  33  -1.653  10.004   7.633
  233    HZ3  LYS  33           2HZ      LYS  33  -0.548  10.908   6.727
  234    H    VAL  34           H        VAL  34   3.608   5.976   7.074
  235    HA   VAL  34           HA       VAL  34   5.775   5.724   8.660
  236    HB   VAL  34           HB       VAL  34   4.885   3.681   6.620
  237   HG11  VAL  34          1HG1      VAL  34   7.185   3.603   8.097
  238   HG12  VAL  34          2HG1      VAL  34   6.047   2.739   9.132
  239   HG13  VAL  34          3HG1      VAL  34   6.324   2.194   7.477
  240   HG21  VAL  34          3HG2      VAL  34   3.302   2.950   8.112
  241   HG22  VAL  34          1HG2      VAL  34   4.172   3.579   9.511
  242   HG23  VAL  34          2HG2      VAL  34   3.286   4.680   8.455
  243    H    HIS  35           H        HIS  35   5.849   5.247   5.129
  244    HA   HIS  35           HA       HIS  35   8.649   4.862   4.985
  245    HB2  HIS  35           1HB      HIS  35   6.858   5.874   2.772
  246    HB3  HIS  35           2HB      HIS  35   8.391   5.026   2.601
  247    HD1  HIS  35           HD1      HIS  35   8.174   2.521   4.029
  248    HD2  HIS  35           HD2      HIS  35   4.840   4.191   2.196
  249    HE1  HIS  35           HE1      HIS  35   6.566   0.617   3.694
  250    H    THR  36           H        THR  36   6.611   7.694   4.288
  251    HA   THR  36           HA       THR  36   8.561   9.481   3.505
  252    HB   THR  36           HB       THR  36   6.121  10.107   5.179
  253    HG1  THR  36           HG1      THR  36   6.411  10.275   2.355
  254   HG21  THR  36          3HG2      THR  36   7.761  11.942   5.125
  255   HG22  THR  36          1HG2      THR  36   6.290  12.351   4.244
  256   HG23  THR  36          2HG2      THR  36   7.747  11.891   3.363
  257    H    GLY  37           H        GLY  37  10.376  10.078   4.483
  258    HA2  GLY  37           1HA      GLY  37  11.388  11.361   6.268
  259    HA3  GLY  37           2HA      GLY  37  10.296  10.562   7.391
  260    H    GLU  38           H        GLU  38  12.340  10.193   8.573
  261    HA   GLU  38           HA       GLU  38  14.277   9.018   9.042
  262    HB2  GLU  38           1HB      GLU  38  13.790   6.644   9.352
  263    HB3  GLU  38           2HB      GLU  38  12.441   7.634   9.892
  264    HG2  GLU  38           1HG      GLU  38  11.349   7.196   7.686
  265    HG3  GLU  38           2HG      GLU  38  12.639   6.043   7.350
  266    H    ARG  39           H        ARG  39  14.643   9.980   6.543
  267    HA   ARG  39           HA       ARG  39  14.996   8.283   4.416
  268    HB2  ARG  39           1HB      ARG  39  16.984  10.428   5.159
  269    HB3  ARG  39           2HB      ARG  39  16.588   9.842   3.549
  270    HG2  ARG  39           1HG      ARG  39  14.218  10.707   4.047
  271    HG3  ARG  39           2HG      ARG  39  14.987  11.611   5.353
  272    HD2  ARG  39           1HD      ARG  39  16.644  12.349   3.476
  273    HD3  ARG  39           2HD      ARG  39  15.333  11.875   2.397
  274    HE   ARG  39           HE       ARG  39  14.061  13.477   4.115
  275   HH11  ARG  39          1HH1      ARG  39  17.062  13.868   2.395
  276   HH12  ARG  39          2HH1      ARG  39  16.932  15.593   2.296
  277   HH21  ARG  39          1HH2      ARG  39  13.877  15.748   3.991
  278   HH22  ARG  39          2HH2      ARG  39  15.120  16.661   3.204
  279    HA   PRO  40           HA       PRO  40  18.083   5.373   5.583
  280    HB2  PRO  40           1HB      PRO  40  18.988   4.686   3.117
  281    HB3  PRO  40           2HB      PRO  40  17.422   4.161   3.747
  282    HG2  PRO  40           1HG      PRO  40  18.053   6.409   1.873
  283    HG3  PRO  40           2HG      PRO  40  16.739   5.221   1.793
  284    HD2  PRO  40           1HD      PRO  40  16.370   7.741   2.710
  285    HD3  PRO  40           2HD      PRO  40  15.451   6.355   3.331
  286    H    SER  41           H        SER  41  19.570   6.746   6.640
  287    HA   SER  41           HA       SER  41  21.435   8.366   5.217
  288    HB2  SER  41           1HB      SER  41  20.935   8.995   7.467
  289    HB3  SER  41           2HB      SER  41  21.336   7.389   8.075
  290    HG   SER  41           HG       SER  41  23.364   7.936   8.134
  291    H    GLY  42           H        GLY  42  23.409   7.897   4.436
  292    HA2  GLY  42           1HA      GLY  42  24.275   5.516   3.600
  293    HA3  GLY  42           2HA      GLY  42  25.409   6.738   4.155
  294    HA   PRO  43           HA       PRO  43  25.122   2.842   6.982
  295    HB2  PRO  43           1HB      PRO  43  26.898   1.172   5.786
  296    HB3  PRO  43           2HB      PRO  43  25.165   1.142   5.437
  297    HG2  PRO  43           1HG      PRO  43  27.387   2.425   3.894
  298    HG3  PRO  43           2HG      PRO  43  26.005   1.488   3.296
  299    HD2  PRO  43           1HD      PRO  43  26.069   4.195   3.231
  300    HD3  PRO  43           2HD      PRO  43  24.563   3.280   3.452
  301    H    SER  44           H        SER  44  26.254   3.633   8.653
  302    HA   SER  44           HA       SER  44  29.170   3.716   8.429
  303    HB2  SER  44           1HB      SER  44  28.443   6.026   8.049
  304    HB3  SER  44           2HB      SER  44  27.505   5.989   9.542
  305    HG   SER  44           HG       SER  44  29.432   6.929  10.047
  306    H    SER  45           H        SER  45  29.833   2.311   9.906
  307    HA   SER  45           HA       SER  45  28.550   1.102  11.921
  308    HB2  SER  45           1HB      SER  45  30.854   0.549  11.366
  309    HB3  SER  45           2HB      SER  45  31.411   2.088  12.022
  310    HG   SER  45           HG       SER  45  31.448   1.191  13.910
  311    H    GLY  46           H        GLY  46  27.349   1.802  13.551
  312    HA2  GLY  46           1HA      GLY  46  28.084   4.359  14.833
  313    HA3  GLY  46           2HA      GLY  46  26.444   3.737  14.727
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1   9.954 -27.685  -8.096
    2    HA2  GLY   1           1HA      GLY   1  10.790 -25.051  -7.113
    3    HA3  GLY   1           2HA      GLY   1  10.215 -25.173  -8.769
    4    H    SER   2           H        SER   2   9.070 -26.722  -5.781
    5    HA   SER   2           HA       SER   2   6.466 -25.412  -6.220
    6    HB2  SER   2           1HB      SER   2   6.996 -28.232  -5.257
    7    HB3  SER   2           2HB      SER   2   5.408 -27.466  -5.290
    8    HG   SER   2           HG       SER   2   5.468 -28.472  -7.193
    9    H    SER   3           H        SER   3   6.532 -23.826  -4.720
   10    HA   SER   3           HA       SER   3   6.254 -24.550  -1.968
   11    HB2  SER   3           1HB      SER   3   8.174 -23.230  -1.126
   12    HB3  SER   3           2HB      SER   3   8.692 -24.617  -2.083
   13    HG   SER   3           HG       SER   3   8.313 -22.220  -3.441
   14    H    GLY   4           H        GLY   4   4.756 -23.227  -1.193
   15    HA2  GLY   4           1HA      GLY   4   3.915 -21.097  -0.591
   16    HA3  GLY   4           2HA      GLY   4   4.825 -20.390  -1.919
   17    H    SER   5           H        SER   5   3.387 -19.430  -3.203
   18    HA   SER   5           HA       SER   5   1.607 -19.100  -4.581
   19    HB2  SER   5           1HB      SER   5   2.136 -22.024  -4.802
   20    HB3  SER   5           2HB      SER   5   0.626 -21.415  -5.480
   21    HG   SER   5           HG       SER   5   2.968 -20.025  -6.078
   22    H    SER   6           H        SER   6   1.059 -19.071  -1.844
   23    HA   SER   6           HA       SER   6  -1.765 -19.820  -1.887
   24    HB2  SER   6           1HB      SER   6  -1.620 -20.736   0.415
   25    HB3  SER   6           2HB      SER   6  -0.691 -21.686  -0.745
   26    HG   SER   6           HG       SER   6   0.620 -19.621   0.598
   27    H    GLY   7           H        GLY   7  -3.050 -18.283  -1.053
   28    HA2  GLY   7           1HA      GLY   7  -2.528 -16.629   1.115
   29    HA3  GLY   7           2HA      GLY   7  -1.956 -15.771  -0.308
   30    H    THR   8           H        THR   8  -4.771 -17.896   0.061
   31    HA   THR   8           HA       THR   8  -6.566 -16.661  -1.497
   32    HB   THR   8           HB       THR   8  -7.036 -18.679  -0.101
   33    HG1  THR   8           HG1      THR   8  -8.980 -18.225  -0.780
   34   HG21  THR   8          3HG2      THR   8  -7.244 -18.613   2.132
   35   HG22  THR   8          1HG2      THR   8  -8.205 -17.135   2.087
   36   HG23  THR   8          2HG2      THR   8  -6.445 -17.044   2.027
   37    H    GLY   9           H        GLY   9  -8.114 -15.010  -1.346
   38    HA2  GLY   9           1HA      GLY   9  -9.124 -13.100  -0.467
   39    HA3  GLY   9           2HA      GLY   9  -8.094 -13.237   0.950
   40    H    GLU  10           H        GLU  10  -8.792 -11.208  -1.420
   41    HA   GLU  10           HA       GLU  10  -6.032 -10.192  -1.588
   42    HB2  GLU  10           1HB      GLU  10  -8.133 -10.391  -3.722
   43    HB3  GLU  10           2HB      GLU  10  -6.889  -9.152  -3.812
   44    HG2  GLU  10           1HG      GLU  10  -6.235 -12.063  -3.498
   45    HG3  GLU  10           2HG      GLU  10  -6.464 -11.305  -5.073
   46    H    LYS  11           H        LYS  11  -5.795  -7.908  -1.653
   47    HA   LYS  11           HA       LYS  11  -8.141  -6.440  -0.639
   48    HB2  LYS  11           1HB      LYS  11  -5.235  -5.993   0.069
   49    HB3  LYS  11           2HB      LYS  11  -6.594  -5.053   0.671
   50    HG2  LYS  11           1HG      LYS  11  -7.479  -7.283   1.578
   51    HG3  LYS  11           2HG      LYS  11  -5.842  -7.881   1.302
   52    HD2  LYS  11           1HD      LYS  11  -4.971  -6.047   2.711
   53    HD3  LYS  11           2HD      LYS  11  -6.630  -5.536   3.033
   54    HE2  LYS  11           1HE      LYS  11  -5.815  -8.358   3.581
   55    HE3  LYS  11           2HE      LYS  11  -5.373  -7.087   4.720
   56    HZ1  LYS  11           3HZ      LYS  11  -8.091  -6.830   4.001
   57    HZ2  LYS  11           1HZ      LYS  11  -7.418  -7.101   5.530
   58    HZ3  LYS  11           2HZ      LYS  11  -7.799  -8.410   4.529
   59    HA   PRO  12           HA       PRO  12  -7.660  -3.714  -4.062
   60    HB2  PRO  12           1HB      PRO  12  -8.904  -1.523  -3.050
   61    HB3  PRO  12           2HB      PRO  12  -9.778  -2.968  -3.574
   62    HG2  PRO  12           1HG      PRO  12  -8.987  -2.130  -0.810
   63    HG3  PRO  12           2HG      PRO  12 -10.520  -2.820  -1.375
   64    HD2  PRO  12           1HD      PRO  12  -8.630  -4.301  -0.123
   65    HD3  PRO  12           2HD      PRO  12  -9.698  -4.973  -1.372
   66    H    TYR  13           H        TYR  13  -7.088  -2.142  -0.906
   67    HA   TYR  13           HA       TYR  13  -5.257  -0.244  -2.025
   68    HB2  TYR  13           1HB      TYR  13  -5.709  -0.932   0.884
   69    HB3  TYR  13           2HB      TYR  13  -4.950   0.526   0.254
   70    HD1  TYR  13           HD2      TYR  13  -6.325   2.219  -0.929
   71    HD2  TYR  13           HD1      TYR  13  -8.083  -1.146   0.991
   72    HE1  TYR  13           HE2      TYR  13  -8.514   3.339  -0.983
   73    HE2  TYR  13           HE1      TYR  13 -10.277  -0.036   0.941
   74    HH   TYR  13           HH       TYR  13 -11.367   1.818  -0.575
   75    H    LYS  14           H        LYS  14  -3.627  -1.457  -3.007
   76    HA   LYS  14           HA       LYS  14  -1.945  -3.076  -1.222
   77    HB2  LYS  14           1HB      LYS  14  -2.127  -2.976  -4.236
   78    HB3  LYS  14           2HB      LYS  14  -0.922  -3.909  -3.359
   79    HG2  LYS  14           1HG      LYS  14  -2.485  -5.416  -2.553
   80    HG3  LYS  14           2HG      LYS  14  -3.834  -4.308  -2.813
   81    HD2  LYS  14           1HD      LYS  14  -4.109  -5.810  -4.548
   82    HD3  LYS  14           2HD      LYS  14  -3.177  -4.527  -5.324
   83    HE2  LYS  14           1HE      LYS  14  -2.146  -6.537  -5.983
   84    HE3  LYS  14           2HE      LYS  14  -1.109  -5.872  -4.723
   85    HZ1  LYS  14           3HZ      LYS  14  -1.526  -7.586  -3.370
   86    HZ2  LYS  14           1HZ      LYS  14  -2.034  -8.392  -4.768
   87    HZ3  LYS  14           2HZ      LYS  14  -3.170  -7.649  -3.761
   88    H    CYS  15           H        CYS  15  -0.457  -1.819  -0.279
   89    HA   CYS  15           HA       CYS  15   0.550   0.594  -1.158
   90    HB2  CYS  15           1HB      CYS  15   0.856  -0.657   1.106
   91    HB3  CYS  15           2HB      CYS  15   2.301  -1.322   0.351
   92    H    GLU  16           H        GLU  16   2.674   1.160  -1.989
   93    HA   GLU  16           HA       GLU  16   3.670  -0.839  -3.912
   94    HB2  GLU  16           1HB      GLU  16   4.308   1.030  -5.362
   95    HB3  GLU  16           2HB      GLU  16   2.584   1.049  -5.018
   96    HG2  GLU  16           1HG      GLU  16   4.571   2.717  -3.505
   97    HG3  GLU  16           2HG      GLU  16   3.753   3.274  -4.964
   98    H    LYS  17           H        LYS  17   4.501   1.556  -1.514
   99    HA   LYS  17           HA       LYS  17   7.265   1.708  -1.937
  100    HB2  LYS  17           1HB      LYS  17   5.495   2.149   0.442
  101    HB3  LYS  17           2HB      LYS  17   7.243   2.190   0.635
  102    HG2  LYS  17           1HG      LYS  17   6.026   3.826  -1.526
  103    HG3  LYS  17           2HG      LYS  17   5.857   4.370   0.145
  104    HD2  LYS  17           1HD      LYS  17   8.439   3.882   0.222
  105    HD3  LYS  17           2HD      LYS  17   8.311   4.084  -1.527
  106    HE2  LYS  17           1HE      LYS  17   7.260   6.094   0.453
  107    HE3  LYS  17           2HE      LYS  17   8.889   6.162  -0.218
  108    HZ1  LYS  17           3HZ      LYS  17   7.641   7.540  -1.589
  109    HZ2  LYS  17           1HZ      LYS  17   6.309   6.497  -1.616
  110    HZ3  LYS  17           2HZ      LYS  17   7.715   6.095  -2.465
  111    H    CYS  18           H        CYS  18   5.355  -0.493   0.084
  112    HA   CYS  18           HA       CYS  18   7.766  -2.155   0.417
  113    HB2  CYS  18           1HB      CYS  18   6.635  -3.079   2.437
  114    HB3  CYS  18           2HB      CYS  18   6.985  -1.357   2.558
  115    H    GLY  19           H        GLY  19   4.232  -2.305   0.024
  116    HA2  GLY  19           1HA      GLY  19   3.333  -3.704  -1.755
  117    HA3  GLY  19           2HA      GLY  19   4.617  -4.854  -1.415
  118    H    LYS  20           H        LYS  20   2.531  -3.184   0.902
  119    HA   LYS  20           HA       LYS  20   1.672  -5.808   1.894
  120    HB2  LYS  20           1HB      LYS  20   2.765  -3.884   3.333
  121    HB3  LYS  20           2HB      LYS  20   1.121  -3.261   3.358
  122    HG2  LYS  20           1HG      LYS  20   1.548  -6.114   4.062
  123    HG3  LYS  20           2HG      LYS  20   2.019  -4.879   5.231
  124    HD2  LYS  20           1HD      LYS  20  -0.352  -3.913   4.757
  125    HD3  LYS  20           2HD      LYS  20  -0.693  -5.536   4.152
  126    HE2  LYS  20           1HE      LYS  20   0.051  -6.463   6.314
  127    HE3  LYS  20           2HE      LYS  20   0.306  -4.823   6.908
  128    HZ1  LYS  20           3HZ      LYS  20  -1.807  -4.803   7.520
  129    HZ2  LYS  20           1HZ      LYS  20  -2.085  -6.319   6.820
  130    HZ3  LYS  20           2HZ      LYS  20  -2.273  -4.914   5.897
  131    H    GLY  21           H        GLY  21  -0.524  -6.225   2.368
  132    HA2  GLY  21           1HA      GLY  21  -2.349  -4.853   0.562
  133    HA3  GLY  21           2HA      GLY  21  -2.671  -6.341   1.439
  134    H    TYR  22           H        TYR  22  -4.345  -3.968   1.171
  135    HA   TYR  22           HA       TYR  22  -4.938  -3.614   3.985
  136    HB2  TYR  22           1HB      TYR  22  -4.042  -1.362   2.209
  137    HB3  TYR  22           2HB      TYR  22  -5.136  -1.064   3.556
  138    HD1  TYR  22           HD1      TYR  22  -4.347  -1.963   5.878
  139    HD2  TYR  22           HD2      TYR  22  -1.752  -1.310   2.570
  140    HE1  TYR  22           HE1      TYR  22  -2.429  -1.844   7.414
  141    HE2  TYR  22           HE2      TYR  22   0.173  -1.190   4.096
  142    HH   TYR  22           HH       TYR  22   0.500  -0.594   6.602
  143    H    ASN  23           H        ASN  23  -7.078  -3.273   4.368
  144    HA   ASN  23           HA       ASN  23  -8.815  -3.140   1.995
  145    HB2  ASN  23           1HB      ASN  23 -10.519  -4.266   3.343
  146    HB3  ASN  23           2HB      ASN  23  -9.031  -5.207   3.319
  147   HD21  ASN  23          1HD2      ASN  23 -11.275  -5.116   5.237
  148   HD22  ASN  23          2HD2      ASN  23 -10.551  -4.795   6.772
  149    H    SER  24           H        SER  24  -7.757  -0.767   2.989
  150    HA   SER  24           HA       SER  24 -10.126   0.740   3.422
  151    HB2  SER  24           1HB      SER  24  -9.617  -0.236   5.733
  152    HB3  SER  24           2HB      SER  24  -8.201   0.815   5.745
  153    HG   SER  24           HG       SER  24  -9.717   2.571   5.342
  154    H    LYS  25           H        LYS  25  -9.837   2.780   2.728
  155    HA   LYS  25           HA       LYS  25  -7.389   3.518   1.513
  156    HB2  LYS  25           1HB      LYS  25  -8.487   5.628   1.001
  157    HB3  LYS  25           2HB      LYS  25  -9.584   4.287   0.699
  158    HG2  LYS  25           1HG      LYS  25 -10.674   4.720   2.861
  159    HG3  LYS  25           2HG      LYS  25  -9.603   6.103   3.101
  160    HD2  LYS  25           1HD      LYS  25 -10.501   7.158   1.092
  161    HD3  LYS  25           2HD      LYS  25 -11.550   5.764   0.818
  162    HE2  LYS  25           1HE      LYS  25 -12.319   6.323   3.289
  163    HE3  LYS  25           2HE      LYS  25 -11.744   7.930   2.848
  164    HZ1  LYS  25           3HZ      LYS  25 -13.303   8.102   1.147
  165    HZ2  LYS  25           1HZ      LYS  25 -14.174   7.376   2.403
  166    HZ3  LYS  25           2HZ      LYS  25 -13.612   6.440   1.112
  167    H    PHE  26           H        PHE  26  -8.937   4.395   4.555
  168    HA   PHE  26           HA       PHE  26  -7.189   6.480   5.275
  169    HB2  PHE  26           1HB      PHE  26  -9.385   6.031   6.360
  170    HB3  PHE  26           2HB      PHE  26  -8.681   4.608   7.123
  171    HD1  PHE  26           HD2      PHE  26  -8.524   8.291   6.952
  172    HD2  PHE  26           HD1      PHE  26  -7.375   4.786   9.076
  173    HE1  PHE  26           HE2      PHE  26  -7.752   9.685   8.826
  174    HE2  PHE  26           HE1      PHE  26  -6.602   6.174  10.955
  175    HZ   PHE  26           HZ       PHE  26  -6.789   8.627  10.831
  176    H    ASN  27           H        ASN  27  -7.230   3.085   6.370
  177    HA   ASN  27           HA       ASN  27  -5.006   3.025   7.938
  178    HB2  ASN  27           1HB      ASN  27  -6.109   0.978   6.027
  179    HB3  ASN  27           2HB      ASN  27  -4.686   0.636   7.006
  180   HD21  ASN  27          1HD2      ASN  27  -4.949   0.006   9.049
  181   HD22  ASN  27          2HD2      ASN  27  -6.460  -0.039   9.886
  182    H    LEU  28           H        LEU  28  -5.088   2.824   4.402
  183    HA   LEU  28           HA       LEU  28  -2.273   2.501   4.108
  184    HB2  LEU  28           1HB      LEU  28  -3.829   1.767   2.392
  185    HB3  LEU  28           2HB      LEU  28  -4.368   3.427   2.147
  186    HG   LEU  28           HG       LEU  28  -1.954   3.919   1.457
  187   HD11  LEU  28          1HD1      LEU  28  -1.911   0.957   1.707
  188   HD12  LEU  28          2HD1      LEU  28  -0.651   2.141   2.052
  189   HD13  LEU  28          3HD1      LEU  28  -1.018   1.705   0.383
  190   HD21  LEU  28          3HD2      LEU  28  -2.523   3.619  -0.740
  191   HD22  LEU  28          1HD2      LEU  28  -4.109   3.463   0.016
  192   HD23  LEU  28          2HD2      LEU  28  -3.213   2.020  -0.459
  193    H    ASP  29           H        ASP  29  -4.446   5.274   3.575
  194    HA   ASP  29           HA       ASP  29  -2.753   7.217   2.779
  195    HB2  ASP  29           1HB      ASP  29  -5.237   7.402   3.386
  196    HB3  ASP  29           2HB      ASP  29  -4.690   7.751   5.024
  197    H    MET  30           H        MET  30  -3.032   5.960   6.064
  198    HA   MET  30           HA       MET  30  -1.076   7.813   7.102
  199    HB2  MET  30           1HB      MET  30  -2.602   5.501   8.269
  200    HB3  MET  30           2HB      MET  30  -1.288   6.262   9.155
  201    HG2  MET  30           1HG      MET  30  -3.719   7.702   8.122
  202    HG3  MET  30           2HG      MET  30  -3.518   7.112   9.770
  203    HE1  MET  30           3HE      MET  30  -2.882   8.116  11.423
  204    HE2  MET  30           1HE      MET  30  -1.375   9.016  11.591
  205    HE3  MET  30           2HE      MET  30  -2.904   9.880  11.432
  206    H    HIS  31           H        HIS  31  -1.208   4.251   6.886
  207    HA   HIS  31           HA       HIS  31   1.284   3.540   7.609
  208    HB2  HIS  31           1HB      HIS  31  -0.110   1.780   6.949
  209    HB3  HIS  31           2HB      HIS  31  -0.447   2.507   5.381
  210    HD1  HIS  31           HD1      HIS  31   2.435   0.860   7.224
  211    HD2  HIS  31           HD2      HIS  31   1.086   1.543   3.354
  212    HE1  HIS  31           HE1      HIS  31   4.003  -0.418   5.729
  213    H    GLN  32           H        GLN  32   0.405   5.033   4.541
  214    HA   GLN  32           HA       GLN  32   2.671   4.734   3.050
  215    HB2  GLN  32           1HB      GLN  32   0.794   7.061   3.346
  216    HB3  GLN  32           2HB      GLN  32   2.165   7.145   2.247
  217    HG2  GLN  32           1HG      GLN  32   1.320   5.124   1.103
  218    HG3  GLN  32           2HG      GLN  32  -0.095   5.160   2.155
  219   HE21  GLN  32          1HE2      GLN  32  -1.751   5.769   0.957
  220   HE22  GLN  32          2HE2      GLN  32  -1.783   7.123  -0.116
  221    H    LYS  33           H        LYS  33   2.126   7.142   5.598
  222    HA   LYS  33           HA       LYS  33   4.506   8.557   5.370
  223    HB2  LYS  33           1HB      LYS  33   3.999   9.501   7.420
  224    HB3  LYS  33           2HB      LYS  33   2.420   8.931   6.896
  225    HG2  LYS  33           1HG      LYS  33   2.567   7.014   8.323
  226    HG3  LYS  33           2HG      LYS  33   4.240   7.396   8.738
  227    HD2  LYS  33           1HD      LYS  33   2.833   8.093  10.551
  228    HD3  LYS  33           2HD      LYS  33   3.433   9.536   9.730
  229    HE2  LYS  33           1HE      LYS  33   1.351   9.879   8.636
  230    HE3  LYS  33           2HE      LYS  33   0.757   8.294   9.130
  231    HZ1  LYS  33           3HZ      LYS  33  -0.180  10.093  10.468
  232    HZ2  LYS  33           1HZ      LYS  33   1.371  10.537  10.978
  233    HZ3  LYS  33           2HZ      LYS  33   0.736   9.032  11.415
  234    H    VAL  34           H        VAL  34   3.828   5.517   7.013
  235    HA   VAL  34           HA       VAL  34   5.956   5.089   8.611
  236    HB   VAL  34           HB       VAL  34   4.893   3.090   6.611
  237   HG11  VAL  34          1HG1      VAL  34   7.063   2.910   8.439
  238   HG12  VAL  34          2HG1      VAL  34   5.757   1.876   9.021
  239   HG13  VAL  34          3HG1      VAL  34   6.397   1.658   7.391
  240   HG21  VAL  34          3HG2      VAL  34   3.392   4.309   8.423
  241   HG22  VAL  34          1HG2      VAL  34   3.197   2.595   8.055
  242   HG23  VAL  34          2HG2      VAL  34   4.113   3.093   9.478
  243    H    HIS  35           H        HIS  35   6.022   5.282   5.128
  244    HA   HIS  35           HA       HIS  35   8.787   4.392   4.988
  245    HB2  HIS  35           1HB      HIS  35   7.063   5.478   2.756
  246    HB3  HIS  35           2HB      HIS  35   8.553   4.552   2.598
  247    HD1  HIS  35           HD1      HIS  35   8.182   2.089   4.102
  248    HD2  HIS  35           HD2      HIS  35   4.990   3.879   2.137
  249    HE1  HIS  35           HE1      HIS  35   6.488   0.260   3.766
  250    H    THR  36           H        THR  36   8.771   6.519   6.587
  251    HA   THR  36           HA       THR  36   9.648   8.773   4.903
  252    HB   THR  36           HB       THR  36   7.743   9.314   6.379
  253    HG1  THR  36           HG1      THR  36  10.257  10.537   6.680
  254   HG21  THR  36          3HG2      THR  36   9.621   8.934   8.700
  255   HG22  THR  36          1HG2      THR  36   8.481   7.689   8.191
  256   HG23  THR  36          2HG2      THR  36   7.888   9.258   8.738
  257    H    GLY  37           H        GLY  37  10.424   6.792   7.720
  258    HA2  GLY  37           1HA      GLY  37  12.626   6.125   8.271
  259    HA3  GLY  37           2HA      GLY  37  13.243   7.492   7.356
  260    H    GLU  38           H        GLU  38  14.379   8.705   8.724
  261    HA   GLU  38           HA       GLU  38  13.525   9.012  11.482
  262    HB2  GLU  38           1HB      GLU  38  15.637  10.114  11.842
  263    HB3  GLU  38           2HB      GLU  38  15.916   8.655  10.903
  264    HG2  GLU  38           1HG      GLU  38  16.049   9.993   8.863
  265    HG3  GLU  38           2HG      GLU  38  15.782  11.456   9.810
  266    H    ARG  39           H        ARG  39  12.771  10.863  12.411
  267    HA   ARG  39           HA       ARG  39  11.254  12.646  10.966
  268    HB2  ARG  39           1HB      ARG  39  12.527  12.851  13.682
  269    HB3  ARG  39           2HB      ARG  39  11.552  14.163  13.035
  270    HG2  ARG  39           1HG      ARG  39  10.530  11.348  13.246
  271    HG3  ARG  39           2HG      ARG  39  10.383  12.520  14.557
  272    HD2  ARG  39           1HD      ARG  39   9.359  14.037  12.694
  273    HD3  ARG  39           2HD      ARG  39   9.087  12.504  11.866
  274    HE   ARG  39           HE       ARG  39   7.428  12.019  13.373
  275   HH11  ARG  39          1HH1      ARG  39   9.317  14.693  14.556
  276   HH12  ARG  39          2HH1      ARG  39   8.238  15.046  15.865
  277   HH21  ARG  39          1HH2      ARG  39   5.999  12.473  15.092
  278   HH22  ARG  39          2HH2      ARG  39   6.351  13.782  16.169
  279    HA   PRO  40           HA       PRO  40  14.067  15.429   9.041
  280    HB2  PRO  40           1HB      PRO  40  12.423  17.567   8.737
  281    HB3  PRO  40           2HB      PRO  40  12.287  16.103   7.756
  282    HG2  PRO  40           1HG      PRO  40  10.699  16.930  10.155
  283    HG3  PRO  40           2HG      PRO  40  10.138  16.200   8.639
  284    HD2  PRO  40           1HD      PRO  40  10.480  14.763  10.909
  285    HD3  PRO  40           2HD      PRO  40  10.740  14.074   9.293
  286    H    SER  41           H        SER  41  14.486  17.985   9.219
  287    HA   SER  41           HA       SER  41  15.827  18.423  11.600
  288    HB2  SER  41           1HB      SER  41  16.106  19.675   9.407
  289    HB3  SER  41           2HB      SER  41  14.707  20.639   9.878
  290    HG   SER  41           HG       SER  41  16.319  21.790  10.705
  291    H    GLY  42           H        GLY  42  14.606  18.035  13.424
  292    HA2  GLY  42           1HA      GLY  42  13.293  20.143  14.643
  293    HA3  GLY  42           2HA      GLY  42  12.038  19.186  13.869
  294    HA   PRO  43           HA       PRO  43  14.173  16.504  17.326
  295    HB2  PRO  43           1HB      PRO  43  15.379  17.960  19.274
  296    HB3  PRO  43           2HB      PRO  43  16.239  17.361  17.851
  297    HG2  PRO  43           1HG      PRO  43  15.120  20.086  18.380
  298    HG3  PRO  43           2HG      PRO  43  16.678  19.636  17.661
  299    HD2  PRO  43           1HD      PRO  43  14.557  20.418  16.170
  300    HD3  PRO  43           2HD      PRO  43  15.749  19.237  15.590
  301    H    SER  44           H        SER  44  12.132  16.038  18.024
  302    HA   SER  44           HA       SER  44  11.229  17.386  20.422
  303    HB2  SER  44           1HB      SER  44   9.716  17.498  17.829
  304    HB3  SER  44           2HB      SER  44   8.850  17.513  19.365
  305    HG   SER  44           HG       SER  44  10.912  19.325  18.640
  306    H    SER  45           H        SER  45  11.101  15.668  21.716
  307    HA   SER  45           HA       SER  45   9.812  13.228  20.692
  308    HB2  SER  45           1HB      SER  45  12.223  13.176  21.608
  309    HB3  SER  45           2HB      SER  45  11.481  13.366  23.196
  310    HG   SER  45           HG       SER  45  10.112  11.476  22.246
  311    H    GLY  46           H        GLY  46   7.752  13.053  21.266
  312    HA2  GLY  46           1HA      GLY  46   7.020  13.711  24.041
  313    HA3  GLY  46           2HA      GLY  46   6.060  14.348  22.714
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1  10.059 -24.548 -11.515
    2    HA2  GLY   1           1HA      GLY   1  10.555 -21.782 -11.034
    3    HA3  GLY   1           2HA      GLY   1   9.442 -21.997 -12.378
    4    H    SER   2           H        SER   2   9.725 -21.724  -9.047
    5    HA   SER   2           HA       SER   2   7.527 -23.294  -8.194
    6    HB2  SER   2           1HB      SER   2   7.647 -21.949  -6.121
    7    HB3  SER   2           2HB      SER   2   9.236 -22.527  -6.621
    8    HG   SER   2           HG       SER   2   8.280 -19.977  -7.369
    9    H    SER   3           H        SER   3   5.510 -22.402  -7.268
   10    HA   SER   3           HA       SER   3   4.560 -19.863  -8.218
   11    HB2  SER   3           1HB      SER   3   3.744 -22.414  -9.568
   12    HB3  SER   3           2HB      SER   3   2.582 -21.096  -9.424
   13    HG   SER   3           HG       SER   3   5.131 -20.462 -10.352
   14    H    GLY   4           H        GLY   4   2.219 -19.542  -7.630
   15    HA2  GLY   4           1HA      GLY   4   0.745 -21.220  -5.995
   16    HA3  GLY   4           2HA      GLY   4   1.826 -20.339  -4.926
   17    H    SER   5           H        SER   5  -0.036 -19.416  -7.821
   18    HA   SER   5           HA       SER   5  -0.716 -16.877  -6.718
   19    HB2  SER   5           1HB      SER   5  -1.668 -18.370  -9.165
   20    HB3  SER   5           2HB      SER   5  -2.258 -16.764  -8.739
   21    HG   SER   5           HG       SER   5  -0.572 -16.206  -9.900
   22    H    SER   6           H        SER   6  -2.699 -19.729  -7.529
   23    HA   SER   6           HA       SER   6  -4.886 -20.197  -6.949
   24    HB2  SER   6           1HB      SER   6  -5.053 -20.790  -4.610
   25    HB3  SER   6           2HB      SER   6  -3.424 -21.172  -5.167
   26    HG   SER   6           HG       SER   6  -3.902 -19.846  -3.083
   27    H    GLY   7           H        GLY   7  -4.755 -17.526  -7.685
   28    HA2  GLY   7           1HA      GLY   7  -6.533 -15.947  -7.608
   29    HA3  GLY   7           2HA      GLY   7  -6.835 -16.411  -5.941
   30    H    THR   8           H        THR   8  -6.883 -14.056  -5.622
   31    HA   THR   8           HA       THR   8  -4.161 -13.024  -5.174
   32    HB   THR   8           HB       THR   8  -6.535 -11.388  -6.088
   33    HG1  THR   8           HG1      THR   8  -4.110 -11.950  -7.472
   34   HG21  THR   8          3HG2      THR   8  -3.670 -10.608  -5.533
   35   HG22  THR   8          1HG2      THR   8  -5.089 -10.116  -4.609
   36   HG23  THR   8          2HG2      THR   8  -4.882  -9.560  -6.270
   37    H    GLY   9           H        GLY   9  -7.588 -12.726  -4.271
   38    HA2  GLY   9           1HA      GLY   9  -8.124 -13.014  -1.893
   39    HA3  GLY   9           2HA      GLY   9  -6.688 -12.067  -1.535
   40    H    GLU  10           H        GLU  10  -8.151 -10.759  -0.236
   41    HA   GLU  10           HA       GLU  10  -9.771  -8.913  -1.861
   42    HB2  GLU  10           1HB      GLU  10 -10.915 -10.289  -0.050
   43    HB3  GLU  10           2HB      GLU  10 -10.016  -9.327   1.115
   44    HG2  GLU  10           1HG      GLU  10 -11.141  -7.359   0.530
   45    HG3  GLU  10           2HG      GLU  10 -11.761  -8.058  -0.965
   46    H    LYS  11           H        LYS  11  -7.260  -8.256  -2.066
   47    HA   LYS  11           HA       LYS  11  -6.820  -6.117  -0.086
   48    HB2  LYS  11           1HB      LYS  11  -4.676  -7.468  -1.727
   49    HB3  LYS  11           2HB      LYS  11  -4.452  -6.349  -0.389
   50    HG2  LYS  11           1HG      LYS  11  -4.868  -7.932   1.193
   51    HG3  LYS  11           2HG      LYS  11  -5.937  -8.863   0.140
   52    HD2  LYS  11           1HD      LYS  11  -3.961 -10.152   0.444
   53    HD3  LYS  11           2HD      LYS  11  -3.902  -9.497  -1.194
   54    HE2  LYS  11           1HE      LYS  11  -2.362  -7.783  -0.509
   55    HE3  LYS  11           2HE      LYS  11  -2.523  -8.254   1.182
   56    HZ1  LYS  11           3HZ      LYS  11  -0.541  -9.224   0.479
   57    HZ2  LYS  11           1HZ      LYS  11  -1.181  -9.714  -1.009
   58    HZ3  LYS  11           2HZ      LYS  11  -1.651 -10.499   0.413
   59    HA   PRO  12           HA       PRO  12  -7.615  -4.070  -4.142
   60    HB2  PRO  12           1HB      PRO  12  -8.991  -1.992  -3.065
   61    HB3  PRO  12           2HB      PRO  12  -9.749  -3.535  -3.478
   62    HG2  PRO  12           1HG      PRO  12  -8.811  -2.538  -0.816
   63    HG3  PRO  12           2HG      PRO  12 -10.306  -3.400  -1.225
   64    HD2  PRO  12           1HD      PRO  12  -8.166  -4.638  -0.120
   65    HD3  PRO  12           2HD      PRO  12  -9.262  -5.455  -1.253
   66    H    TYR  13           H        TYR  13  -6.864  -2.431  -1.063
   67    HA   TYR  13           HA       TYR  13  -5.207  -0.498  -2.482
   68    HB2  TYR  13           1HB      TYR  13  -5.759  -0.644   0.484
   69    HB3  TYR  13           2HB      TYR  13  -5.131   0.730  -0.419
   70    HD1  TYR  13           HD2      TYR  13  -6.896   0.981  -2.682
   71    HD2  TYR  13           HD1      TYR  13  -7.833  -0.077   1.332
   72    HE1  TYR  13           HE2      TYR  13  -9.186   1.821  -3.000
   73    HE2  TYR  13           HE1      TYR  13 -10.125   0.759   1.024
   74    HH   TYR  13           HH       TYR  13 -11.110   2.741  -0.953
   75    H    LYS  14           H        LYS  14  -3.329  -1.466  -3.069
   76    HA   LYS  14           HA       LYS  14  -1.762  -2.788  -0.956
   77    HB2  LYS  14           1HB      LYS  14  -1.533  -3.050  -3.960
   78    HB3  LYS  14           2HB      LYS  14  -0.511  -3.872  -2.788
   79    HG2  LYS  14           1HG      LYS  14  -2.459  -5.060  -1.917
   80    HG3  LYS  14           2HG      LYS  14  -3.486  -4.234  -3.092
   81    HD2  LYS  14           1HD      LYS  14  -1.106  -5.820  -3.987
   82    HD3  LYS  14           2HD      LYS  14  -2.636  -6.621  -3.624
   83    HE2  LYS  14           1HE      LYS  14  -3.681  -4.883  -5.202
   84    HE3  LYS  14           2HE      LYS  14  -2.031  -4.585  -5.745
   85    HZ1  LYS  14           3HZ      LYS  14  -2.257  -6.310  -7.092
   86    HZ2  LYS  14           1HZ      LYS  14  -3.775  -6.692  -6.451
   87    HZ3  LYS  14           2HZ      LYS  14  -2.375  -7.330  -5.748
   88    H    CYS  15           H        CYS  15  -0.036  -1.758  -0.209
   89    HA   CYS  15           HA       CYS  15   0.731   0.793  -0.959
   90    HB2  CYS  15           1HB      CYS  15   1.332  -0.619   1.148
   91    HB3  CYS  15           2HB      CYS  15   2.726  -1.126   0.201
   92    H    GLU  16           H        GLU  16   3.087   1.325  -1.644
   93    HA   GLU  16           HA       GLU  16   3.680  -0.235  -4.073
   94    HB2  GLU  16           1HB      GLU  16   2.843   2.192  -4.282
   95    HB3  GLU  16           2HB      GLU  16   4.428   2.653  -3.676
   96    HG2  GLU  16           1HG      GLU  16   5.454   1.413  -5.559
   97    HG3  GLU  16           2HG      GLU  16   3.836   1.110  -6.190
   98    H    LYS  17           H        LYS  17   5.221   1.882  -1.656
   99    HA   LYS  17           HA       LYS  17   7.867   1.322  -2.220
  100    HB2  LYS  17           1HB      LYS  17   6.715   1.748   0.542
  101    HB3  LYS  17           2HB      LYS  17   8.375   2.040   0.040
  102    HG2  LYS  17           1HG      LYS  17   6.213   3.481  -1.395
  103    HG3  LYS  17           2HG      LYS  17   6.615   3.993   0.246
  104    HD2  LYS  17           1HD      LYS  17   8.083   5.296  -0.916
  105    HD3  LYS  17           2HD      LYS  17   9.083   3.855  -0.717
  106    HE2  LYS  17           1HE      LYS  17   9.342   4.174  -2.958
  107    HE3  LYS  17           2HE      LYS  17   7.894   3.170  -2.982
  108    HZ1  LYS  17           3HZ      LYS  17   6.997   4.809  -4.166
  109    HZ2  LYS  17           1HZ      LYS  17   8.230   5.902  -3.779
  110    HZ3  LYS  17           2HZ      LYS  17   6.922   5.694  -2.726
  111    H    CYS  18           H        CYS  18   5.873  -0.270   0.277
  112    HA   CYS  18           HA       CYS  18   7.803  -2.458   0.391
  113    HB2  CYS  18           1HB      CYS  18   6.481  -3.209   2.351
  114    HB3  CYS  18           2HB      CYS  18   7.076  -1.561   2.525
  115    H    GLY  19           H        GLY  19   4.393  -1.861  -0.340
  116    HA2  GLY  19           1HA      GLY  19   3.146  -3.025  -1.959
  117    HA3  GLY  19           2HA      GLY  19   4.360  -4.295  -1.950
  118    H    LYS  20           H        LYS  20   2.695  -2.918   0.845
  119    HA   LYS  20           HA       LYS  20   1.848  -5.595   1.613
  120    HB2  LYS  20           1HB      LYS  20   1.809  -2.936   3.040
  121    HB3  LYS  20           2HB      LYS  20   1.094  -4.393   3.718
  122    HG2  LYS  20           1HG      LYS  20   3.970  -4.254   2.865
  123    HG3  LYS  20           2HG      LYS  20   3.430  -3.808   4.485
  124    HD2  LYS  20           1HD      LYS  20   2.611  -6.012   4.898
  125    HD3  LYS  20           2HD      LYS  20   2.850  -6.478   3.213
  126    HE2  LYS  20           1HE      LYS  20   5.086  -5.650   5.054
  127    HE3  LYS  20           2HE      LYS  20   4.589  -7.324   4.813
  128    HZ1  LYS  20           3HZ      LYS  20   5.551  -5.498   2.678
  129    HZ2  LYS  20           1HZ      LYS  20   5.109  -7.118   2.473
  130    HZ3  LYS  20           2HZ      LYS  20   6.465  -6.722   3.403
  131    H    GLY  21           H        GLY  21  -0.383  -5.831   2.566
  132    HA2  GLY  21           1HA      GLY  21  -2.302  -4.641   0.691
  133    HA3  GLY  21           2HA      GLY  21  -2.557  -6.100   1.637
  134    H    TYR  22           H        TYR  22  -4.449  -4.059   1.478
  135    HA   TYR  22           HA       TYR  22  -4.854  -3.525   4.259
  136    HB2  TYR  22           1HB      TYR  22  -4.196  -1.242   2.398
  137    HB3  TYR  22           2HB      TYR  22  -5.065  -1.016   3.912
  138    HD1  TYR  22           HD1      TYR  22  -3.911  -1.767   6.067
  139    HD2  TYR  22           HD2      TYR  22  -1.856  -1.314   2.368
  140    HE1  TYR  22           HE1      TYR  22  -1.774  -1.629   7.277
  141    HE2  TYR  22           HE2      TYR  22   0.286  -1.176   3.569
  142    HH   TYR  22           HH       TYR  22   0.451  -1.572   7.086
  143    H    ASN  23           H        ASN  23  -6.967  -3.629   4.638
  144    HA   ASN  23           HA       ASN  23  -8.802  -3.481   2.370
  145    HB2  ASN  23           1HB      ASN  23  -9.460  -4.334   5.190
  146    HB3  ASN  23           2HB      ASN  23 -10.368  -4.673   3.720
  147   HD21  ASN  23          1HD2      ASN  23  -9.987  -6.511   2.686
  148   HD22  ASN  23          2HD2      ASN  23  -8.673  -7.587   3.007
  149    H    SER  24           H        SER  24  -7.723  -1.034   3.296
  150    HA   SER  24           HA       SER  24 -10.120   0.458   3.651
  151    HB2  SER  24           1HB      SER  24  -8.388  -0.076   6.024
  152    HB3  SER  24           2HB      SER  24  -9.091   1.532   5.852
  153    HG   SER  24           HG       SER  24 -10.598  -0.865   5.715
  154    H    LYS  25           H        LYS  25  -9.755   2.106   2.339
  155    HA   LYS  25           HA       LYS  25  -7.330   2.922   1.314
  156    HB2  LYS  25           1HB      LYS  25  -9.588   3.545   0.440
  157    HB3  LYS  25           2HB      LYS  25  -9.728   4.710   1.751
  158    HG2  LYS  25           1HG      LYS  25  -8.084   6.092   0.868
  159    HG3  LYS  25           2HG      LYS  25  -7.412   4.809  -0.141
  160    HD2  LYS  25           1HD      LYS  25 -10.218   5.746  -0.584
  161    HD3  LYS  25           2HD      LYS  25  -8.864   6.682  -1.223
  162    HE2  LYS  25           1HE      LYS  25  -8.052   4.509  -2.260
  163    HE3  LYS  25           2HE      LYS  25  -9.634   3.843  -1.854
  164    HZ1  LYS  25           3HZ      LYS  25 -10.420   6.010  -3.093
  165    HZ2  LYS  25           1HZ      LYS  25 -10.049   4.594  -3.941
  166    HZ3  LYS  25           2HZ      LYS  25  -8.919   5.850  -3.857
  167    H    PHE  26           H        PHE  26  -9.159   4.537   3.918
  168    HA   PHE  26           HA       PHE  26  -7.407   6.540   4.557
  169    HB2  PHE  26           1HB      PHE  26  -9.706   5.920   5.593
  170    HB3  PHE  26           2HB      PHE  26  -8.758   4.979   6.740
  171    HD1  PHE  26           HD1      PHE  26  -7.000   6.171   8.108
  172    HD2  PHE  26           HD2      PHE  26  -9.966   8.226   5.851
  173    HE1  PHE  26           HE1      PHE  26  -6.616   8.195   9.453
  174    HE2  PHE  26           HE2      PHE  26  -9.586  10.254   7.191
  175    HZ   PHE  26           HZ       PHE  26  -7.909  10.241   8.994
  176    H    ASN  27           H        ASN  27  -7.434   3.291   6.026
  177    HA   ASN  27           HA       ASN  27  -5.262   3.503   7.683
  178    HB2  ASN  27           1HB      ASN  27  -6.842   1.503   7.290
  179    HB3  ASN  27           2HB      ASN  27  -5.708   1.026   6.029
  180   HD21  ASN  27          1HD2      ASN  27  -6.533   0.400   9.068
  181   HD22  ASN  27          2HD2      ASN  27  -5.009  -0.076   9.726
  182    H    LEU  28           H        LEU  28  -5.150   2.309   4.322
  183    HA   LEU  28           HA       LEU  28  -2.491   1.917   3.978
  184    HB2  LEU  28           1HB      LEU  28  -4.227   1.581   2.254
  185    HB3  LEU  28           2HB      LEU  28  -4.281   3.325   2.002
  186    HG   LEU  28           HG       LEU  28  -1.798   3.120   1.391
  187   HD11  LEU  28          1HD1      LEU  28  -2.477   0.287   0.732
  188   HD12  LEU  28          2HD1      LEU  28  -1.813   0.696   2.313
  189   HD13  LEU  28          3HD1      LEU  28  -0.899   1.064   0.851
  190   HD21  LEU  28          3HD2      LEU  28  -2.835   3.589  -0.528
  191   HD22  LEU  28          1HD2      LEU  28  -4.209   2.554  -0.136
  192   HD23  LEU  28          2HD2      LEU  28  -2.758   1.858  -0.860
  193    H    ASP  29           H        ASP  29  -4.124   5.048   3.494
  194    HA   ASP  29           HA       ASP  29  -1.908   6.588   2.893
  195    HB2  ASP  29           1HB      ASP  29  -3.923   7.706   2.619
  196    HB3  ASP  29           2HB      ASP  29  -4.540   7.190   4.186
  197    H    MET  30           H        MET  30  -3.316   5.969   6.104
  198    HA   MET  30           HA       MET  30  -1.476   7.453   7.593
  199    HB2  MET  30           1HB      MET  30  -3.210   5.087   8.247
  200    HB3  MET  30           2HB      MET  30  -2.114   5.761   9.446
  201    HG2  MET  30           1HG      MET  30  -3.289   8.011   8.796
  202    HG3  MET  30           2HG      MET  30  -4.570   6.932   8.248
  203    HE1  MET  30           3HE      MET  30  -6.329   5.669  10.192
  204    HE2  MET  30           1HE      MET  30  -4.900   4.735   9.748
  205    HE3  MET  30           2HE      MET  30  -5.354   4.898  11.444
  206    H    HIS  31           H        HIS  31  -1.116   4.463   5.957
  207    HA   HIS  31           HA       HIS  31   1.204   3.654   7.518
  208    HB2  HIS  31           1HB      HIS  31  -0.014   1.772   6.912
  209    HB3  HIS  31           2HB      HIS  31  -0.403   2.410   5.317
  210    HD1  HIS  31           HD1      HIS  31   2.411   0.777   7.218
  211    HD2  HIS  31           HD2      HIS  31   1.363   1.730   3.312
  212    HE1  HIS  31           HE1      HIS  31   4.102  -0.387   5.766
  213    H    GLN  32           H        GLN  32   0.419   4.981   4.359
  214    HA   GLN  32           HA       GLN  32   2.750   4.691   2.969
  215    HB2  GLN  32           1HB      GLN  32   0.851   7.024   3.110
  216    HB3  GLN  32           2HB      GLN  32   2.220   7.006   2.007
  217    HG2  GLN  32           1HG      GLN  32   1.362   5.146   0.825
  218    HG3  GLN  32           2HG      GLN  32   0.136   4.845   2.056
  219   HE21  GLN  32          1HE2      GLN  32  -1.628   5.025   0.762
  220   HE22  GLN  32          2HE2      GLN  32  -2.108   6.493  -0.010
  221    H    LYS  33           H        LYS  33   2.043   7.148   5.425
  222    HA   LYS  33           HA       LYS  33   4.426   8.597   5.222
  223    HB2  LYS  33           1HB      LYS  33   3.910   9.472   7.417
  224    HB3  LYS  33           2HB      LYS  33   2.425   9.338   6.484
  225    HG2  LYS  33           1HG      LYS  33   1.580   7.684   7.801
  226    HG3  LYS  33           2HG      LYS  33   3.174   7.062   8.236
  227    HD2  LYS  33           1HD      LYS  33   3.506   9.147   9.596
  228    HD3  LYS  33           2HD      LYS  33   1.810   9.534   9.294
  229    HE2  LYS  33           1HE      LYS  33   1.863   8.466  11.396
  230    HE3  LYS  33           2HE      LYS  33   1.259   7.261  10.260
  231    HZ1  LYS  33           3HZ      LYS  33   2.826   6.106  11.478
  232    HZ2  LYS  33           1HZ      LYS  33   3.898   7.412  11.564
  233    HZ3  LYS  33           2HZ      LYS  33   3.713   6.564  10.112
  234    H    VAL  34           H        VAL  34   3.701   5.574   6.807
  235    HA   VAL  34           HA       VAL  34   5.624   5.227   8.669
  236    HB   VAL  34           HB       VAL  34   4.899   3.213   6.536
  237   HG11  VAL  34          1HG1      VAL  34   5.807   1.524   7.888
  238   HG12  VAL  34          2HG1      VAL  34   7.023   2.803   7.890
  239   HG13  VAL  34          3HG1      VAL  34   5.956   2.598   9.279
  240   HG21  VAL  34          3HG2      VAL  34   3.811   3.292   9.326
  241   HG22  VAL  34          1HG2      VAL  34   3.087   4.267   8.047
  242   HG23  VAL  34          2HG2      VAL  34   3.145   2.511   7.892
  243    H    HIS  35           H        HIS  35   6.120   4.864   5.167
  244    HA   HIS  35           HA       HIS  35   8.884   4.251   5.363
  245    HB2  HIS  35           1HB      HIS  35   7.477   5.461   2.980
  246    HB3  HIS  35           2HB      HIS  35   8.946   4.488   2.977
  247    HD1  HIS  35           HD1      HIS  35   8.371   1.964   4.216
  248    HD2  HIS  35           HD2      HIS  35   5.388   3.985   2.146
  249    HE1  HIS  35           HE1      HIS  35   6.662   0.217   3.622
  250    H    THR  36           H        THR  36  10.178   5.664   6.386
  251    HA   THR  36           HA       THR  36  10.152   8.458   5.443
  252    HB   THR  36           HB       THR  36  11.078   9.083   7.679
  253    HG1  THR  36           HG1      THR  36  11.420   7.580   9.146
  254   HG21  THR  36          3HG2      THR  36   8.927   8.879   8.890
  255   HG22  THR  36          1HG2      THR  36   8.365   7.754   7.654
  256   HG23  THR  36          2HG2      THR  36   8.722   9.428   7.227
  257    H    GLY  37           H        GLY  37  11.704   7.965   3.828
  258    HA2  GLY  37           1HA      GLY  37  14.267   6.866   4.612
  259    HA3  GLY  37           2HA      GLY  37  13.807   7.402   3.003
  260    H    GLU  38           H        GLU  38  14.599   8.644   6.237
  261    HA   GLU  38           HA       GLU  38  16.338  10.629   5.065
  262    HB2  GLU  38           1HB      GLU  38  13.837  11.489   5.230
  263    HB3  GLU  38           2HB      GLU  38  14.279  11.752   6.911
  264    HG2  GLU  38           1HG      GLU  38  14.699  13.790   5.873
  265    HG3  GLU  38           2HG      GLU  38  16.286  13.035   6.010
  266    H    ARG  39           H        ARG  39  18.090  10.712   6.292
  267    HA   ARG  39           HA       ARG  39  17.813  10.395   9.200
  268    HB2  ARG  39           1HB      ARG  39  18.535   8.241   8.476
  269    HB3  ARG  39           2HB      ARG  39  19.728   8.934   7.386
  270    HG2  ARG  39           1HG      ARG  39  20.734   9.924   9.582
  271    HG3  ARG  39           2HG      ARG  39  19.820   8.621  10.346
  272    HD2  ARG  39           1HD      ARG  39  21.023   6.962   9.218
  273    HD3  ARG  39           2HD      ARG  39  21.633   8.097   8.015
  274    HE   ARG  39           HE       ARG  39  23.307   8.717   9.475
  275   HH11  ARG  39          1HH1      ARG  39  20.982   6.703  11.104
  276   HH12  ARG  39          2HH1      ARG  39  21.969   6.475  12.510
  277   HH21  ARG  39          1HH2      ARG  39  24.616   8.425  11.320
  278   HH22  ARG  39          2HH2      ARG  39  24.036   7.456  12.632
  279    HA   PRO  40           HA       PRO  40  20.354  13.986   9.366
  280    HB2  PRO  40           1HB      PRO  40  21.289  13.731  11.902
  281    HB3  PRO  40           2HB      PRO  40  19.629  14.213  11.534
  282    HG2  PRO  40           1HG      PRO  40  20.693  11.525  12.310
  283    HG3  PRO  40           2HG      PRO  40  19.225  12.349  12.865
  284    HD2  PRO  40           1HD      PRO  40  19.180  10.406  10.980
  285    HD3  PRO  40           2HD      PRO  40  18.031  11.760  10.984
  286    H    SER  41           H        SER  41  22.642  14.605  10.147
  287    HA   SER  41           HA       SER  41  24.491  12.815   8.845
  288    HB2  SER  41           1HB      SER  41  24.541  15.335   8.624
  289    HB3  SER  41           2HB      SER  41  25.139  15.396  10.282
  290    HG   SER  41           HG       SER  41  27.002  14.474   9.664
  291    H    GLY  42           H        GLY  42  25.588  11.257   9.825
  292    HA2  GLY  42           1HA      GLY  42  25.965  11.443  12.748
  293    HA3  GLY  42           2HA      GLY  42  25.803   9.933  11.863
  294    HA   PRO  43           HA       PRO  43  30.325  11.574  12.212
  295    HB2  PRO  43           1HB      PRO  43  31.091  10.547  14.606
  296    HB3  PRO  43           2HB      PRO  43  30.431  12.177  14.427
  297    HG2  PRO  43           1HG      PRO  43  29.063   9.666  15.312
  298    HG3  PRO  43           2HG      PRO  43  28.938  11.303  15.981
  299    HD2  PRO  43           1HD      PRO  43  27.067  10.260  14.324
  300    HD3  PRO  43           2HD      PRO  43  27.458  11.991  14.352
  301    H    SER  44           H        SER  44  28.540   8.774  12.203
  302    HA   SER  44           HA       SER  44  30.894   7.027  12.028
  303    HB2  SER  44           1HB      SER  44  27.975   6.495  12.527
  304    HB3  SER  44           2HB      SER  44  29.053   5.204  11.999
  305    HG   SER  44           HG       SER  44  29.437   5.054  14.068
  306    H    SER  45           H        SER  45  27.893   7.832  10.308
  307    HA   SER  45           HA       SER  45  27.299   7.682   8.116
  308    HB2  SER  45           1HB      SER  45  29.435   9.074   7.954
  309    HB3  SER  45           2HB      SER  45  30.246   7.586   7.467
  310    HG   SER  45           HG       SER  45  28.250   7.594   5.919
  311    H    GLY  46           H        GLY  46  27.403   5.272   9.545
  312    HA2  GLY  46           1HA      GLY  46  27.217   3.386   7.484
  313    HA3  GLY  46           2HA      GLY  46  28.799   3.208   8.229
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1   2.849 -24.392  -0.513
    2    HA2  GLY   1           1HA      GLY   1   1.818 -23.154   1.416
    3    HA3  GLY   1           2HA      GLY   1   1.038 -24.694   1.086
    4    H    SER   2           H        SER   2   2.722 -22.827   3.367
    5    HA   SER   2           HA       SER   2   2.214 -24.652   5.467
    6    HB2  SER   2           1HB      SER   2   4.294 -25.620   4.234
    7    HB3  SER   2           2HB      SER   2   5.163 -24.298   5.014
    8    HG   SER   2           HG       SER   2   5.134 -26.282   6.234
    9    H    SER   3           H        SER   3   2.058 -23.539   7.314
   10    HA   SER   3           HA       SER   3   1.908 -21.669   8.631
   11    HB2  SER   3           1HB      SER   3   4.863 -21.639   7.969
   12    HB3  SER   3           2HB      SER   3   4.114 -20.791   9.322
   13    HG   SER   3           HG       SER   3   4.652 -23.492   8.989
   14    H    GLY   4           H        GLY   4   1.097 -21.075   6.049
   15    HA2  GLY   4           1HA      GLY   4   1.078 -18.310   6.005
   16    HA3  GLY   4           2HA      GLY   4   2.420 -18.792   4.977
   17    H    SER   5           H        SER   5  -0.997 -19.665   5.510
   18    HA   SER   5           HA       SER   5  -1.266 -20.077   2.616
   19    HB2  SER   5           1HB      SER   5  -3.310 -21.308   3.142
   20    HB3  SER   5           2HB      SER   5  -1.964 -21.940   4.089
   21    HG   SER   5           HG       SER   5  -4.276 -20.974   4.964
   22    H    SER   6           H        SER   6  -2.610 -18.872   1.381
   23    HA   SER   6           HA       SER   6  -4.088 -16.710   2.735
   24    HB2  SER   6           1HB      SER   6  -2.125 -15.922   1.422
   25    HB3  SER   6           2HB      SER   6  -2.847 -16.623  -0.026
   26    HG   SER   6           HG       SER   6  -4.072 -14.932  -0.179
   27    H    GLY   7           H        GLY   7  -5.871 -15.795   1.276
   28    HA2  GLY   7           1HA      GLY   7  -7.094 -17.110  -0.793
   29    HA3  GLY   7           2HA      GLY   7  -7.648 -17.955   0.645
   30    H    THR   8           H        THR   8  -9.411 -17.201   1.615
   31    HA   THR   8           HA       THR   8 -11.045 -15.251   0.624
   32    HB   THR   8           HB       THR   8 -10.822 -15.914   3.566
   33    HG1  THR   8           HG1      THR   8 -12.407 -17.196   1.574
   34   HG21  THR   8          3HG2      THR   8 -13.271 -15.136   1.995
   35   HG22  THR   8          1HG2      THR   8 -12.267 -13.959   2.840
   36   HG23  THR   8          2HG2      THR   8 -13.085 -15.232   3.746
   37    H    GLY   9           H        GLY   9 -10.742 -13.148   0.322
   38    HA2  GLY   9           1HA      GLY   9 -10.532 -11.099   1.919
   39    HA3  GLY   9           2HA      GLY   9  -8.892 -11.707   2.089
   40    H    GLU  10           H        GLU  10 -10.371  -9.279   0.768
   41    HA   GLU  10           HA       GLU  10  -8.833  -9.383  -1.744
   42    HB2  GLU  10           1HB      GLU  10 -11.477  -9.222  -1.717
   43    HB3  GLU  10           2HB      GLU  10 -11.143  -7.519  -1.435
   44    HG2  GLU  10           1HG      GLU  10  -9.881  -9.009  -3.706
   45    HG3  GLU  10           2HG      GLU  10 -11.487  -8.295  -3.841
   46    H    LYS  11           H        LYS  11  -7.091  -8.146  -1.629
   47    HA   LYS  11           HA       LYS  11  -7.181  -5.713   0.024
   48    HB2  LYS  11           1HB      LYS  11  -4.883  -7.458  -0.858
   49    HB3  LYS  11           2HB      LYS  11  -4.647  -5.869  -0.141
   50    HG2  LYS  11           1HG      LYS  11  -4.414  -7.281   1.666
   51    HG3  LYS  11           2HG      LYS  11  -6.102  -6.781   1.789
   52    HD2  LYS  11           1HD      LYS  11  -6.079  -9.122   2.138
   53    HD3  LYS  11           2HD      LYS  11  -6.683  -8.877   0.497
   54    HE2  LYS  11           1HE      LYS  11  -4.549  -9.445  -0.436
   55    HE3  LYS  11           2HE      LYS  11  -3.808  -9.490   1.163
   56    HZ1  LYS  11           3HZ      LYS  11  -5.571 -11.443  -0.123
   57    HZ2  LYS  11           1HZ      LYS  11  -5.649 -11.286   1.559
   58    HZ3  LYS  11           2HZ      LYS  11  -4.187 -11.694   0.815
   59    HA   PRO  12           HA       PRO  12  -7.182  -4.134  -4.310
   60    HB2  PRO  12           1HB      PRO  12  -8.807  -2.028  -3.769
   61    HB3  PRO  12           2HB      PRO  12  -9.420  -3.640  -4.155
   62    HG2  PRO  12           1HG      PRO  12  -9.081  -2.332  -1.484
   63    HG3  PRO  12           2HG      PRO  12 -10.435  -3.304  -2.090
   64    HD2  PRO  12           1HD      PRO  12  -8.535  -4.316  -0.446
   65    HD3  PRO  12           2HD      PRO  12  -9.351  -5.297  -1.680
   66    H    TYR  13           H        TYR  13  -6.423  -2.808  -1.203
   67    HA   TYR  13           HA       TYR  13  -4.995  -0.559  -2.441
   68    HB2  TYR  13           1HB      TYR  13  -6.025  -1.055   0.339
   69    HB3  TYR  13           2HB      TYR  13  -4.781   0.155   0.042
   70    HD1  TYR  13           HD2      TYR  13  -5.384   1.784  -2.011
   71    HD2  TYR  13           HD1      TYR  13  -8.207  -0.321   0.377
   72    HE1  TYR  13           HE2      TYR  13  -7.116   3.420  -2.625
   73    HE2  TYR  13           HE1      TYR  13  -9.946   1.308  -0.232
   74    HH   TYR  13           HH       TYR  13  -9.419   3.728  -2.681
   75    H    LYS  14           H        LYS  14  -3.140  -1.573  -3.151
   76    HA   LYS  14           HA       LYS  14  -1.494  -2.929  -1.129
   77    HB2  LYS  14           1HB      LYS  14  -2.081  -4.031  -3.377
   78    HB3  LYS  14           2HB      LYS  14  -0.950  -2.887  -4.090
   79    HG2  LYS  14           1HG      LYS  14  -0.035  -4.528  -1.787
   80    HG3  LYS  14           2HG      LYS  14  -0.196  -5.298  -3.368
   81    HD2  LYS  14           1HD      LYS  14   1.287  -2.711  -3.051
   82    HD3  LYS  14           2HD      LYS  14   2.075  -4.257  -2.725
   83    HE2  LYS  14           1HE      LYS  14   1.831  -4.974  -4.942
   84    HE3  LYS  14           2HE      LYS  14   0.612  -3.751  -5.296
   85    HZ1  LYS  14           3HZ      LYS  14   2.424  -2.072  -4.931
   86    HZ2  LYS  14           1HZ      LYS  14   2.597  -3.037  -6.310
   87    HZ3  LYS  14           2HZ      LYS  14   3.525  -3.357  -4.933
   88    H    CYS  15           H        CYS  15   0.252  -1.958  -0.335
   89    HA   CYS  15           HA       CYS  15   0.927   0.700  -1.068
   90    HB2  CYS  15           1HB      CYS  15   1.211  -0.254   1.221
   91    HB3  CYS  15           2HB      CYS  15   2.538  -1.235   0.607
   92    H    GLU  16           H        GLU  16   2.352   1.454  -2.503
   93    HA   GLU  16           HA       GLU  16   3.845  -0.466  -4.105
   94    HB2  GLU  16           1HB      GLU  16   2.967   2.358  -4.444
   95    HB3  GLU  16           2HB      GLU  16   4.411   1.846  -5.305
   96    HG2  GLU  16           1HG      GLU  16   3.267   0.423  -6.671
   97    HG3  GLU  16           2HG      GLU  16   1.986   0.143  -5.493
   98    H    LYS  17           H        LYS  17   4.483   0.771  -1.281
   99    HA   LYS  17           HA       LYS  17   7.189   1.733  -1.855
  100    HB2  LYS  17           1HB      LYS  17   5.690   1.667   0.770
  101    HB3  LYS  17           2HB      LYS  17   7.245   2.437   0.483
  102    HG2  LYS  17           1HG      LYS  17   4.914   3.268  -1.169
  103    HG3  LYS  17           2HG      LYS  17   5.022   3.825   0.503
  104    HD2  LYS  17           1HD      LYS  17   7.442   4.494  -0.131
  105    HD3  LYS  17           2HD      LYS  17   6.868   4.365  -1.795
  106    HE2  LYS  17           1HE      LYS  17   5.542   6.053   0.321
  107    HE3  LYS  17           2HE      LYS  17   6.742   6.665  -0.816
  108    HZ1  LYS  17           3HZ      LYS  17   4.238   5.339  -1.683
  109    HZ2  LYS  17           1HZ      LYS  17   5.313   6.245  -2.625
  110    HZ3  LYS  17           2HZ      LYS  17   4.360   7.011  -1.457
  111    H    CYS  18           H        CYS  18   5.550  -0.613   0.268
  112    HA   CYS  18           HA       CYS  18   8.074  -2.125   0.402
  113    HB2  CYS  18           1HB      CYS  18   7.062  -3.177   2.452
  114    HB3  CYS  18           2HB      CYS  18   7.400  -1.455   2.599
  115    H    GLY  19           H        GLY  19   4.541  -2.551   0.237
  116    HA2  GLY  19           1HA      GLY  19   3.791  -4.006  -1.648
  117    HA3  GLY  19           2HA      GLY  19   5.034  -5.131  -1.120
  118    H    LYS  20           H        LYS  20   2.807  -3.278   0.906
  119    HA   LYS  20           HA       LYS  20   1.811  -5.823   1.985
  120    HB2  LYS  20           1HB      LYS  20   2.892  -3.851   3.387
  121    HB3  LYS  20           2HB      LYS  20   1.259  -3.203   3.307
  122    HG2  LYS  20           1HG      LYS  20   1.203  -4.380   5.277
  123    HG3  LYS  20           2HG      LYS  20   0.566  -5.567   4.137
  124    HD2  LYS  20           1HD      LYS  20   2.505  -6.826   4.162
  125    HD3  LYS  20           2HD      LYS  20   3.503  -5.467   4.683
  126    HE2  LYS  20           1HE      LYS  20   3.386  -6.732   6.608
  127    HE3  LYS  20           2HE      LYS  20   2.062  -5.592   6.847
  128    HZ1  LYS  20           3HZ      LYS  20   1.745  -8.337   5.758
  129    HZ2  LYS  20           1HZ      LYS  20   0.503  -7.250   6.131
  130    HZ3  LYS  20           2HZ      LYS  20   1.455  -7.902   7.367
  131    H    GLY  21           H        GLY  21  -0.440  -6.085   2.415
  132    HA2  GLY  21           1HA      GLY  21  -2.106  -4.599   0.504
  133    HA3  GLY  21           2HA      GLY  21  -2.480  -6.177   1.179
  134    H    TYR  22           H        TYR  22  -4.220  -3.898   1.079
  135    HA   TYR  22           HA       TYR  22  -4.836  -3.722   3.924
  136    HB2  TYR  22           1HB      TYR  22  -4.232  -1.383   2.147
  137    HB3  TYR  22           2HB      TYR  22  -5.383  -1.208   3.467
  138    HD1  TYR  22           HD2      TYR  22  -1.863  -1.914   2.628
  139    HD2  TYR  22           HD1      TYR  22  -4.650  -1.110   5.741
  140    HE1  TYR  22           HE2      TYR  22  -0.001  -1.545   4.192
  141    HE2  TYR  22           HE1      TYR  22  -2.795  -0.738   7.313
  142    HH   TYR  22           HH       TYR  22   0.573  -1.218   6.328
  143    H    ASN  23           H        ASN  23  -7.031  -3.127   4.361
  144    HA   ASN  23           HA       ASN  23  -8.812  -3.532   2.049
  145    HB2  ASN  23           1HB      ASN  23  -8.945  -4.539   4.869
  146    HB3  ASN  23           2HB      ASN  23 -10.434  -4.311   3.956
  147   HD21  ASN  23          1HD2      ASN  23  -7.570  -6.184   4.342
  148   HD22  ASN  23          2HD2      ASN  23  -7.969  -7.423   3.206
  149    H    SER  24           H        SER  24  -7.729  -1.013   3.199
  150    HA   SER  24           HA       SER  24 -10.196   0.454   3.213
  151    HB2  SER  24           1HB      SER  24  -8.687  -0.015   5.744
  152    HB3  SER  24           2HB      SER  24  -9.371   1.589   5.477
  153    HG   SER  24           HG       SER  24 -10.793  -0.868   5.397
  154    H    LYS  25           H        LYS  25  -9.913   2.542   2.578
  155    HA   LYS  25           HA       LYS  25  -7.470   3.268   1.376
  156    HB2  LYS  25           1HB      LYS  25  -8.526   5.346   0.828
  157    HB3  LYS  25           2HB      LYS  25  -9.740   4.081   0.693
  158    HG2  LYS  25           1HG      LYS  25 -10.546   4.699   2.963
  159    HG3  LYS  25           2HG      LYS  25  -9.420   6.058   2.939
  160    HD2  LYS  25           1HD      LYS  25 -11.283   5.737   0.642
  161    HD3  LYS  25           2HD      LYS  25 -11.941   6.321   2.173
  162    HE2  LYS  25           1HE      LYS  25 -10.086   8.038   2.166
  163    HE3  LYS  25           2HE      LYS  25  -9.753   7.546   0.506
  164    HZ1  LYS  25           3HZ      LYS  25 -11.962   8.195  -0.129
  165    HZ2  LYS  25           1HZ      LYS  25 -11.215   9.495   0.655
  166    HZ3  LYS  25           2HZ      LYS  25 -12.369   8.566   1.471
  167    H    PHE  26           H        PHE  26  -9.048   4.389   4.355
  168    HA   PHE  26           HA       PHE  26  -7.182   6.318   5.097
  169    HB2  PHE  26           1HB      PHE  26  -9.480   5.698   6.147
  170    HB3  PHE  26           2HB      PHE  26  -8.543   4.586   7.139
  171    HD1  PHE  26           HD1      PHE  26  -6.998   5.407   8.810
  172    HD2  PHE  26           HD2      PHE  26  -9.282   8.087   6.420
  173    HE1  PHE  26           HE1      PHE  26  -6.456   7.242  10.357
  174    HE2  PHE  26           HE2      PHE  26  -8.744   9.927   7.962
  175    HZ   PHE  26           HZ       PHE  26  -7.329   9.506   9.933
  176    H    ASN  27           H        ASN  27  -7.364   2.927   6.190
  177    HA   ASN  27           HA       ASN  27  -5.131   2.805   7.763
  178    HB2  ASN  27           1HB      ASN  27  -6.032   0.664   5.823
  179    HB3  ASN  27           2HB      ASN  27  -5.022   0.415   7.244
  180   HD21  ASN  27          1HD2      ASN  27  -6.684  -1.134   7.819
  181   HD22  ASN  27          2HD2      ASN  27  -8.105  -0.581   8.631
  182    H    LEU  28           H        LEU  28  -5.288   2.743   4.250
  183    HA   LEU  28           HA       LEU  28  -2.505   2.167   3.894
  184    HB2  LEU  28           1HB      LEU  28  -4.159   1.570   2.206
  185    HB3  LEU  28           2HB      LEU  28  -4.550   3.273   1.974
  186    HG   LEU  28           HG       LEU  28  -2.161   3.588   1.207
  187   HD11  LEU  28          1HD1      LEU  28  -0.711   1.904   1.172
  188   HD12  LEU  28          2HD1      LEU  28  -1.871   0.825   0.397
  189   HD13  LEU  28          3HD1      LEU  28  -1.867   1.000   2.152
  190   HD21  LEU  28          3HD2      LEU  28  -4.405   2.352  -0.166
  191   HD22  LEU  28          1HD2      LEU  28  -2.855   1.976  -0.920
  192   HD23  LEU  28          2HD2      LEU  28  -3.337   3.656  -0.686
  193    H    ASP  29           H        ASP  29  -4.507   5.087   3.710
  194    HA   ASP  29           HA       ASP  29  -2.619   6.907   2.840
  195    HB2  ASP  29           1HB      ASP  29  -4.926   7.558   3.058
  196    HB3  ASP  29           2HB      ASP  29  -4.892   7.279   4.797
  197    H    MET  30           H        MET  30  -3.167   5.658   6.094
  198    HA   MET  30           HA       MET  30  -1.290   7.399   7.356
  199    HB2  MET  30           1HB      MET  30  -2.793   4.943   8.174
  200    HB3  MET  30           2HB      MET  30  -1.463   5.512   9.174
  201    HG2  MET  30           1HG      MET  30  -2.595   7.734   9.274
  202    HG3  MET  30           2HG      MET  30  -3.972   7.001   8.455
  203    HE1  MET  30           3HE      MET  30  -2.597   7.617  12.245
  204    HE2  MET  30           1HE      MET  30  -3.514   8.572  11.080
  205    HE3  MET  30           2HE      MET  30  -4.345   7.780  12.419
  206    H    HIS  31           H        HIS  31  -1.169   3.865   6.860
  207    HA   HIS  31           HA       HIS  31   1.343   3.261   7.567
  208    HB2  HIS  31           1HB      HIS  31  -0.062   1.545   6.668
  209    HB3  HIS  31           2HB      HIS  31  -0.123   2.335   5.094
  210    HD1  HIS  31           HD1      HIS  31   2.235   0.395   7.309
  211    HD2  HIS  31           HD2      HIS  31   1.916   1.672   3.369
  212    HE1  HIS  31           HE1      HIS  31   4.091  -0.768   6.073
  213    H    GLN  32           H        GLN  32   0.441   5.091   4.721
  214    HA   GLN  32           HA       GLN  32   2.775   5.040   3.252
  215    HB2  GLN  32           1HB      GLN  32   0.716   7.189   3.673
  216    HB3  GLN  32           2HB      GLN  32   2.106   7.459   2.630
  217    HG2  GLN  32           1HG      GLN  32   1.453   5.617   1.216
  218    HG3  GLN  32           2HG      GLN  32   0.116   5.227   2.297
  219   HE21  GLN  32          1HE2      GLN  32  -1.117   5.445   0.283
  220   HE22  GLN  32          2HE2      GLN  32  -1.672   7.015  -0.178
  221    H    LYS  33           H        LYS  33   1.937   7.244   5.912
  222    HA   LYS  33           HA       LYS  33   4.146   8.867   5.944
  223    HB2  LYS  33           1HB      LYS  33   3.590   9.430   8.136
  224    HB3  LYS  33           2HB      LYS  33   2.066   8.842   7.484
  225    HG2  LYS  33           1HG      LYS  33   2.286   6.766   8.615
  226    HG3  LYS  33           2HG      LYS  33   3.954   7.120   9.068
  227    HD2  LYS  33           1HD      LYS  33   2.802   7.586  11.022
  228    HD3  LYS  33           2HD      LYS  33   2.920   9.178  10.269
  229    HE2  LYS  33           1HE      LYS  33   0.695   9.088  10.903
  230    HE3  LYS  33           2HE      LYS  33   0.630   8.575   9.217
  231    HZ1  LYS  33           3HZ      LYS  33   0.185   6.420   9.796
  232    HZ2  LYS  33           1HZ      LYS  33  -0.606   7.233  11.051
  233    HZ3  LYS  33           2HZ      LYS  33   0.915   6.542  11.317
  234    H    VAL  34           H        VAL  34   3.968   5.509   6.723
  235    HA   VAL  34           HA       VAL  34   6.187   5.201   8.384
  236    HB   VAL  34           HB       VAL  34   5.217   3.273   6.269
  237   HG11  VAL  34          1HG1      VAL  34   6.232   1.560   7.735
  238   HG12  VAL  34          2HG1      VAL  34   7.420   2.678   7.062
  239   HG13  VAL  34          3HG1      VAL  34   6.897   2.849   8.738
  240   HG21  VAL  34          3HG2      VAL  34   3.580   4.162   8.075
  241   HG22  VAL  34          1HG2      VAL  34   3.682   2.426   7.783
  242   HG23  VAL  34          2HG2      VAL  34   4.504   3.136   9.173
  243    H    HIS  35           H        HIS  35   5.977   5.210   4.843
  244    HA   HIS  35           HA       HIS  35   8.874   4.999   4.623
  245    HB2  HIS  35           1HB      HIS  35   6.955   5.353   2.329
  246    HB3  HIS  35           2HB      HIS  35   8.554   4.613   2.316
  247    HD1  HIS  35           HD1      HIS  35   8.693   2.257   3.673
  248    HD2  HIS  35           HD2      HIS  35   4.907   3.588   2.597
  249    HE1  HIS  35           HE1      HIS  35   7.200   0.240   3.833
  250    H    THR  36           H        THR  36   9.400   7.028   5.580
  251    HA   THR  36           HA       THR  36   8.991   9.297   3.746
  252    HB   THR  36           HB       THR  36   7.605   9.627   5.749
  253    HG1  THR  36           HG1      THR  36   9.886  11.340   5.718
  254   HG21  THR  36          3HG2      THR  36   8.305   9.220   7.834
  255   HG22  THR  36          1HG2      THR  36   9.796  10.129   7.594
  256   HG23  THR  36          2HG2      THR  36   9.706   8.437   7.103
  257    H    GLY  37           H        GLY  37  11.182   7.632   3.545
  258    HA2  GLY  37           1HA      GLY  37  13.349   9.198   4.800
  259    HA3  GLY  37           2HA      GLY  37  13.493   7.514   4.317
  260    H    GLU  38           H        GLU  38  12.629   7.404   1.803
  261    HA   GLU  38           HA       GLU  38  14.753   8.543   0.329
  262    HB2  GLU  38           1HB      GLU  38  13.293   6.431  -0.147
  263    HB3  GLU  38           2HB      GLU  38  12.236   7.566  -0.975
  264    HG2  GLU  38           1HG      GLU  38  14.039   8.216  -2.452
  265    HG3  GLU  38           2HG      GLU  38  15.153   7.155  -1.591
  266    H    ARG  39           H        ARG  39  14.966  10.557  -0.357
  267    HA   ARG  39           HA       ARG  39  12.603  12.018  -1.282
  268    HB2  ARG  39           1HB      ARG  39  12.832  12.823   0.953
  269    HB3  ARG  39           2HB      ARG  39  14.574  12.991   0.783
  270    HG2  ARG  39           1HG      ARG  39  13.901  14.667  -1.124
  271    HG3  ARG  39           2HG      ARG  39  12.390  14.743  -0.215
  272    HD2  ARG  39           1HD      ARG  39  13.560  16.420   0.808
  273    HD3  ARG  39           2HD      ARG  39  14.021  15.056   1.825
  274    HE   ARG  39           HE       ARG  39  15.932  15.122  -0.116
  275   HH11  ARG  39          1HH1      ARG  39  14.689  17.427   2.177
  276   HH12  ARG  39          2HH1      ARG  39  16.187  18.286   2.324
  277   HH21  ARG  39          1HH2      ARG  39  17.910  16.244   0.068
  278   HH22  ARG  39          2HH2      ARG  39  18.018  17.612   1.123
  279    HA   PRO  40           HA       PRO  40  15.261  13.073  -4.630
  280    HB2  PRO  40           1HB      PRO  40  13.929  15.246  -5.564
  281    HB3  PRO  40           2HB      PRO  40  13.346  13.593  -5.787
  282    HG2  PRO  40           1HG      PRO  40  12.519  15.635  -3.761
  283    HG3  PRO  40           2HG      PRO  40  11.510  14.528  -4.710
  284    HD2  PRO  40           1HD      PRO  40  12.166  14.049  -2.127
  285    HD3  PRO  40           2HD      PRO  40  11.927  12.746  -3.308
  286    H    SER  41           H        SER  41  16.318  15.116  -5.588
  287    HA   SER  41           HA       SER  41  17.421  16.674  -3.353
  288    HB2  SER  41           1HB      SER  41  18.570  16.103  -6.096
  289    HB3  SER  41           2HB      SER  41  19.348  17.096  -4.863
  290    HG   SER  41           HG       SER  41  20.201  15.137  -4.524
  291    H    GLY  42           H        GLY  42  15.434  18.013  -3.511
  292    HA2  GLY  42           1HA      GLY  42  15.660  20.517  -4.222
  293    HA3  GLY  42           2HA      GLY  42  15.401  19.826  -5.817
  294    HA   PRO  43           HA       PRO  43  11.343  19.303  -3.177
  295    HB2  PRO  43           1HB      PRO  43  11.103  21.088  -1.146
  296    HB3  PRO  43           2HB      PRO  43  11.811  19.482  -0.935
  297    HG2  PRO  43           1HG      PRO  43  13.176  22.122  -1.297
  298    HG3  PRO  43           2HG      PRO  43  13.569  20.803  -0.178
  299    HD2  PRO  43           1HD      PRO  43  14.913  21.197  -2.495
  300    HD3  PRO  43           2HD      PRO  43  14.660  19.583  -1.801
  301    H    SER  44           H        SER  44   9.453  20.374  -3.686
  302    HA   SER  44           HA       SER  44   9.265  23.183  -4.043
  303    HB2  SER  44           1HB      SER  44   9.050  23.271  -6.473
  304    HB3  SER  44           2HB      SER  44  10.639  22.644  -6.035
  305    HG   SER  44           HG       SER  44   8.383  21.159  -6.901
  306    H    SER  45           H        SER  45   7.153  23.866  -4.495
  307    HA   SER  45           HA       SER  45   4.881  23.748  -4.491
  308    HB2  SER  45           1HB      SER  45   5.318  21.003  -5.693
  309    HB3  SER  45           2HB      SER  45   3.801  21.903  -5.696
  310    HG   SER  45           HG       SER  45   4.667  23.368  -7.085
  311    H    GLY  46           H        GLY  46   6.164  23.155  -2.112
  312    HA2  GLY  46           1HA      GLY  46   5.594  20.814  -0.797
  313    HA3  GLY  46           2HA      GLY  46   5.605  22.389  -0.016
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1  14.231 -13.689  -1.687
    2    HA2  GLY   1           1HA      GLY   1  12.132 -14.379  -0.501
    3    HA3  GLY   1           2HA      GLY   1  11.873 -12.663  -0.230
    4    H    SER   2           H        SER   2   9.934 -14.175  -1.441
    5    HA   SER   2           HA       SER   2   9.906 -12.995  -4.122
    6    HB2  SER   2           1HB      SER   2   9.564 -15.895  -3.444
    7    HB3  SER   2           2HB      SER   2   8.685 -15.213  -4.813
    8    HG   SER   2           HG       SER   2  10.970 -16.136  -5.058
    9    H    SER   3           H        SER   3   7.789 -12.666  -4.989
   10    HA   SER   3           HA       SER   3   5.793 -12.287  -2.888
   11    HB2  SER   3           1HB      SER   3   5.861 -11.258  -5.735
   12    HB3  SER   3           2HB      SER   3   4.650 -10.838  -4.523
   13    HG   SER   3           HG       SER   3   6.352  -9.281  -4.708
   14    H    GLY   4           H        GLY   4   3.563 -12.862  -3.243
   15    HA2  GLY   4           1HA      GLY   4   2.937 -14.717  -5.378
   16    HA3  GLY   4           2HA      GLY   4   3.012 -15.443  -3.780
   17    H    SER   5           H        SER   5   1.738 -14.075  -2.081
   18    HA   SER   5           HA       SER   5  -0.961 -14.282  -2.661
   19    HB2  SER   5           1HB      SER   5   0.231 -12.402  -0.612
   20    HB3  SER   5           2HB      SER   5  -1.375 -13.131  -0.582
   21    HG   SER   5           HG       SER   5   0.010 -15.193  -0.678
   22    H    SER   6           H        SER   6  -1.850 -13.258  -4.355
   23    HA   SER   6           HA       SER   6  -2.174 -10.403  -4.225
   24    HB2  SER   6           1HB      SER   6   0.015 -10.625  -5.390
   25    HB3  SER   6           2HB      SER   6  -0.780 -11.576  -6.644
   26    HG   SER   6           HG       SER   6  -1.774  -9.034  -5.979
   27    H    GLY   7           H        GLY   7  -4.297 -10.249  -4.507
   28    HA2  GLY   7           1HA      GLY   7  -5.492 -11.508  -6.868
   29    HA3  GLY   7           2HA      GLY   7  -6.188 -11.885  -5.299
   30    H    THR   8           H        THR   8  -7.902 -10.851  -6.995
   31    HA   THR   8           HA       THR   8  -7.984  -7.951  -6.619
   32    HB   THR   8           HB       THR   8  -8.423  -8.786  -8.884
   33    HG1  THR   8           HG1      THR   8 -10.599  -7.587  -7.499
   34   HG21  THR   8          3HG2      THR   8  -9.765 -10.835  -7.655
   35   HG22  THR   8          1HG2      THR   8  -9.844 -10.456  -9.375
   36   HG23  THR   8          2HG2      THR   8 -11.084  -9.845  -8.279
   37    H    GLY   9           H        GLY   9  -9.406  -6.942  -5.310
   38    HA2  GLY   9           1HA      GLY   9 -11.415  -6.693  -4.098
   39    HA3  GLY   9           2HA      GLY   9 -11.691  -8.422  -4.245
   40    H    GLU  10           H        GLU  10  -9.207  -9.345  -3.303
   41    HA   GLU  10           HA       GLU  10  -9.672  -9.291  -0.514
   42    HB2  GLU  10           1HB      GLU  10  -7.529 -10.413  -2.276
   43    HB3  GLU  10           2HB      GLU  10  -7.273 -10.366  -0.537
   44    HG2  GLU  10           1HG      GLU  10  -8.140 -12.486  -0.939
   45    HG3  GLU  10           2HG      GLU  10  -9.516 -11.558  -0.344
   46    H    LYS  11           H        LYS  11  -7.178  -7.792  -2.547
   47    HA   LYS  11           HA       LYS  11  -6.640  -5.912  -0.350
   48    HB2  LYS  11           1HB      LYS  11  -4.553  -7.124  -2.172
   49    HB3  LYS  11           2HB      LYS  11  -4.258  -5.933  -0.911
   50    HG2  LYS  11           1HG      LYS  11  -4.561  -7.459   0.790
   51    HG3  LYS  11           2HG      LYS  11  -5.526  -8.543  -0.214
   52    HD2  LYS  11           1HD      LYS  11  -3.646  -9.391  -1.311
   53    HD3  LYS  11           2HD      LYS  11  -2.634  -8.029  -0.824
   54    HE2  LYS  11           1HE      LYS  11  -1.875  -9.602   0.642
   55    HE3  LYS  11           2HE      LYS  11  -3.204  -8.940   1.593
   56    HZ1  LYS  11           3HZ      LYS  11  -3.960 -11.009   1.713
   57    HZ2  LYS  11           1HZ      LYS  11  -2.866 -11.571   0.551
   58    HZ3  LYS  11           2HZ      LYS  11  -4.345 -10.907   0.069
   59    HA   PRO  12           HA       PRO  12  -7.751  -3.603  -4.188
   60    HB2  PRO  12           1HB      PRO  12  -9.214  -1.721  -2.890
   61    HB3  PRO  12           2HB      PRO  12  -9.885  -3.273  -3.404
   62    HG2  PRO  12           1HG      PRO  12  -8.904  -2.436  -0.703
   63    HG3  PRO  12           2HG      PRO  12 -10.354  -3.363  -1.128
   64    HD2  PRO  12           1HD      PRO  12  -8.093  -4.536  -0.212
   65    HD3  PRO  12           2HD      PRO  12  -9.179  -5.331  -1.369
   66    H    TYR  13           H        TYR  13  -6.454  -2.635  -1.078
   67    HA   TYR  13           HA       TYR  13  -5.053  -0.407  -2.407
   68    HB2  TYR  13           1HB      TYR  13  -5.897  -0.598   0.492
   69    HB3  TYR  13           2HB      TYR  13  -5.010   0.739  -0.232
   70    HD1  TYR  13           HD2      TYR  13  -6.247   1.679  -2.458
   71    HD2  TYR  13           HD1      TYR  13  -8.147  -0.257   0.821
   72    HE1  TYR  13           HE2      TYR  13  -8.369   2.772  -3.049
   73    HE2  TYR  13           HE1      TYR  13 -10.275   0.830   0.237
   74    HH   TYR  13           HH       TYR  13 -10.752   3.267  -1.237
   75    H    LYS  14           H        LYS  14  -3.279  -1.702  -2.963
   76    HA   LYS  14           HA       LYS  14  -1.727  -2.806  -0.724
   77    HB2  LYS  14           1HB      LYS  14  -0.400  -3.834  -2.725
   78    HB3  LYS  14           2HB      LYS  14  -1.941  -4.534  -2.247
   79    HG2  LYS  14           1HG      LYS  14  -3.038  -3.730  -4.104
   80    HG3  LYS  14           2HG      LYS  14  -1.873  -2.428  -4.359
   81    HD2  LYS  14           1HD      LYS  14  -1.377  -5.371  -4.813
   82    HD3  LYS  14           2HD      LYS  14  -1.647  -4.158  -6.067
   83    HE2  LYS  14           1HE      LYS  14   0.373  -2.952  -4.957
   84    HE3  LYS  14           2HE      LYS  14   0.715  -4.539  -4.271
   85    HZ1  LYS  14           3HZ      LYS  14   0.456  -5.303  -6.720
   86    HZ2  LYS  14           1HZ      LYS  14   1.906  -4.592  -6.214
   87    HZ3  LYS  14           2HZ      LYS  14   0.775  -3.682  -7.082
   88    H    CYS  15           H        CYS  15   0.201  -1.973  -0.175
   89    HA   CYS  15           HA       CYS  15   1.037   0.489  -1.433
   90    HB2  CYS  15           1HB      CYS  15   1.064   0.242   1.023
   91    HB3  CYS  15           2HB      CYS  15   2.268  -1.034   0.874
   92    H    GLU  16           H        GLU  16   2.663   0.755  -2.834
   93    HA   GLU  16           HA       GLU  16   4.026  -1.596  -3.831
   94    HB2  GLU  16           1HB      GLU  16   3.067   0.256  -5.285
   95    HB3  GLU  16           2HB      GLU  16   4.412   1.251  -4.745
   96    HG2  GLU  16           1HG      GLU  16   5.916  -0.622  -5.598
   97    HG3  GLU  16           2HG      GLU  16   4.480  -1.233  -6.418
   98    H    LYS  17           H        LYS  17   4.768   1.276  -1.974
   99    HA   LYS  17           HA       LYS  17   7.502   1.411  -2.108
  100    HB2  LYS  17           1HB      LYS  17   5.801   1.739   0.371
  101    HB3  LYS  17           2HB      LYS  17   7.445   2.332   0.179
  102    HG2  LYS  17           1HG      LYS  17   5.375   3.185  -1.782
  103    HG3  LYS  17           2HG      LYS  17   5.388   3.912  -0.173
  104    HD2  LYS  17           1HD      LYS  17   7.560   4.779  -0.473
  105    HD3  LYS  17           2HD      LYS  17   7.857   3.761  -1.884
  106    HE2  LYS  17           1HE      LYS  17   5.919   5.028  -2.972
  107    HE3  LYS  17           2HE      LYS  17   6.093   6.182  -1.651
  108    HZ1  LYS  17           3HZ      LYS  17   8.626   5.916  -2.522
  109    HZ2  LYS  17           1HZ      LYS  17   7.569   7.149  -2.998
  110    HZ3  LYS  17           2HZ      LYS  17   7.758   5.776  -3.968
  111    H    CYS  18           H        CYS  18   5.576  -0.683   0.023
  112    HA   CYS  18           HA       CYS  18   8.021  -2.225   0.587
  113    HB2  CYS  18           1HB      CYS  18   6.665  -3.097   2.564
  114    HB3  CYS  18           2HB      CYS  18   7.185  -1.417   2.646
  115    H    GLY  19           H        GLY  19   4.519  -2.585   0.045
  116    HA2  GLY  19           1HA      GLY  19   3.842  -4.154  -1.724
  117    HA3  GLY  19           2HA      GLY  19   5.097  -5.233  -1.133
  118    H    LYS  20           H        LYS  20   2.861  -3.389   0.868
  119    HA   LYS  20           HA       LYS  20   1.836  -5.932   1.922
  120    HB2  LYS  20           1HB      LYS  20   2.291  -3.234   3.088
  121    HB3  LYS  20           2HB      LYS  20   0.934  -4.162   3.711
  122    HG2  LYS  20           1HG      LYS  20   2.799  -4.590   5.112
  123    HG3  LYS  20           2HG      LYS  20   2.523  -6.041   4.146
  124    HD2  LYS  20           1HD      LYS  20   4.285  -5.204   2.565
  125    HD3  LYS  20           2HD      LYS  20   4.641  -3.935   3.738
  126    HE2  LYS  20           1HE      LYS  20   4.779  -6.901   4.273
  127    HE3  LYS  20           2HE      LYS  20   6.162  -5.860   3.940
  128    HZ1  LYS  20           3HZ      LYS  20   4.339  -5.210   6.158
  129    HZ2  LYS  20           1HZ      LYS  20   5.972  -4.810   5.963
  130    HZ3  LYS  20           2HZ      LYS  20   5.532  -6.392   6.370
  131    H    GLY  21           H        GLY  21  -0.454  -6.021   2.536
  132    HA2  GLY  21           1HA      GLY  21  -2.096  -4.536   0.586
  133    HA3  GLY  21           2HA      GLY  21  -2.485  -6.129   1.219
  134    H    TYR  22           H        TYR  22  -4.245  -3.904   1.200
  135    HA   TYR  22           HA       TYR  22  -4.796  -3.751   4.059
  136    HB2  TYR  22           1HB      TYR  22  -4.183  -1.417   2.301
  137    HB3  TYR  22           2HB      TYR  22  -5.426  -1.229   3.534
  138    HD1  TYR  22           HD1      TYR  22  -4.849  -1.350   5.911
  139    HD2  TYR  22           HD2      TYR  22  -1.857  -1.648   2.900
  140    HE1  TYR  22           HE1      TYR  22  -3.113  -0.932   7.602
  141    HE2  TYR  22           HE2      TYR  22  -0.113  -1.231   4.583
  142    HH   TYR  22           HH       TYR  22  -0.560   0.101   7.402
  143    H    ASN  23           H        ASN  23  -6.988  -3.249   4.556
  144    HA   ASN  23           HA       ASN  23  -8.816  -3.639   2.277
  145    HB2  ASN  23           1HB      ASN  23  -9.405  -4.395   5.140
  146    HB3  ASN  23           2HB      ASN  23 -10.284  -4.876   3.691
  147   HD21  ASN  23          1HD2      ASN  23  -9.874  -6.822   2.950
  148   HD22  ASN  23          2HD2      ASN  23  -8.445  -7.746   3.248
  149    H    SER  24           H        SER  24  -7.889  -1.085   3.100
  150    HA   SER  24           HA       SER  24 -10.393   0.247   3.432
  151    HB2  SER  24           1HB      SER  24  -8.394   0.407   5.700
  152    HB3  SER  24           2HB      SER  24  -9.813   1.439   5.530
  153    HG   SER  24           HG       SER  24 -11.116  -0.260   5.926
  154    H    LYS  25           H        LYS  25  -9.921   2.718   3.806
  155    HA   LYS  25           HA       LYS  25  -7.820   3.419   1.887
  156    HB2  LYS  25           1HB      LYS  25 -10.102   5.115   2.914
  157    HB3  LYS  25           2HB      LYS  25  -9.011   5.520   1.595
  158    HG2  LYS  25           1HG      LYS  25 -10.795   4.774   0.402
  159    HG3  LYS  25           2HG      LYS  25  -9.924   3.252   0.604
  160    HD2  LYS  25           1HD      LYS  25 -11.337   2.649   2.471
  161    HD3  LYS  25           2HD      LYS  25 -12.148   4.215   2.403
  162    HE2  LYS  25           1HE      LYS  25 -13.257   3.692   0.427
  163    HE3  LYS  25           2HE      LYS  25 -12.124   2.406   0.018
  164    HZ1  LYS  25           3HZ      LYS  25 -14.260   2.360   2.068
  165    HZ2  LYS  25           1HZ      LYS  25 -13.022   1.208   2.022
  166    HZ3  LYS  25           2HZ      LYS  25 -14.089   1.355   0.718
  167    H    PHE  26           H        PHE  26  -9.135   4.509   5.009
  168    HA   PHE  26           HA       PHE  26  -7.253   6.468   5.580
  169    HB2  PHE  26           1HB      PHE  26  -9.426   5.711   6.850
  170    HB3  PHE  26           2HB      PHE  26  -8.301   4.722   7.775
  171    HD1  PHE  26           HD2      PHE  26  -8.814   8.229   6.638
  172    HD2  PHE  26           HD1      PHE  26  -7.251   5.624   9.618
  173    HE1  PHE  26           HE2      PHE  26  -8.274  10.172   8.047
  174    HE2  PHE  26           HE1      PHE  26  -6.709   7.562  11.033
  175    HZ   PHE  26           HZ       PHE  26  -7.219   9.840  10.247
  176    H    ASN  27           H        ASN  27  -7.193   3.017   6.434
  177    HA   ASN  27           HA       ASN  27  -4.823   2.957   7.860
  178    HB2  ASN  27           1HB      ASN  27  -6.204   0.924   6.129
  179    HB3  ASN  27           2HB      ASN  27  -4.658   0.553   6.888
  180   HD21  ASN  27          1HD2      ASN  27  -7.463  -0.446   7.272
  181   HD22  ASN  27          2HD2      ASN  27  -7.737  -0.315   8.973
  182    H    LEU  28           H        LEU  28  -5.247   2.368   4.369
  183    HA   LEU  28           HA       LEU  28  -2.572   2.031   3.706
  184    HB2  LEU  28           1HB      LEU  28  -4.333   1.525   2.147
  185    HB3  LEU  28           2HB      LEU  28  -4.827   3.216   2.097
  186    HG   LEU  28           HG       LEU  28  -2.526   3.689   1.106
  187   HD11  LEU  28          1HD1      LEU  28  -2.590   0.750   0.477
  188   HD12  LEU  28          2HD1      LEU  28  -1.626   1.435   1.785
  189   HD13  LEU  28          3HD1      LEU  28  -1.316   1.915   0.116
  190   HD21  LEU  28          3HD2      LEU  28  -4.958   2.771  -0.060
  191   HD22  LEU  28          1HD2      LEU  28  -3.606   2.167  -1.017
  192   HD23  LEU  28          2HD2      LEU  28  -3.771   3.897  -0.718
  193    H    ASP  29           H        ASP  29  -4.487   5.010   3.864
  194    HA   ASP  29           HA       ASP  29  -2.580   6.791   2.894
  195    HB2  ASP  29           1HB      ASP  29  -5.016   7.267   3.417
  196    HB3  ASP  29           2HB      ASP  29  -4.537   7.421   5.105
  197    H    MET  30           H        MET  30  -3.384   6.367   6.345
  198    HA   MET  30           HA       MET  30  -1.266   7.726   7.430
  199    HB2  MET  30           1HB      MET  30  -2.895   5.406   8.383
  200    HB3  MET  30           2HB      MET  30  -1.507   5.921   9.332
  201    HG2  MET  30           1HG      MET  30  -3.585   7.891   8.476
  202    HG3  MET  30           2HG      MET  30  -3.835   6.867   9.888
  203    HE1  MET  30           3HE      MET  30  -3.896   8.045  11.770
  204    HE2  MET  30           1HE      MET  30  -2.379   7.342  12.332
  205    HE3  MET  30           2HE      MET  30  -2.657   9.077  12.488
  206    H    HIS  31           H        HIS  31  -1.348   4.344   6.389
  207    HA   HIS  31           HA       HIS  31   1.111   3.488   7.314
  208    HB2  HIS  31           1HB      HIS  31  -0.345   1.884   6.336
  209    HB3  HIS  31           2HB      HIS  31  -0.418   2.769   4.815
  210    HD1  HIS  31           HD1      HIS  31   1.841   0.520   6.807
  211    HD2  HIS  31           HD2      HIS  31   1.620   2.218   3.021
  212    HE1  HIS  31           HE1      HIS  31   3.631  -0.616   5.454
  213    H    GLN  32           H        GLN  32   0.367   5.157   4.270
  214    HA   GLN  32           HA       GLN  32   2.751   5.120   2.975
  215    HB2  GLN  32           1HB      GLN  32   0.888   7.476   3.306
  216    HB3  GLN  32           2HB      GLN  32   2.191   7.407   2.126
  217    HG2  GLN  32           1HG      GLN  32   1.081   5.299   1.250
  218    HG3  GLN  32           2HG      GLN  32  -0.306   5.751   2.240
  219   HE21  GLN  32          1HE2      GLN  32  -1.183   5.657  -0.056
  220   HE22  GLN  32          2HE2      GLN  32  -1.190   7.148  -0.929
  221    H    LYS  33           H        LYS  33   1.857   7.463   5.503
  222    HA   LYS  33           HA       LYS  33   4.067   9.029   5.633
  223    HB2  LYS  33           1HB      LYS  33   2.279   7.935   7.772
  224    HB3  LYS  33           2HB      LYS  33   3.679   8.899   8.225
  225    HG2  LYS  33           1HG      LYS  33   2.699  10.569   6.450
  226    HG3  LYS  33           2HG      LYS  33   1.199   9.705   6.797
  227    HD2  LYS  33           1HD      LYS  33   2.860  10.638   9.085
  228    HD3  LYS  33           2HD      LYS  33   1.919  11.832   8.188
  229    HE2  LYS  33           1HE      LYS  33  -0.103  10.467   8.560
  230    HE3  LYS  33           2HE      LYS  33   0.857   9.339   9.515
  231    HZ1  LYS  33           3HZ      LYS  33  -0.440  11.575  10.435
  232    HZ2  LYS  33           1HZ      LYS  33   1.193  12.015  10.421
  233    HZ3  LYS  33           2HZ      LYS  33   0.693  10.648  11.282
  234    H    VAL  34           H        VAL  34   3.759   5.746   6.889
  235    HA   VAL  34           HA       VAL  34   5.980   5.418   8.409
  236    HB   VAL  34           HB       VAL  34   5.014   3.489   6.293
  237   HG11  VAL  34          1HG1      VAL  34   6.413   1.907   7.088
  238   HG12  VAL  34          2HG1      VAL  34   7.371   3.302   7.588
  239   HG13  VAL  34          3HG1      VAL  34   6.311   2.497   8.746
  240   HG21  VAL  34          3HG2      VAL  34   4.390   3.366   9.223
  241   HG22  VAL  34          1HG2      VAL  34   3.410   4.335   8.122
  242   HG23  VAL  34          2HG2      VAL  34   3.554   2.595   7.875
  243    H    HIS  35           H        HIS  35   5.880   5.421   4.865
  244    HA   HIS  35           HA       HIS  35   8.766   5.139   4.705
  245    HB2  HIS  35           1HB      HIS  35   6.892   5.665   2.403
  246    HB3  HIS  35           2HB      HIS  35   8.481   4.905   2.362
  247    HD1  HIS  35           HD1      HIS  35   8.595   2.464   3.505
  248    HD2  HIS  35           HD2      HIS  35   4.803   3.931   2.649
  249    HE1  HIS  35           HE1      HIS  35   7.071   0.465   3.568
  250    H    THR  36           H        THR  36   9.742   6.664   2.878
  251    HA   THR  36           HA       THR  36  10.727   8.757   2.795
  252    HB   THR  36           HB       THR  36   8.952   8.724   1.040
  253    HG1  THR  36           HG1      THR  36   9.867  11.059   2.301
  254   HG21  THR  36          3HG2      THR  36   6.864   8.726   1.936
  255   HG22  THR  36          1HG2      THR  36   7.051  10.471   1.768
  256   HG23  THR  36          2HG2      THR  36   7.343   9.699   3.327
  257    H    GLY  37           H        GLY  37  10.125   8.152   5.477
  258    HA2  GLY  37           1HA      GLY  37   9.816  10.864   6.505
  259    HA3  GLY  37           2HA      GLY  37   8.657   9.674   7.080
  260    H    GLU  38           H        GLU  38  12.150   9.441   6.444
  261    HA   GLU  38           HA       GLU  38  12.525   8.767   9.286
  262    HB2  GLU  38           1HB      GLU  38  12.649   6.855   7.483
  263    HB3  GLU  38           2HB      GLU  38  14.246   7.523   7.179
  264    HG2  GLU  38           1HG      GLU  38  13.200   6.344   9.734
  265    HG3  GLU  38           2HG      GLU  38  14.504   5.741   8.714
  266    H    ARG  39           H        ARG  39  13.175  10.931   9.662
  267    HA   ARG  39           HA       ARG  39  15.262  12.196   8.222
  268    HB2  ARG  39           1HB      ARG  39  15.152  13.909   9.840
  269    HB3  ARG  39           2HB      ARG  39  13.509  13.295   9.711
  270    HG2  ARG  39           1HG      ARG  39  15.435  12.389  11.833
  271    HG3  ARG  39           2HG      ARG  39  14.333  13.752  12.039
  272    HD2  ARG  39           1HD      ARG  39  12.490  12.098  11.353
  273    HD3  ARG  39           2HD      ARG  39  13.687  10.845  11.677
  274    HE   ARG  39           HE       ARG  39  13.555  12.572  13.885
  275   HH11  ARG  39          1HH1      ARG  39  11.642  10.167  12.248
  276   HH12  ARG  39          2HH1      ARG  39  10.788   9.686  13.677
  277   HH21  ARG  39          1HH2      ARG  39  12.438  11.947  15.773
  278   HH22  ARG  39          2HH2      ARG  39  11.241  10.700  15.681
  279    HA   PRO  40           HA       PRO  40  18.831  10.237   9.892
  280    HB2  PRO  40           1HB      PRO  40  20.648  12.208   9.465
  281    HB3  PRO  40           2HB      PRO  40  19.990  11.210   8.163
  282    HG2  PRO  40           1HG      PRO  40  19.204  13.970   9.017
  283    HG3  PRO  40           2HG      PRO  40  19.422  13.325   7.379
  284    HD2  PRO  40           1HD      PRO  40  16.982  13.625   8.514
  285    HD3  PRO  40           2HD      PRO  40  17.346  12.324   7.361
  286    H    SER  41           H        SER  41  17.271  12.803  11.335
  287    HA   SER  41           HA       SER  41  17.238  13.519  13.506
  288    HB2  SER  41           1HB      SER  41  18.169  11.110  13.902
  289    HB3  SER  41           2HB      SER  41  19.706  11.938  14.154
  290    HG   SER  41           HG       SER  41  18.546  11.676  16.107
  291    H    GLY  42           H        GLY  42  18.509  14.982  11.492
  292    HA2  GLY  42           1HA      GLY  42  20.207  16.526  11.089
  293    HA3  GLY  42           2HA      GLY  42  19.658  17.082  12.664
  294    HA   PRO  43           HA       PRO  43  23.753  16.456  14.133
  295    HB2  PRO  43           1HB      PRO  43  23.238  16.333  16.795
  296    HB3  PRO  43           2HB      PRO  43  23.179  17.841  15.874
  297    HG2  PRO  43           1HG      PRO  43  20.934  16.054  16.727
  298    HG3  PRO  43           2HG      PRO  43  21.030  17.824  16.762
  299    HD2  PRO  43           1HD      PRO  43  19.713  16.474  14.819
  300    HD3  PRO  43           2HD      PRO  43  20.532  18.020  14.520
  301    H    SER  44           H        SER  44  25.119  14.845  14.889
  302    HA   SER  44           HA       SER  44  24.539  12.224  14.430
  303    HB2  SER  44           1HB      SER  44  26.822  13.088  14.808
  304    HB3  SER  44           2HB      SER  44  26.470  13.244  16.529
  305    HG   SER  44           HG       SER  44  25.870  10.836  16.152
  306    H    SER  45           H        SER  45  23.292  10.739  15.341
  307    HA   SER  45           HA       SER  45  22.923  10.625  18.204
  308    HB2  SER  45           1HB      SER  45  20.588  10.976  18.281
  309    HB3  SER  45           2HB      SER  45  21.199  12.285  17.270
  310    HG   SER  45           HG       SER  45  20.735  10.560  15.521
  311    H    GLY  46           H        GLY  46  22.311   8.608  18.920
  312    HA2  GLY  46           1HA      GLY  46  21.306   6.621  17.075
  313    HA3  GLY  46           2HA      GLY  46  22.969   6.357  17.578
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1   4.709 -27.700   3.148
    2    HA2  GLY   1           1HA      GLY   1   3.186 -29.436   3.645
    3    HA3  GLY   1           2HA      GLY   1   3.322 -29.036   5.350
    4    H    SER   2           H        SER   2   1.324 -28.566   6.012
    5    HA   SER   2           HA       SER   2  -0.384 -26.903   4.304
    6    HB2  SER   2           1HB      SER   2  -1.200 -29.123   5.268
    7    HB3  SER   2           2HB      SER   2  -1.222 -28.316   6.836
    8    HG   SER   2           HG       SER   2  -2.492 -27.043   4.704
    9    H    SER   3           H        SER   3   0.494 -27.193   7.749
   10    HA   SER   3           HA       SER   3  -0.517 -24.646   8.461
   11    HB2  SER   3           1HB      SER   3   1.353 -26.590   9.799
   12    HB3  SER   3           2HB      SER   3   1.014 -25.013  10.513
   13    HG   SER   3           HG       SER   3  -0.701 -25.935  11.285
   14    H    GLY   4           H        GLY   4   0.252 -22.785   7.713
   15    HA2  GLY   4           1HA      GLY   4   2.397 -21.410   8.225
   16    HA3  GLY   4           2HA      GLY   4   3.119 -22.563   7.114
   17    H    SER   5           H        SER   5   0.258 -20.437   7.260
   18    HA   SER   5           HA       SER   5   1.009 -18.913   5.010
   19    HB2  SER   5           1HB      SER   5  -0.459 -19.735   3.307
   20    HB3  SER   5           2HB      SER   5   0.455 -21.120   3.903
   21    HG   SER   5           HG       SER   5  -1.853 -21.465   3.677
   22    H    SER   6           H        SER   6  -0.326 -17.153   4.710
   23    HA   SER   6           HA       SER   6  -2.931 -17.054   5.965
   24    HB2  SER   6           1HB      SER   6  -0.674 -15.286   6.938
   25    HB3  SER   6           2HB      SER   6  -2.371 -15.086   7.370
   26    HG   SER   6           HG       SER   6  -0.739 -16.453   8.718
   27    H    GLY   7           H        GLY   7  -3.931 -14.829   5.659
   28    HA2  GLY   7           1HA      GLY   7  -3.758 -12.719   4.398
   29    HA3  GLY   7           2HA      GLY   7  -2.935 -13.636   3.145
   30    H    THR   8           H        THR   8  -6.029 -13.341   4.847
   31    HA   THR   8           HA       THR   8  -7.362 -14.228   2.371
   32    HB   THR   8           HB       THR   8  -8.407 -14.649   5.176
   33    HG1  THR   8           HG1      THR   8  -7.944 -16.933   4.512
   34   HG21  THR   8          3HG2      THR   8 -10.188 -14.484   3.558
   35   HG22  THR   8          1HG2      THR   8  -9.994 -16.176   4.016
   36   HG23  THR   8          2HG2      THR   8  -9.360 -15.601   2.474
   37    H    GLY   9           H        GLY   9  -8.161 -12.444   1.446
   38    HA2  GLY   9           1HA      GLY   9 -10.347 -11.067   2.220
   39    HA3  GLY   9           2HA      GLY   9  -9.056 -10.197   3.038
   40    H    GLU  10           H        GLU  10 -10.785  -9.107   1.060
   41    HA   GLU  10           HA       GLU  10  -9.357  -8.996  -1.435
   42    HB2  GLU  10           1HB      GLU  10 -11.045  -7.175  -1.950
   43    HB3  GLU  10           2HB      GLU  10 -11.707  -8.766  -1.605
   44    HG2  GLU  10           1HG      GLU  10 -12.361  -8.104   0.587
   45    HG3  GLU  10           2HG      GLU  10 -11.494  -6.576   0.442
   46    H    LYS  11           H        LYS  11  -7.574  -7.851  -1.720
   47    HA   LYS  11           HA       LYS  11  -7.153  -5.443  -0.082
   48    HB2  LYS  11           1HB      LYS  11  -5.066  -7.001  -1.610
   49    HB3  LYS  11           2HB      LYS  11  -4.791  -5.740  -0.415
   50    HG2  LYS  11           1HG      LYS  11  -6.287  -8.177   0.404
   51    HG3  LYS  11           2HG      LYS  11  -4.537  -8.278   0.196
   52    HD2  LYS  11           1HD      LYS  11  -4.618  -7.669   2.395
   53    HD3  LYS  11           2HD      LYS  11  -4.607  -6.067   1.654
   54    HE2  LYS  11           1HE      LYS  11  -6.995  -5.895   1.869
   55    HE3  LYS  11           2HE      LYS  11  -7.107  -7.562   2.431
   56    HZ1  LYS  11           3HZ      LYS  11  -5.347  -6.387   4.153
   57    HZ2  LYS  11           1HZ      LYS  11  -6.976  -6.715   4.466
   58    HZ3  LYS  11           2HZ      LYS  11  -6.515  -5.188   3.906
   59    HA   PRO  12           HA       PRO  12  -7.981  -3.841  -4.339
   60    HB2  PRO  12           1HB      PRO  12  -9.413  -1.696  -3.490
   61    HB3  PRO  12           2HB      PRO  12 -10.134  -3.288  -3.756
   62    HG2  PRO  12           1HG      PRO  12  -9.253  -2.012  -1.196
   63    HG3  PRO  12           2HG      PRO  12 -10.724  -2.942  -1.534
   64    HD2  PRO  12           1HD      PRO  12  -8.574  -4.018  -0.287
   65    HD3  PRO  12           2HD      PRO  12  -9.638  -4.966  -1.346
   66    H    TYR  13           H        TYR  13  -6.542  -2.621  -1.455
   67    HA   TYR  13           HA       TYR  13  -5.143  -0.560  -3.030
   68    HB2  TYR  13           1HB      TYR  13  -5.726  -0.411  -0.069
   69    HB3  TYR  13           2HB      TYR  13  -5.030   0.850  -1.082
   70    HD1  TYR  13           HD2      TYR  13  -6.679   1.177  -3.322
   71    HD2  TYR  13           HD1      TYR  13  -7.860   0.097   0.620
   72    HE1  TYR  13           HE2      TYR  13  -8.927   2.074  -3.756
   73    HE2  TYR  13           HE1      TYR  13 -10.112   0.990   0.196
   74    HH   TYR  13           HH       TYR  13 -11.149   1.934  -2.965
   75    H    LYS  14           H        LYS  14  -3.093  -1.085  -3.334
   76    HA   LYS  14           HA       LYS  14  -1.722  -2.700  -1.290
   77    HB2  LYS  14           1HB      LYS  14  -1.104  -2.383  -4.233
   78    HB3  LYS  14           2HB      LYS  14  -0.163  -3.347  -3.102
   79    HG2  LYS  14           1HG      LYS  14  -2.122  -4.771  -2.706
   80    HG3  LYS  14           2HG      LYS  14  -3.035  -3.818  -3.879
   81    HD2  LYS  14           1HD      LYS  14  -0.431  -4.971  -4.734
   82    HD3  LYS  14           2HD      LYS  14  -1.804  -6.066  -4.555
   83    HE2  LYS  14           1HE      LYS  14  -2.100  -5.453  -6.731
   84    HE3  LYS  14           2HE      LYS  14  -3.023  -4.171  -5.946
   85    HZ1  LYS  14           3HZ      LYS  14  -0.434  -4.037  -7.299
   86    HZ2  LYS  14           1HZ      LYS  14  -0.681  -3.009  -5.978
   87    HZ3  LYS  14           2HZ      LYS  14  -1.718  -2.936  -7.312
   88    H    CYS  15           H        CYS  15   0.703  -2.306  -1.227
   89    HA   CYS  15           HA       CYS  15   1.191   0.599  -1.285
   90    HB2  CYS  15           1HB      CYS  15   1.171  -0.427   0.977
   91    HB3  CYS  15           2HB      CYS  15   2.497  -1.475   0.488
   92    H    GLU  16           H        GLU  16   2.449   1.174  -2.923
   93    HA   GLU  16           HA       GLU  16   4.314  -0.724  -4.091
   94    HB2  GLU  16           1HB      GLU  16   2.816   0.785  -5.460
   95    HB3  GLU  16           2HB      GLU  16   3.816   2.131  -4.933
   96    HG2  GLU  16           1HG      GLU  16   5.722   1.263  -6.047
   97    HG3  GLU  16           2HG      GLU  16   4.911  -0.268  -6.372
   98    H    LYS  17           H        LYS  17   4.993   0.017  -1.486
   99    HA   LYS  17           HA       LYS  17   7.483   1.508  -1.975
  100    HB2  LYS  17           1HB      LYS  17   5.598   1.754   0.367
  101    HB3  LYS  17           2HB      LYS  17   7.262   2.320   0.424
  102    HG2  LYS  17           1HG      LYS  17   5.549   3.251  -1.814
  103    HG3  LYS  17           2HG      LYS  17   5.265   3.921  -0.206
  104    HD2  LYS  17           1HD      LYS  17   6.827   5.405  -0.958
  105    HD3  LYS  17           2HD      LYS  17   7.901   4.191  -0.259
  106    HE2  LYS  17           1HE      LYS  17   8.369   3.254  -2.385
  107    HE3  LYS  17           2HE      LYS  17   7.064   4.161  -3.149
  108    HZ1  LYS  17           3HZ      LYS  17   8.354   5.952  -3.386
  109    HZ2  LYS  17           1HZ      LYS  17   9.655   4.902  -3.124
  110    HZ3  LYS  17           2HZ      LYS  17   9.030   5.812  -1.842
  111    H    CYS  18           H        CYS  18   5.801  -0.818   0.106
  112    HA   CYS  18           HA       CYS  18   8.409  -2.075   0.659
  113    HB2  CYS  18           1HB      CYS  18   7.500  -2.826   2.812
  114    HB3  CYS  18           2HB      CYS  18   7.463  -1.070   2.685
  115    H    GLY  19           H        GLY  19   4.920  -2.680   0.324
  116    HA2  GLY  19           1HA      GLY  19   4.365  -4.424  -1.370
  117    HA3  GLY  19           2HA      GLY  19   5.596  -5.408  -0.592
  118    H    LYS  20           H        LYS  20   3.075  -3.385   0.868
  119    HA   LYS  20           HA       LYS  20   2.090  -5.787   2.254
  120    HB2  LYS  20           1HB      LYS  20   3.025  -3.623   3.460
  121    HB3  LYS  20           2HB      LYS  20   1.394  -3.032   3.170
  122    HG2  LYS  20           1HG      LYS  20   1.369  -3.951   5.329
  123    HG3  LYS  20           2HG      LYS  20   0.570  -5.140   4.297
  124    HD2  LYS  20           1HD      LYS  20   2.805  -6.304   4.118
  125    HD3  LYS  20           2HD      LYS  20   3.375  -5.225   5.394
  126    HE2  LYS  20           1HE      LYS  20   1.361  -6.046   6.737
  127    HE3  LYS  20           2HE      LYS  20   1.232  -7.326   5.532
  128    HZ1  LYS  20           3HZ      LYS  20   3.463  -8.034   6.070
  129    HZ2  LYS  20           1HZ      LYS  20   2.518  -8.012   7.474
  130    HZ3  LYS  20           2HZ      LYS  20   3.636  -6.775   7.187
  131    H    GLY  21           H        GLY  21  -0.245  -5.844   2.730
  132    HA2  GLY  21           1HA      GLY  21  -1.810  -4.521   0.599
  133    HA3  GLY  21           2HA      GLY  21  -2.073  -6.196   1.062
  134    H    TYR  22           H        TYR  22  -3.683  -3.563   1.149
  135    HA   TYR  22           HA       TYR  22  -4.670  -3.958   3.895
  136    HB2  TYR  22           1HB      TYR  22  -4.342  -1.349   2.405
  137    HB3  TYR  22           2HB      TYR  22  -5.272  -1.515   3.890
  138    HD1  TYR  22           HD2      TYR  22  -1.888  -1.660   2.437
  139    HD2  TYR  22           HD1      TYR  22  -4.188  -1.689   6.016
  140    HE1  TYR  22           HE2      TYR  22   0.163  -1.321   3.751
  141    HE2  TYR  22           HE1      TYR  22  -2.144  -1.348   7.340
  142    HH   TYR  22           HH       TYR  22   0.050  -1.027   7.290
  143    H    ASN  23           H        ASN  23  -6.944  -2.881   4.084
  144    HA   ASN  23           HA       ASN  23  -8.503  -3.684   1.716
  145    HB2  ASN  23           1HB      ASN  23 -10.190  -4.553   3.101
  146    HB3  ASN  23           2HB      ASN  23  -8.697  -5.072   3.878
  147   HD21  ASN  23          1HD2      ASN  23 -11.622  -3.463   4.262
  148   HD22  ASN  23          2HD2      ASN  23 -11.342  -2.801   5.833
  149    H    SER  24           H        SER  24  -8.419  -1.480   4.495
  150    HA   SER  24           HA       SER  24 -10.499   0.186   3.365
  151    HB2  SER  24           1HB      SER  24  -8.798   0.464   5.851
  152    HB3  SER  24           2HB      SER  24 -10.044   1.621   5.381
  153    HG   SER  24           HG       SER  24 -10.314  -1.041   6.240
  154    H    LYS  25           H        LYS  25 -10.068   2.621   3.338
  155    HA   LYS  25           HA       LYS  25  -7.758   3.067   1.631
  156    HB2  LYS  25           1HB      LYS  25 -10.169   4.739   2.328
  157    HB3  LYS  25           2HB      LYS  25  -8.831   5.366   1.373
  158    HG2  LYS  25           1HG      LYS  25  -9.222   3.413  -0.195
  159    HG3  LYS  25           2HG      LYS  25 -10.735   3.153   0.676
  160    HD2  LYS  25           1HD      LYS  25 -10.120   5.887  -0.337
  161    HD3  LYS  25           2HD      LYS  25 -10.644   4.656  -1.488
  162    HE2  LYS  25           1HE      LYS  25 -12.134   5.354   1.037
  163    HE3  LYS  25           2HE      LYS  25 -12.489   6.053  -0.542
  164    HZ1  LYS  25           3HZ      LYS  25 -13.790   3.984   0.283
  165    HZ2  LYS  25           1HZ      LYS  25 -12.427   3.130  -0.241
  166    HZ3  LYS  25           2HZ      LYS  25 -13.303   4.076  -1.335
  167    H    PHE  26           H        PHE  26  -9.221   4.817   4.378
  168    HA   PHE  26           HA       PHE  26  -7.194   6.563   4.939
  169    HB2  PHE  26           1HB      PHE  26  -9.495   6.226   6.096
  170    HB3  PHE  26           2HB      PHE  26  -8.613   5.160   7.185
  171    HD1  PHE  26           HD1      PHE  26  -6.225   6.334   7.898
  172    HD2  PHE  26           HD2      PHE  26  -9.869   8.313   6.941
  173    HE1  PHE  26           HE1      PHE  26  -5.514   8.278   9.228
  174    HE2  PHE  26           HE2      PHE  26  -9.164  10.261   8.268
  175    HZ   PHE  26           HZ       PHE  26  -6.983  10.245   9.414
  176    H    ASN  27           H        ASN  27  -7.534   3.277   6.268
  177    HA   ASN  27           HA       ASN  27  -5.356   3.128   7.896
  178    HB2  ASN  27           1HB      ASN  27  -7.123   1.318   7.167
  179    HB3  ASN  27           2HB      ASN  27  -5.859   0.835   6.039
  180   HD21  ASN  27          1HD2      ASN  27  -3.613   0.780   7.188
  181   HD22  ASN  27          2HD2      ASN  27  -3.590  -0.109   8.669
  182    H    LEU  28           H        LEU  28  -5.277   2.117   4.473
  183    HA   LEU  28           HA       LEU  28  -2.627   1.646   4.143
  184    HB2  LEU  28           1HB      LEU  28  -4.231   1.339   2.362
  185    HB3  LEU  28           2HB      LEU  28  -4.470   3.081   2.238
  186    HG   LEU  28           HG       LEU  28  -2.003   3.199   1.585
  187   HD11  LEU  28          1HD1      LEU  28  -1.904   0.619   2.326
  188   HD12  LEU  28          2HD1      LEU  28  -0.803   1.340   1.154
  189   HD13  LEU  28          3HD1      LEU  28  -2.207   0.428   0.599
  190   HD21  LEU  28          3HD2      LEU  28  -2.827   1.953  -0.725
  191   HD22  LEU  28          1HD2      LEU  28  -3.121   3.638  -0.296
  192   HD23  LEU  28          2HD2      LEU  28  -4.346   2.415   0.044
  193    H    ASP  29           H        ASP  29  -4.151   4.839   3.699
  194    HA   ASP  29           HA       ASP  29  -1.925   6.344   3.140
  195    HB2  ASP  29           1HB      ASP  29  -4.473   6.968   4.594
  196    HB3  ASP  29           2HB      ASP  29  -3.211   8.191   4.471
  197    H    MET  30           H        MET  30  -3.245   5.665   6.380
  198    HA   MET  30           HA       MET  30  -1.368   7.018   7.894
  199    HB2  MET  30           1HB      MET  30  -3.022   4.570   8.414
  200    HB3  MET  30           2HB      MET  30  -1.862   5.123   9.614
  201    HG2  MET  30           1HG      MET  30  -3.055   7.411   9.324
  202    HG3  MET  30           2HG      MET  30  -4.358   6.436   8.649
  203    HE1  MET  30           3HE      MET  30  -5.252   4.442   9.665
  204    HE2  MET  30           1HE      MET  30  -5.476   4.160  11.392
  205    HE3  MET  30           2HE      MET  30  -6.351   5.466  10.591
  206    H    HIS  31           H        HIS  31  -1.033   4.072   6.115
  207    HA   HIS  31           HA       HIS  31   1.414   3.301   7.475
  208    HB2  HIS  31           1HB      HIS  31   0.115   1.444   6.833
  209    HB3  HIS  31           2HB      HIS  31  -0.199   2.108   5.232
  210    HD1  HIS  31           HD1      HIS  31   2.870   0.978   7.192
  211    HD2  HIS  31           HD2      HIS  31   1.305   0.911   3.343
  212    HE1  HIS  31           HE1      HIS  31   4.534  -0.306   5.811
  213    H    GLN  32           H        GLN  32   0.398   4.728   4.425
  214    HA   GLN  32           HA       GLN  32   2.788   4.593   3.012
  215    HB2  GLN  32           1HB      GLN  32   0.488   6.518   2.976
  216    HB3  GLN  32           2HB      GLN  32   1.903   6.813   1.974
  217    HG2  GLN  32           1HG      GLN  32   0.192   4.337   1.897
  218    HG3  GLN  32           2HG      GLN  32   0.118   5.675   0.752
  219   HE21  GLN  32          1HE2      GLN  32   0.791   2.784   0.460
  220   HE22  GLN  32          2HE2      GLN  32   2.319   2.764  -0.345
  221    H    LYS  33           H        LYS  33   1.658   7.059   5.295
  222    HA   LYS  33           HA       LYS  33   3.704   8.903   5.048
  223    HB2  LYS  33           1HB      LYS  33   3.056   9.750   7.159
  224    HB3  LYS  33           2HB      LYS  33   1.593   9.077   6.452
  225    HG2  LYS  33           1HG      LYS  33   1.414   8.225   8.545
  226    HG3  LYS  33           2HG      LYS  33   2.362   6.935   7.801
  227    HD2  LYS  33           1HD      LYS  33   3.606   7.292   9.685
  228    HD3  LYS  33           2HD      LYS  33   4.381   8.445   8.596
  229    HE2  LYS  33           1HE      LYS  33   2.671  10.134   9.509
  230    HE3  LYS  33           2HE      LYS  33   2.413   8.964  10.801
  231    HZ1  LYS  33           3HZ      LYS  33   4.251  10.876  10.905
  232    HZ2  LYS  33           1HZ      LYS  33   5.180   9.634  10.228
  233    HZ3  LYS  33           2HZ      LYS  33   4.408   9.399  11.714
  234    H    VAL  34           H        VAL  34   3.643   5.865   6.817
  235    HA   VAL  34           HA       VAL  34   5.865   6.090   8.423
  236    HB   VAL  34           HB       VAL  34   5.097   3.631   6.844
  237   HG11  VAL  34          1HG1      VAL  34   6.565   3.865   9.468
  238   HG12  VAL  34          2HG1      VAL  34   6.205   2.381   8.584
  239   HG13  VAL  34          3HG1      VAL  34   7.331   3.559   7.910
  240   HG21  VAL  34          3HG2      VAL  34   4.129   4.628   9.521
  241   HG22  VAL  34          1HG2      VAL  34   3.177   4.453   8.047
  242   HG23  VAL  34          2HG2      VAL  34   3.802   3.023   8.868
  243    H    HIS  35           H        HIS  35   5.734   5.352   4.969
  244    HA   HIS  35           HA       HIS  35   8.566   4.940   4.744
  245    HB2  HIS  35           1HB      HIS  35   6.565   5.465   2.539
  246    HB3  HIS  35           2HB      HIS  35   8.167   4.754   2.362
  247    HD1  HIS  35           HD1      HIS  35   8.282   2.508   4.227
  248    HD2  HIS  35           HD2      HIS  35   4.744   3.500   2.288
  249    HE1  HIS  35           HE1      HIS  35   6.880   0.420   4.275
  250    H    THR  36           H        THR  36   8.394   7.265   6.023
  251    HA   THR  36           HA       THR  36   8.786   9.364   3.999
  252    HB   THR  36           HB       THR  36   7.108   9.923   5.683
  253    HG1  THR  36           HG1      THR  36   9.323  11.495   6.415
  254   HG21  THR  36          3HG2      THR  36   8.194  10.407   8.045
  255   HG22  THR  36          1HG2      THR  36   9.283   9.112   7.549
  256   HG23  THR  36          2HG2      THR  36   7.547   8.817   7.643
  257    H    GLY  37           H        GLY  37  10.783   7.350   4.567
  258    HA2  GLY  37           1HA      GLY  37  13.145   8.335   4.341
  259    HA3  GLY  37           2HA      GLY  37  12.841   8.927   5.968
  260    H    GLU  38           H        GLU  38  13.808   7.749   7.466
  261    HA   GLU  38           HA       GLU  38  15.130   5.387   7.152
  262    HB2  GLU  38           1HB      GLU  38  15.053   6.958   9.185
  263    HB3  GLU  38           2HB      GLU  38  13.672   6.005   9.712
  264    HG2  GLU  38           1HG      GLU  38  15.381   4.972  10.825
  265    HG3  GLU  38           2HG      GLU  38  15.282   3.989   9.366
  266    H    ARG  39           H        ARG  39  14.574   3.359   6.734
  267    HA   ARG  39           HA       ARG  39  11.985   2.350   7.653
  268    HB2  ARG  39           1HB      ARG  39  11.546   3.043   5.381
  269    HB3  ARG  39           2HB      ARG  39  12.985   2.211   4.806
  270    HG2  ARG  39           1HG      ARG  39  11.855   0.086   5.729
  271    HG3  ARG  39           2HG      ARG  39  10.383   1.059   5.723
  272    HD2  ARG  39           1HD      ARG  39  10.497  -0.153   3.659
  273    HD3  ARG  39           2HD      ARG  39  10.791   1.553   3.321
  274    HE   ARG  39           HE       ARG  39  12.959   1.042   2.718
  275   HH11  ARG  39          1HH1      ARG  39  11.423  -1.734   4.151
  276   HH12  ARG  39          2HH1      ARG  39  12.674  -2.835   3.675
  277   HH21  ARG  39          1HH2      ARG  39  14.612  -0.397   2.085
  278   HH22  ARG  39          2HH2      ARG  39  14.488  -2.073   2.501
  279    HA   PRO  40           HA       PRO  40  14.415  -1.140   8.799
  280    HB2  PRO  40           1HB      PRO  40  12.423  -2.967   9.056
  281    HB3  PRO  40           2HB      PRO  40  12.696  -1.673  10.228
  282    HG2  PRO  40           1HG      PRO  40  10.709  -1.817   7.995
  283    HG3  PRO  40           2HG      PRO  40  10.484  -1.242   9.657
  284    HD2  PRO  40           1HD      PRO  40  10.840   0.443   7.568
  285    HD3  PRO  40           2HD      PRO  40  11.418   0.816   9.205
  286    H    SER  41           H        SER  41  15.374  -2.910   7.879
  287    HA   SER  41           HA       SER  41  15.630  -3.261   5.235
  288    HB2  SER  41           1HB      SER  41  15.739  -5.284   7.455
  289    HB3  SER  41           2HB      SER  41  16.021  -5.777   5.785
  290    HG   SER  41           HG       SER  41  17.579  -4.211   7.469
  291    H    GLY  42           H        GLY  42  13.212  -4.985   7.203
  292    HA2  GLY  42           1HA      GLY  42  11.160  -4.842   5.321
  293    HA3  GLY  42           2HA      GLY  42  12.016  -6.350   5.033
  294    HA   PRO  43           HA       PRO  43   8.944  -6.490   8.732
  295    HB2  PRO  43           1HB      PRO  43   6.673  -7.289   7.478
  296    HB3  PRO  43           2HB      PRO  43   7.062  -5.590   7.768
  297    HG2  PRO  43           1HG      PRO  43   7.404  -7.213   5.276
  298    HG3  PRO  43           2HG      PRO  43   6.798  -5.556   5.458
  299    HD2  PRO  43           1HD      PRO  43   9.330  -6.102   4.670
  300    HD3  PRO  43           2HD      PRO  43   8.916  -4.665   5.627
  301    H    SER  44           H        SER  44  10.164  -8.389   6.250
  302    HA   SER  44           HA       SER  44   9.334 -10.860   7.628
  303    HB2  SER  44           1HB      SER  44   9.641 -10.249   4.710
  304    HB3  SER  44           2HB      SER  44   9.920 -11.893   5.283
  305    HG   SER  44           HG       SER  44   7.849 -12.133   5.515
  306    H    SER  45           H        SER  45  10.884 -12.487   7.899
  307    HA   SER  45           HA       SER  45  13.604 -11.494   8.063
  308    HB2  SER  45           1HB      SER  45  12.130 -13.859   9.147
  309    HB3  SER  45           2HB      SER  45  13.887 -13.943   9.025
  310    HG   SER  45           HG       SER  45  13.576 -11.680  10.099
  311    H    GLY  46           H        GLY  46  15.222 -11.988   6.717
  312    HA2  GLY  46           1HA      GLY  46  15.079 -14.377   5.056
  313    HA3  GLY  46           2HA      GLY  46  15.061 -12.842   4.200
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1   7.766 -18.456  13.964
    2    HA2  GLY   1           1HA      GLY   1   7.317 -17.469  11.216
    3    HA3  GLY   1           2HA      GLY   1   6.278 -18.633  12.024
    4    H    SER   2           H        SER   2   5.573 -16.078  10.809
    5    HA   SER   2           HA       SER   2   4.330 -14.847  13.170
    6    HB2  SER   2           1HB      SER   2   4.695 -12.617  12.264
    7    HB3  SER   2           2HB      SER   2   6.243 -13.446  12.425
    8    HG   SER   2           HG       SER   2   4.917 -13.704   9.993
    9    H    SER   3           H        SER   3   2.379 -13.612  12.672
   10    HA   SER   3           HA       SER   3   0.983 -14.734  10.334
   11    HB2  SER   3           1HB      SER   3   0.024 -15.437  12.478
   12    HB3  SER   3           2HB      SER   3  -0.161 -13.751  12.961
   13    HG   SER   3           HG       SER   3  -2.088 -14.740  12.081
   14    H    GLY   4           H        GLY   4  -0.792 -13.336   9.462
   15    HA2  GLY   4           1HA      GLY   4  -1.474 -10.837   9.657
   16    HA3  GLY   4           2HA      GLY   4   0.214 -10.585   9.239
   17    H    SER   5           H        SER   5  -2.320 -12.791   8.046
   18    HA   SER   5           HA       SER   5  -2.033 -11.590   5.387
   19    HB2  SER   5           1HB      SER   5  -2.013 -13.881   4.377
   20    HB3  SER   5           2HB      SER   5  -0.565 -13.508   5.311
   21    HG   SER   5           HG       SER   5  -2.755 -15.142   6.049
   22    H    SER   6           H        SER   6  -3.860 -11.695   4.094
   23    HA   SER   6           HA       SER   6  -6.343 -11.860   5.459
   24    HB2  SER   6           1HB      SER   6  -5.671 -10.454   3.363
   25    HB3  SER   6           2HB      SER   6  -6.133 -11.899   2.463
   26    HG   SER   6           HG       SER   6  -7.730 -10.039   3.286
   27    H    GLY   7           H        GLY   7  -4.870 -13.879   2.920
   28    HA2  GLY   7           1HA      GLY   7  -5.013 -16.225   2.802
   29    HA3  GLY   7           2HA      GLY   7  -6.328 -16.181   3.967
   30    H    THR   8           H        THR   8  -8.168 -14.569   2.882
   31    HA   THR   8           HA       THR   8  -8.837 -15.930   0.356
   32    HB   THR   8           HB       THR   8 -11.208 -15.454   0.909
   33    HG1  THR   8           HG1      THR   8 -10.432 -13.692   2.472
   34   HG21  THR   8          3HG2      THR   8 -11.302 -17.455   1.895
   35   HG22  THR   8          1HG2      THR   8 -10.514 -16.846   3.349
   36   HG23  THR   8          2HG2      THR   8  -9.542 -17.409   1.989
   37    H    GLY   9           H        GLY   9  -9.300 -14.758  -1.426
   38    HA2  GLY   9           1HA      GLY   9  -9.424 -12.939  -2.820
   39    HA3  GLY   9           2HA      GLY   9 -10.318 -12.167  -1.519
   40    H    GLU  10           H        GLU  10  -8.605 -10.787  -3.267
   41    HA   GLU  10           HA       GLU  10  -6.196 -10.252  -1.697
   42    HB2  GLU  10           1HB      GLU  10  -7.060  -9.381  -4.454
   43    HB3  GLU  10           2HB      GLU  10  -5.610  -8.777  -3.665
   44    HG2  GLU  10           1HG      GLU  10  -4.785 -11.105  -3.503
   45    HG3  GLU  10           2HG      GLU  10  -6.195 -11.629  -4.421
   46    H    LYS  11           H        LYS  11  -5.567  -7.947  -1.403
   47    HA   LYS  11           HA       LYS  11  -7.769  -6.504  -0.222
   48    HB2  LYS  11           1HB      LYS  11  -4.796  -6.031  -0.349
   49    HB3  LYS  11           2HB      LYS  11  -5.898  -4.847   0.343
   50    HG2  LYS  11           1HG      LYS  11  -5.257  -5.990   2.215
   51    HG3  LYS  11           2HG      LYS  11  -6.713  -6.882   1.769
   52    HD2  LYS  11           1HD      LYS  11  -5.113  -8.537   2.226
   53    HD3  LYS  11           2HD      LYS  11  -5.156  -8.430   0.465
   54    HE2  LYS  11           1HE      LYS  11  -2.868  -8.530   1.113
   55    HE3  LYS  11           2HE      LYS  11  -3.196  -6.873   0.606
   56    HZ1  LYS  11           3HZ      LYS  11  -3.501  -6.325   2.994
   57    HZ2  LYS  11           1HZ      LYS  11  -1.927  -6.803   2.599
   58    HZ3  LYS  11           2HZ      LYS  11  -2.966  -7.881   3.387
   59    HA   PRO  12           HA       PRO  12  -8.623  -3.809  -3.594
   60    HB2  PRO  12           1HB      PRO  12  -9.673  -1.711  -2.226
   61    HB3  PRO  12           2HB      PRO  12 -10.537  -3.236  -2.459
   62    HG2  PRO  12           1HG      PRO  12  -8.995  -2.276  -0.079
   63    HG3  PRO  12           2HG      PRO  12 -10.561  -3.106  -0.137
   64    HD2  PRO  12           1HD      PRO  12  -8.251  -4.393   0.446
   65    HD3  PRO  12           2HD      PRO  12  -9.594  -5.180  -0.408
   66    H    TYR  13           H        TYR  13  -6.983  -2.387  -0.780
   67    HA   TYR  13           HA       TYR  13  -5.526  -0.608  -2.623
   68    HB2  TYR  13           1HB      TYR  13  -5.762  -0.106   0.330
   69    HB3  TYR  13           2HB      TYR  13  -5.416   1.039  -0.961
   70    HD1  TYR  13           HD2      TYR  13  -7.448   1.006  -2.822
   71    HD2  TYR  13           HD1      TYR  13  -7.806   0.187   1.337
   72    HE1  TYR  13           HE2      TYR  13  -9.825   1.631  -2.910
   73    HE2  TYR  13           HE1      TYR  13 -10.184   0.808   1.261
   74    HH   TYR  13           HH       TYR  13 -11.771   1.629  -1.790
   75    H    LYS  14           H        LYS  14  -3.734  -1.784  -3.087
   76    HA   LYS  14           HA       LYS  14  -2.189  -2.909  -0.858
   77    HB2  LYS  14           1HB      LYS  14  -0.973  -4.177  -2.568
   78    HB3  LYS  14           2HB      LYS  14  -2.706  -4.460  -2.677
   79    HG2  LYS  14           1HG      LYS  14  -2.238  -4.174  -4.878
   80    HG3  LYS  14           2HG      LYS  14  -2.553  -2.494  -4.438
   81    HD2  LYS  14           1HD      LYS  14  -0.037  -2.340  -3.978
   82    HD3  LYS  14           2HD      LYS  14   0.089  -3.861  -4.866
   83    HE2  LYS  14           1HE      LYS  14   0.498  -2.012  -6.364
   84    HE3  LYS  14           2HE      LYS  14  -1.025  -2.791  -6.791
   85    HZ1  LYS  14           3HZ      LYS  14  -0.622  -0.118  -6.272
   86    HZ2  LYS  14           1HZ      LYS  14  -1.448  -0.703  -4.916
   87    HZ3  LYS  14           2HZ      LYS  14  -2.109  -0.902  -6.461
   88    H    CYS  15           H        CYS  15  -0.038  -2.378  -0.527
   89    HA   CYS  15           HA       CYS  15   0.734   0.240  -1.505
   90    HB2  CYS  15           1HB      CYS  15   0.967  -0.613   0.916
   91    HB3  CYS  15           2HB      CYS  15   2.370  -1.499   0.329
   92    H    GLU  16           H        GLU  16   2.668   0.707  -2.593
   93    HA   GLU  16           HA       GLU  16   3.755  -1.568  -4.107
   94    HB2  GLU  16           1HB      GLU  16   4.453   0.119  -5.778
   95    HB3  GLU  16           2HB      GLU  16   2.714   0.101  -5.518
   96    HG2  GLU  16           1HG      GLU  16   2.755   2.115  -4.330
   97    HG3  GLU  16           2HG      GLU  16   4.499   2.036  -4.088
   98    H    LYS  17           H        LYS  17   4.652   1.340  -2.316
   99    HA   LYS  17           HA       LYS  17   7.374   1.390  -2.658
  100    HB2  LYS  17           1HB      LYS  17   5.678   2.010  -0.248
  101    HB3  LYS  17           2HB      LYS  17   7.422   2.241  -0.233
  102    HG2  LYS  17           1HG      LYS  17   6.929   3.602  -2.429
  103    HG3  LYS  17           2HG      LYS  17   5.320   3.732  -1.713
  104    HD2  LYS  17           1HD      LYS  17   6.645   4.428   0.428
  105    HD3  LYS  17           2HD      LYS  17   7.934   4.792  -0.722
  106    HE2  LYS  17           1HE      LYS  17   5.155   5.832  -1.140
  107    HE3  LYS  17           2HE      LYS  17   6.278   6.663  -0.064
  108    HZ1  LYS  17           3HZ      LYS  17   7.700   6.180  -2.364
  109    HZ2  LYS  17           1HZ      LYS  17   7.063   7.665  -1.863
  110    HZ3  LYS  17           2HZ      LYS  17   6.174   6.672  -2.905
  111    H    CYS  18           H        CYS  18   5.565  -0.515  -0.260
  112    HA   CYS  18           HA       CYS  18   7.985  -2.151   0.134
  113    HB2  CYS  18           1HB      CYS  18   7.111  -2.707   2.357
  114    HB3  CYS  18           2HB      CYS  18   7.295  -0.967   2.170
  115    H    GLY  19           H        GLY  19   4.436  -2.271  -0.024
  116    HA2  GLY  19           1HA      GLY  19   3.702  -4.046  -1.697
  117    HA3  GLY  19           2HA      GLY  19   4.645  -5.137  -0.693
  118    H    LYS  20           H        LYS  20   3.880  -3.919   1.813
  119    HA   LYS  20           HA       LYS  20   1.862  -5.457   2.694
  120    HB2  LYS  20           1HB      LYS  20   3.273  -3.661   3.936
  121    HB3  LYS  20           2HB      LYS  20   1.925  -2.589   3.583
  122    HG2  LYS  20           1HG      LYS  20   1.318  -3.334   5.647
  123    HG3  LYS  20           2HG      LYS  20   0.520  -4.545   4.640
  124    HD2  LYS  20           1HD      LYS  20   2.587  -5.965   4.917
  125    HD3  LYS  20           2HD      LYS  20   3.125  -4.804   6.133
  126    HE2  LYS  20           1HE      LYS  20   0.392  -5.967   6.367
  127    HE3  LYS  20           2HE      LYS  20   1.777  -6.968   6.802
  128    HZ1  LYS  20           3HZ      LYS  20   0.744  -5.635   8.650
  129    HZ2  LYS  20           1HZ      LYS  20   1.371  -4.250   7.906
  130    HZ3  LYS  20           2HZ      LYS  20   2.416  -5.456   8.466
  131    H    GLY  21           H        GLY  21  -0.380  -5.384   2.882
  132    HA2  GLY  21           1HA      GLY  21  -1.697  -3.559   0.969
  133    HA3  GLY  21           2HA      GLY  21  -2.256  -5.185   1.331
  134    H    TYR  22           H        TYR  22  -4.090  -3.255   1.472
  135    HA   TYR  22           HA       TYR  22  -4.840  -3.313   4.248
  136    HB2  TYR  22           1HB      TYR  22  -4.347  -0.650   2.899
  137    HB3  TYR  22           2HB      TYR  22  -5.138  -0.863   4.457
  138    HD1  TYR  22           HD1      TYR  22  -3.854  -1.521   6.426
  139    HD2  TYR  22           HD2      TYR  22  -1.953  -0.907   2.670
  140    HE1  TYR  22           HE1      TYR  22  -1.669  -1.439   7.552
  141    HE2  TYR  22           HE2      TYR  22   0.238  -0.824   3.785
  142    HH   TYR  22           HH       TYR  22   0.557  -1.425   7.255
  143    H    ASN  23           H        ASN  23  -7.000  -3.410   4.450
  144    HA   ASN  23           HA       ASN  23  -8.592  -3.157   2.016
  145    HB2  ASN  23           1HB      ASN  23 -10.313  -4.388   3.226
  146    HB3  ASN  23           2HB      ASN  23  -8.772  -5.231   3.351
  147   HD21  ASN  23          1HD2      ASN  23 -11.403  -4.553   5.033
  148   HD22  ASN  23          2HD2      ASN  23 -10.755  -4.444   6.631
  149    H    SER  24           H        SER  24  -7.744  -0.727   3.057
  150    HA   SER  24           HA       SER  24 -10.196   0.665   3.291
  151    HB2  SER  24           1HB      SER  24  -9.773  -0.359   5.652
  152    HB3  SER  24           2HB      SER  24  -8.558   0.910   5.797
  153    HG   SER  24           HG       SER  24 -11.193   1.102   6.112
  154    H    LYS  25           H        LYS  25  -9.889   2.625   2.461
  155    HA   LYS  25           HA       LYS  25  -7.442   3.519   1.502
  156    HB2  LYS  25           1HB      LYS  25  -9.857   5.201   2.199
  157    HB3  LYS  25           2HB      LYS  25  -8.548   5.673   1.123
  158    HG2  LYS  25           1HG      LYS  25  -9.152   3.830  -0.388
  159    HG3  LYS  25           2HG      LYS  25 -10.497   3.421   0.678
  160    HD2  LYS  25           1HD      LYS  25 -11.524   4.733  -0.929
  161    HD3  LYS  25           2HD      LYS  25 -11.180   5.905   0.345
  162    HE2  LYS  25           1HE      LYS  25  -9.534   6.937  -0.862
  163    HE3  LYS  25           2HE      LYS  25  -9.123   5.475  -1.758
  164    HZ1  LYS  25           3HZ      LYS  25 -11.412   5.789  -2.827
  165    HZ2  LYS  25           1HZ      LYS  25 -10.158   6.813  -3.321
  166    HZ3  LYS  25           2HZ      LYS  25 -11.331   7.373  -2.238
  167    H    PHE  26           H        PHE  26  -9.219   4.685   4.364
  168    HA   PHE  26           HA       PHE  26  -7.444   6.574   5.273
  169    HB2  PHE  26           1HB      PHE  26  -9.518   6.379   6.400
  170    HB3  PHE  26           2HB      PHE  26  -9.242   4.681   6.777
  171    HD1  PHE  26           HD2      PHE  26  -8.378   8.136   7.654
  172    HD2  PHE  26           HD1      PHE  26  -7.919   4.025   8.660
  173    HE1  PHE  26           HE2      PHE  26  -7.458   8.778   9.844
  174    HE2  PHE  26           HE1      PHE  26  -6.999   4.661  10.852
  175    HZ   PHE  26           HZ       PHE  26  -6.767   7.040  11.446
  176    H    ASN  27           H        ASN  27  -7.476   3.124   6.166
  177    HA   ASN  27           HA       ASN  27  -5.288   3.062   7.830
  178    HB2  ASN  27           1HB      ASN  27  -6.540   1.067   5.996
  179    HB3  ASN  27           2HB      ASN  27  -4.982   0.672   6.717
  180   HD21  ASN  27          1HD2      ASN  27  -4.878   1.051   9.124
  181   HD22  ASN  27          2HD2      ASN  27  -6.252   0.551  10.045
  182    H    LEU  28           H        LEU  28  -5.242   2.414   4.321
  183    HA   LEU  28           HA       LEU  28  -2.504   2.155   4.005
  184    HB2  LEU  28           1HB      LEU  28  -4.130   1.632   2.262
  185    HB3  LEU  28           2HB      LEU  28  -4.494   3.347   2.078
  186    HG   LEU  28           HG       LEU  28  -2.048   3.626   1.413
  187   HD11  LEU  28          1HD1      LEU  28  -1.337   1.410   2.279
  188   HD12  LEU  28          2HD1      LEU  28  -0.887   1.693   0.598
  189   HD13  LEU  28          3HD1      LEU  28  -2.258   0.652   0.979
  190   HD21  LEU  28          3HD2      LEU  28  -4.312   2.575  -0.097
  191   HD22  LEU  28          1HD2      LEU  28  -2.751   2.243  -0.849
  192   HD23  LEU  28          2HD2      LEU  28  -3.213   3.904  -0.474
  193    H    ASP  29           H        ASP  29  -4.444   5.106   3.502
  194    HA   ASP  29           HA       ASP  29  -2.611   6.946   2.833
  195    HB2  ASP  29           1HB      ASP  29  -5.129   7.180   3.605
  196    HB3  ASP  29           2HB      ASP  29  -4.387   7.687   5.120
  197    H    MET  30           H        MET  30  -3.213   5.967   6.207
  198    HA   MET  30           HA       MET  30  -1.149   7.515   7.330
  199    HB2  MET  30           1HB      MET  30  -2.808   5.212   8.233
  200    HB3  MET  30           2HB      MET  30  -1.357   5.584   9.152
  201    HG2  MET  30           1HG      MET  30  -3.623   7.480   8.582
  202    HG3  MET  30           2HG      MET  30  -3.314   6.656  10.109
  203    HE1  MET  30           3HE      MET  30  -2.727   9.509  11.645
  204    HE2  MET  30           1HE      MET  30  -2.852   7.753  11.753
  205    HE3  MET  30           2HE      MET  30  -1.310   8.548  12.072
  206    H    HIS  31           H        HIS  31  -1.224   3.978   6.838
  207    HA   HIS  31           HA       HIS  31   1.242   3.204   7.496
  208    HB2  HIS  31           1HB      HIS  31  -0.101   1.529   6.573
  209    HB3  HIS  31           2HB      HIS  31  -0.407   2.449   5.103
  210    HD1  HIS  31           HD1      HIS  31   2.536   0.732   6.799
  211    HD2  HIS  31           HD2      HIS  31   1.103   1.645   3.007
  212    HE1  HIS  31           HE1      HIS  31   4.136  -0.359   5.194
  213    H    GLN  32           H        GLN  32   0.466   4.883   4.470
  214    HA   GLN  32           HA       GLN  32   2.813   4.832   3.119
  215    HB2  GLN  32           1HB      GLN  32   1.063   7.260   3.541
  216    HB3  GLN  32           2HB      GLN  32   2.275   7.098   2.277
  217    HG2  GLN  32           1HG      GLN  32   1.012   5.104   1.446
  218    HG3  GLN  32           2HG      GLN  32  -0.258   5.514   2.599
  219   HE21  GLN  32          1HE2      GLN  32  -1.607   5.677   0.698
  220   HE22  GLN  32          2HE2      GLN  32  -1.613   7.143  -0.216
  221    H    LYS  33           H        LYS  33   2.033   7.292   5.583
  222    HA   LYS  33           HA       LYS  33   4.341   8.706   5.688
  223    HB2  LYS  33           1HB      LYS  33   3.738   9.404   7.817
  224    HB3  LYS  33           2HB      LYS  33   2.206   8.835   7.169
  225    HG2  LYS  33           1HG      LYS  33   2.585   6.670   8.325
  226    HG3  LYS  33           2HG      LYS  33   4.025   7.371   9.068
  227    HD2  LYS  33           1HD      LYS  33   2.734   8.983  10.245
  228    HD3  LYS  33           2HD      LYS  33   1.283   8.594   9.318
  229    HE2  LYS  33           1HE      LYS  33   2.633   6.487  10.956
  230    HE3  LYS  33           2HE      LYS  33   1.568   7.660  11.729
  231    HZ1  LYS  33           3HZ      LYS  33  -0.072   6.292  11.160
  232    HZ2  LYS  33           1HZ      LYS  33   0.908   5.394  10.113
  233    HZ3  LYS  33           2HZ      LYS  33   0.153   6.804   9.564
  234    H    VAL  34           H        VAL  34   3.801   5.499   7.046
  235    HA   VAL  34           HA       VAL  34   5.935   5.064   8.645
  236    HB   VAL  34           HB       VAL  34   5.006   3.154   6.496
  237   HG11  VAL  34          1HG1      VAL  34   6.858   2.893   8.800
  238   HG12  VAL  34          2HG1      VAL  34   5.773   1.544   8.460
  239   HG13  VAL  34          3HG1      VAL  34   6.895   2.108   7.221
  240   HG21  VAL  34          3HG2      VAL  34   3.259   2.551   7.807
  241   HG22  VAL  34          1HG2      VAL  34   4.131   2.874   9.306
  242   HG23  VAL  34          2HG2      VAL  34   3.428   4.207   8.389
  243    H    HIS  35           H        HIS  35   5.996   5.109   5.107
  244    HA   HIS  35           HA       HIS  35   8.812   4.516   4.984
  245    HB2  HIS  35           1HB      HIS  35   7.105   5.602   2.746
  246    HB3  HIS  35           2HB      HIS  35   8.585   4.656   2.617
  247    HD1  HIS  35           HD1      HIS  35   8.215   2.148   3.922
  248    HD2  HIS  35           HD2      HIS  35   4.950   4.077   2.227
  249    HE1  HIS  35           HE1      HIS  35   6.485   0.357   3.569
  250    H    THR  36           H        THR  36  10.017   6.070   5.961
  251    HA   THR  36           HA       THR  36  10.417   8.525   4.556
  252    HB   THR  36           HB       THR  36   8.453   9.200   5.850
  253    HG1  THR  36           HG1      THR  36   9.763  10.915   5.647
  254   HG21  THR  36          3HG2      THR  36   9.372   7.532   7.797
  255   HG22  THR  36          1HG2      THR  36   8.136   8.766   8.038
  256   HG23  THR  36          2HG2      THR  36   9.817   9.109   8.450
  257    H    GLY  37           H        GLY  37  12.564   8.610   4.540
  258    HA2  GLY  37           1HA      GLY  37  14.023   7.749   6.954
  259    HA3  GLY  37           2HA      GLY  37  14.677   7.731   5.323
  260    H    GLU  38           H        GLU  38  13.579   9.884   7.910
  261    HA   GLU  38           HA       GLU  38  14.330  12.328   6.915
  262    HB2  GLU  38           1HB      GLU  38  14.721  11.396   9.764
  263    HB3  GLU  38           2HB      GLU  38  14.605  13.065   9.226
  264    HG2  GLU  38           1HG      GLU  38  12.332  12.889   8.764
  265    HG3  GLU  38           2HG      GLU  38  12.381  11.128   8.724
  266    H    ARG  39           H        ARG  39  16.386   9.959   8.572
  267    HA   ARG  39           HA       ARG  39  18.744  11.590   8.282
  268    HB2  ARG  39           1HB      ARG  39  18.129   9.745  10.085
  269    HB3  ARG  39           2HB      ARG  39  18.903   8.679   8.919
  270    HG2  ARG  39           1HG      ARG  39  20.971   9.722   9.153
  271    HG3  ARG  39           2HG      ARG  39  20.264  11.167   9.878
  272    HD2  ARG  39           1HD      ARG  39  21.211  10.084  11.698
  273    HD3  ARG  39           2HD      ARG  39  19.524   9.576  11.771
  274    HE   ARG  39           HE       ARG  39  20.185   7.426  11.332
  275   HH11  ARG  39          1HH1      ARG  39  22.810   9.603  10.632
  276   HH12  ARG  39          2HH1      ARG  39  23.968   8.337  10.391
  277   HH21  ARG  39          1HH2      ARG  39  21.701   5.750  11.018
  278   HH22  ARG  39          2HH2      ARG  39  23.336   6.146  10.610
  279    HA   PRO  40           HA       PRO  40  19.889  10.258   4.241
  280    HB2  PRO  40           1HB      PRO  40  22.536  10.855   4.351
  281    HB3  PRO  40           2HB      PRO  40  21.278  12.088   4.202
  282    HG2  PRO  40           1HG      PRO  40  22.760  11.180   6.639
  283    HG3  PRO  40           2HG      PRO  40  22.343  12.827   6.132
  284    HD2  PRO  40           1HD      PRO  40  20.933  11.480   8.011
  285    HD3  PRO  40           2HD      PRO  40  20.181  12.655   6.913
  286    H    SER  41           H        SER  41  20.619   8.638   7.020
  287    HA   SER  41           HA       SER  41  22.710   6.995   6.747
  288    HB2  SER  41           1HB      SER  41  21.449   5.233   7.849
  289    HB3  SER  41           2HB      SER  41  20.970   6.794   8.516
  290    HG   SER  41           HG       SER  41  19.316   5.088   7.741
  291    H    GLY  42           H        GLY  42  23.470   5.455   5.414
  292    HA2  GLY  42           1HA      GLY  42  22.395   5.166   2.819
  293    HA3  GLY  42           2HA      GLY  42  23.683   4.189   3.510
  294    HA   PRO  43           HA       PRO  43  19.402   1.981   3.276
  295    HB2  PRO  43           1HB      PRO  43  19.451   0.969   0.757
  296    HB3  PRO  43           2HB      PRO  43  18.713   2.526   1.154
  297    HG2  PRO  43           1HG      PRO  43  21.410   1.950  -0.012
  298    HG3  PRO  43           2HG      PRO  43  20.239   3.201  -0.467
  299    HD2  PRO  43           1HD      PRO  43  22.397   3.720   1.084
  300    HD3  PRO  43           2HD      PRO  43  20.859   4.589   1.265
  301    H    SER  44           H        SER  44  20.469   0.583   4.723
  302    HA   SER  44           HA       SER  44  22.500  -1.234   3.887
  303    HB2  SER  44           1HB      SER  44  22.025  -2.340   6.105
  304    HB3  SER  44           2HB      SER  44  22.419  -0.624   6.207
  305    HG   SER  44           HG       SER  44  20.014  -1.935   6.690
  306    H    SER  45           H        SER  45  21.840  -2.469   2.173
  307    HA   SER  45           HA       SER  45  19.439  -3.609   1.617
  308    HB2  SER  45           1HB      SER  45  21.780  -3.771   0.409
  309    HB3  SER  45           2HB      SER  45  21.867  -5.319   1.248
  310    HG   SER  45           HG       SER  45  20.796  -5.076  -0.984
  311    H    GLY  46           H        GLY  46  18.142  -4.534   3.089
  312    HA2  GLY  46           1HA      GLY  46  17.975  -7.000   3.894
  313    HA3  GLY  46           2HA      GLY  46  19.286  -6.498   4.950
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1   3.285  -2.534 -21.440
    2    HA2  GLY   1           1HA      GLY   1   2.644  -2.457 -18.727
    3    HA3  GLY   1           2HA      GLY   1   2.725  -0.791 -19.283
    4    H    SER   2           H        SER   2   1.508  -3.780 -20.791
    5    HA   SER   2           HA       SER   2  -0.794  -2.398 -21.811
    6    HB2  SER   2           1HB      SER   2   0.372  -4.272 -23.013
    7    HB3  SER   2           2HB      SER   2  -0.270  -5.378 -21.799
    8    HG   SER   2           HG       SER   2  -1.514  -5.079 -23.829
    9    H    SER   3           H        SER   3  -3.003  -3.505 -21.536
   10    HA   SER   3           HA       SER   3  -3.509  -3.679 -18.666
   11    HB2  SER   3           1HB      SER   3  -5.838  -3.282 -19.220
   12    HB3  SER   3           2HB      SER   3  -4.838  -2.107 -20.074
   13    HG   SER   3           HG       SER   3  -6.293  -4.277 -21.070
   14    H    GLY   4           H        GLY   4  -5.174  -5.259 -17.918
   15    HA2  GLY   4           1HA      GLY   4  -6.312  -7.393 -18.756
   16    HA3  GLY   4           2HA      GLY   4  -4.682  -7.859 -19.218
   17    H    SER   5           H        SER   5  -6.931  -7.490 -16.615
   18    HA   SER   5           HA       SER   5  -5.613  -9.368 -14.984
   19    HB2  SER   5           1HB      SER   5  -4.913  -7.905 -13.124
   20    HB3  SER   5           2HB      SER   5  -4.012  -7.552 -14.598
   21    HG   SER   5           HG       SER   5  -4.661  -5.584 -14.273
   22    H    SER   6           H        SER   6  -6.607  -9.404 -12.720
   23    HA   SER   6           HA       SER   6  -9.122  -8.074 -12.365
   24    HB2  SER   6           1HB      SER   6 -10.606  -9.896 -12.611
   25    HB3  SER   6           2HB      SER   6  -9.567  -9.978 -14.033
   26    HG   SER   6           HG       SER   6  -9.471 -11.567 -11.695
   27    H    GLY   7           H        GLY   7  -9.821  -8.150 -10.262
   28    HA2  GLY   7           1HA      GLY   7  -7.980  -9.450  -8.385
   29    HA3  GLY   7           2HA      GLY   7  -9.087  -8.140  -8.003
   30    H    THR   8           H        THR   8  -8.558 -11.457  -7.842
   31    HA   THR   8           HA       THR   8 -11.405 -12.029  -7.389
   32    HB   THR   8           HB       THR   8 -10.760 -14.419  -7.491
   33    HG1  THR   8           HG1      THR   8  -8.240 -13.637  -8.490
   34   HG21  THR   8          3HG2      THR   8 -10.022 -14.359  -9.956
   35   HG22  THR   8          1HG2      THR   8 -10.121 -12.606  -9.798
   36   HG23  THR   8          2HG2      THR   8 -11.555 -13.597  -9.534
   37    H    GLY   9           H        GLY   9 -11.755 -11.364  -5.307
   38    HA2  GLY   9           1HA      GLY   9 -11.710 -11.434  -3.014
   39    HA3  GLY   9           2HA      GLY   9 -11.100 -13.072  -3.202
   40    H    GLU  10           H        GLU  10  -9.764  -9.833  -3.873
   41    HA   GLU  10           HA       GLU  10  -7.534 -10.477  -2.069
   42    HB2  GLU  10           1HB      GLU  10  -7.287  -9.239  -4.817
   43    HB3  GLU  10           2HB      GLU  10  -5.970  -9.425  -3.667
   44    HG2  GLU  10           1HG      GLU  10  -6.668 -11.950  -3.755
   45    HG3  GLU  10           2HG      GLU  10  -7.363 -11.478  -5.305
   46    H    LYS  11           H        LYS  11  -6.506  -8.684  -1.097
   47    HA   LYS  11           HA       LYS  11  -7.999  -6.728  -0.024
   48    HB2  LYS  11           1HB      LYS  11  -6.028  -5.564   0.538
   49    HB3  LYS  11           2HB      LYS  11  -5.536  -7.247   0.392
   50    HG2  LYS  11           1HG      LYS  11  -5.253  -5.293  -1.868
   51    HG3  LYS  11           2HG      LYS  11  -4.008  -5.507  -0.635
   52    HD2  LYS  11           1HD      LYS  11  -5.118  -7.806  -2.225
   53    HD3  LYS  11           2HD      LYS  11  -3.741  -6.850  -2.778
   54    HE2  LYS  11           1HE      LYS  11  -3.856  -8.226  -0.101
   55    HE3  LYS  11           2HE      LYS  11  -3.156  -8.957  -1.544
   56    HZ1  LYS  11           3HZ      LYS  11  -2.249  -6.452  -0.232
   57    HZ2  LYS  11           1HZ      LYS  11  -1.607  -7.081  -1.665
   58    HZ3  LYS  11           2HZ      LYS  11  -1.443  -7.939  -0.217
   59    HA   PRO  12           HA       PRO  12  -9.282  -3.948  -3.188
   60    HB2  PRO  12           1HB      PRO  12  -9.777  -1.759  -1.660
   61    HB3  PRO  12           2HB      PRO  12 -10.831  -3.178  -1.675
   62    HG2  PRO  12           1HG      PRO  12  -8.714  -2.410   0.298
   63    HG3  PRO  12           2HG      PRO  12 -10.336  -3.064   0.595
   64    HD2  PRO  12           1HD      PRO  12  -8.107  -4.599   0.684
   65    HD3  PRO  12           2HD      PRO  12  -9.680  -5.229   0.155
   66    H    TYR  13           H        TYR  13  -7.135  -2.448  -0.759
   67    HA   TYR  13           HA       TYR  13  -5.899  -0.870  -2.900
   68    HB2  TYR  13           1HB      TYR  13  -5.441  -0.543   0.063
   69    HB3  TYR  13           2HB      TYR  13  -5.113   0.618  -1.220
   70    HD1  TYR  13           HD2      TYR  13  -7.148   1.527  -2.518
   71    HD2  TYR  13           HD1      TYR  13  -7.456  -0.457   1.233
   72    HE1  TYR  13           HE2      TYR  13  -9.360   2.544  -2.168
   73    HE2  TYR  13           HE1      TYR  13  -9.669   0.554   1.593
   74    HH   TYR  13           HH       TYR  13 -11.536   1.721  -0.607
   75    H    LYS  14           H        LYS  14  -3.451  -0.381  -2.243
   76    HA   LYS  14           HA       LYS  14  -2.004  -2.611  -1.175
   77    HB2  LYS  14           1HB      LYS  14  -2.611  -3.448  -3.438
   78    HB3  LYS  14           2HB      LYS  14  -1.766  -2.075  -4.142
   79    HG2  LYS  14           1HG      LYS  14   0.298  -2.901  -2.927
   80    HG3  LYS  14           2HG      LYS  14  -0.607  -4.383  -2.610
   81    HD2  LYS  14           1HD      LYS  14  -0.859  -4.798  -4.963
   82    HD3  LYS  14           2HD      LYS  14  -0.151  -3.231  -5.360
   83    HE2  LYS  14           1HE      LYS  14   1.989  -3.906  -4.621
   84    HE3  LYS  14           2HE      LYS  14   1.344  -5.336  -3.818
   85    HZ1  LYS  14           3HZ      LYS  14   1.439  -4.871  -6.749
   86    HZ2  LYS  14           1HZ      LYS  14   0.755  -6.226  -6.002
   87    HZ3  LYS  14           2HZ      LYS  14   2.417  -5.940  -5.875
   88    H    CYS  15           H        CYS  15   0.216  -2.179  -0.902
   89    HA   CYS  15           HA       CYS  15   0.883   0.667  -1.158
   90    HB2  CYS  15           1HB      CYS  15   0.971  -0.333   1.107
   91    HB3  CYS  15           2HB      CYS  15   2.195  -1.465   0.541
   92    H    GLU  16           H        GLU  16   2.236   1.282  -2.699
   93    HA   GLU  16           HA       GLU  16   3.902  -0.732  -4.016
   94    HB2  GLU  16           1HB      GLU  16   2.839   1.951  -4.813
   95    HB3  GLU  16           2HB      GLU  16   4.266   1.315  -5.618
   96    HG2  GLU  16           1HG      GLU  16   1.795  -0.346  -5.397
   97    HG3  GLU  16           2HG      GLU  16   1.932   0.897  -6.639
   98    H    LYS  17           H        LYS  17   4.698   0.133  -1.446
   99    HA   LYS  17           HA       LYS  17   7.195   1.544  -2.116
  100    HB2  LYS  17           1HB      LYS  17   5.463   1.852   0.336
  101    HB3  LYS  17           2HB      LYS  17   7.125   2.422   0.260
  102    HG2  LYS  17           1HG      LYS  17   5.194   3.289  -1.837
  103    HG3  LYS  17           2HG      LYS  17   5.136   4.037  -0.239
  104    HD2  LYS  17           1HD      LYS  17   7.711   4.303  -0.588
  105    HD3  LYS  17           2HD      LYS  17   7.306   4.108  -2.295
  106    HE2  LYS  17           1HE      LYS  17   6.004   6.128  -0.477
  107    HE3  LYS  17           2HE      LYS  17   7.401   6.481  -1.493
  108    HZ1  LYS  17           3HZ      LYS  17   5.396   5.253  -3.044
  109    HZ2  LYS  17           1HZ      LYS  17   6.062   6.800  -3.207
  110    HZ3  LYS  17           2HZ      LYS  17   4.719   6.559  -2.208
  111    H    CYS  18           H        CYS  18   5.628  -0.634   0.217
  112    HA   CYS  18           HA       CYS  18   8.248  -1.905   0.665
  113    HB2  CYS  18           1HB      CYS  18   7.260  -2.732   2.807
  114    HB3  CYS  18           2HB      CYS  18   7.396  -0.979   2.719
  115    H    GLY  19           H        GLY  19   4.767  -2.596   0.393
  116    HA2  GLY  19           1HA      GLY  19   4.187  -4.337  -1.280
  117    HA3  GLY  19           2HA      GLY  19   5.499  -5.285  -0.594
  118    H    LYS  20           H        LYS  20   2.750  -3.473   0.776
  119    HA   LYS  20           HA       LYS  20   1.971  -5.939   2.190
  120    HB2  LYS  20           1HB      LYS  20   2.206  -3.124   3.187
  121    HB3  LYS  20           2HB      LYS  20   1.025  -4.206   3.914
  122    HG2  LYS  20           1HG      LYS  20   3.922  -4.947   3.662
  123    HG3  LYS  20           2HG      LYS  20   3.295  -4.034   5.037
  124    HD2  LYS  20           1HD      LYS  20   2.064  -6.637   4.184
  125    HD3  LYS  20           2HD      LYS  20   3.462  -6.586   5.261
  126    HE2  LYS  20           1HE      LYS  20   2.188  -5.155   6.807
  127    HE3  LYS  20           2HE      LYS  20   0.790  -5.268   5.739
  128    HZ1  LYS  20           3HZ      LYS  20   1.812  -7.842   6.400
  129    HZ2  LYS  20           1HZ      LYS  20   0.249  -7.226   6.597
  130    HZ3  LYS  20           2HZ      LYS  20   1.417  -6.970   7.794
  131    H    GLY  21           H        GLY  21  -0.381  -5.642   3.084
  132    HA2  GLY  21           1HA      GLY  21  -2.017  -4.440   0.935
  133    HA3  GLY  21           2HA      GLY  21  -2.378  -6.020   1.615
  134    H    TYR  22           H        TYR  22  -4.071  -3.654   1.500
  135    HA   TYR  22           HA       TYR  22  -4.731  -3.527   4.342
  136    HB2  TYR  22           1HB      TYR  22  -4.047  -1.183   2.607
  137    HB3  TYR  22           2HB      TYR  22  -5.244  -0.994   3.884
  138    HD1  TYR  22           HD1      TYR  22  -4.514  -1.757   6.261
  139    HD2  TYR  22           HD2      TYR  22  -1.791  -0.921   3.100
  140    HE1  TYR  22           HE1      TYR  22  -2.716  -1.427   7.906
  141    HE2  TYR  22           HE2      TYR  22   0.015  -0.591   4.736
  142    HH   TYR  22           HH       TYR  22   0.556  -1.266   7.044
  143    H    ASN  23           H        ASN  23  -6.921  -2.935   4.766
  144    HA   ASN  23           HA       ASN  23  -8.682  -3.272   2.427
  145    HB2  ASN  23           1HB      ASN  23  -9.155  -4.105   5.298
  146    HB3  ASN  23           2HB      ASN  23 -10.326  -4.267   3.993
  147   HD21  ASN  23          1HD2      ASN  23  -9.390  -5.441   2.020
  148   HD22  ASN  23          2HD2      ASN  23  -8.506  -6.885   2.364
  149    H    SER  24           H        SER  24  -7.655  -0.753   3.353
  150    HA   SER  24           HA       SER  24 -10.121   0.686   3.537
  151    HB2  SER  24           1HB      SER  24  -9.412  -0.093   5.957
  152    HB3  SER  24           2HB      SER  24  -8.292   1.265   5.834
  153    HG   SER  24           HG       SER  24  -9.916   2.630   5.922
  154    H    LYS  25           H        LYS  25  -9.907   2.649   2.633
  155    HA   LYS  25           HA       LYS  25  -7.491   3.377   1.370
  156    HB2  LYS  25           1HB      LYS  25  -8.662   5.407   0.699
  157    HB3  LYS  25           2HB      LYS  25  -9.705   4.005   0.502
  158    HG2  LYS  25           1HG      LYS  25 -11.013   4.579   2.363
  159    HG3  LYS  25           2HG      LYS  25  -9.815   5.735   2.951
  160    HD2  LYS  25           1HD      LYS  25 -10.281   6.865   0.606
  161    HD3  LYS  25           2HD      LYS  25 -11.816   6.008   0.763
  162    HE2  LYS  25           1HE      LYS  25 -10.698   7.776   2.927
  163    HE3  LYS  25           2HE      LYS  25 -11.754   8.379   1.651
  164    HZ1  LYS  25           3HZ      LYS  25 -13.300   6.490   2.411
  165    HZ2  LYS  25           1HZ      LYS  25 -13.211   7.891   3.355
  166    HZ3  LYS  25           2HZ      LYS  25 -12.379   6.497   3.831
  167    H    PHE  26           H        PHE  26  -8.870   4.165   4.460
  168    HA   PHE  26           HA       PHE  26  -7.261   6.468   4.965
  169    HB2  PHE  26           1HB      PHE  26  -9.133   6.469   6.312
  170    HB3  PHE  26           2HB      PHE  26  -9.073   4.730   6.579
  171    HD1  PHE  26           HD2      PHE  26  -6.640   7.498   7.169
  172    HD2  PHE  26           HD1      PHE  26  -8.878   4.273   8.816
  173    HE1  PHE  26           HE2      PHE  26  -5.571   7.875   9.352
  174    HE2  PHE  26           HE1      PHE  26  -7.813   4.646  11.002
  175    HZ   PHE  26           HZ       PHE  26  -6.156   6.448  11.272
  176    H    ASN  27           H        ASN  27  -7.121   3.108   6.144
  177    HA   ASN  27           HA       ASN  27  -4.821   3.297   7.670
  178    HB2  ASN  27           1HB      ASN  27  -6.484   1.300   7.232
  179    HB3  ASN  27           2HB      ASN  27  -5.286   0.839   6.026
  180   HD21  ASN  27          1HD2      ASN  27  -6.228   0.030   8.917
  181   HD22  ASN  27          2HD2      ASN  27  -4.728  -0.344   9.689
  182    H    LEU  28           H        LEU  28  -5.114   2.530   4.213
  183    HA   LEU  28           HA       LEU  28  -2.441   2.061   3.644
  184    HB2  LEU  28           1HB      LEU  28  -4.135   1.606   2.019
  185    HB3  LEU  28           2HB      LEU  28  -4.606   3.303   1.960
  186    HG   LEU  28           HG       LEU  28  -2.206   3.695   1.076
  187   HD11  LEU  28          1HD1      LEU  28  -1.576   1.289   1.639
  188   HD12  LEU  28          2HD1      LEU  28  -1.095   1.905   0.059
  189   HD13  LEU  28          3HD1      LEU  28  -2.493   0.839   0.201
  190   HD21  LEU  28          3HD2      LEU  28  -2.988   3.036  -1.248
  191   HD22  LEU  28          1HD2      LEU  28  -4.039   4.123  -0.339
  192   HD23  LEU  28          2HD2      LEU  28  -4.443   2.412  -0.470
  193    H    ASP  29           H        ASP  29  -4.154   5.093   4.046
  194    HA   ASP  29           HA       ASP  29  -2.092   6.766   3.028
  195    HB2  ASP  29           1HB      ASP  29  -4.364   7.592   3.150
  196    HB3  ASP  29           2HB      ASP  29  -4.397   7.355   4.895
  197    H    MET  30           H        MET  30  -3.161   6.149   6.378
  198    HA   MET  30           HA       MET  30  -1.116   7.519   7.665
  199    HB2  MET  30           1HB      MET  30  -1.905   6.597   9.613
  200    HB3  MET  30           2HB      MET  30  -3.286   6.311   8.562
  201    HG2  MET  30           1HG      MET  30  -3.098   4.252   9.483
  202    HG3  MET  30           2HG      MET  30  -2.018   4.042   8.107
  203    HE1  MET  30           3HE      MET  30  -0.640   4.814  12.442
  204    HE2  MET  30           1HE      MET  30  -1.526   6.004  11.488
  205    HE3  MET  30           2HE      MET  30  -2.314   4.505  11.980
  206    H    HIS  31           H        HIS  31  -1.143   4.331   6.238
  207    HA   HIS  31           HA       HIS  31   1.242   3.383   7.458
  208    HB2  HIS  31           1HB      HIS  31  -0.310   1.797   6.518
  209    HB3  HIS  31           2HB      HIS  31  -0.190   2.549   4.929
  210    HD1  HIS  31           HD1      HIS  31   2.112   0.777   7.389
  211    HD2  HIS  31           HD2      HIS  31   1.585   1.316   3.304
  212    HE1  HIS  31           HE1      HIS  31   3.847  -0.675   6.290
  213    H    GLN  32           H        GLN  32   0.590   4.669   4.197
  214    HA   GLN  32           HA       GLN  32   3.033   4.592   3.047
  215    HB2  GLN  32           1HB      GLN  32   0.932   6.739   2.977
  216    HB3  GLN  32           2HB      GLN  32   2.415   6.897   2.046
  217    HG2  GLN  32           1HG      GLN  32   1.905   5.059   0.699
  218    HG3  GLN  32           2HG      GLN  32   0.677   4.469   1.817
  219   HE21  GLN  32          1HE2      GLN  32  -1.354   5.407   1.822
  220   HE22  GLN  32          2HE2      GLN  32  -1.903   6.437   0.549
  221    H    LYS  33           H        LYS  33   1.945   7.085   5.332
  222    HA   LYS  33           HA       LYS  33   4.084   8.782   5.346
  223    HB2  LYS  33           1HB      LYS  33   2.530   7.806   7.749
  224    HB3  LYS  33           2HB      LYS  33   3.553   9.236   7.725
  225    HG2  LYS  33           1HG      LYS  33   2.106  10.376   6.264
  226    HG3  LYS  33           2HG      LYS  33   1.230   8.899   5.854
  227    HD2  LYS  33           1HD      LYS  33  -0.197  10.006   7.336
  228    HD3  LYS  33           2HD      LYS  33   0.618   8.811   8.348
  229    HE2  LYS  33           1HE      LYS  33   1.974  10.417   9.358
  230    HE3  LYS  33           2HE      LYS  33   1.699  11.593   8.074
  231    HZ1  LYS  33           3HZ      LYS  33  -0.002  10.901  10.356
  232    HZ2  LYS  33           1HZ      LYS  33  -0.754  11.392   8.922
  233    HZ3  LYS  33           2HZ      LYS  33   0.348  12.418   9.692
  234    H    VAL  34           H        VAL  34   3.836   5.646   6.947
  235    HA   VAL  34           HA       VAL  34   5.994   5.574   8.584
  236    HB   VAL  34           HB       VAL  34   5.209   3.390   6.650
  237   HG11  VAL  34          1HG1      VAL  34   6.492   1.893   7.842
  238   HG12  VAL  34          2HG1      VAL  34   7.509   3.335   7.887
  239   HG13  VAL  34          3HG1      VAL  34   6.524   2.905   9.285
  240   HG21  VAL  34          3HG2      VAL  34   4.440   3.487   9.536
  241   HG22  VAL  34          1HG2      VAL  34   3.510   4.397   8.345
  242   HG23  VAL  34          2HG2      VAL  34   3.661   2.646   8.196
  243    H    HIS  35           H        HIS  35   6.062   5.200   5.060
  244    HA   HIS  35           HA       HIS  35   8.936   4.926   5.010
  245    HB2  HIS  35           1HB      HIS  35   7.247   5.487   2.591
  246    HB3  HIS  35           2HB      HIS  35   8.729   4.544   2.710
  247    HD1  HIS  35           HD1      HIS  35   8.441   2.185   4.029
  248    HD2  HIS  35           HD2      HIS  35   4.966   4.011   2.669
  249    HE1  HIS  35           HE1      HIS  35   6.688   0.382   4.034
  250    H    THR  36           H        THR  36   8.215   7.272   6.297
  251    HA   THR  36           HA       THR  36   9.148   9.306   4.380
  252    HB   THR  36           HB       THR  36   7.208   9.735   6.661
  253    HG1  THR  36           HG1      THR  36   6.904   9.759   3.829
  254   HG21  THR  36          3HG2      THR  36   7.139  12.030   6.042
  255   HG22  THR  36          1HG2      THR  36   8.118  11.742   4.605
  256   HG23  THR  36          2HG2      THR  36   8.843  11.607   6.207
  257    H    GLY  37           H        GLY  37   8.982   8.390   7.812
  258    HA2  GLY  37           1HA      GLY  37  10.506   8.644   9.511
  259    HA3  GLY  37           2HA      GLY  37  11.726   8.866   8.266
  260    H    GLU  38           H        GLU  38   8.868  10.862   8.866
  261    HA   GLU  38           HA       GLU  38  10.602  13.197   9.057
  262    HB2  GLU  38           1HB      GLU  38   8.669  14.512   8.658
  263    HB3  GLU  38           2HB      GLU  38   8.545  13.126   7.584
  264    HG2  GLU  38           1HG      GLU  38   6.792  12.209   8.738
  265    HG3  GLU  38           2HG      GLU  38   7.232  13.001  10.251
  266    H    ARG  39           H        ARG  39  10.538  14.672  10.778
  267    HA   ARG  39           HA       ARG  39   9.146  13.818  13.211
  268    HB2  ARG  39           1HB      ARG  39  12.101  14.194  12.874
  269    HB3  ARG  39           2HB      ARG  39  11.346  14.525  14.427
  270    HG2  ARG  39           1HG      ARG  39  10.825  12.322  14.801
  271    HG3  ARG  39           2HG      ARG  39  10.809  11.923  13.081
  272    HD2  ARG  39           1HD      ARG  39  13.336  12.729  14.485
  273    HD3  ARG  39           2HD      ARG  39  12.762  11.062  14.507
  274    HE   ARG  39           HE       ARG  39  12.746  11.702  11.874
  275   HH11  ARG  39          1HH1      ARG  39  15.150  11.884  14.385
  276   HH12  ARG  39          2HH1      ARG  39  16.484  11.643  13.305
  277   HH21  ARG  39          1HH2      ARG  39  14.494  11.383  10.442
  278   HH22  ARG  39          2HH2      ARG  39  16.109  11.359  11.063
  279    HA   PRO  40           HA       PRO  40   8.176  18.099  13.521
  280    HB2  PRO  40           1HB      PRO  40   7.594  18.223  16.170
  281    HB3  PRO  40           2HB      PRO  40   6.523  17.465  14.986
  282    HG2  PRO  40           1HG      PRO  40   8.485  16.190  16.853
  283    HG3  PRO  40           2HG      PRO  40   6.835  15.684  16.448
  284    HD2  PRO  40           1HD      PRO  40   9.024  14.530  15.349
  285    HD3  PRO  40           2HD      PRO  40   7.489  14.694  14.472
  286    H    SER  41           H        SER  41   9.443  19.838  13.634
  287    HA   SER  41           HA       SER  41  12.052  19.854  14.531
  288    HB2  SER  41           1HB      SER  41  11.816  22.377  14.530
  289    HB3  SER  41           2HB      SER  41  11.330  21.575  13.036
  290    HG   SER  41           HG       SER  41   9.823  23.176  13.783
  291    H    GLY  42           H        GLY  42   9.189  21.147  16.217
  292    HA2  GLY  42           1HA      GLY  42  10.689  21.731  18.600
  293    HA3  GLY  42           2HA      GLY  42   8.946  21.848  18.408
  294    HA   PRO  43           HA       PRO  43  10.129  18.154  21.075
  295    HB2  PRO  43           1HB      PRO  43   8.873  18.991  23.332
  296    HB3  PRO  43           2HB      PRO  43  10.553  19.395  22.961
  297    HG2  PRO  43           1HG      PRO  43   8.083  21.045  22.591
  298    HG3  PRO  43           2HG      PRO  43   9.670  21.530  23.216
  299    HD2  PRO  43           1HD      PRO  43   8.887  22.039  20.675
  300    HD3  PRO  43           2HD      PRO  43  10.580  21.727  21.108
  301    H    SER  44           H        SER  44   8.806  16.625  20.274
  302    HA   SER  44           HA       SER  44   6.016  16.649  21.111
  303    HB2  SER  44           1HB      SER  44   6.931  16.650  18.248
  304    HB3  SER  44           2HB      SER  44   5.423  15.858  18.705
  305    HG   SER  44           HG       SER  44   5.749  18.393  19.731
  306    H    SER  45           H        SER  45   4.962  14.535  20.758
  307    HA   SER  45           HA       SER  45   6.874  12.394  21.268
  308    HB2  SER  45           1HB      SER  45   4.738  12.892  22.662
  309    HB3  SER  45           2HB      SER  45   3.885  12.073  21.354
  310    HG   SER  45           HG       SER  45   4.435  10.577  22.938
  311    H    GLY  46           H        GLY  46   7.460  10.981  19.763
  312    HA2  GLY  46           1HA      GLY  46   5.576  10.296  17.622
  313    HA3  GLY  46           2HA      GLY  46   7.150  10.931  17.164
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1   9.287 -32.246  -8.355
    2    HA2  GLY   1           1HA      GLY   1   9.546 -31.598  -5.679
    3    HA3  GLY   1           2HA      GLY   1  11.089 -31.194  -6.417
    4    H    SER   2           H        SER   2   8.052 -30.056  -5.664
    5    HA   SER   2           HA       SER   2   8.520 -27.521  -6.828
    6    HB2  SER   2           1HB      SER   2   7.664 -29.113  -8.764
    7    HB3  SER   2           2HB      SER   2   6.091 -28.765  -8.048
    8    HG   SER   2           HG       SER   2   6.600 -27.249  -9.660
    9    H    SER   3           H        SER   3   7.870 -26.381  -5.124
   10    HA   SER   3           HA       SER   3   5.140 -26.813  -4.127
   11    HB2  SER   3           1HB      SER   3   5.927 -26.398  -1.820
   12    HB3  SER   3           2HB      SER   3   6.664 -27.842  -2.513
   13    HG   SER   3           HG       SER   3   8.015 -25.426  -2.835
   14    H    GLY   4           H        GLY   4   4.125 -24.954  -3.219
   15    HA2  GLY   4           1HA      GLY   4   5.501 -22.396  -3.629
   16    HA3  GLY   4           2HA      GLY   4   3.993 -22.675  -4.488
   17    H    SER   5           H        SER   5   3.250 -20.765  -3.333
   18    HA   SER   5           HA       SER   5   2.188 -21.494  -0.694
   19    HB2  SER   5           1HB      SER   5   4.186 -19.978  -0.463
   20    HB3  SER   5           2HB      SER   5   3.275 -18.745  -1.335
   21    HG   SER   5           HG       SER   5   3.012 -18.440   0.874
   22    H    SER   6           H        SER   6   0.061 -21.227  -0.571
   23    HA   SER   6           HA       SER   6  -1.263 -19.620  -2.644
   24    HB2  SER   6           1HB      SER   6  -3.170 -20.997  -2.396
   25    HB3  SER   6           2HB      SER   6  -1.802 -22.108  -2.325
   26    HG   SER   6           HG       SER   6  -3.286 -21.074  -0.139
   27    H    GLY   7           H        GLY   7  -3.098 -18.311  -2.058
   28    HA2  GLY   7           1HA      GLY   7  -4.479 -17.398  -0.240
   29    HA3  GLY   7           2HA      GLY   7  -3.037 -17.433   0.763
   30    H    THR   8           H        THR   8  -3.457 -16.296  -2.572
   31    HA   THR   8           HA       THR   8  -1.818 -14.110  -2.442
   32    HB   THR   8           HB       THR   8  -3.248 -13.096  -4.255
   33    HG1  THR   8           HG1      THR   8  -4.881 -15.245  -3.461
   34   HG21  THR   8          3HG2      THR   8  -3.017 -15.316  -5.712
   35   HG22  THR   8          1HG2      THR   8  -2.066 -15.820  -4.316
   36   HG23  THR   8          2HG2      THR   8  -1.614 -14.370  -5.213
   37    H    GLY   9           H        GLY   9  -5.306 -14.176  -1.730
   38    HA2  GLY   9           1HA      GLY   9  -6.564 -12.828  -0.351
   39    HA3  GLY   9           2HA      GLY   9  -5.061 -12.170   0.278
   40    H    GLU  10           H        GLU  10  -7.601 -11.803  -2.072
   41    HA   GLU  10           HA       GLU  10  -6.525  -9.662  -3.546
   42    HB2  GLU  10           1HB      GLU  10  -8.820  -9.228  -4.260
   43    HB3  GLU  10           2HB      GLU  10  -8.470 -10.950  -4.300
   44    HG2  GLU  10           1HG      GLU  10  -9.867 -11.420  -2.547
   45    HG3  GLU  10           2HG      GLU  10  -9.735  -9.799  -1.866
   46    H    LYS  11           H        LYS  11  -6.932  -7.421  -3.425
   47    HA   LYS  11           HA       LYS  11  -8.266  -6.273  -1.161
   48    HB2  LYS  11           1HB      LYS  11  -5.803  -7.049  -0.512
   49    HB3  LYS  11           2HB      LYS  11  -5.386  -5.517  -1.269
   50    HG2  LYS  11           1HG      LYS  11  -6.504  -4.273   0.329
   51    HG3  LYS  11           2HG      LYS  11  -7.517  -5.631   0.823
   52    HD2  LYS  11           1HD      LYS  11  -4.536  -5.580   1.243
   53    HD3  LYS  11           2HD      LYS  11  -5.680  -4.954   2.433
   54    HE2  LYS  11           1HE      LYS  11  -6.090  -7.700   1.355
   55    HE3  LYS  11           2HE      LYS  11  -4.810  -7.440   2.539
   56    HZ1  LYS  11           3HZ      LYS  11  -7.137  -6.147   3.426
   57    HZ2  LYS  11           1HZ      LYS  11  -6.322  -7.448   4.135
   58    HZ3  LYS  11           2HZ      LYS  11  -7.545  -7.733   3.003
   59    HA   PRO  12           HA       PRO  12  -8.683  -3.047  -4.134
   60    HB2  PRO  12           1HB      PRO  12  -9.529  -1.070  -2.476
   61    HB3  PRO  12           2HB      PRO  12 -10.559  -2.422  -2.963
   62    HG2  PRO  12           1HG      PRO  12  -9.010  -2.037  -0.430
   63    HG3  PRO  12           2HG      PRO  12 -10.661  -2.647  -0.651
   64    HD2  PRO  12           1HD      PRO  12  -8.546  -4.285  -0.229
   65    HD3  PRO  12           2HD      PRO  12  -9.938  -4.759  -1.224
   66    H    TYR  13           H        TYR  13  -7.015  -2.267  -1.092
   67    HA   TYR  13           HA       TYR  13  -5.288  -0.416  -2.598
   68    HB2  TYR  13           1HB      TYR  13  -5.608  -0.397   0.395
   69    HB3  TYR  13           2HB      TYR  13  -5.004   0.883  -0.651
   70    HD1  TYR  13           HD2      TYR  13  -6.943   1.343  -2.637
   71    HD2  TYR  13           HD1      TYR  13  -7.588   0.188   1.407
   72    HE1  TYR  13           HE2      TYR  13  -9.189   2.341  -2.716
   73    HE2  TYR  13           HE1      TYR  13  -9.837   1.183   1.339
   74    HH   TYR  13           HH       TYR  13 -10.913   3.193  -0.226
   75    H    LYS  14           H        LYS  14  -3.258  -1.025  -2.896
   76    HA   LYS  14           HA       LYS  14  -2.034  -2.878  -0.964
   77    HB2  LYS  14           1HB      LYS  14  -0.838  -3.942  -2.869
   78    HB3  LYS  14           2HB      LYS  14  -2.580  -4.180  -2.918
   79    HG2  LYS  14           1HG      LYS  14  -2.743  -2.331  -4.555
   80    HG3  LYS  14           2HG      LYS  14  -0.981  -2.227  -4.560
   81    HD2  LYS  14           1HD      LYS  14  -2.261  -4.867  -5.079
   82    HD3  LYS  14           2HD      LYS  14  -2.270  -3.654  -6.361
   83    HE2  LYS  14           1HE      LYS  14  -0.307  -4.766  -6.809
   84    HE3  LYS  14           2HE      LYS  14   0.270  -3.451  -5.786
   85    HZ1  LYS  14           3HZ      LYS  14   0.992  -5.891  -5.322
   86    HZ2  LYS  14           1HZ      LYS  14  -0.503  -5.993  -4.536
   87    HZ3  LYS  14           2HZ      LYS  14   0.641  -4.853  -4.034
   88    H    CYS  15           H        CYS  15  -0.177  -2.175  -0.140
   89    HA   CYS  15           HA       CYS  15   0.923   0.329  -0.875
   90    HB2  CYS  15           1HB      CYS  15   1.014  -0.987   1.393
   91    HB3  CYS  15           2HB      CYS  15   2.475  -1.689   0.706
   92    H    GLU  16           H        GLU  16   1.832   0.569  -2.827
   93    HA   GLU  16           HA       GLU  16   3.443  -1.536  -3.997
   94    HB2  GLU  16           1HB      GLU  16   1.826   0.005  -5.261
   95    HB3  GLU  16           2HB      GLU  16   3.071   1.236  -5.110
   96    HG2  GLU  16           1HG      GLU  16   3.507   0.357  -7.187
   97    HG3  GLU  16           2HG      GLU  16   4.621  -0.547  -6.163
   98    H    LYS  17           H        LYS  17   4.334  -0.164  -1.535
   99    HA   LYS  17           HA       LYS  17   6.860   0.980  -2.534
  100    HB2  LYS  17           1HB      LYS  17   5.305   1.543  -0.012
  101    HB3  LYS  17           2HB      LYS  17   6.984   2.026  -0.212
  102    HG2  LYS  17           1HG      LYS  17   5.067   2.823  -2.327
  103    HG3  LYS  17           2HG      LYS  17   4.967   3.647  -0.769
  104    HD2  LYS  17           1HD      LYS  17   6.492   4.997  -1.793
  105    HD3  LYS  17           2HD      LYS  17   7.596   3.799  -1.113
  106    HE2  LYS  17           1HE      LYS  17   8.053   4.351  -3.493
  107    HE3  LYS  17           2HE      LYS  17   7.727   2.642  -3.208
  108    HZ1  LYS  17           3HZ      LYS  17   6.596   3.746  -5.183
  109    HZ2  LYS  17           1HZ      LYS  17   5.587   4.497  -4.051
  110    HZ3  LYS  17           2HZ      LYS  17   5.624   2.810  -4.162
  111    H    CYS  18           H        CYS  18   5.445  -0.964   0.086
  112    HA   CYS  18           HA       CYS  18   8.074  -2.241   0.451
  113    HB2  CYS  18           1HB      CYS  18   7.151  -2.927   2.702
  114    HB3  CYS  18           2HB      CYS  18   7.418  -1.199   2.493
  115    H    GLY  19           H        GLY  19   4.585  -2.865   0.295
  116    HA2  GLY  19           1HA      GLY  19   3.955  -4.748  -1.197
  117    HA3  GLY  19           2HA      GLY  19   5.227  -5.665  -0.404
  118    H    LYS  20           H        LYS  20   2.619  -3.584   0.842
  119    HA   LYS  20           HA       LYS  20   1.727  -5.870   2.476
  120    HB2  LYS  20           1HB      LYS  20   1.937  -2.944   3.135
  121    HB3  LYS  20           2HB      LYS  20   0.838  -3.995   4.020
  122    HG2  LYS  20           1HG      LYS  20   3.765  -4.602   3.738
  123    HG3  LYS  20           2HG      LYS  20   3.119  -3.602   5.042
  124    HD2  LYS  20           1HD      LYS  20   1.607  -5.492   5.645
  125    HD3  LYS  20           2HD      LYS  20   2.436  -6.479   4.440
  126    HE2  LYS  20           1HE      LYS  20   4.033  -5.076   6.534
  127    HE3  LYS  20           2HE      LYS  20   3.160  -6.547   6.960
  128    HZ1  LYS  20           3HZ      LYS  20   4.908  -6.492   4.588
  129    HZ2  LYS  20           1HZ      LYS  20   4.425  -7.815   5.526
  130    HZ3  LYS  20           2HZ      LYS  20   5.571  -6.725   6.127
  131    H    GLY  21           H        GLY  21  -0.593  -5.749   3.129
  132    HA2  GLY  21           1HA      GLY  21  -2.213  -4.515   0.987
  133    HA3  GLY  21           2HA      GLY  21  -2.531  -6.132   1.595
  134    H    TYR  22           H        TYR  22  -3.869  -3.282   1.602
  135    HA   TYR  22           HA       TYR  22  -4.974  -3.613   4.296
  136    HB2  TYR  22           1HB      TYR  22  -4.039  -0.980   3.135
  137    HB3  TYR  22           2HB      TYR  22  -4.953  -1.155   4.629
  138    HD1  TYR  22           HD1      TYR  22  -3.886  -2.626   6.474
  139    HD2  TYR  22           HD2      TYR  22  -1.713  -1.018   3.188
  140    HE1  TYR  22           HE1      TYR  22  -1.790  -2.910   7.729
  141    HE2  TYR  22           HE2      TYR  22   0.390  -1.298   4.434
  142    HH   TYR  22           HH       TYR  22   1.296  -2.560   6.257
  143    H    ASN  23           H        ASN  23  -7.087  -3.884   4.107
  144    HA   ASN  23           HA       ASN  23  -8.483  -3.091   1.710
  145    HB2  ASN  23           1HB      ASN  23 -10.421  -4.210   2.734
  146    HB3  ASN  23           2HB      ASN  23  -8.993  -5.241   2.767
  147   HD21  ASN  23          1HD2      ASN  23 -11.544  -4.171   4.527
  148   HD22  ASN  23          2HD2      ASN  23 -10.939  -4.458   6.120
  149    H    SER  24           H        SER  24  -7.498  -0.854   2.991
  150    HA   SER  24           HA       SER  24  -9.893   0.673   3.341
  151    HB2  SER  24           1HB      SER  24  -9.359  -0.442   5.631
  152    HB3  SER  24           2HB      SER  24  -8.057   0.744   5.719
  153    HG   SER  24           HG       SER  24 -10.423   1.181   6.498
  154    H    LYS  25           H        LYS  25  -9.569   2.791   2.868
  155    HA   LYS  25           HA       LYS  25  -7.041   3.536   1.760
  156    HB2  LYS  25           1HB      LYS  25  -8.131   5.671   1.248
  157    HB3  LYS  25           2HB      LYS  25  -9.137   4.311   0.767
  158    HG2  LYS  25           1HG      LYS  25 -10.452   4.595   2.836
  159    HG3  LYS  25           2HG      LYS  25  -9.482   6.019   3.222
  160    HD2  LYS  25           1HD      LYS  25 -10.261   7.151   1.249
  161    HD3  LYS  25           2HD      LYS  25 -11.099   5.699   0.696
  162    HE2  LYS  25           1HE      LYS  25 -11.758   6.916   3.350
  163    HE3  LYS  25           2HE      LYS  25 -12.443   7.585   1.869
  164    HZ1  LYS  25           3HZ      LYS  25 -13.169   5.215   1.387
  165    HZ2  LYS  25           1HZ      LYS  25 -14.001   6.037   2.609
  166    HZ3  LYS  25           2HZ      LYS  25 -12.829   4.886   3.011
  167    H    PHE  26           H        PHE  26  -8.903   4.532   4.609
  168    HA   PHE  26           HA       PHE  26  -7.172   6.539   5.509
  169    HB2  PHE  26           1HB      PHE  26  -9.376   6.357   6.450
  170    HB3  PHE  26           2HB      PHE  26  -9.052   4.725   7.026
  171    HD1  PHE  26           HD2      PHE  26  -7.674   8.175   7.367
  172    HD2  PHE  26           HD1      PHE  26  -8.542   4.455   9.244
  173    HE1  PHE  26           HE2      PHE  26  -6.920   9.091   9.522
  174    HE2  PHE  26           HE1      PHE  26  -7.791   5.366  11.403
  175    HZ   PHE  26           HZ       PHE  26  -6.977   7.686  11.544
  176    H    ASN  27           H        ASN  27  -7.249   3.068   6.223
  177    HA   ASN  27           HA       ASN  27  -5.196   3.025   8.125
  178    HB2  ASN  27           1HB      ASN  27  -6.784   1.144   7.590
  179    HB3  ASN  27           2HB      ASN  27  -5.821   0.822   6.151
  180   HD21  ASN  27          1HD2      ASN  27  -5.368   1.341   9.633
  181   HD22  ASN  27          2HD2      ASN  27  -4.200   0.084   9.840
  182    H    LEU  28           H        LEU  28  -5.047   2.429   4.617
  183    HA   LEU  28           HA       LEU  28  -2.276   2.036   4.466
  184    HB2  LEU  28           1HB      LEU  28  -3.839   1.434   2.681
  185    HB3  LEU  28           2HB      LEU  28  -4.148   3.142   2.376
  186    HG   LEU  28           HG       LEU  28  -1.790   3.411   1.688
  187   HD11  LEU  28          1HD1      LEU  28  -1.618   0.410   1.783
  188   HD12  LEU  28          2HD1      LEU  28  -0.978   1.454   3.052
  189   HD13  LEU  28          3HD1      LEU  28  -0.337   1.564   1.413
  190   HD21  LEU  28          3HD2      LEU  28  -3.218   1.223   0.183
  191   HD22  LEU  28          1HD2      LEU  28  -2.020   2.346  -0.459
  192   HD23  LEU  28          2HD2      LEU  28  -3.597   2.942   0.060
  193    H    ASP  29           H        ASP  29  -4.193   4.970   3.824
  194    HA   ASP  29           HA       ASP  29  -2.210   6.732   3.157
  195    HB2  ASP  29           1HB      ASP  29  -4.354   7.623   3.040
  196    HB3  ASP  29           2HB      ASP  29  -4.783   7.066   4.655
  197    H    MET  30           H        MET  30  -3.211   5.793   6.427
  198    HA   MET  30           HA       MET  30  -1.417   7.515   7.781
  199    HB2  MET  30           1HB      MET  30  -3.087   5.161   8.529
  200    HB3  MET  30           2HB      MET  30  -1.806   5.647   9.631
  201    HG2  MET  30           1HG      MET  30  -2.783   7.949   9.612
  202    HG3  MET  30           2HG      MET  30  -4.141   7.294   8.701
  203    HE1  MET  30           3HE      MET  30  -2.067   7.357  11.767
  204    HE2  MET  30           1HE      MET  30  -3.412   8.317  12.385
  205    HE3  MET  30           2HE      MET  30  -3.072   6.729  13.074
  206    H    HIS  31           H        HIS  31  -1.043   4.446   6.245
  207    HA   HIS  31           HA       HIS  31   1.416   3.788   7.620
  208    HB2  HIS  31           1HB      HIS  31   0.122   1.907   6.987
  209    HB3  HIS  31           2HB      HIS  31  -0.106   2.516   5.350
  210    HD1  HIS  31           HD1      HIS  31   2.845   1.454   7.516
  211    HD2  HIS  31           HD2      HIS  31   1.515   1.283   3.584
  212    HE1  HIS  31           HE1      HIS  31   4.591   0.139   6.273
  213    H    GLN  32           H        GLN  32   0.428   5.054   4.479
  214    HA   GLN  32           HA       GLN  32   2.750   4.942   3.042
  215    HB2  GLN  32           1HB      GLN  32   0.588   7.018   3.175
  216    HB3  GLN  32           2HB      GLN  32   1.977   7.248   2.121
  217    HG2  GLN  32           1HG      GLN  32   0.250   4.794   2.027
  218    HG3  GLN  32           2HG      GLN  32  -0.075   6.237   1.069
  219   HE21  GLN  32          1HE2      GLN  32   0.716   3.434   0.372
  220   HE22  GLN  32          2HE2      GLN  32   2.088   3.612  -0.663
  221    H    LYS  33           H        LYS  33   1.828   7.533   5.304
  222    HA   LYS  33           HA       LYS  33   4.007   9.179   5.091
  223    HB2  LYS  33           1HB      LYS  33   3.492  10.008   7.261
  224    HB3  LYS  33           2HB      LYS  33   1.966   9.520   6.534
  225    HG2  LYS  33           1HG      LYS  33   2.385   7.282   7.782
  226    HG3  LYS  33           2HG      LYS  33   3.495   8.247   8.760
  227    HD2  LYS  33           1HD      LYS  33   0.707   9.212   8.264
  228    HD3  LYS  33           2HD      LYS  33   1.012   7.989   9.499
  229    HE2  LYS  33           1HE      LYS  33   2.674   9.510  10.527
  230    HE3  LYS  33           2HE      LYS  33   2.244  10.738   9.338
  231    HZ1  LYS  33           3HZ      LYS  33   1.114  10.978  11.519
  232    HZ2  LYS  33           1HZ      LYS  33   0.304   9.522  11.225
  233    HZ3  LYS  33           2HZ      LYS  33   0.049  10.852  10.211
  234    H    VAL  34           H        VAL  34   3.788   6.091   6.730
  235    HA   VAL  34           HA       VAL  34   6.019   6.107   8.336
  236    HB   VAL  34           HB       VAL  34   5.137   3.778   6.627
  237   HG11  VAL  34          1HG1      VAL  34   6.004   2.567   8.763
  238   HG12  VAL  34          2HG1      VAL  34   7.152   3.111   7.538
  239   HG13  VAL  34          3HG1      VAL  34   6.918   4.054   9.010
  240   HG21  VAL  34          3HG2      VAL  34   4.264   3.867   9.416
  241   HG22  VAL  34          1HG2      VAL  34   3.576   5.142   8.410
  242   HG23  VAL  34          2HG2      VAL  34   3.364   3.450   7.958
  243    H    HIS  35           H        HIS  35   5.852   5.494   4.853
  244    HA   HIS  35           HA       HIS  35   8.640   4.942   4.579
  245    HB2  HIS  35           1HB      HIS  35   6.669   5.780   2.443
  246    HB3  HIS  35           2HB      HIS  35   8.227   4.999   2.184
  247    HD1  HIS  35           HD1      HIS  35   8.136   2.656   4.050
  248    HD2  HIS  35           HD2      HIS  35   4.835   3.889   1.849
  249    HE1  HIS  35           HE1      HIS  35   6.644   0.638   3.889
  250    H    THR  36           H        THR  36   9.397   6.833   5.803
  251    HA   THR  36           HA       THR  36   9.935   9.052   3.983
  252    HB   THR  36           HB       THR  36   9.604  10.587   6.093
  253    HG1  THR  36           HG1      THR  36   8.273   8.228   6.740
  254   HG21  THR  36          3HG2      THR  36   8.035   9.935   3.829
  255   HG22  THR  36          1HG2      THR  36   8.039  11.436   4.755
  256   HG23  THR  36          2HG2      THR  36   6.933  10.133   5.191
  257    H    GLY  37           H        GLY  37  11.988   9.751   4.112
  258    HA2  GLY  37           1HA      GLY  37  13.540   9.056   6.522
  259    HA3  GLY  37           2HA      GLY  37  14.158   8.673   4.922
  260    H    GLU  38           H        GLU  38  12.543  11.570   6.215
  261    HA   GLU  38           HA       GLU  38  14.824  13.147   5.230
  262    HB2  GLU  38           1HB      GLU  38  13.254  15.052   5.144
  263    HB3  GLU  38           2HB      GLU  38  12.747  13.718   4.118
  264    HG2  GLU  38           1HG      GLU  38  11.048  13.076   5.634
  265    HG3  GLU  38           2HG      GLU  38  11.671  14.147   6.888
  266    H    ARG  39           H        ARG  39  15.159  11.931   7.661
  267    HA   ARG  39           HA       ARG  39  14.691  14.061   9.634
  268    HB2  ARG  39           1HB      ARG  39  15.185  12.318  11.333
  269    HB3  ARG  39           2HB      ARG  39  13.792  11.933  10.331
  270    HG2  ARG  39           1HG      ARG  39  15.366  10.529   8.927
  271    HG3  ARG  39           2HG      ARG  39  16.541  10.736  10.228
  272    HD2  ARG  39           1HD      ARG  39  13.803   9.826  10.942
  273    HD3  ARG  39           2HD      ARG  39  14.879   8.674  10.152
  274    HE   ARG  39           HE       ARG  39  16.365   9.750  12.184
  275   HH11  ARG  39          1HH1      ARG  39  13.323   8.074  11.947
  276   HH12  ARG  39          2HH1      ARG  39  13.448   7.355  13.518
  277   HH21  ARG  39          1HH2      ARG  39  16.542   8.808  14.254
  278   HH22  ARG  39          2HH2      ARG  39  15.279   7.774  14.830
  279    HA   PRO  40           HA       PRO  40  18.970  15.093   9.618
  280    HB2  PRO  40           1HB      PRO  40  19.158  16.195  12.092
  281    HB3  PRO  40           2HB      PRO  40  18.359  17.003  10.739
  282    HG2  PRO  40           1HG      PRO  40  17.154  15.450  12.997
  283    HG3  PRO  40           2HG      PRO  40  16.620  16.984  12.284
  284    HD2  PRO  40           1HD      PRO  40  15.459  14.613  11.678
  285    HD3  PRO  40           2HD      PRO  40  15.585  15.942  10.507
  286    H    SER  41           H        SER  41  20.912  14.255  10.255
  287    HA   SER  41           HA       SER  41  20.812  12.101  12.262
  288    HB2  SER  41           1HB      SER  41  22.801  11.168  11.039
  289    HB3  SER  41           2HB      SER  41  21.315  11.194  10.090
  290    HG   SER  41           HG       SER  41  23.576  12.173   9.357
  291    H    GLY  42           H        GLY  42  21.183  13.736  13.912
  292    HA2  GLY  42           1HA      GLY  42  23.743  15.108  13.889
  293    HA3  GLY  42           2HA      GLY  42  22.508  15.220  15.135
  294    HA   PRO  43           HA       PRO  43  26.087  12.205  16.193
  295    HB2  PRO  43           1HB      PRO  43  27.700  13.864  17.612
  296    HB3  PRO  43           2HB      PRO  43  27.888  13.596  15.875
  297    HG2  PRO  43           1HG      PRO  43  26.558  15.862  17.308
  298    HG3  PRO  43           2HG      PRO  43  27.638  15.907  15.903
  299    HD2  PRO  43           1HD      PRO  43  24.947  16.108  15.679
  300    HD3  PRO  43           2HD      PRO  43  25.955  15.344  14.433
  301    H    SER  44           H        SER  44  25.641  11.038  17.950
  302    HA   SER  44           HA       SER  44  23.905  12.032  19.986
  303    HB2  SER  44           1HB      SER  44  24.132   9.610  19.079
  304    HB3  SER  44           2HB      SER  44  25.469   9.473  20.220
  305    HG   SER  44           HG       SER  44  23.085  10.526  21.190
  306    H    SER  45           H        SER  45  24.497  11.551  22.361
  307    HA   SER  45           HA       SER  45  26.540  13.308  23.130
  308    HB2  SER  45           1HB      SER  45  24.651  12.841  24.593
  309    HB3  SER  45           2HB      SER  45  25.144  11.154  24.735
  310    HG   SER  45           HG       SER  45  26.550  13.436  25.665
  311    H    GLY  46           H        GLY  46  28.632  13.036  23.752
  312    HA2  GLY  46           1HA      GLY  46  29.722  10.346  24.031
  313    HA3  GLY  46           2HA      GLY  46  30.345  11.302  22.694
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1   8.385 -11.768  11.669
    2    HA2  GLY   1           1HA      GLY   1   8.710 -12.140   9.426
    3    HA3  GLY   1           2HA      GLY   1   8.733 -13.843   9.858
    4    H    SER   2           H        SER   2   7.090 -11.417   8.190
    5    HA   SER   2           HA       SER   2   4.577 -12.911   8.098
    6    HB2  SER   2           1HB      SER   2   5.403 -10.141   7.310
    7    HB3  SER   2           2HB      SER   2   3.975 -10.860   6.566
    8    HG   SER   2           HG       SER   2   3.129 -11.169   8.662
    9    H    SER   3           H        SER   3   5.297 -14.709   6.899
   10    HA   SER   3           HA       SER   3   5.623 -14.144   4.033
   11    HB2  SER   3           1HB      SER   3   7.231 -16.022   3.868
   12    HB3  SER   3           2HB      SER   3   7.832 -14.723   4.898
   13    HG   SER   3           HG       SER   3   6.941 -17.288   5.593
   14    H    GLY   4           H        GLY   4   3.733 -14.816   3.219
   15    HA2  GLY   4           1HA      GLY   4   3.080 -17.479   2.894
   16    HA3  GLY   4           2HA      GLY   4   2.209 -16.956   4.328
   17    H    SER   5           H        SER   5   2.052 -17.262   1.024
   18    HA   SER   5           HA       SER   5   0.481 -14.978   0.366
   19    HB2  SER   5           1HB      SER   5   0.934 -17.625  -1.015
   20    HB3  SER   5           2HB      SER   5  -0.105 -16.369  -1.687
   21    HG   SER   5           HG       SER   5   2.460 -16.565  -1.995
   22    H    SER   6           H        SER   6  -1.427 -14.624   1.292
   23    HA   SER   6           HA       SER   6  -3.229 -16.908   1.733
   24    HB2  SER   6           1HB      SER   6  -3.230 -14.177   3.041
   25    HB3  SER   6           2HB      SER   6  -4.372 -15.475   3.387
   26    HG   SER   6           HG       SER   6  -1.578 -15.818   3.647
   27    H    GLY   7           H        GLY   7  -4.103 -16.983  -0.350
   28    HA2  GLY   7           1HA      GLY   7  -5.214 -14.656  -1.607
   29    HA3  GLY   7           2HA      GLY   7  -5.401 -16.320  -2.141
   30    H    THR   8           H        THR   8  -6.311 -14.723   0.902
   31    HA   THR   8           HA       THR   8  -9.052 -15.707   0.480
   32    HB   THR   8           HB       THR   8  -7.642 -14.967   3.051
   33    HG1  THR   8           HG1      THR   8  -7.231 -17.039   3.170
   34   HG21  THR   8          3HG2      THR   8  -9.696 -15.886   4.134
   35   HG22  THR   8          1HG2      THR   8 -10.466 -15.907   2.548
   36   HG23  THR   8          2HG2      THR   8  -9.962 -14.375   3.263
   37    H    GLY   9           H        GLY   9  -9.974 -14.036  -0.657
   38    HA2  GLY   9           1HA      GLY   9 -11.155 -12.065  -0.837
   39    HA3  GLY   9           2HA      GLY   9 -10.790 -11.754   0.854
   40    H    GLU  10           H        GLU  10  -9.473 -11.556  -2.421
   41    HA   GLU  10           HA       GLU  10  -7.096 -10.314  -2.084
   42    HB2  GLU  10           1HB      GLU  10  -7.446  -9.181  -4.206
   43    HB3  GLU  10           2HB      GLU  10  -8.094 -10.813  -4.280
   44    HG2  GLU  10           1HG      GLU  10 -10.350  -9.887  -3.858
   45    HG3  GLU  10           2HG      GLU  10  -9.659  -8.267  -3.935
   46    H    LYS  11           H        LYS  11  -6.472  -8.009  -2.269
   47    HA   LYS  11           HA       LYS  11  -8.171  -6.372  -0.517
   48    HB2  LYS  11           1HB      LYS  11  -6.062  -5.045  -0.156
   49    HB3  LYS  11           2HB      LYS  11  -6.013  -6.700   0.440
   50    HG2  LYS  11           1HG      LYS  11  -4.811  -7.354  -1.628
   51    HG3  LYS  11           2HG      LYS  11  -4.765  -5.651  -2.091
   52    HD2  LYS  11           1HD      LYS  11  -3.440  -5.100  -0.172
   53    HD3  LYS  11           2HD      LYS  11  -3.633  -6.726   0.489
   54    HE2  LYS  11           1HE      LYS  11  -2.413  -6.362  -2.213
   55    HE3  LYS  11           2HE      LYS  11  -1.442  -6.059  -0.773
   56    HZ1  LYS  11           3HZ      LYS  11  -1.271  -8.227  -0.357
   57    HZ2  LYS  11           1HZ      LYS  11  -1.813  -8.474  -1.941
   58    HZ3  LYS  11           2HZ      LYS  11  -2.909  -8.524  -0.654
   59    HA   PRO  12           HA       PRO  12  -9.074  -3.619  -3.835
   60    HB2  PRO  12           1HB      PRO  12  -9.694  -1.406  -2.388
   61    HB3  PRO  12           2HB      PRO  12 -10.762  -2.810  -2.503
   62    HG2  PRO  12           1HG      PRO  12  -8.857  -2.052  -0.322
   63    HG3  PRO  12           2HG      PRO  12 -10.511  -2.679  -0.195
   64    HD2  PRO  12           1HD      PRO  12  -8.329  -4.246   0.147
   65    HD3  PRO  12           2HD      PRO  12  -9.846  -4.858  -0.543
   66    H    TYR  13           H        TYR  13  -7.101  -2.225  -1.209
   67    HA   TYR  13           HA       TYR  13  -5.693  -0.580  -3.182
   68    HB2  TYR  13           1HB      TYR  13  -5.556  -0.485  -0.162
   69    HB3  TYR  13           2HB      TYR  13  -4.827   0.669  -1.272
   70    HD1  TYR  13           HD2      TYR  13  -6.474   1.894  -2.883
   71    HD2  TYR  13           HD1      TYR  13  -7.668  -0.063   0.702
   72    HE1  TYR  13           HE2      TYR  13  -8.532   3.239  -2.842
   73    HE2  TYR  13           HE1      TYR  13  -9.730   1.277   0.752
   74    HH   TYR  13           HH       TYR  13 -11.153   2.542  -1.276
   75    H    LYS  14           H        LYS  14  -3.302  -0.317  -2.813
   76    HA   LYS  14           HA       LYS  14  -1.933  -2.583  -1.644
   77    HB2  LYS  14           1HB      LYS  14  -1.930  -2.070  -4.618
   78    HB3  LYS  14           2HB      LYS  14  -0.698  -3.032  -3.812
   79    HG2  LYS  14           1HG      LYS  14  -2.527  -4.515  -2.970
   80    HG3  LYS  14           2HG      LYS  14  -3.641  -3.620  -4.006
   81    HD2  LYS  14           1HD      LYS  14  -1.151  -4.745  -5.200
   82    HD3  LYS  14           2HD      LYS  14  -2.493  -5.835  -4.844
   83    HE2  LYS  14           1HE      LYS  14  -2.858  -3.294  -6.408
   84    HE3  LYS  14           2HE      LYS  14  -2.404  -4.814  -7.179
   85    HZ1  LYS  14           3HZ      LYS  14  -4.673  -4.994  -5.398
   86    HZ2  LYS  14           1HZ      LYS  14  -4.459  -5.634  -6.949
   87    HZ3  LYS  14           2HZ      LYS  14  -4.930  -4.021  -6.758
   88    H    CYS  15           H        CYS  15   0.416  -2.318  -1.663
   89    HA   CYS  15           HA       CYS  15   1.190   0.517  -1.899
   90    HB2  CYS  15           1HB      CYS  15   1.075  -0.388   0.442
   91    HB3  CYS  15           2HB      CYS  15   2.359  -1.513   0.011
   92    H    GLU  16           H        GLU  16   3.422   0.942  -2.445
   93    HA   GLU  16           HA       GLU  16   4.626  -1.229  -4.033
   94    HB2  GLU  16           1HB      GLU  16   4.245   1.673  -4.606
   95    HB3  GLU  16           2HB      GLU  16   5.685   0.885  -5.235
   96    HG2  GLU  16           1HG      GLU  16   4.383  -0.666  -6.487
   97    HG3  GLU  16           2HG      GLU  16   2.895  -0.123  -5.714
   98    H    LYS  17           H        LYS  17   5.203   1.484  -1.878
   99    HA   LYS  17           HA       LYS  17   7.978   1.540  -1.867
  100    HB2  LYS  17           1HB      LYS  17   5.852   2.293   0.070
  101    HB3  LYS  17           2HB      LYS  17   7.492   2.161   0.692
  102    HG2  LYS  17           1HG      LYS  17   8.271   3.899  -0.635
  103    HG3  LYS  17           2HG      LYS  17   6.914   3.779  -1.758
  104    HD2  LYS  17           1HD      LYS  17   6.324   4.447   1.078
  105    HD3  LYS  17           2HD      LYS  17   7.058   5.696   0.069
  106    HE2  LYS  17           1HE      LYS  17   4.805   6.083  -0.254
  107    HE3  LYS  17           2HE      LYS  17   5.197   5.046  -1.625
  108    HZ1  LYS  17           3HZ      LYS  17   3.145   4.580  -0.053
  109    HZ2  LYS  17           1HZ      LYS  17   4.316   3.737   0.830
  110    HZ3  LYS  17           2HZ      LYS  17   4.015   3.326  -0.782
  111    H    CYS  18           H        CYS  18   5.761  -0.524  -0.043
  112    HA   CYS  18           HA       CYS  18   8.069  -2.197   0.704
  113    HB2  CYS  18           1HB      CYS  18   6.947  -2.761   2.793
  114    HB3  CYS  18           2HB      CYS  18   7.151  -1.017   2.668
  115    H    GLY  19           H        GLY  19   4.597  -2.124  -0.004
  116    HA2  GLY  19           1HA      GLY  19   3.654  -3.675  -1.581
  117    HA3  GLY  19           2HA      GLY  19   4.861  -4.851  -1.082
  118    H    LYS  20           H        LYS  20   3.036  -2.905   1.184
  119    HA   LYS  20           HA       LYS  20   1.927  -5.349   2.327
  120    HB2  LYS  20           1HB      LYS  20   2.293  -2.541   3.308
  121    HB3  LYS  20           2HB      LYS  20   1.132  -3.598   4.101
  122    HG2  LYS  20           1HG      LYS  20   2.977  -5.245   4.436
  123    HG3  LYS  20           2HG      LYS  20   4.097  -4.026   3.821
  124    HD2  LYS  20           1HD      LYS  20   4.263  -3.609   6.063
  125    HD3  LYS  20           2HD      LYS  20   2.923  -2.533   5.659
  126    HE2  LYS  20           1HE      LYS  20   2.161  -3.649   7.551
  127    HE3  LYS  20           2HE      LYS  20   1.422  -4.548   6.227
  128    HZ1  LYS  20           3HZ      LYS  20   2.374  -6.365   7.020
  129    HZ2  LYS  20           1HZ      LYS  20   3.166  -5.485   8.228
  130    HZ3  LYS  20           2HZ      LYS  20   3.901  -5.703   6.721
  131    H    GLY  21           H        GLY  21  -0.310  -5.547   2.868
  132    HA2  GLY  21           1HA      GLY  21  -2.036  -4.066   0.994
  133    HA3  GLY  21           2HA      GLY  21  -2.374  -5.670   1.627
  134    H    TYR  22           H        TYR  22  -4.211  -3.535   1.671
  135    HA   TYR  22           HA       TYR  22  -4.738  -3.437   4.522
  136    HB2  TYR  22           1HB      TYR  22  -4.390  -0.940   2.857
  137    HB3  TYR  22           2HB      TYR  22  -5.182  -0.961   4.429
  138    HD1  TYR  22           HD2      TYR  22  -1.975  -1.344   2.673
  139    HD2  TYR  22           HD1      TYR  22  -3.907  -1.173   6.460
  140    HE1  TYR  22           HE2      TYR  22   0.210  -1.079   3.769
  141    HE2  TYR  22           HE1      TYR  22  -1.727  -0.907   7.567
  142    HH   TYR  22           HH       TYR  22   1.159  -1.571   6.126
  143    H    ASN  23           H        ASN  23  -6.896  -3.293   5.011
  144    HA   ASN  23           HA       ASN  23  -8.719  -3.759   2.813
  145    HB2  ASN  23           1HB      ASN  23  -8.837  -5.106   4.892
  146    HB3  ASN  23           2HB      ASN  23  -9.272  -3.652   5.787
  147   HD21  ASN  23          1HD2      ASN  23 -11.310  -2.769   5.540
  148   HD22  ASN  23          2HD2      ASN  23 -12.607  -3.630   4.789
  149    H    SER  24           H        SER  24  -8.227  -1.332   5.339
  150    HA   SER  24           HA       SER  24 -10.415   0.288   4.318
  151    HB2  SER  24           1HB      SER  24 -10.278   0.283   6.688
  152    HB3  SER  24           2HB      SER  24  -8.539   0.575   6.664
  153    HG   SER  24           HG       SER  24 -10.589   2.352   6.589
  154    H    LYS  25           H        LYS  25 -10.161   2.422   3.547
  155    HA   LYS  25           HA       LYS  25  -7.821   2.781   1.915
  156    HB2  LYS  25           1HB      LYS  25  -8.965   4.651   0.965
  157    HB3  LYS  25           2HB      LYS  25 -10.154   3.377   1.200
  158    HG2  LYS  25           1HG      LYS  25 -11.332   5.142   2.005
  159    HG3  LYS  25           2HG      LYS  25 -10.527   4.636   3.492
  160    HD2  LYS  25           1HD      LYS  25  -9.070   6.416   3.468
  161    HD3  LYS  25           2HD      LYS  25  -9.171   6.612   1.717
  162    HE2  LYS  25           1HE      LYS  25 -11.331   7.612   1.882
  163    HE3  LYS  25           2HE      LYS  25 -11.451   7.207   3.594
  164    HZ1  LYS  25           3HZ      LYS  25  -9.440   8.676   3.895
  165    HZ2  LYS  25           1HZ      LYS  25 -10.883   9.466   3.504
  166    HZ3  LYS  25           2HZ      LYS  25  -9.703   9.226   2.317
  167    H    PHE  26           H        PHE  26  -9.129   4.192   4.853
  168    HA   PHE  26           HA       PHE  26  -7.366   6.399   5.002
  169    HB2  PHE  26           1HB      PHE  26  -9.295   6.538   6.347
  170    HB3  PHE  26           2HB      PHE  26  -9.035   4.939   7.036
  171    HD1  PHE  26           HD1      PHE  26  -7.302   4.594   8.746
  172    HD2  PHE  26           HD2      PHE  26  -8.245   8.469   7.257
  173    HE1  PHE  26           HE1      PHE  26  -6.158   5.610  10.673
  174    HE2  PHE  26           HE2      PHE  26  -7.101   9.490   9.181
  175    HZ   PHE  26           HZ       PHE  26  -6.055   8.061  10.892
  176    H    ASN  27           H        ASN  27  -7.143   3.064   6.074
  177    HA   ASN  27           HA       ASN  27  -4.907   3.303   7.749
  178    HB2  ASN  27           1HB      ASN  27  -6.133   1.050   6.201
  179    HB3  ASN  27           2HB      ASN  27  -4.569   0.815   6.976
  180   HD21  ASN  27          1HD2      ASN  27  -4.825  -0.257   8.788
  181   HD22  ASN  27          2HD2      ASN  27  -6.065   0.005   9.962
  182    H    LEU  28           H        LEU  28  -5.076   2.354   4.317
  183    HA   LEU  28           HA       LEU  28  -2.390   2.027   3.808
  184    HB2  LEU  28           1HB      LEU  28  -4.142   1.503   2.200
  185    HB3  LEU  28           2HB      LEU  28  -4.482   3.220   1.994
  186    HG   LEU  28           HG       LEU  28  -1.988   3.329   1.222
  187   HD11  LEU  28          1HD1      LEU  28  -1.362   1.240   0.006
  188   HD12  LEU  28          2HD1      LEU  28  -2.664   0.416   0.863
  189   HD13  LEU  28          3HD1      LEU  28  -1.314   1.105   1.764
  190   HD21  LEU  28          3HD2      LEU  28  -3.118   2.182  -1.040
  191   HD22  LEU  28          1HD2      LEU  28  -3.171   3.884  -0.579
  192   HD23  LEU  28          2HD2      LEU  28  -4.493   2.807  -0.128
  193    H    ASP  29           H        ASP  29  -4.254   5.028   3.304
  194    HA   ASP  29           HA       ASP  29  -2.296   6.733   2.502
  195    HB2  ASP  29           1HB      ASP  29  -4.828   7.136   3.087
  196    HB3  ASP  29           2HB      ASP  29  -4.175   7.690   4.627
  197    H    MET  30           H        MET  30  -3.208   6.354   5.934
  198    HA   MET  30           HA       MET  30  -1.082   7.795   7.001
  199    HB2  MET  30           1HB      MET  30  -2.532   5.446   8.236
  200    HB3  MET  30           2HB      MET  30  -1.554   6.618   9.109
  201    HG2  MET  30           1HG      MET  30  -3.981   7.376   7.511
  202    HG3  MET  30           2HG      MET  30  -4.042   6.946   9.218
  203    HE1  MET  30           3HE      MET  30  -2.249   9.606  11.069
  204    HE2  MET  30           1HE      MET  30  -3.979   9.263  11.034
  205    HE3  MET  30           2HE      MET  30  -2.816   7.938  10.970
  206    H    HIS  31           H        HIS  31  -1.332   4.332   6.288
  207    HA   HIS  31           HA       HIS  31   1.028   3.424   7.382
  208    HB2  HIS  31           1HB      HIS  31  -0.280   1.721   6.527
  209    HB3  HIS  31           2HB      HIS  31  -0.608   2.583   5.026
  210    HD1  HIS  31           HD1      HIS  31   2.637   1.363   6.615
  211    HD2  HIS  31           HD2      HIS  31   0.539   1.178   3.034
  212    HE1  HIS  31           HE1      HIS  31   4.100   0.051   5.046
  213    H    GLN  32           H        GLN  32   0.535   4.806   4.144
  214    HA   GLN  32           HA       GLN  32   3.002   4.537   3.034
  215    HB2  GLN  32           1HB      GLN  32   1.254   7.001   2.942
  216    HB3  GLN  32           2HB      GLN  32   2.580   6.665   1.836
  217    HG2  GLN  32           1HG      GLN  32   1.371   4.565   1.185
  218    HG3  GLN  32           2HG      GLN  32  -0.001   5.155   2.122
  219   HE21  GLN  32          1HE2      GLN  32  -0.548   4.685  -0.388
  220   HE22  GLN  32          2HE2      GLN  32  -0.653   6.135  -1.323
  221    H    LYS  33           H        LYS  33   2.015   7.207   5.175
  222    HA   LYS  33           HA       LYS  33   4.314   8.675   5.269
  223    HB2  LYS  33           1HB      LYS  33   2.247   8.048   7.345
  224    HB3  LYS  33           2HB      LYS  33   3.657   9.002   7.785
  225    HG2  LYS  33           1HG      LYS  33   2.993  10.424   5.704
  226    HG3  LYS  33           2HG      LYS  33   1.414   9.674   5.941
  227    HD2  LYS  33           1HD      LYS  33   2.848  10.955   8.237
  228    HD3  LYS  33           2HD      LYS  33   1.929  11.939   7.096
  229    HE2  LYS  33           1HE      LYS  33   0.787   9.558   8.545
  230    HE3  LYS  33           2HE      LYS  33   0.673  11.210   9.148
  231    HZ1  LYS  33           3HZ      LYS  33  -0.514  10.094   6.674
  232    HZ2  LYS  33           1HZ      LYS  33  -0.401  11.758   6.959
  233    HZ3  LYS  33           2HZ      LYS  33  -1.315  10.784   7.995
  234    H    VAL  34           H        VAL  34   3.645   5.649   6.948
  235    HA   VAL  34           HA       VAL  34   5.652   5.442   8.759
  236    HB   VAL  34           HB       VAL  34   4.820   3.263   6.838
  237   HG11  VAL  34          1HG1      VAL  34   5.846   1.705   8.190
  238   HG12  VAL  34          2HG1      VAL  34   6.990   3.047   8.276
  239   HG13  VAL  34          3HG1      VAL  34   5.851   2.770   9.595
  240   HG21  VAL  34          3HG2      VAL  34   3.117   4.526   8.400
  241   HG22  VAL  34          1HG2      VAL  34   3.053   2.774   8.212
  242   HG23  VAL  34          2HG2      VAL  34   3.819   3.481   9.635
  243    H    HIS  35           H        HIS  35   5.954   4.951   5.264
  244    HA   HIS  35           HA       HIS  35   8.727   4.271   5.371
  245    HB2  HIS  35           1HB      HIS  35   7.282   5.319   2.943
  246    HB3  HIS  35           2HB      HIS  35   8.657   4.221   3.004
  247    HD1  HIS  35           HD1      HIS  35   8.035   1.802   4.181
  248    HD2  HIS  35           HD2      HIS  35   4.909   4.059   2.632
  249    HE1  HIS  35           HE1      HIS  35   6.125   0.192   3.886
  250    H    THR  36           H        THR  36   9.712   5.937   6.554
  251    HA   THR  36           HA       THR  36   9.860   8.532   5.163
  252    HB   THR  36           HB       THR  36  10.429   9.567   7.292
  253    HG1  THR  36           HG1      THR  36  10.168   8.162   9.213
  254   HG21  THR  36          3HG2      THR  36   8.294   9.622   8.179
  255   HG22  THR  36          1HG2      THR  36   8.036   7.894   7.940
  256   HG23  THR  36          2HG2      THR  36   7.986   8.993   6.561
  257    H    GLY  37           H        GLY  37  11.456   6.350   4.364
  258    HA2  GLY  37           1HA      GLY  37  14.060   7.550   4.627
  259    HA3  GLY  37           2HA      GLY  37  13.933   5.996   5.438
  260    H    GLU  38           H        GLU  38  14.518   7.574   2.512
  261    HA   GLU  38           HA       GLU  38  13.758   5.458   0.740
  262    HB2  GLU  38           1HB      GLU  38  15.020   6.734  -0.957
  263    HB3  GLU  38           2HB      GLU  38  13.870   7.736  -0.083
  264    HG2  GLU  38           1HG      GLU  38  15.683   9.110  -0.092
  265    HG3  GLU  38           2HG      GLU  38  15.948   8.255   1.427
  266    H    ARG  39           H        ARG  39  15.104   4.007  -0.360
  267    HA   ARG  39           HA       ARG  39  17.761   3.606   0.849
  268    HB2  ARG  39           1HB      ARG  39  15.818   1.941   1.412
  269    HB3  ARG  39           2HB      ARG  39  16.148   1.309  -0.195
  270    HG2  ARG  39           1HG      ARG  39  18.383   0.743   0.403
  271    HG3  ARG  39           2HG      ARG  39  18.243   1.593   1.943
  272    HD2  ARG  39           1HD      ARG  39  16.260  -0.057   2.342
  273    HD3  ARG  39           2HD      ARG  39  17.058  -1.015   1.095
  274    HE   ARG  39           HE       ARG  39  19.010  -0.341   2.933
  275   HH11  ARG  39          1HH1      ARG  39  16.018  -2.121   2.911
  276   HH12  ARG  39          2HH1      ARG  39  16.501  -3.202   4.176
  277   HH21  ARG  39          1HH2      ARG  39  19.657  -1.758   4.599
  278   HH22  ARG  39          2HH2      ARG  39  18.570  -2.994   5.137
  279    HA   PRO  40           HA       PRO  40  19.301   3.832  -3.274
  280    HB2  PRO  40           1HB      PRO  40  21.705   2.636  -2.870
  281    HB3  PRO  40           2HB      PRO  40  21.343   4.276  -2.319
  282    HG2  PRO  40           1HG      PRO  40  21.326   1.712  -0.774
  283    HG3  PRO  40           2HG      PRO  40  21.962   3.299  -0.302
  284    HD2  PRO  40           1HD      PRO  40  19.562   2.380   0.549
  285    HD3  PRO  40           2HD      PRO  40  19.880   4.104   0.270
  286    H    SER  41           H        SER  41  20.934   2.077  -4.542
  287    HA   SER  41           HA       SER  41  20.581   0.339  -6.025
  288    HB2  SER  41           1HB      SER  41  20.921  -0.777  -3.273
  289    HB3  SER  41           2HB      SER  41  20.568  -1.890  -4.594
  290    HG   SER  41           HG       SER  41  22.395  -0.988  -5.690
  291    H    GLY  42           H        GLY  42  18.153   1.589  -5.646
  292    HA2  GLY  42           1HA      GLY  42  16.263  -0.664  -5.373
  293    HA3  GLY  42           2HA      GLY  42  15.851   1.016  -5.063
  294    HA   PRO  43           HA       PRO  43  15.246  -0.377  -9.637
  295    HB2  PRO  43           1HB      PRO  43  12.721  -1.372  -9.562
  296    HB3  PRO  43           2HB      PRO  43  14.158  -2.382  -9.364
  297    HG2  PRO  43           1HG      PRO  43  12.331  -1.256  -7.276
  298    HG3  PRO  43           2HG      PRO  43  13.037  -2.879  -7.388
  299    HD2  PRO  43           1HD      PRO  43  14.043  -0.961  -5.763
  300    HD3  PRO  43           2HD      PRO  43  15.065  -2.193  -6.532
  301    H    SER  44           H        SER  44  12.638   0.674  -7.440
  302    HA   SER  44           HA       SER  44  11.643   2.545  -9.417
  303    HB2  SER  44           1HB      SER  44  10.752   1.957  -6.584
  304    HB3  SER  44           2HB      SER  44   9.936   3.075  -7.677
  305    HG   SER  44           HG       SER  44   9.329   0.647  -7.488
  306    H    SER  45           H        SER  45  11.890   4.717  -9.407
  307    HA   SER  45           HA       SER  45  13.620   5.846  -7.305
  308    HB2  SER  45           1HB      SER  45  14.190   7.574  -9.100
  309    HB3  SER  45           2HB      SER  45  14.820   5.946  -9.351
  310    HG   SER  45           HG       SER  45  13.838   6.057 -11.199
  311    H    GLY  46           H        GLY  46  12.716   7.299  -6.014
  312    HA2  GLY  46           1HA      GLY  46  11.568   9.389  -5.708
  313    HA3  GLY  46           2HA      GLY  46  10.548   8.983  -7.079
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1   8.074 -14.752  -2.957
    2    HA2  GLY   1           1HA      GLY   1   7.692 -15.081  -5.867
    3    HA3  GLY   1           2HA      GLY   1   7.788 -16.410  -4.720
    4    H    SER   2           H        SER   2   5.878 -17.386  -4.659
    5    HA   SER   2           HA       SER   2   3.428 -15.919  -5.092
    6    HB2  SER   2           1HB      SER   2   2.339 -18.116  -4.941
    7    HB3  SER   2           2HB      SER   2   3.714 -18.172  -6.043
    8    HG   SER   2           HG       SER   2   4.195 -18.794  -3.373
    9    H    SER   3           H        SER   3   3.019 -14.594  -3.381
   10    HA   SER   3           HA       SER   3   3.335 -15.407  -0.663
   11    HB2  SER   3           1HB      SER   3   2.064 -13.025  -1.998
   12    HB3  SER   3           2HB      SER   3   1.948 -13.267  -0.255
   13    HG   SER   3           HG       SER   3   4.018 -12.828  -0.041
   14    H    GLY   4           H        GLY   4   0.462 -14.767  -2.680
   15    HA2  GLY   4           1HA      GLY   4  -1.585 -15.294  -1.002
   16    HA3  GLY   4           2HA      GLY   4  -1.587 -15.847  -2.671
   17    H    SER   5           H        SER   5  -2.016 -16.836   0.414
   18    HA   SER   5           HA       SER   5  -0.735 -19.424   0.205
   19    HB2  SER   5           1HB      SER   5  -0.900 -18.259   2.386
   20    HB3  SER   5           2HB      SER   5  -2.657 -18.385   2.302
   21    HG   SER   5           HG       SER   5  -1.060 -20.690   2.076
   22    H    SER   6           H        SER   6  -1.611 -20.850  -1.150
   23    HA   SER   6           HA       SER   6  -3.135 -22.116  -2.277
   24    HB2  SER   6           1HB      SER   6  -4.602 -21.825   0.355
   25    HB3  SER   6           2HB      SER   6  -5.016 -22.992  -0.900
   26    HG   SER   6           HG       SER   6  -2.557 -23.464  -0.580
   27    H    GLY   7           H        GLY   7  -3.285 -19.406  -2.894
   28    HA2  GLY   7           1HA      GLY   7  -4.641 -17.921  -4.000
   29    HA3  GLY   7           2HA      GLY   7  -5.773 -19.253  -4.188
   30    H    THR   8           H        THR   8  -4.779 -16.614  -2.085
   31    HA   THR   8           HA       THR   8  -7.432 -15.970  -1.372
   32    HB   THR   8           HB       THR   8  -7.073 -18.063   0.016
   33    HG1  THR   8           HG1      THR   8  -8.553 -16.240   0.515
   34   HG21  THR   8          3HG2      THR   8  -5.523 -18.173   1.682
   35   HG22  THR   8          1HG2      THR   8  -5.541 -16.433   1.964
   36   HG23  THR   8          2HG2      THR   8  -4.652 -17.094   0.592
   37    H    GLY   9           H        GLY   9  -7.574 -14.072  -0.087
   38    HA2  GLY   9           1HA      GLY   9  -6.581 -12.342   1.241
   39    HA3  GLY   9           2HA      GLY   9  -5.011 -12.802   0.600
   40    H    GLU  10           H        GLU  10  -8.164 -11.591  -0.540
   41    HA   GLU  10           HA       GLU  10  -6.754 -10.069  -2.615
   42    HB2  GLU  10           1HB      GLU  10  -8.836 -11.641  -2.994
   43    HB3  GLU  10           2HB      GLU  10  -9.735 -10.229  -2.458
   44    HG2  GLU  10           1HG      GLU  10  -8.254  -9.015  -4.260
   45    HG3  GLU  10           2HG      GLU  10  -8.144 -10.641  -4.931
   46    H    LYS  11           H        LYS  11  -6.444  -7.962  -2.380
   47    HA   LYS  11           HA       LYS  11  -8.317  -6.405  -0.747
   48    HB2  LYS  11           1HB      LYS  11  -6.299  -5.155   0.173
   49    HB3  LYS  11           2HB      LYS  11  -6.578  -6.771   0.809
   50    HG2  LYS  11           1HG      LYS  11  -4.747  -6.442  -1.513
   51    HG3  LYS  11           2HG      LYS  11  -4.182  -5.992   0.097
   52    HD2  LYS  11           1HD      LYS  11  -5.501  -8.641  -0.339
   53    HD3  LYS  11           2HD      LYS  11  -3.806  -8.417  -0.779
   54    HE2  LYS  11           1HE      LYS  11  -3.236  -7.819   1.466
   55    HE3  LYS  11           2HE      LYS  11  -4.933  -7.767   1.939
   56    HZ1  LYS  11           3HZ      LYS  11  -4.976 -10.204   1.301
   57    HZ2  LYS  11           1HZ      LYS  11  -4.139  -9.805   2.716
   58    HZ3  LYS  11           2HZ      LYS  11  -3.286 -10.136   1.294
   59    HA   PRO  12           HA       PRO  12  -8.103  -3.729  -4.258
   60    HB2  PRO  12           1HB      PRO  12  -9.358  -1.589  -3.154
   61    HB3  PRO  12           2HB      PRO  12 -10.216  -3.048  -3.664
   62    HG2  PRO  12           1HG      PRO  12  -9.325  -2.233  -0.924
   63    HG3  PRO  12           2HG      PRO  12 -10.863  -2.955  -1.432
   64    HD2  PRO  12           1HD      PRO  12  -8.880  -4.404  -0.291
   65    HD3  PRO  12           2HD      PRO  12  -9.985  -5.085  -1.502
   66    H    TYR  13           H        TYR  13  -6.767  -2.973  -1.144
   67    HA   TYR  13           HA       TYR  13  -5.181  -0.794  -2.330
   68    HB2  TYR  13           1HB      TYR  13  -5.676  -1.368   0.599
   69    HB3  TYR  13           2HB      TYR  13  -4.823   0.022  -0.063
   70    HD1  TYR  13           HD2      TYR  13  -6.041   1.841  -1.126
   71    HD2  TYR  13           HD1      TYR  13  -8.097  -1.511   0.500
   72    HE1  TYR  13           HE2      TYR  13  -8.156   3.092  -1.237
   73    HE2  TYR  13           HE1      TYR  13 -10.218  -0.269   0.392
   74    HH   TYR  13           HH       TYR  13 -11.222   1.611  -0.224
   75    H    LYS  14           H        LYS  14  -3.155  -1.265  -2.819
   76    HA   LYS  14           HA       LYS  14  -1.692  -3.186  -1.143
   77    HB2  LYS  14           1HB      LYS  14  -1.810  -3.127  -4.159
   78    HB3  LYS  14           2HB      LYS  14  -0.572  -3.996  -3.262
   79    HG2  LYS  14           1HG      LYS  14  -2.033  -5.598  -2.524
   80    HG3  LYS  14           2HG      LYS  14  -3.433  -4.530  -2.641
   81    HD2  LYS  14           1HD      LYS  14  -1.951  -5.412  -5.094
   82    HD3  LYS  14           2HD      LYS  14  -3.188  -6.436  -4.361
   83    HE2  LYS  14           1HE      LYS  14  -4.889  -4.938  -4.828
   84    HE3  LYS  14           2HE      LYS  14  -3.785  -3.569  -4.957
   85    HZ1  LYS  14           3HZ      LYS  14  -3.862  -3.866  -7.139
   86    HZ2  LYS  14           1HZ      LYS  14  -4.711  -5.322  -6.990
   87    HZ3  LYS  14           2HZ      LYS  14  -3.020  -5.319  -6.936
   88    H    CYS  15           H        CYS  15  -0.451  -1.676  -0.118
   89    HA   CYS  15           HA       CYS  15   0.640   0.643  -1.079
   90    HB2  CYS  15           1HB      CYS  15   0.752  -0.412   1.289
   91    HB3  CYS  15           2HB      CYS  15   2.251  -1.143   0.724
   92    H    GLU  16           H        GLU  16   2.119   1.175  -2.548
   93    HA   GLU  16           HA       GLU  16   3.567  -0.943  -3.913
   94    HB2  GLU  16           1HB      GLU  16   3.043   1.956  -4.480
   95    HB3  GLU  16           2HB      GLU  16   4.314   1.101  -5.343
   96    HG2  GLU  16           1HG      GLU  16   1.497   0.080  -5.237
   97    HG3  GLU  16           2HG      GLU  16   2.035   1.238  -6.452
   98    H    LYS  17           H        LYS  17   4.152   1.625  -1.664
   99    HA   LYS  17           HA       LYS  17   6.876   2.070  -2.021
  100    HB2  LYS  17           1HB      LYS  17   5.107   2.194   0.410
  101    HB3  LYS  17           2HB      LYS  17   6.821   2.576   0.503
  102    HG2  LYS  17           1HG      LYS  17   6.593   4.444  -0.896
  103    HG3  LYS  17           2HG      LYS  17   4.996   3.937  -1.451
  104    HD2  LYS  17           1HD      LYS  17   4.098   4.321   0.796
  105    HD3  LYS  17           2HD      LYS  17   5.696   4.828   1.348
  106    HE2  LYS  17           1HE      LYS  17   4.422   6.795   0.898
  107    HE3  LYS  17           2HE      LYS  17   5.630   6.634  -0.377
  108    HZ1  LYS  17           3HZ      LYS  17   3.050   7.087  -0.839
  109    HZ2  LYS  17           1HZ      LYS  17   3.060   5.397  -0.913
  110    HZ3  LYS  17           2HZ      LYS  17   4.065   6.294  -1.935
  111    H    CYS  18           H        CYS  18   5.241  -0.332   0.025
  112    HA   CYS  18           HA       CYS  18   7.817  -1.740   0.283
  113    HB2  CYS  18           1HB      CYS  18   6.766  -2.800   2.322
  114    HB3  CYS  18           2HB      CYS  18   7.092  -1.075   2.457
  115    H    GLY  19           H        GLY  19   4.301  -2.297   0.085
  116    HA2  GLY  19           1HA      GLY  19   3.607  -3.789  -1.786
  117    HA3  GLY  19           2HA      GLY  19   4.904  -4.855  -1.268
  118    H    LYS  20           H        LYS  20   2.578  -3.108   0.747
  119    HA   LYS  20           HA       LYS  20   1.768  -5.680   1.900
  120    HB2  LYS  20           1HB      LYS  20   1.716  -2.849   2.899
  121    HB3  LYS  20           2HB      LYS  20   0.690  -4.072   3.638
  122    HG2  LYS  20           1HG      LYS  20   3.672  -4.349   3.363
  123    HG3  LYS  20           2HG      LYS  20   2.873  -3.678   4.787
  124    HD2  LYS  20           1HD      LYS  20   1.631  -5.786   5.057
  125    HD3  LYS  20           2HD      LYS  20   2.480  -6.451   3.659
  126    HE2  LYS  20           1HE      LYS  20   3.700  -7.277   5.452
  127    HE3  LYS  20           2HE      LYS  20   4.624  -5.856   4.968
  128    HZ1  LYS  20           3HZ      LYS  20   4.071  -4.741   6.843
  129    HZ2  LYS  20           1HZ      LYS  20   3.947  -6.309   7.466
  130    HZ3  LYS  20           2HZ      LYS  20   2.554  -5.476   6.989
  131    H    GLY  21           H        GLY  21  -0.637  -5.350   2.889
  132    HA2  GLY  21           1HA      GLY  21  -2.354  -4.272   0.757
  133    HA3  GLY  21           2HA      GLY  21  -2.551  -5.945   1.257
  134    H    TYR  22           H        TYR  22  -4.206  -3.349   1.434
  135    HA   TYR  22           HA       TYR  22  -5.023  -3.772   4.226
  136    HB2  TYR  22           1HB      TYR  22  -4.746  -1.106   2.825
  137    HB3  TYR  22           2HB      TYR  22  -5.523  -1.333   4.388
  138    HD1  TYR  22           HD2      TYR  22  -2.282  -1.880   2.632
  139    HD2  TYR  22           HD1      TYR  22  -4.258  -1.199   6.338
  140    HE1  TYR  22           HE2      TYR  22  -0.101  -1.635   3.743
  141    HE2  TYR  22           HE1      TYR  22  -2.083  -0.951   7.459
  142    HH   TYR  22           HH       TYR  22   0.121  -0.969   7.227
  143    H    ASN  23           H        ASN  23  -7.261  -3.016   4.652
  144    HA   ASN  23           HA       ASN  23  -8.971  -3.752   2.404
  145    HB2  ASN  23           1HB      ASN  23  -9.331  -4.912   4.529
  146    HB3  ASN  23           2HB      ASN  23  -9.618  -3.373   5.336
  147   HD21  ASN  23          1HD2      ASN  23 -11.580  -2.411   5.183
  148   HD22  ASN  23          2HD2      ASN  23 -12.939  -3.121   4.386
  149    H    SER  24           H        SER  24  -8.432  -1.091   4.658
  150    HA   SER  24           HA       SER  24 -10.416   0.528   3.228
  151    HB2  SER  24           1HB      SER  24 -10.273   2.075   5.113
  152    HB3  SER  24           2HB      SER  24 -10.578   0.439   5.698
  153    HG   SER  24           HG       SER  24  -8.779   0.543   6.762
  154    H    LYS  25           H        LYS  25  -9.799   2.881   2.947
  155    HA   LYS  25           HA       LYS  25  -7.234   2.975   1.578
  156    HB2  LYS  25           1HB      LYS  25  -8.034   5.057   0.613
  157    HB3  LYS  25           2HB      LYS  25  -9.262   3.809   0.447
  158    HG2  LYS  25           1HG      LYS  25 -10.573   5.520   1.148
  159    HG3  LYS  25           2HG      LYS  25 -10.115   4.862   2.721
  160    HD2  LYS  25           1HD      LYS  25  -9.632   7.062   3.086
  161    HD3  LYS  25           2HD      LYS  25  -8.085   6.540   2.416
  162    HE2  LYS  25           1HE      LYS  25  -8.918   7.263   0.168
  163    HE3  LYS  25           2HE      LYS  25 -10.326   7.950   0.975
  164    HZ1  LYS  25           3HZ      LYS  25  -7.701   8.736   1.978
  165    HZ2  LYS  25           1HZ      LYS  25  -9.122   9.643   1.837
  166    HZ3  LYS  25           2HZ      LYS  25  -8.164   9.358   0.474
  167    H    PHE  26           H        PHE  26  -8.880   4.479   4.299
  168    HA   PHE  26           HA       PHE  26  -7.078   6.540   4.838
  169    HB2  PHE  26           1HB      PHE  26  -9.366   6.056   5.911
  170    HB3  PHE  26           2HB      PHE  26  -8.487   4.987   7.000
  171    HD1  PHE  26           HD1      PHE  26  -6.583   5.985   8.362
  172    HD2  PHE  26           HD2      PHE  26  -9.486   8.341   6.327
  173    HE1  PHE  26           HE1      PHE  26  -6.029   7.904   9.799
  174    HE2  PHE  26           HE2      PHE  26  -8.936  10.263   7.760
  175    HZ   PHE  26           HZ       PHE  26  -7.205  10.047   9.499
  176    H    ASN  27           H        ASN  27  -7.201   3.291   6.306
  177    HA   ASN  27           HA       ASN  27  -5.007   3.392   7.924
  178    HB2  ASN  27           1HB      ASN  27  -6.672   1.439   7.377
  179    HB3  ASN  27           2HB      ASN  27  -5.417   0.945   6.245
  180   HD21  ASN  27          1HD2      ASN  27  -5.956  -0.816   8.098
  181   HD22  ASN  27          2HD2      ASN  27  -4.750  -0.857   9.335
  182    H    LEU  28           H        LEU  28  -5.045   2.761   4.441
  183    HA   LEU  28           HA       LEU  28  -2.288   2.242   4.165
  184    HB2  LEU  28           1HB      LEU  28  -3.756   1.575   2.425
  185    HB3  LEU  28           2HB      LEU  28  -4.376   3.213   2.231
  186    HG   LEU  28           HG       LEU  28  -1.984   3.809   1.492
  187   HD11  LEU  28          1HD1      LEU  28  -0.957   1.710   2.256
  188   HD12  LEU  28          2HD1      LEU  28  -0.697   1.998   0.536
  189   HD13  LEU  28          3HD1      LEU  28  -1.906   0.827   1.060
  190   HD21  LEU  28          3HD2      LEU  28  -3.703   2.026  -0.232
  191   HD22  LEU  28          1HD2      LEU  28  -2.475   3.155  -0.805
  192   HD23  LEU  28          2HD2      LEU  28  -3.922   3.761   0.001
  193    H    ASP  29           H        ASP  29  -4.140   5.201   3.431
  194    HA   ASP  29           HA       ASP  29  -2.192   6.908   2.655
  195    HB2  ASP  29           1HB      ASP  29  -4.669   7.275   4.264
  196    HB3  ASP  29           2HB      ASP  29  -3.543   8.627   4.190
  197    H    MET  30           H        MET  30  -3.084   6.389   6.071
  198    HA   MET  30           HA       MET  30  -1.017   7.947   7.154
  199    HB2  MET  30           1HB      MET  30  -2.832   5.823   8.197
  200    HB3  MET  30           2HB      MET  30  -1.442   6.278   9.173
  201    HG2  MET  30           1HG      MET  30  -3.455   8.252   8.135
  202    HG3  MET  30           2HG      MET  30  -3.574   7.469   9.709
  203    HE1  MET  30           3HE      MET  30  -2.993  11.032  10.288
  204    HE2  MET  30           1HE      MET  30  -3.965   9.579  10.524
  205    HE3  MET  30           2HE      MET  30  -2.683   9.977  11.668
  206    H    HIS  31           H        HIS  31  -1.203   4.471   6.475
  207    HA   HIS  31           HA       HIS  31   1.169   3.618   7.587
  208    HB2  HIS  31           1HB      HIS  31  -0.267   1.965   6.701
  209    HB3  HIS  31           2HB      HIS  31  -0.299   2.726   5.113
  210    HD1  HIS  31           HD1      HIS  31   2.537   1.414   7.301
  211    HD2  HIS  31           HD2      HIS  31   1.092   1.168   3.414
  212    HE1  HIS  31           HE1      HIS  31   4.152  -0.074   6.077
  213    H    GLN  32           H        GLN  32   0.664   4.955   4.332
  214    HA   GLN  32           HA       GLN  32   3.102   4.719   3.191
  215    HB2  GLN  32           1HB      GLN  32   1.338   7.171   3.196
  216    HB3  GLN  32           2HB      GLN  32   2.694   6.935   2.101
  217    HG2  GLN  32           1HG      GLN  32   1.628   5.043   1.091
  218    HG3  GLN  32           2HG      GLN  32   0.328   5.086   2.281
  219   HE21  GLN  32          1HE2      GLN  32  -1.447   5.642   1.233
  220   HE22  GLN  32          2HE2      GLN  32  -1.607   6.977   0.149
  221    H    LYS  33           H        LYS  33   2.204   7.125   5.629
  222    HA   LYS  33           HA       LYS  33   4.466   8.688   5.679
  223    HB2  LYS  33           1HB      LYS  33   2.929   7.750   8.108
  224    HB3  LYS  33           2HB      LYS  33   3.932   9.191   8.000
  225    HG2  LYS  33           1HG      LYS  33   1.472   8.735   6.328
  226    HG3  LYS  33           2HG      LYS  33   1.479   9.607   7.863
  227    HD2  LYS  33           1HD      LYS  33   3.395  10.983   6.715
  228    HD3  LYS  33           2HD      LYS  33   2.656  10.378   5.230
  229    HE2  LYS  33           1HE      LYS  33   1.673  12.494   5.707
  230    HE3  LYS  33           2HE      LYS  33   0.467  11.260   6.068
  231    HZ1  LYS  33           3HZ      LYS  33   0.286  12.230   8.042
  232    HZ2  LYS  33           1HZ      LYS  33   1.664  13.182   7.804
  233    HZ3  LYS  33           2HZ      LYS  33   1.816  11.614   8.419
  234    H    VAL  34           H        VAL  34   3.946   5.564   7.263
  235    HA   VAL  34           HA       VAL  34   6.114   5.278   8.854
  236    HB   VAL  34           HB       VAL  34   5.105   3.187   6.920
  237   HG11  VAL  34          1HG1      VAL  34   7.010   3.082   9.214
  238   HG12  VAL  34          2HG1      VAL  34   5.973   1.694   8.880
  239   HG13  VAL  34          3HG1      VAL  34   7.091   2.278   7.647
  240   HG21  VAL  34          3HG2      VAL  34   4.384   3.253   9.806
  241   HG22  VAL  34          1HG2      VAL  34   3.570   4.368   8.709
  242   HG23  VAL  34          2HG2      VAL  34   3.475   2.629   8.429
  243    H    HIS  35           H        HIS  35   6.099   4.888   5.328
  244    HA   HIS  35           HA       HIS  35   8.903   4.301   5.196
  245    HB2  HIS  35           1HB      HIS  35   7.182   5.217   2.897
  246    HB3  HIS  35           2HB      HIS  35   8.622   4.205   2.842
  247    HD1  HIS  35           HD1      HIS  35   8.278   1.768   4.060
  248    HD2  HIS  35           HD2      HIS  35   4.862   3.819   2.884
  249    HE1  HIS  35           HE1      HIS  35   6.450   0.042   3.986
  250    H    THR  36           H        THR  36   9.717   6.128   6.393
  251    HA   THR  36           HA       THR  36  10.271   8.386   4.641
  252    HB   THR  36           HB       THR  36   9.821  10.009   6.523
  253    HG1  THR  36           HG1      THR  36   9.104   9.227   8.348
  254   HG21  THR  36          3HG2      THR  36   8.306   9.989   4.688
  255   HG22  THR  36          1HG2      THR  36   7.324   9.991   6.152
  256   HG23  THR  36          2HG2      THR  36   7.549   8.496   5.244
  257    H    GLY  37           H        GLY  37  12.392   8.714   4.678
  258    HA2  GLY  37           1HA      GLY  37  14.366   9.368   5.888
  259    HA3  GLY  37           2HA      GLY  37  13.827   8.362   7.225
  260    H    GLU  38           H        GLU  38  14.363   7.826   3.738
  261    HA   GLU  38           HA       GLU  38  15.945   5.451   4.466
  262    HB2  GLU  38           1HB      GLU  38  15.330   4.517   2.292
  263    HB3  GLU  38           2HB      GLU  38  13.899   4.915   3.231
  264    HG2  GLU  38           1HG      GLU  38  13.340   5.685   1.140
  265    HG3  GLU  38           2HG      GLU  38  13.952   7.143   1.919
  266    H    ARG  39           H        ARG  39  17.989   5.251   3.733
  267    HA   ARG  39           HA       ARG  39  19.621   7.287   3.125
  268    HB2  ARG  39           1HB      ARG  39  19.707   4.431   2.198
  269    HB3  ARG  39           2HB      ARG  39  20.967   5.563   1.727
  270    HG2  ARG  39           1HG      ARG  39  20.202   5.060   4.589
  271    HG3  ARG  39           2HG      ARG  39  21.457   4.151   3.744
  272    HD2  ARG  39           1HD      ARG  39  22.679   6.219   3.318
  273    HD3  ARG  39           2HD      ARG  39  21.413   7.143   4.127
  274    HE   ARG  39           HE       ARG  39  22.278   6.500   6.153
  275   HH11  ARG  39          1HH1      ARG  39  23.671   4.552   3.626
  276   HH12  ARG  39          2HH1      ARG  39  24.856   3.825   4.661
  277   HH21  ARG  39          1HH2      ARG  39  23.833   5.550   7.525
  278   HH22  ARG  39          2HH2      ARG  39  24.946   4.392   6.878
  279    HA   PRO  40           HA       PRO  40  18.535   8.950  -0.803
  280    HB2  PRO  40           1HB      PRO  40  20.897  10.124  -1.443
  281    HB3  PRO  40           2HB      PRO  40  19.804  10.772  -0.214
  282    HG2  PRO  40           1HG      PRO  40  22.269   9.108   0.130
  283    HG3  PRO  40           2HG      PRO  40  21.739  10.527   1.053
  284    HD2  PRO  40           1HD      PRO  40  21.411   7.996   1.957
  285    HD3  PRO  40           2HD      PRO  40  20.268   9.301   2.335
  286    H    SER  41           H        SER  41  20.752   6.449  -0.371
  287    HA   SER  41           HA       SER  41  21.607   6.257  -3.126
  288    HB2  SER  41           1HB      SER  41  21.935   4.320  -0.820
  289    HB3  SER  41           2HB      SER  41  22.714   4.172  -2.396
  290    HG   SER  41           HG       SER  41  23.388   6.512  -1.730
  291    H    GLY  42           H        GLY  42  19.360   6.242  -3.948
  292    HA2  GLY  42           1HA      GLY  42  18.458   3.473  -4.232
  293    HA3  GLY  42           2HA      GLY  42  17.293   4.642  -3.627
  294    HA   PRO  43           HA       PRO  43  18.301   6.084  -8.123
  295    HB2  PRO  43           1HB      PRO  43  19.937   4.494  -9.595
  296    HB3  PRO  43           2HB      PRO  43  20.536   5.817  -8.589
  297    HG2  PRO  43           1HG      PRO  43  20.443   2.884  -8.001
  298    HG3  PRO  43           2HG      PRO  43  21.745   4.046  -7.691
  299    HD2  PRO  43           1HD      PRO  43  20.037   3.221  -5.758
  300    HD3  PRO  43           2HD      PRO  43  20.741   4.851  -5.778
  301    H    SER  44           H        SER  44  17.316   3.127  -6.995
  302    HA   SER  44           HA       SER  44  15.669   1.697  -7.662
  303    HB2  SER  44           1HB      SER  44  14.754   3.900  -8.698
  304    HB3  SER  44           2HB      SER  44  15.320   3.226 -10.227
  305    HG   SER  44           HG       SER  44  13.792   1.578  -8.579
  306    H    SER  45           H        SER  45  18.200   0.893  -8.068
  307    HA   SER  45           HA       SER  45  18.497  -0.028 -10.811
  308    HB2  SER  45           1HB      SER  45  20.235  -0.056  -8.368
  309    HB3  SER  45           2HB      SER  45  20.592  -1.155  -9.700
  310    HG   SER  45           HG       SER  45  20.112   1.510 -10.345
  311    H    GLY  46           H        GLY  46  18.147  -1.441  -7.565
  312    HA2  GLY  46           1HA      GLY  46  16.714  -3.318  -7.169
  313    HA3  GLY  46           2HA      GLY  46  16.973  -3.822  -8.833
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1   1.194 -24.466 -10.889
    2    HA2  GLY   1           1HA      GLY   1   2.892 -25.049  -8.725
    3    HA3  GLY   1           2HA      GLY   1   3.435 -23.553  -9.469
    4    H    SER   2           H        SER   2   2.754 -23.209  -6.991
    5    HA   SER   2           HA       SER   2   0.051 -22.043  -7.093
    6    HB2  SER   2           1HB      SER   2   1.352 -23.653  -4.915
    7    HB3  SER   2           2HB      SER   2   0.103 -22.470  -4.524
    8    HG   SER   2           HG       SER   2  -0.978 -23.730  -6.431
    9    H    SER   3           H        SER   3   0.949 -20.034  -7.684
   10    HA   SER   3           HA       SER   3   3.046 -18.669  -6.605
   11    HB2  SER   3           1HB      SER   3   0.360 -17.665  -7.539
   12    HB3  SER   3           2HB      SER   3   1.644 -16.566  -7.037
   13    HG   SER   3           HG       SER   3   2.872 -18.085  -8.649
   14    H    GLY   4           H        GLY   4  -0.314 -18.335  -5.436
   15    HA2  GLY   4           1HA      GLY   4  -0.279 -18.725  -2.855
   16    HA3  GLY   4           2HA      GLY   4   0.739 -17.293  -2.903
   17    H    SER   5           H        SER   5  -0.432 -15.639  -4.635
   18    HA   SER   5           HA       SER   5  -2.439 -14.400  -3.240
   19    HB2  SER   5           1HB      SER   5  -1.266 -13.263  -5.030
   20    HB3  SER   5           2HB      SER   5  -1.948 -14.364  -6.227
   21    HG   SER   5           HG       SER   5  -4.036 -13.535  -5.582
   22    H    SER   6           H        SER   6  -4.634 -14.475  -3.151
   23    HA   SER   6           HA       SER   6  -5.885 -16.879  -4.213
   24    HB2  SER   6           1HB      SER   6  -6.935 -14.773  -2.308
   25    HB3  SER   6           2HB      SER   6  -7.789 -16.249  -2.757
   26    HG   SER   6           HG       SER   6  -5.327 -16.036  -1.366
   27    H    GLY   7           H        GLY   7  -7.910 -16.825  -5.344
   28    HA2  GLY   7           1HA      GLY   7  -7.986 -14.708  -7.311
   29    HA3  GLY   7           2HA      GLY   7  -8.992 -16.149  -7.285
   30    H    THR   8           H        THR   8 -10.249 -15.985  -4.880
   31    HA   THR   8           HA       THR   8 -12.201 -13.953  -5.398
   32    HB   THR   8           HB       THR   8 -12.000 -15.806  -3.016
   33    HG1  THR   8           HG1      THR   8 -13.813 -16.769  -4.479
   34   HG21  THR   8          3HG2      THR   8 -14.085 -13.915  -4.014
   35   HG22  THR   8          1HG2      THR   8 -13.560 -14.238  -2.362
   36   HG23  THR   8          2HG2      THR   8 -14.586 -15.400  -3.205
   37    H    GLY   9           H        GLY   9 -10.053 -14.629  -2.625
   38    HA2  GLY   9           1HA      GLY   9 -10.664 -12.097  -1.395
   39    HA3  GLY   9           2HA      GLY   9  -9.482 -13.272  -0.838
   40    H    GLU  10           H        GLU  10  -9.959 -10.302  -2.388
   41    HA   GLU  10           HA       GLU  10  -7.075 -10.058  -2.818
   42    HB2  GLU  10           1HB      GLU  10  -8.203 -10.614  -4.998
   43    HB3  GLU  10           2HB      GLU  10  -9.088  -9.102  -4.855
   44    HG2  GLU  10           1HG      GLU  10  -6.713  -8.058  -4.622
   45    HG3  GLU  10           2HG      GLU  10  -6.193  -9.558  -5.388
   46    H    LYS  11           H        LYS  11  -6.325  -8.292  -1.862
   47    HA   LYS  11           HA       LYS  11  -8.057  -6.407  -0.627
   48    HB2  LYS  11           1HB      LYS  11  -5.656  -7.169   0.042
   49    HB3  LYS  11           2HB      LYS  11  -5.130  -5.910  -1.068
   50    HG2  LYS  11           1HG      LYS  11  -5.145  -4.953   1.089
   51    HG3  LYS  11           2HG      LYS  11  -6.552  -4.305   0.243
   52    HD2  LYS  11           1HD      LYS  11  -7.408  -4.860   2.331
   53    HD3  LYS  11           2HD      LYS  11  -7.826  -6.265   1.348
   54    HE2  LYS  11           1HE      LYS  11  -6.936  -7.333   3.153
   55    HE3  LYS  11           2HE      LYS  11  -5.465  -7.104   2.209
   56    HZ1  LYS  11           3HZ      LYS  11  -5.275  -6.476   4.591
   57    HZ2  LYS  11           1HZ      LYS  11  -6.374  -5.220   4.312
   58    HZ3  LYS  11           2HZ      LYS  11  -4.880  -5.228   3.519
   59    HA   PRO  12           HA       PRO  12  -8.626  -3.635  -4.025
   60    HB2  PRO  12           1HB      PRO  12  -9.619  -1.542  -2.609
   61    HB3  PRO  12           2HB      PRO  12 -10.562  -2.994  -2.967
   62    HG2  PRO  12           1HG      PRO  12  -9.103  -2.253  -0.460
   63    HG3  PRO  12           2HG      PRO  12 -10.711  -2.975  -0.646
   64    HD2  PRO  12           1HD      PRO  12  -8.524  -4.437  -0.007
   65    HD3  PRO  12           2HD      PRO  12  -9.862  -5.093  -0.972
   66    H    TYR  13           H        TYR  13  -6.576  -3.049  -1.315
   67    HA   TYR  13           HA       TYR  13  -5.201  -0.929  -2.829
   68    HB2  TYR  13           1HB      TYR  13  -5.505  -1.119   0.175
   69    HB3  TYR  13           2HB      TYR  13  -4.557   0.095  -0.678
   70    HD1  TYR  13           HD2      TYR  13  -6.342   0.821  -2.894
   71    HD2  TYR  13           HD1      TYR  13  -7.236   0.054   1.195
   72    HE1  TYR  13           HE2      TYR  13  -8.331   2.258  -3.065
   73    HE2  TYR  13           HE1      TYR  13  -9.228   1.488   1.034
   74    HH   TYR  13           HH       TYR  13  -9.761   3.621  -1.468
   75    H    LYS  14           H        LYS  14  -3.001  -1.043  -2.958
   76    HA   LYS  14           HA       LYS  14  -1.576  -3.061  -1.408
   77    HB2  LYS  14           1HB      LYS  14  -1.822  -3.062  -4.407
   78    HB3  LYS  14           2HB      LYS  14  -0.446  -3.801  -3.600
   79    HG2  LYS  14           1HG      LYS  14  -3.305  -4.542  -3.033
   80    HG3  LYS  14           2HG      LYS  14  -2.284  -5.374  -4.208
   81    HD2  LYS  14           1HD      LYS  14  -0.669  -5.863  -2.396
   82    HD3  LYS  14           2HD      LYS  14  -1.779  -5.116  -1.243
   83    HE2  LYS  14           1HE      LYS  14  -3.487  -6.773  -1.829
   84    HE3  LYS  14           2HE      LYS  14  -2.371  -7.519  -2.971
   85    HZ1  LYS  14           3HZ      LYS  14  -2.525  -8.617  -0.745
   86    HZ2  LYS  14           1HZ      LYS  14  -1.783  -7.251  -0.078
   87    HZ3  LYS  14           2HZ      LYS  14  -0.958  -8.189  -1.217
   88    H    CYS  15           H        CYS  15  -0.001  -1.920  -0.497
   89    HA   CYS  15           HA       CYS  15   1.002   0.517  -1.512
   90    HB2  CYS  15           1HB      CYS  15   1.029  -0.182   0.896
   91    HB3  CYS  15           2HB      CYS  15   2.330  -1.303   0.505
   92    H    GLU  16           H        GLU  16   3.195   0.983  -2.183
   93    HA   GLU  16           HA       GLU  16   4.350  -1.226  -3.749
   94    HB2  GLU  16           1HB      GLU  16   4.052   1.695  -4.270
   95    HB3  GLU  16           2HB      GLU  16   5.454   0.872  -4.940
   96    HG2  GLU  16           1HG      GLU  16   3.629  -0.835  -5.770
   97    HG3  GLU  16           2HG      GLU  16   2.576   0.569  -5.603
   98    H    LYS  17           H        LYS  17   5.089   1.484  -1.624
   99    HA   LYS  17           HA       LYS  17   7.839   1.476  -1.649
  100    HB2  LYS  17           1HB      LYS  17   5.873   1.983   0.573
  101    HB3  LYS  17           2HB      LYS  17   7.606   2.132   0.832
  102    HG2  LYS  17           1HG      LYS  17   6.226   3.607  -1.381
  103    HG3  LYS  17           2HG      LYS  17   6.287   4.244   0.264
  104    HD2  LYS  17           1HD      LYS  17   8.629   4.418   0.226
  105    HD3  LYS  17           2HD      LYS  17   8.768   3.367  -1.186
  106    HE2  LYS  17           1HE      LYS  17   9.157   5.612  -1.902
  107    HE3  LYS  17           2HE      LYS  17   7.577   5.118  -2.509
  108    HZ1  LYS  17           3HZ      LYS  17   7.321   7.279  -1.650
  109    HZ2  LYS  17           1HZ      LYS  17   8.163   6.915  -0.229
  110    HZ3  LYS  17           2HZ      LYS  17   6.630   6.253  -0.496
  111    H    CYS  18           H        CYS  18   5.665  -0.668   0.133
  112    HA   CYS  18           HA       CYS  18   7.989  -2.368   0.760
  113    HB2  CYS  18           1HB      CYS  18   6.837  -3.082   2.801
  114    HB3  CYS  18           2HB      CYS  18   7.081  -1.338   2.795
  115    H    GLY  19           H        GLY  19   4.495  -2.324   0.125
  116    HA2  GLY  19           1HA      GLY  19   3.607  -3.791  -1.591
  117    HA3  GLY  19           2HA      GLY  19   4.797  -4.989  -1.105
  118    H    LYS  20           H        LYS  20   2.760  -3.072   1.043
  119    HA   LYS  20           HA       LYS  20   1.630  -5.577   2.074
  120    HB2  LYS  20           1HB      LYS  20   2.849  -3.700   3.492
  121    HB3  LYS  20           2HB      LYS  20   1.254  -2.960   3.462
  122    HG2  LYS  20           1HG      LYS  20   1.119  -4.169   5.391
  123    HG3  LYS  20           2HG      LYS  20   0.477  -5.341   4.238
  124    HD2  LYS  20           1HD      LYS  20   2.379  -6.641   4.296
  125    HD3  LYS  20           2HD      LYS  20   3.410  -5.295   4.789
  126    HE2  LYS  20           1HE      LYS  20   1.291  -6.482   6.566
  127    HE3  LYS  20           2HE      LYS  20   2.959  -7.052   6.548
  128    HZ1  LYS  20           3HZ      LYS  20   3.097  -5.515   8.192
  129    HZ2  LYS  20           1HZ      LYS  20   1.862  -4.542   7.566
  130    HZ3  LYS  20           2HZ      LYS  20   3.408  -4.492   6.881
  131    H    GLY  21           H        GLY  21  -0.636  -5.650   2.650
  132    HA2  GLY  21           1HA      GLY  21  -2.259  -3.985   0.834
  133    HA3  GLY  21           2HA      GLY  21  -2.677  -5.616   1.337
  134    H    TYR  22           H        TYR  22  -4.291  -3.213   1.515
  135    HA   TYR  22           HA       TYR  22  -4.947  -3.402   4.346
  136    HB2  TYR  22           1HB      TYR  22  -4.543  -0.721   3.005
  137    HB3  TYR  22           2HB      TYR  22  -5.044  -0.995   4.670
  138    HD1  TYR  22           HD2      TYR  22  -2.226  -1.163   2.312
  139    HD2  TYR  22           HD1      TYR  22  -3.444  -1.576   6.368
  140    HE1  TYR  22           HE2      TYR  22   0.131  -1.150   3.015
  141    HE2  TYR  22           HE1      TYR  22  -1.090  -1.562   7.082
  142    HH   TYR  22           HH       TYR  22   1.148  -2.102   6.056
  143    H    ASN  23           H        ASN  23  -7.082  -3.516   4.644
  144    HA   ASN  23           HA       ASN  23  -8.847  -3.477   2.409
  145    HB2  ASN  23           1HB      ASN  23 -10.618  -3.760   4.241
  146    HB3  ASN  23           2HB      ASN  23  -9.398  -5.023   4.104
  147   HD21  ASN  23          1HD2      ASN  23 -11.042  -3.176   6.228
  148   HD22  ASN  23          2HD2      ASN  23  -9.942  -3.199   7.561
  149    H    SER  24           H        SER  24  -8.472  -1.385   5.259
  150    HA   SER  24           HA       SER  24 -10.389   0.515   4.179
  151    HB2  SER  24           1HB      SER  24 -10.021   1.738   6.296
  152    HB3  SER  24           2HB      SER  24 -10.446   0.051   6.581
  153    HG   SER  24           HG       SER  24  -8.367   1.305   7.512
  154    H    LYS  25           H        LYS  25  -9.871   2.256   3.033
  155    HA   LYS  25           HA       LYS  25  -7.286   2.740   2.082
  156    HB2  LYS  25           1HB      LYS  25  -8.209   4.878   1.233
  157    HB3  LYS  25           2HB      LYS  25  -9.230   3.497   0.858
  158    HG2  LYS  25           1HG      LYS  25 -10.807   4.987   1.549
  159    HG3  LYS  25           2HG      LYS  25 -10.437   4.200   3.085
  160    HD2  LYS  25           1HD      LYS  25 -10.277   6.381   3.737
  161    HD3  LYS  25           2HD      LYS  25  -8.614   6.121   3.204
  162    HE2  LYS  25           1HE      LYS  25 -10.714   7.139   1.320
  163    HE3  LYS  25           2HE      LYS  25  -9.848   8.232   2.398
  164    HZ1  LYS  25           3HZ      LYS  25  -7.813   6.906   1.346
  165    HZ2  LYS  25           1HZ      LYS  25  -8.443   8.317   0.656
  166    HZ3  LYS  25           2HZ      LYS  25  -8.897   6.804   0.051
  167    H    PHE  26           H        PHE  26  -9.080   4.205   4.746
  168    HA   PHE  26           HA       PHE  26  -7.417   6.330   5.356
  169    HB2  PHE  26           1HB      PHE  26  -9.462   6.185   6.532
  170    HB3  PHE  26           2HB      PHE  26  -9.114   4.555   7.099
  171    HD1  PHE  26           HD1      PHE  26  -7.459   4.197   8.892
  172    HD2  PHE  26           HD2      PHE  26  -8.682   8.096   7.702
  173    HE1  PHE  26           HE1      PHE  26  -6.552   5.116  10.986
  174    HE2  PHE  26           HE2      PHE  26  -7.776   9.022   9.794
  175    HZ   PHE  26           HZ       PHE  26  -6.709   7.532  11.439
  176    H    ASN  27           H        ASN  27  -7.158   2.947   6.378
  177    HA   ASN  27           HA       ASN  27  -4.963   3.247   8.097
  178    HB2  ASN  27           1HB      ASN  27  -6.365   1.219   8.016
  179    HB3  ASN  27           2HB      ASN  27  -5.717   0.840   6.423
  180   HD21  ASN  27          1HD2      ASN  27  -5.422  -1.105   8.085
  181   HD22  ASN  27          2HD2      ASN  27  -3.821  -1.217   8.725
  182    H    LEU  28           H        LEU  28  -5.116   2.531   4.629
  183    HA   LEU  28           HA       LEU  28  -2.355   2.171   4.229
  184    HB2  LEU  28           1HB      LEU  28  -3.802   1.406   2.541
  185    HB3  LEU  28           2HB      LEU  28  -4.608   2.968   2.413
  186    HG   LEU  28           HG       LEU  28  -2.256   3.778   1.594
  187   HD11  LEU  28          1HD1      LEU  28  -1.787   1.352   0.189
  188   HD12  LEU  28          2HD1      LEU  28  -1.801   1.005   1.918
  189   HD13  LEU  28          3HD1      LEU  28  -0.707   2.229   1.273
  190   HD21  LEU  28          3HD2      LEU  28  -2.918   3.058  -0.743
  191   HD22  LEU  28          1HD2      LEU  28  -4.134   3.947   0.176
  192   HD23  LEU  28          2HD2      LEU  28  -4.263   2.196   0.007
  193    H    ASP  29           H        ASP  29  -4.407   5.040   3.752
  194    HA   ASP  29           HA       ASP  29  -2.584   6.842   2.812
  195    HB2  ASP  29           1HB      ASP  29  -4.920   7.426   3.104
  196    HB3  ASP  29           2HB      ASP  29  -4.761   7.322   4.855
  197    H    MET  30           H        MET  30  -3.176   6.069   6.235
  198    HA   MET  30           HA       MET  30  -1.169   7.795   7.240
  199    HB2  MET  30           1HB      MET  30  -2.789   5.545   8.351
  200    HB3  MET  30           2HB      MET  30  -1.386   6.096   9.256
  201    HG2  MET  30           1HG      MET  30  -3.429   7.173  10.021
  202    HG3  MET  30           2HG      MET  30  -2.294   8.340   9.347
  203    HE1  MET  30           3HE      MET  30  -4.732  10.431   8.040
  204    HE2  MET  30           1HE      MET  30  -5.685   9.528   9.219
  205    HE3  MET  30           2HE      MET  30  -3.988   9.885   9.544
  206    H    HIS  31           H        HIS  31  -1.216   4.310   6.561
  207    HA   HIS  31           HA       HIS  31   1.288   3.614   7.494
  208    HB2  HIS  31           1HB      HIS  31  -0.052   1.830   6.789
  209    HB3  HIS  31           2HB      HIS  31  -0.393   2.577   5.231
  210    HD1  HIS  31           HD1      HIS  31   2.746   1.336   7.010
  211    HD2  HIS  31           HD2      HIS  31   0.950   1.324   3.263
  212    HE1  HIS  31           HE1      HIS  31   4.301   0.034   5.523
  213    H    GLN  32           H        GLN  32   0.417   4.901   4.303
  214    HA   GLN  32           HA       GLN  32   2.725   4.755   2.912
  215    HB2  GLN  32           1HB      GLN  32   0.823   7.084   3.132
  216    HB3  GLN  32           2HB      GLN  32   2.141   7.043   1.969
  217    HG2  GLN  32           1HG      GLN  32   1.174   4.900   1.097
  218    HG3  GLN  32           2HG      GLN  32  -0.225   5.199   2.128
  219   HE21  GLN  32          1HE2      GLN  32  -1.857   5.991   1.033
  220   HE22  GLN  32          2HE2      GLN  32  -1.765   7.114  -0.277
  221    H    LYS  33           H        LYS  33   1.981   7.400   5.184
  222    HA   LYS  33           HA       LYS  33   4.244   8.885   5.069
  223    HB2  LYS  33           1HB      LYS  33   2.791   8.058   7.589
  224    HB3  LYS  33           2HB      LYS  33   3.915   9.405   7.470
  225    HG2  LYS  33           1HG      LYS  33   2.459  10.607   6.034
  226    HG3  LYS  33           2HG      LYS  33   1.411   9.203   5.819
  227    HD2  LYS  33           1HD      LYS  33   0.234  10.449   7.370
  228    HD3  LYS  33           2HD      LYS  33   1.141   9.343   8.404
  229    HE2  LYS  33           1HE      LYS  33   2.032  12.136   7.698
  230    HE3  LYS  33           2HE      LYS  33   1.163  11.714   9.173
  231    HZ1  LYS  33           3HZ      LYS  33   3.937  11.270   8.472
  232    HZ2  LYS  33           1HZ      LYS  33   3.179   9.963   9.232
  233    HZ3  LYS  33           2HZ      LYS  33   3.222  11.473   9.991
  234    H    VAL  34           H        VAL  34   3.848   5.892   6.938
  235    HA   VAL  34           HA       VAL  34   6.101   5.646   8.355
  236    HB   VAL  34           HB       VAL  34   4.996   3.507   6.531
  237   HG11  VAL  34          1HG1      VAL  34   6.306   2.622   8.970
  238   HG12  VAL  34          2HG1      VAL  34   6.499   2.053   7.310
  239   HG13  VAL  34          3HG1      VAL  34   7.407   3.456   7.874
  240   HG21  VAL  34          3HG2      VAL  34   3.591   2.867   8.269
  241   HG22  VAL  34          1HG2      VAL  34   4.538   3.727   9.482
  242   HG23  VAL  34          2HG2      VAL  34   3.535   4.628   8.345
  243    H    HIS  35           H        HIS  35   5.919   5.290   4.841
  244    HA   HIS  35           HA       HIS  35   8.744   4.741   4.605
  245    HB2  HIS  35           1HB      HIS  35   6.824   5.428   2.380
  246    HB3  HIS  35           2HB      HIS  35   8.355   4.569   2.250
  247    HD1  HIS  35           HD1      HIS  35   8.233   2.270   3.990
  248    HD2  HIS  35           HD2      HIS  35   4.789   3.684   2.145
  249    HE1  HIS  35           HE1      HIS  35   6.627   0.335   3.991
  250    H    THR  36           H        THR  36   8.497   7.071   5.964
  251    HA   THR  36           HA       THR  36   9.124   9.160   3.984
  252    HB   THR  36           HB       THR  36   7.216   9.692   5.466
  253    HG1  THR  36           HG1      THR  36   8.048  11.750   6.088
  254   HG21  THR  36          3HG2      THR  36   8.678  10.300   7.853
  255   HG22  THR  36          1HG2      THR  36   8.885   8.594   7.460
  256   HG23  THR  36          2HG2      THR  36   7.265   9.265   7.652
  257    H    GLY  37           H        GLY  37  11.066   7.241   4.662
  258    HA2  GLY  37           1HA      GLY  37  12.863   8.657   6.508
  259    HA3  GLY  37           2HA      GLY  37  13.044   6.991   5.980
  260    H    GLU  38           H        GLU  38  12.797   7.295   3.231
  261    HA   GLU  38           HA       GLU  38  15.388   7.911   2.459
  262    HB2  GLU  38           1HB      GLU  38  12.813   7.689   0.928
  263    HB3  GLU  38           2HB      GLU  38  14.309   8.124   0.113
  264    HG2  GLU  38           1HG      GLU  38  14.314   5.867  -0.189
  265    HG3  GLU  38           2HG      GLU  38  15.225   5.987   1.315
  266    H    ARG  39           H        ARG  39  16.293   9.648   1.286
  267    HA   ARG  39           HA       ARG  39  16.808  11.873   1.131
  268    HB2  ARG  39           1HB      ARG  39  15.231  11.476  -0.769
  269    HB3  ARG  39           2HB      ARG  39  13.923  12.057   0.253
  270    HG2  ARG  39           1HG      ARG  39  14.444  13.937  -0.955
  271    HG3  ARG  39           2HG      ARG  39  15.415  14.172   0.500
  272    HD2  ARG  39           1HD      ARG  39  16.914  14.646  -1.206
  273    HD3  ARG  39           2HD      ARG  39  17.272  12.962  -0.825
  274    HE   ARG  39           HE       ARG  39  16.607  12.399  -2.932
  275   HH11  ARG  39          1HH1      ARG  39  15.301  15.530  -2.150
  276   HH12  ARG  39          2HH1      ARG  39  14.659  15.802  -3.736
  277   HH21  ARG  39          1HH2      ARG  39  15.766  12.746  -5.024
  278   HH22  ARG  39          2HH2      ARG  39  14.923  14.218  -5.370
  279    HA   PRO  40           HA       PRO  40  14.454  12.869   5.106
  280    HB2  PRO  40           1HB      PRO  40  16.567  12.640   6.795
  281    HB3  PRO  40           2HB      PRO  40  15.509  11.283   6.392
  282    HG2  PRO  40           1HG      PRO  40  18.199  11.983   5.281
  283    HG3  PRO  40           2HG      PRO  40  17.564  10.398   5.757
  284    HD2  PRO  40           1HD      PRO  40  17.667  11.210   3.176
  285    HD3  PRO  40           2HD      PRO  40  16.393  10.135   3.789
  286    H    SER  41           H        SER  41  17.640  13.761   3.878
  287    HA   SER  41           HA       SER  41  17.815  16.221   5.304
  288    HB2  SER  41           1HB      SER  41  19.272  15.205   2.856
  289    HB3  SER  41           2HB      SER  41  19.656  16.725   3.664
  290    HG   SER  41           HG       SER  41  19.534  14.391   5.201
  291    H    GLY  42           H        GLY  42  16.353  17.780   5.003
  292    HA2  GLY  42           1HA      GLY  42  15.382  18.298   2.273
  293    HA3  GLY  42           2HA      GLY  42  14.572  18.792   3.752
  294    HA   PRO  43           HA       PRO  43  16.392  22.769   3.559
  295    HB2  PRO  43           1HB      PRO  43  17.033  23.292   6.144
  296    HB3  PRO  43           2HB      PRO  43  15.366  23.255   5.557
  297    HG2  PRO  43           1HG      PRO  43  16.909  21.142   7.012
  298    HG3  PRO  43           2HG      PRO  43  15.234  21.670   7.253
  299    HD2  PRO  43           1HD      PRO  43  15.871  19.428   5.874
  300    HD3  PRO  43           2HD      PRO  43  14.452  20.421   5.480
  301    H    SER  44           H        SER  44  18.250  20.097   4.202
  302    HA   SER  44           HA       SER  44  20.732  21.683   4.308
  303    HB2  SER  44           1HB      SER  44  20.191  20.072   6.241
  304    HB3  SER  44           2HB      SER  44  20.534  18.779   5.091
  305    HG   SER  44           HG       SER  44  22.296  20.853   5.899
  306    H    SER  45           H        SER  45  22.597  20.706   3.183
  307    HA   SER  45           HA       SER  45  21.776  19.785   0.556
  308    HB2  SER  45           1HB      SER  45  24.512  20.521   1.626
  309    HB3  SER  45           2HB      SER  45  24.142  20.155  -0.059
  310    HG   SER  45           HG       SER  45  22.981  22.000  -0.217
  311    H    GLY  46           H        GLY  46  21.278  17.862   2.476
  312    HA2  GLY  46           1HA      GLY  46  21.722  15.681   3.075
  313    HA3  GLY  46           2HA      GLY  46  22.256  15.545   1.406
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1   4.772 -24.499   1.694
    2    HA2  GLY   1           1HA      GLY   1   2.462 -25.309   1.508
    3    HA3  GLY   1           2HA      GLY   1   2.744 -26.218   2.985
    4    H    SER   2           H        SER   2   1.695 -23.272   1.642
    5    HA   SER   2           HA       SER   2   0.703 -22.341   4.138
    6    HB2  SER   2           1HB      SER   2   1.996 -20.265   4.308
    7    HB3  SER   2           2HB      SER   2   3.059 -21.667   4.420
    8    HG   SER   2           HG       SER   2   3.154 -19.653   2.681
    9    H    SER   3           H        SER   3  -1.095 -21.228   3.739
   10    HA   SER   3           HA       SER   3  -1.368 -19.286   1.702
   11    HB2  SER   3           1HB      SER   3  -1.404 -21.416   0.338
   12    HB3  SER   3           2HB      SER   3  -2.904 -21.835   1.166
   13    HG   SER   3           HG       SER   3  -3.909 -20.130   0.221
   14    H    GLY   4           H        GLY   4  -3.508 -18.329   1.652
   15    HA2  GLY   4           1HA      GLY   4  -5.407 -19.226   3.669
   16    HA3  GLY   4           2HA      GLY   4  -4.650 -17.668   3.965
   17    H    SER   5           H        SER   5  -7.071 -19.371   2.245
   18    HA   SER   5           HA       SER   5  -7.588 -17.414   0.239
   19    HB2  SER   5           1HB      SER   5  -9.483 -19.501   1.341
   20    HB3  SER   5           2HB      SER   5  -9.616 -18.667  -0.208
   21    HG   SER   5           HG       SER   5  -7.954 -19.820  -0.991
   22    H    SER   6           H        SER   6  -9.203 -18.223   3.308
   23    HA   SER   6           HA       SER   6 -10.479 -16.983   4.726
   24    HB2  SER   6           1HB      SER   6  -8.512 -15.360   4.351
   25    HB3  SER   6           2HB      SER   6  -9.602 -14.495   3.268
   26    HG   SER   6           HG       SER   6 -11.091 -14.595   5.192
   27    H    GLY   7           H        GLY   7 -11.721 -18.073   2.490
   28    HA2  GLY   7           1HA      GLY   7 -13.774 -17.999   1.457
   29    HA3  GLY   7           2HA      GLY   7 -14.133 -16.581   2.430
   30    H    THR   8           H        THR   8 -14.422 -14.742   1.368
   31    HA   THR   8           HA       THR   8 -13.249 -14.494  -1.326
   32    HB   THR   8           HB       THR   8 -15.679 -14.715  -1.458
   33    HG1  THR   8           HG1      THR   8 -15.259 -13.377  -3.054
   34   HG21  THR   8          3HG2      THR   8 -16.560 -13.977   0.561
   35   HG22  THR   8          1HG2      THR   8 -16.990 -12.668  -0.538
   36   HG23  THR   8          2HG2      THR   8 -15.612 -12.491   0.548
   37    H    GLY   9           H        GLY   9 -12.625 -12.377  -2.010
   38    HA2  GLY   9           1HA      GLY   9 -12.635  -9.956  -1.178
   39    HA3  GLY   9           2HA      GLY   9 -11.901 -10.646   0.263
   40    H    GLU  10           H        GLU  10 -11.062  -8.779  -2.087
   41    HA   GLU  10           HA       GLU  10  -8.409 -10.008  -2.404
   42    HB2  GLU  10           1HB      GLU  10 -10.224  -8.916  -4.506
   43    HB3  GLU  10           2HB      GLU  10  -8.492  -8.682  -4.695
   44    HG2  GLU  10           1HG      GLU  10  -8.137 -11.083  -4.577
   45    HG3  GLU  10           2HG      GLU  10  -9.865 -11.337  -4.339
   46    H    LYS  11           H        LYS  11  -7.101  -8.770  -1.228
   47    HA   LYS  11           HA       LYS  11  -7.334  -6.351  -0.163
   48    HB2  LYS  11           1HB      LYS  11  -4.866  -7.364  -1.583
   49    HB3  LYS  11           2HB      LYS  11  -4.878  -6.005  -0.467
   50    HG2  LYS  11           1HG      LYS  11  -5.978  -8.604   0.464
   51    HG3  LYS  11           2HG      LYS  11  -4.227  -8.430   0.317
   52    HD2  LYS  11           1HD      LYS  11  -4.620  -7.775   2.507
   53    HD3  LYS  11           2HD      LYS  11  -4.580  -6.234   1.648
   54    HE2  LYS  11           1HE      LYS  11  -6.894  -5.978   1.756
   55    HE3  LYS  11           2HE      LYS  11  -7.164  -7.691   2.071
   56    HZ1  LYS  11           3HZ      LYS  11  -6.105  -5.651   3.940
   57    HZ2  LYS  11           1HZ      LYS  11  -6.008  -7.311   4.249
   58    HZ3  LYS  11           2HZ      LYS  11  -7.519  -6.568   4.094
   59    HA   PRO  12           HA       PRO  12  -8.217  -3.951  -3.923
   60    HB2  PRO  12           1HB      PRO  12  -9.535  -1.980  -2.601
   61    HB3  PRO  12           2HB      PRO  12 -10.301  -3.504  -3.066
   62    HG2  PRO  12           1HG      PRO  12  -9.179  -2.680  -0.416
   63    HG3  PRO  12           2HG      PRO  12 -10.688  -3.539  -0.773
   64    HD2  PRO  12           1HD      PRO  12  -8.455  -4.811   0.077
   65    HD3  PRO  12           2HD      PRO  12  -9.622  -5.566  -1.027
   66    H    TYR  13           H        TYR  13  -6.771  -2.994  -0.873
   67    HA   TYR  13           HA       TYR  13  -5.442  -0.739  -2.218
   68    HB2  TYR  13           1HB      TYR  13  -5.874  -1.276   0.727
   69    HB3  TYR  13           2HB      TYR  13  -4.965   0.087   0.083
   70    HD1  TYR  13           HD2      TYR  13  -6.471   1.237  -1.982
   71    HD2  TYR  13           HD1      TYR  13  -7.930  -0.647   1.543
   72    HE1  TYR  13           HE2      TYR  13  -8.545   2.547  -2.148
   73    HE2  TYR  13           HE1      TYR  13 -10.010   0.657   1.386
   74    HH   TYR  13           HH       TYR  13 -10.529   2.974  -1.259
   75    H    LYS  14           H        LYS  14  -3.480  -1.211  -2.932
   76    HA   LYS  14           HA       LYS  14  -1.756  -2.930  -1.270
   77    HB2  LYS  14           1HB      LYS  14  -2.390  -4.133  -3.282
   78    HB3  LYS  14           2HB      LYS  14  -1.896  -2.776  -4.286
   79    HG2  LYS  14           1HG      LYS  14   0.432  -3.104  -3.371
   80    HG3  LYS  14           2HG      LYS  14  -0.151  -4.620  -2.680
   81    HD2  LYS  14           1HD      LYS  14  -0.732  -5.441  -4.881
   82    HD3  LYS  14           2HD      LYS  14  -0.285  -3.895  -5.607
   83    HE2  LYS  14           1HE      LYS  14   1.541  -5.339  -5.987
   84    HE3  LYS  14           2HE      LYS  14   2.034  -4.280  -4.667
   85    HZ1  LYS  14           3HZ      LYS  14   1.107  -6.198  -3.210
   86    HZ2  LYS  14           1HZ      LYS  14   2.653  -6.329  -3.885
   87    HZ3  LYS  14           2HZ      LYS  14   1.348  -7.136  -4.597
   88    H    CYS  15           H        CYS  15   0.282  -2.229  -0.862
   89    HA   CYS  15           HA       CYS  15   0.928   0.484  -1.754
   90    HB2  CYS  15           1HB      CYS  15   0.920  -0.088   0.694
   91    HB3  CYS  15           2HB      CYS  15   2.291  -1.150   0.392
   92    H    GLU  16           H        GLU  16   2.910   1.016  -2.684
   93    HA   GLU  16           HA       GLU  16   4.307  -1.254  -3.924
   94    HB2  GLU  16           1HB      GLU  16   4.128   1.644  -4.763
   95    HB3  GLU  16           2HB      GLU  16   5.112   0.436  -5.576
   96    HG2  GLU  16           1HG      GLU  16   3.199  -0.784  -6.266
   97    HG3  GLU  16           2HG      GLU  16   2.139   0.176  -5.236
   98    H    LYS  17           H        LYS  17   4.655   1.285  -1.672
   99    HA   LYS  17           HA       LYS  17   7.439   1.742  -1.867
  100    HB2  LYS  17           1HB      LYS  17   5.382   2.196   0.269
  101    HB3  LYS  17           2HB      LYS  17   7.087   2.447   0.620
  102    HG2  LYS  17           1HG      LYS  17   5.689   3.777  -1.682
  103    HG3  LYS  17           2HG      LYS  17   5.771   4.484  -0.066
  104    HD2  LYS  17           1HD      LYS  17   8.213   3.622  -1.602
  105    HD3  LYS  17           2HD      LYS  17   7.537   5.249  -1.712
  106    HE2  LYS  17           1HE      LYS  17   7.733   5.365   0.802
  107    HE3  LYS  17           2HE      LYS  17   8.663   3.870   0.717
  108    HZ1  LYS  17           3HZ      LYS  17  10.446   4.923  -0.133
  109    HZ2  LYS  17           1HZ      LYS  17   9.765   6.280   0.613
  110    HZ3  LYS  17           2HZ      LYS  17   9.529   6.017  -1.041
  111    H    CYS  18           H        CYS  18   5.501  -0.583  -0.064
  112    HA   CYS  18           HA       CYS  18   7.993  -1.968   0.680
  113    HB2  CYS  18           1HB      CYS  18   6.783  -2.763   2.727
  114    HB3  CYS  18           2HB      CYS  18   7.096  -1.031   2.702
  115    H    GLY  19           H        GLY  19   4.512  -2.333   0.068
  116    HA2  GLY  19           1HA      GLY  19   3.800  -3.969  -1.582
  117    HA3  GLY  19           2HA      GLY  19   5.100  -5.011  -1.022
  118    H    LYS  20           H        LYS  20   2.752  -3.190   0.904
  119    HA   LYS  20           HA       LYS  20   1.878  -5.744   2.075
  120    HB2  LYS  20           1HB      LYS  20   2.946  -3.743   3.437
  121    HB3  LYS  20           2HB      LYS  20   1.304  -3.117   3.375
  122    HG2  LYS  20           1HG      LYS  20   1.690  -5.929   4.244
  123    HG3  LYS  20           2HG      LYS  20   2.142  -4.637   5.359
  124    HD2  LYS  20           1HD      LYS  20  -0.015  -3.916   5.613
  125    HD3  LYS  20           2HD      LYS  20  -0.502  -4.463   4.007
  126    HE2  LYS  20           1HE      LYS  20  -1.590  -5.932   5.457
  127    HE3  LYS  20           2HE      LYS  20  -0.169  -6.832   4.929
  128    HZ1  LYS  20           3HZ      LYS  20   0.894  -6.473   6.967
  129    HZ2  LYS  20           1HZ      LYS  20  -0.697  -6.867   7.387
  130    HZ3  LYS  20           2HZ      LYS  20  -0.185  -5.256   7.432
  131    H    GLY  21           H        GLY  21  -0.347  -6.086   2.502
  132    HA2  GLY  21           1HA      GLY  21  -2.089  -4.604   0.655
  133    HA3  GLY  21           2HA      GLY  21  -2.396  -6.218   1.276
  134    H    TYR  22           H        TYR  22  -4.020  -3.703   1.277
  135    HA   TYR  22           HA       TYR  22  -4.676  -3.753   4.138
  136    HB2  TYR  22           1HB      TYR  22  -4.308  -1.303   2.417
  137    HB3  TYR  22           2HB      TYR  22  -5.212  -1.272   3.927
  138    HD1  TYR  22           HD1      TYR  22  -4.056  -1.647   6.072
  139    HD2  TYR  22           HD2      TYR  22  -1.912  -1.420   2.404
  140    HE1  TYR  22           HE1      TYR  22  -1.965  -1.308   7.322
  141    HE2  TYR  22           HE2      TYR  22   0.185  -1.082   3.644
  142    HH   TYR  22           HH       TYR  22   1.014  -0.462   5.724
  143    H    ASN  23           H        ASN  23  -6.881  -3.051   4.606
  144    HA   ASN  23           HA       ASN  23  -8.689  -3.782   2.414
  145    HB2  ASN  23           1HB      ASN  23  -8.783  -5.105   4.531
  146    HB3  ASN  23           2HB      ASN  23  -9.283  -3.644   5.378
  147   HD21  ASN  23          1HD2      ASN  23 -11.334  -2.806   5.022
  148   HD22  ASN  23          2HD2      ASN  23 -12.587  -3.731   4.273
  149    H    SER  24           H        SER  24  -8.152  -1.334   4.903
  150    HA   SER  24           HA       SER  24 -10.279   0.318   3.749
  151    HB2  SER  24           1HB      SER  24 -10.496   0.205   6.103
  152    HB3  SER  24           2HB      SER  24  -8.766   0.438   6.355
  153    HG   SER  24           HG       SER  24 -10.760   2.299   5.850
  154    H    LYS  25           H        LYS  25  -9.850   2.631   3.434
  155    HA   LYS  25           HA       LYS  25  -7.372   3.001   1.996
  156    HB2  LYS  25           1HB      LYS  25  -8.339   5.187   1.371
  157    HB3  LYS  25           2HB      LYS  25  -9.424   3.849   1.019
  158    HG2  LYS  25           1HG      LYS  25 -10.871   4.405   2.756
  159    HG3  LYS  25           2HG      LYS  25  -9.661   5.401   3.569
  160    HD2  LYS  25           1HD      LYS  25  -9.841   7.107   1.920
  161    HD3  LYS  25           2HD      LYS  25 -10.809   6.074   0.866
  162    HE2  LYS  25           1HE      LYS  25 -12.359   7.520   1.862
  163    HE3  LYS  25           2HE      LYS  25 -12.505   6.018   2.773
  164    HZ1  LYS  25           3HZ      LYS  25 -11.475   8.609   3.617
  165    HZ2  LYS  25           1HZ      LYS  25 -10.681   7.246   4.229
  166    HZ3  LYS  25           2HZ      LYS  25 -12.339   7.449   4.495
  167    H    PHE  26           H        PHE  26  -8.899   4.260   4.916
  168    HA   PHE  26           HA       PHE  26  -7.162   6.332   5.522
  169    HB2  PHE  26           1HB      PHE  26  -9.312   5.593   6.730
  170    HB3  PHE  26           2HB      PHE  26  -8.272   4.500   7.637
  171    HD1  PHE  26           HD2      PHE  26  -8.658   8.086   6.735
  172    HD2  PHE  26           HD1      PHE  26  -7.206   5.244   9.550
  173    HE1  PHE  26           HE2      PHE  26  -8.105   9.912   8.288
  174    HE2  PHE  26           HE1      PHE  26  -6.651   7.065  11.108
  175    HZ   PHE  26           HZ       PHE  26  -7.099   9.403  10.478
  176    H    ASN  27           H        ASN  27  -6.865   2.881   6.264
  177    HA   ASN  27           HA       ASN  27  -4.516   3.052   7.798
  178    HB2  ASN  27           1HB      ASN  27  -5.364   0.727   6.061
  179    HB3  ASN  27           2HB      ASN  27  -4.314   0.668   7.474
  180   HD21  ASN  27          1HD2      ASN  27  -5.608  -0.788   8.554
  181   HD22  ASN  27          2HD2      ASN  27  -7.145  -0.358   9.216
  182    H    LEU  28           H        LEU  28  -5.041   2.677   4.328
  183    HA   LEU  28           HA       LEU  28  -2.328   2.247   3.640
  184    HB2  LEU  28           1HB      LEU  28  -4.237   1.683   2.185
  185    HB3  LEU  28           2HB      LEU  28  -4.548   3.402   1.959
  186    HG   LEU  28           HG       LEU  28  -2.223   3.545   0.950
  187   HD11  LEU  28          1HD1      LEU  28  -1.947   1.006   1.909
  188   HD12  LEU  28          2HD1      LEU  28  -0.943   1.735   0.655
  189   HD13  LEU  28          3HD1      LEU  28  -2.313   0.719   0.207
  190   HD21  LEU  28          3HD2      LEU  28  -4.563   3.289  -0.213
  191   HD22  LEU  28          1HD2      LEU  28  -3.913   1.720  -0.689
  192   HD23  LEU  28          2HD2      LEU  28  -3.071   3.199  -1.151
  193    H    ASP  29           H        ASP  29  -4.372   5.160   3.476
  194    HA   ASP  29           HA       ASP  29  -2.467   6.943   2.540
  195    HB2  ASP  29           1HB      ASP  29  -4.700   7.512   4.501
  196    HB3  ASP  29           2HB      ASP  29  -3.852   8.712   3.530
  197    H    MET  30           H        MET  30  -3.309   6.220   5.925
  198    HA   MET  30           HA       MET  30  -1.349   7.899   7.063
  199    HB2  MET  30           1HB      MET  30  -2.971   5.590   8.078
  200    HB3  MET  30           2HB      MET  30  -1.695   6.276   9.075
  201    HG2  MET  30           1HG      MET  30  -3.965   7.870   7.915
  202    HG3  MET  30           2HG      MET  30  -3.967   7.171   9.533
  203    HE1  MET  30           3HE      MET  30  -4.437  10.362   9.167
  204    HE2  MET  30           1HE      MET  30  -2.974  11.283   8.815
  205    HE3  MET  30           2HE      MET  30  -3.617  10.158   7.618
  206    H    HIS  31           H        HIS  31  -1.372   4.397   6.440
  207    HA   HIS  31           HA       HIS  31   1.034   3.653   7.501
  208    HB2  HIS  31           1HB      HIS  31  -0.110   1.863   6.614
  209    HB3  HIS  31           2HB      HIS  31  -0.532   2.725   5.138
  210    HD1  HIS  31           HD1      HIS  31   2.637   1.343   6.740
  211    HD2  HIS  31           HD2      HIS  31   0.884   1.862   3.010
  212    HE1  HIS  31           HE1      HIS  31   4.224   0.289   5.099
  213    H    GLN  32           H        GLN  32   0.525   4.915   4.208
  214    HA   GLN  32           HA       GLN  32   2.962   4.857   3.105
  215    HB2  GLN  32           1HB      GLN  32   0.991   7.132   3.147
  216    HB3  GLN  32           2HB      GLN  32   2.462   7.201   2.187
  217    HG2  GLN  32           1HG      GLN  32   1.783   5.424   0.817
  218    HG3  GLN  32           2HG      GLN  32   0.508   4.942   1.935
  219   HE21  GLN  32          1HE2      GLN  32   0.272   5.514  -0.872
  220   HE22  GLN  32          2HE2      GLN  32  -0.832   6.834  -1.025
  221    H    LYS  33           H        LYS  33   1.973   7.600   5.164
  222    HA   LYS  33           HA       LYS  33   4.197   9.057   5.376
  223    HB2  LYS  33           1HB      LYS  33   2.485   8.148   7.695
  224    HB3  LYS  33           2HB      LYS  33   3.642   9.471   7.778
  225    HG2  LYS  33           1HG      LYS  33   2.329  10.499   5.841
  226    HG3  LYS  33           2HG      LYS  33   1.077   9.319   6.236
  227    HD2  LYS  33           1HD      LYS  33   0.608  10.295   8.265
  228    HD3  LYS  33           2HD      LYS  33   2.221  10.995   8.422
  229    HE2  LYS  33           1HE      LYS  33   0.340  11.920   6.280
  230    HE3  LYS  33           2HE      LYS  33   0.224  12.555   7.920
  231    HZ1  LYS  33           3HZ      LYS  33   2.651  13.108   7.701
  232    HZ2  LYS  33           1HZ      LYS  33   1.606  14.021   6.733
  233    HZ3  LYS  33           2HZ      LYS  33   2.511  12.765   6.050
  234    H    VAL  34           H        VAL  34   3.707   5.967   7.036
  235    HA   VAL  34           HA       VAL  34   5.826   5.749   8.686
  236    HB   VAL  34           HB       VAL  34   4.940   3.623   6.731
  237   HG11  VAL  34          1HG1      VAL  34   6.711   3.521   9.152
  238   HG12  VAL  34          2HG1      VAL  34   5.831   2.100   8.585
  239   HG13  VAL  34          3HG1      VAL  34   7.011   2.885   7.535
  240   HG21  VAL  34          3HG2      VAL  34   3.345   2.958   8.271
  241   HG22  VAL  34          1HG2      VAL  34   4.159   3.762   9.614
  242   HG23  VAL  34          2HG2      VAL  34   3.286   4.715   8.414
  243    H    HIS  35           H        HIS  35   6.010   4.921   5.219
  244    HA   HIS  35           HA       HIS  35   8.751   4.452   5.112
  245    HB2  HIS  35           1HB      HIS  35   7.100   5.645   2.881
  246    HB3  HIS  35           2HB      HIS  35   8.570   4.687   2.724
  247    HD1  HIS  35           HD1      HIS  35   7.881   2.309   4.515
  248    HD2  HIS  35           HD2      HIS  35   5.228   4.001   1.802
  249    HE1  HIS  35           HE1      HIS  35   6.207   0.505   3.997
  250    H    THR  36           H        THR  36   9.926   5.966   6.261
  251    HA   THR  36           HA       THR  36  10.172   8.592   4.956
  252    HB   THR  36           HB       THR  36  10.773   9.422   7.356
  253    HG1  THR  36           HG1      THR  36  10.386   7.063   8.057
  254   HG21  THR  36          3HG2      THR  36   8.086   8.990   6.140
  255   HG22  THR  36          1HG2      THR  36   8.956  10.493   6.443
  256   HG23  THR  36          2HG2      THR  36   8.178   9.640   7.777
  257    H    GLY  37           H        GLY  37  12.188   9.055   4.356
  258    HA2  GLY  37           1HA      GLY  37  14.468   8.922   4.129
  259    HA3  GLY  37           2HA      GLY  37  14.499   8.638   5.863
  260    H    GLU  38           H        GLU  38  13.008   6.588   3.403
  261    HA   GLU  38           HA       GLU  38  13.186   4.295   3.192
  262    HB2  GLU  38           1HB      GLU  38  14.886   5.456   1.650
  263    HB3  GLU  38           2HB      GLU  38  16.104   4.914   2.795
  264    HG2  GLU  38           1HG      GLU  38  16.000   3.354   0.994
  265    HG3  GLU  38           2HG      GLU  38  15.340   2.588   2.438
  266    H    ARG  39           H        ARG  39  12.999   4.566   5.790
  267    HA   ARG  39           HA       ARG  39  15.233   3.772   7.330
  268    HB2  ARG  39           1HB      ARG  39  12.268   3.796   7.807
  269    HB3  ARG  39           2HB      ARG  39  13.356   3.069   8.983
  270    HG2  ARG  39           1HG      ARG  39  13.946   5.821   8.031
  271    HG3  ARG  39           2HG      ARG  39  12.613   5.584   9.163
  272    HD2  ARG  39           1HD      ARG  39  15.347   4.445   9.659
  273    HD3  ARG  39           2HD      ARG  39  14.920   6.086  10.140
  274    HE   ARG  39           HE       ARG  39  12.943   4.559  11.208
  275   HH11  ARG  39          1HH1      ARG  39  16.420   4.494  11.371
  276   HH12  ARG  39          2HH1      ARG  39  16.462   3.818  12.966
  277   HH21  ARG  39          1HH2      ARG  39  12.986   3.668  13.307
  278   HH22  ARG  39          2HH2      ARG  39  14.508   3.347  14.066
  279    HA   PRO  40           HA       PRO  40  15.474  -0.540   6.483
  280    HB2  PRO  40           1HB      PRO  40  16.692  -1.362   8.766
  281    HB3  PRO  40           2HB      PRO  40  17.536  -0.470   7.495
  282    HG2  PRO  40           1HG      PRO  40  16.385   0.534  10.069
  283    HG3  PRO  40           2HG      PRO  40  17.936   0.931   9.307
  284    HD2  PRO  40           1HD      PRO  40  15.778   2.558   9.150
  285    HD3  PRO  40           2HD      PRO  40  16.978   2.435   7.847
  286    H    SER  41           H        SER  41  13.587   0.783   8.974
  287    HA   SER  41           HA       SER  41  12.714  -1.182  10.586
  288    HB2  SER  41           1HB      SER  41  11.033   0.837   9.092
  289    HB3  SER  41           2HB      SER  41  10.400  -0.176  10.389
  290    HG   SER  41           HG       SER  41  12.738   1.274  10.873
  291    H    GLY  42           H        GLY  42  12.266  -3.247  10.217
  292    HA2  GLY  42           1HA      GLY  42  10.325  -3.945   8.162
  293    HA3  GLY  42           2HA      GLY  42  11.929  -4.637   7.968
  294    HA   PRO  43           HA       PRO  43   9.127  -7.016  11.054
  295    HB2  PRO  43           1HB      PRO  43   8.066  -8.884   9.394
  296    HB3  PRO  43           2HB      PRO  43   7.269  -7.345   9.742
  297    HG2  PRO  43           1HG      PRO  43   8.920  -8.130   7.372
  298    HG3  PRO  43           2HG      PRO  43   7.400  -7.219   7.424
  299    HD2  PRO  43           1HD      PRO  43   9.809  -6.017   7.138
  300    HD3  PRO  43           2HD      PRO  43   8.454  -5.249   7.989
  301    H    SER  44           H        SER  44  10.510  -8.268  12.128
  302    HA   SER  44           HA       SER  44  11.937 -10.376  10.656
  303    HB2  SER  44           1HB      SER  44  13.548  -8.596  11.079
  304    HB3  SER  44           2HB      SER  44  13.114  -8.577  12.789
  305    HG   SER  44           HG       SER  44  15.018  -9.944  11.788
  306    H    SER  45           H        SER  45  13.123 -11.770  12.545
  307    HA   SER  45           HA       SER  45  12.606 -13.533  13.925
  308    HB2  SER  45           1HB      SER  45  11.737 -11.129  15.541
  309    HB3  SER  45           2HB      SER  45  11.916 -12.749  16.215
  310    HG   SER  45           HG       SER  45  14.143 -12.476  15.100
  311    H    GLY  46           H        GLY  46  10.722 -13.586  12.061
  312    HA2  GLY  46           1HA      GLY  46   8.171 -13.817  13.534
  313    HA3  GLY  46           2HA      GLY  46   8.285 -13.465  11.816
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1   0.650 -13.053  -0.745
    2    HA2  GLY   1           1HA      GLY   1  -0.441 -14.453  -2.390
    3    HA3  GLY   1           2HA      GLY   1   0.873 -15.606  -2.205
    4    H    SER   2           H        SER   2  -1.103 -13.948   0.239
    5    HA   SER   2           HA       SER   2  -1.550 -16.486   1.572
    6    HB2  SER   2           1HB      SER   2  -2.275 -13.642   2.301
    7    HB3  SER   2           2HB      SER   2  -2.694 -15.038   3.293
    8    HG   SER   2           HG       SER   2  -0.518 -13.717   3.476
    9    H    SER   3           H        SER   3  -3.626 -13.816   0.436
   10    HA   SER   3           HA       SER   3  -6.099 -14.861   0.819
   11    HB2  SER   3           1HB      SER   3  -6.860 -13.560  -1.128
   12    HB3  SER   3           2HB      SER   3  -5.711 -12.640  -0.158
   13    HG   SER   3           HG       SER   3  -5.556 -13.140  -2.714
   14    H    GLY   4           H        GLY   4  -7.551 -16.167  -0.329
   15    HA2  GLY   4           1HA      GLY   4  -6.235 -18.247  -1.913
   16    HA3  GLY   4           2HA      GLY   4  -7.824 -18.359  -1.171
   17    H    SER   5           H        SER   5  -7.123 -19.038  -3.876
   18    HA   SER   5           HA       SER   5  -7.577 -17.264  -5.864
   19    HB2  SER   5           1HB      SER   5  -7.343 -19.857  -5.943
   20    HB3  SER   5           2HB      SER   5  -9.106 -19.851  -5.901
   21    HG   SER   5           HG       SER   5  -7.387 -18.744  -7.853
   22    H    SER   6           H        SER   6 -10.121 -18.838  -3.943
   23    HA   SER   6           HA       SER   6 -12.185 -17.242  -5.185
   24    HB2  SER   6           1HB      SER   6 -12.311 -19.183  -2.864
   25    HB3  SER   6           2HB      SER   6 -13.708 -18.436  -3.639
   26    HG   SER   6           HG       SER   6 -12.640 -19.426  -5.640
   27    H    GLY   7           H        GLY   7 -13.388 -15.617  -4.221
   28    HA2  GLY   7           1HA      GLY   7 -13.247 -14.813  -1.546
   29    HA3  GLY   7           2HA      GLY   7 -12.023 -13.916  -2.433
   30    H    THR   8           H        THR   8 -13.429 -12.115  -1.614
   31    HA   THR   8           HA       THR   8 -15.730 -11.677  -3.401
   32    HB   THR   8           HB       THR   8 -15.178 -10.212  -0.818
   33    HG1  THR   8           HG1      THR   8 -15.714 -12.668  -0.862
   34   HG21  THR   8          3HG2      THR   8 -17.620  -9.708  -1.000
   35   HG22  THR   8          1HG2      THR   8 -17.600 -10.435  -2.606
   36   HG23  THR   8          2HG2      THR   8 -16.641  -8.991  -2.280
   37    H    GLY   9           H        GLY   9 -13.353  -9.682  -1.625
   38    HA2  GLY   9           1HA      GLY   9 -12.850  -8.214  -4.126
   39    HA3  GLY   9           2HA      GLY   9 -13.285  -7.326  -2.674
   40    H    GLU  10           H        GLU  10 -10.783  -8.966  -4.382
   41    HA   GLU  10           HA       GLU  10  -8.871  -9.395  -2.436
   42    HB2  GLU  10           1HB      GLU  10  -7.213  -9.238  -4.192
   43    HB3  GLU  10           2HB      GLU  10  -8.642 -10.053  -4.811
   44    HG2  GLU  10           1HG      GLU  10  -7.997  -8.601  -6.515
   45    HG3  GLU  10           2HG      GLU  10  -9.347  -7.790  -5.724
   46    H    LYS  11           H        LYS  11  -7.533  -8.159  -1.252
   47    HA   LYS  11           HA       LYS  11  -7.954  -5.669  -0.440
   48    HB2  LYS  11           1HB      LYS  11  -5.579  -5.426   0.080
   49    HB3  LYS  11           2HB      LYS  11  -6.127  -7.062   0.419
   50    HG2  LYS  11           1HG      LYS  11  -5.244  -7.569  -1.972
   51    HG3  LYS  11           2HG      LYS  11  -4.322  -6.081  -1.743
   52    HD2  LYS  11           1HD      LYS  11  -3.210  -6.963   0.162
   53    HD3  LYS  11           2HD      LYS  11  -4.303  -8.346   0.242
   54    HE2  LYS  11           1HE      LYS  11  -2.280  -9.144  -0.695
   55    HE3  LYS  11           2HE      LYS  11  -3.429  -9.017  -2.026
   56    HZ1  LYS  11           3HZ      LYS  11  -1.009  -8.082  -2.236
   57    HZ2  LYS  11           1HZ      LYS  11  -1.682  -6.730  -1.473
   58    HZ3  LYS  11           2HZ      LYS  11  -2.313  -7.272  -2.945
   59    HA   PRO  12           HA       PRO  12  -7.624  -3.508  -4.427
   60    HB2  PRO  12           1HB      PRO  12  -9.179  -1.421  -3.655
   61    HB3  PRO  12           2HB      PRO  12  -9.845  -2.953  -4.233
   62    HG2  PRO  12           1HG      PRO  12  -9.492  -1.980  -1.424
   63    HG3  PRO  12           2HG      PRO  12 -10.872  -2.824  -2.150
   64    HD2  PRO  12           1HD      PRO  12  -9.030  -4.090  -0.621
   65    HD3  PRO  12           2HD      PRO  12  -9.865  -4.889  -1.969
   66    H    TYR  13           H        TYR  13  -6.386  -2.976  -1.387
   67    HA   TYR  13           HA       TYR  13  -5.018  -0.519  -2.270
   68    HB2  TYR  13           1HB      TYR  13  -5.762  -1.302   0.556
   69    HB3  TYR  13           2HB      TYR  13  -4.841   0.128   0.105
   70    HD1  TYR  13           HD2      TYR  13  -5.944   1.977  -1.112
   71    HD2  TYR  13           HD1      TYR  13  -8.143  -1.369   0.326
   72    HE1  TYR  13           HE2      TYR  13  -8.035   3.246  -1.373
   73    HE2  TYR  13           HE1      TYR  13 -10.240  -0.110   0.068
   74    HH   TYR  13           HH       TYR  13 -10.315   3.035  -1.477
   75    H    LYS  14           H        LYS  14  -3.107  -1.268  -2.988
   76    HA   LYS  14           HA       LYS  14  -1.563  -3.015  -1.183
   77    HB2  LYS  14           1HB      LYS  14  -0.301  -3.663  -3.285
   78    HB3  LYS  14           2HB      LYS  14  -1.955  -4.247  -3.167
   79    HG2  LYS  14           1HG      LYS  14  -2.729  -2.628  -4.719
   80    HG3  LYS  14           2HG      LYS  14  -1.192  -1.761  -4.676
   81    HD2  LYS  14           1HD      LYS  14  -1.264  -3.035  -6.700
   82    HD3  LYS  14           2HD      LYS  14  -0.103  -3.805  -5.617
   83    HE2  LYS  14           1HE      LYS  14  -2.926  -4.733  -5.539
   84    HE3  LYS  14           2HE      LYS  14  -1.939  -5.197  -6.924
   85    HZ1  LYS  14           3HZ      LYS  14  -0.707  -6.584  -5.688
   86    HZ2  LYS  14           1HZ      LYS  14  -2.025  -6.556  -4.628
   87    HZ3  LYS  14           2HZ      LYS  14  -0.687  -5.563  -4.339
   88    H    CYS  15           H        CYS  15  -0.038  -1.914  -0.155
   89    HA   CYS  15           HA       CYS  15   0.842   0.652  -0.792
   90    HB2  CYS  15           1HB      CYS  15   1.076  -0.570   1.423
   91    HB3  CYS  15           2HB      CYS  15   2.473  -1.384   0.726
   92    H    GLU  16           H        GLU  16   1.975   1.315  -2.483
   93    HA   GLU  16           HA       GLU  16   3.604  -0.546  -3.993
   94    HB2  GLU  16           1HB      GLU  16   2.071   1.194  -5.027
   95    HB3  GLU  16           2HB      GLU  16   3.241   2.403  -4.515
   96    HG2  GLU  16           1HG      GLU  16   4.895   1.573  -5.957
   97    HG3  GLU  16           2HG      GLU  16   4.016   0.070  -6.231
   98    H    LYS  17           H        LYS  17   4.587  -0.089  -1.410
   99    HA   LYS  17           HA       LYS  17   7.142   1.215  -2.049
  100    HB2  LYS  17           1HB      LYS  17   5.536   1.540   0.489
  101    HB3  LYS  17           2HB      LYS  17   7.220   2.023   0.331
  102    HG2  LYS  17           1HG      LYS  17   4.996   3.086  -1.395
  103    HG3  LYS  17           2HG      LYS  17   5.583   3.877   0.070
  104    HD2  LYS  17           1HD      LYS  17   7.783   4.124  -0.896
  105    HD3  LYS  17           2HD      LYS  17   7.295   3.207  -2.324
  106    HE2  LYS  17           1HE      LYS  17   5.585   4.966  -2.776
  107    HE3  LYS  17           2HE      LYS  17   6.263   5.901  -1.444
  108    HZ1  LYS  17           3HZ      LYS  17   7.087   5.927  -4.069
  109    HZ2  LYS  17           1HZ      LYS  17   8.296   5.075  -3.246
  110    HZ3  LYS  17           2HZ      LYS  17   7.877   6.637  -2.752
  111    H    CYS  18           H        CYS  18   5.540  -0.754   0.461
  112    HA   CYS  18           HA       CYS  18   8.004  -2.349   0.664
  113    HB2  CYS  18           1HB      CYS  18   7.145  -3.068   2.866
  114    HB3  CYS  18           2HB      CYS  18   7.327  -1.320   2.766
  115    H    GLY  19           H        GLY  19   4.470  -2.611   0.475
  116    HA2  GLY  19           1HA      GLY  19   3.514  -4.241  -1.050
  117    HA3  GLY  19           2HA      GLY  19   4.841  -5.318  -0.640
  118    H    LYS  20           H        LYS  20   2.204  -3.554   0.987
  119    HA   LYS  20           HA       LYS  20   1.567  -6.030   2.433
  120    HB2  LYS  20           1HB      LYS  20   2.050  -3.298   3.584
  121    HB3  LYS  20           2HB      LYS  20   0.985  -4.436   4.400
  122    HG2  LYS  20           1HG      LYS  20   3.877  -4.926   3.714
  123    HG3  LYS  20           2HG      LYS  20   3.250  -4.494   5.307
  124    HD2  LYS  20           1HD      LYS  20   1.790  -6.575   5.113
  125    HD3  LYS  20           2HD      LYS  20   2.813  -7.029   3.747
  126    HE2  LYS  20           1HE      LYS  20   4.057  -6.278   6.359
  127    HE3  LYS  20           2HE      LYS  20   3.372  -7.888   6.146
  128    HZ1  LYS  20           3HZ      LYS  20   5.560  -8.162   5.512
  129    HZ2  LYS  20           1HZ      LYS  20   5.656  -6.652   4.754
  130    HZ3  LYS  20           2HZ      LYS  20   4.798  -7.913   4.022
  131    H    GLY  21           H        GLY  21  -0.629  -6.170   3.189
  132    HA2  GLY  21           1HA      GLY  21  -2.448  -4.503   1.571
  133    HA3  GLY  21           2HA      GLY  21  -2.782  -6.156   2.065
  134    H    TYR  22           H        TYR  22  -4.143  -3.454   2.478
  135    HA   TYR  22           HA       TYR  22  -4.505  -3.748   5.386
  136    HB2  TYR  22           1HB      TYR  22  -4.394  -1.212   3.753
  137    HB3  TYR  22           2HB      TYR  22  -5.044  -1.270   5.388
  138    HD1  TYR  22           HD1      TYR  22  -3.459  -2.250   7.211
  139    HD2  TYR  22           HD2      TYR  22  -2.131  -0.804   3.436
  140    HE1  TYR  22           HE1      TYR  22  -1.195  -1.960   8.126
  141    HE2  TYR  22           HE2      TYR  22   0.138  -0.511   4.340
  142    HH   TYR  22           HH       TYR  22   0.944  -0.192   7.214
  143    H    ASN  23           H        ASN  23  -5.926  -3.216   2.254
  144    HA   ASN  23           HA       ASN  23  -8.061  -3.358   1.484
  145    HB2  ASN  23           1HB      ASN  23  -7.927  -5.501   2.853
  146    HB3  ASN  23           2HB      ASN  23  -8.777  -4.630   4.126
  147   HD21  ASN  23          1HD2      ASN  23 -10.551  -5.989   4.014
  148   HD22  ASN  23          2HD2      ASN  23 -11.672  -5.939   2.701
  149    H    SER  24           H        SER  24  -7.161  -1.072   3.163
  150    HA   SER  24           HA       SER  24  -9.687   0.259   3.336
  151    HB2  SER  24           1HB      SER  24  -9.384   0.874   5.785
  152    HB3  SER  24           2HB      SER  24  -9.895  -0.784   5.469
  153    HG   SER  24           HG       SER  24  -7.904  -0.116   6.925
  154    H    LYS  25           H        LYS  25  -9.117   2.051   2.295
  155    HA   LYS  25           HA       LYS  25  -6.637   3.151   1.965
  156    HB2  LYS  25           1HB      LYS  25  -7.694   5.120   1.202
  157    HB3  LYS  25           2HB      LYS  25  -8.825   3.820   0.850
  158    HG2  LYS  25           1HG      LYS  25  -9.056   5.395   3.382
  159    HG3  LYS  25           2HG      LYS  25  -9.714   6.012   1.865
  160    HD2  LYS  25           1HD      LYS  25 -11.045   3.959   1.626
  161    HD3  LYS  25           2HD      LYS  25 -10.405   3.376   3.164
  162    HE2  LYS  25           1HE      LYS  25 -11.447   5.190   4.346
  163    HE3  LYS  25           2HE      LYS  25 -11.949   5.944   2.834
  164    HZ1  LYS  25           3HZ      LYS  25 -12.882   3.260   3.028
  165    HZ2  LYS  25           1HZ      LYS  25 -13.757   4.684   2.765
  166    HZ3  LYS  25           2HZ      LYS  25 -13.409   4.185   4.343
  167    H    PHE  26           H        PHE  26  -8.741   3.421   4.729
  168    HA   PHE  26           HA       PHE  26  -7.612   5.647   5.988
  169    HB2  PHE  26           1HB      PHE  26  -9.688   4.720   6.791
  170    HB3  PHE  26           2HB      PHE  26  -8.913   3.183   7.159
  171    HD1  PHE  26           HD2      PHE  26  -8.404   6.792   7.975
  172    HD2  PHE  26           HD1      PHE  26  -8.521   2.774   9.373
  173    HE1  PHE  26           HE2      PHE  26  -7.945   7.578  10.261
  174    HE2  PHE  26           HE1      PHE  26  -8.063   3.552  11.661
  175    HZ   PHE  26           HZ       PHE  26  -7.773   5.957  12.108
  176    H    ASN  27           H        ASN  27  -6.729   2.221   6.138
  177    HA   ASN  27           HA       ASN  27  -4.598   2.659   8.010
  178    HB2  ASN  27           1HB      ASN  27  -5.653   0.330   6.471
  179    HB3  ASN  27           2HB      ASN  27  -4.012   0.232   7.104
  180   HD21  ASN  27          1HD2      ASN  27  -6.988   1.665   8.389
  181   HD22  ASN  27          2HD2      ASN  27  -6.984   0.768   9.866
  182    H    LEU  28           H        LEU  28  -4.816   2.062   4.522
  183    HA   LEU  28           HA       LEU  28  -2.065   1.967   3.992
  184    HB2  LEU  28           1HB      LEU  28  -3.583   1.201   2.339
  185    HB3  LEU  28           2HB      LEU  28  -4.421   2.752   2.296
  186    HG   LEU  28           HG       LEU  28  -2.134   3.657   1.436
  187   HD11  LEU  28          1HD1      LEU  28  -0.721   1.806   1.719
  188   HD12  LEU  28          2HD1      LEU  28  -1.051   1.868  -0.012
  189   HD13  LEU  28          3HD1      LEU  28  -1.890   0.695   1.003
  190   HD21  LEU  28          3HD2      LEU  28  -3.804   3.895  -0.091
  191   HD22  LEU  28          1HD2      LEU  28  -4.289   2.202   0.007
  192   HD23  LEU  28          2HD2      LEU  28  -2.854   2.656  -0.913
  193    H    ASP  29           H        ASP  29  -4.302   4.692   3.430
  194    HA   ASP  29           HA       ASP  29  -2.636   6.657   2.664
  195    HB2  ASP  29           1HB      ASP  29  -5.047   6.983   3.032
  196    HB3  ASP  29           2HB      ASP  29  -4.782   6.972   4.773
  197    H    MET  30           H        MET  30  -3.306   6.008   6.110
  198    HA   MET  30           HA       MET  30  -1.376   7.744   7.138
  199    HB2  MET  30           1HB      MET  30  -2.388   5.177   8.372
  200    HB3  MET  30           2HB      MET  30  -1.598   6.494   9.229
  201    HG2  MET  30           1HG      MET  30  -4.207   6.752   7.754
  202    HG3  MET  30           2HG      MET  30  -4.061   6.446   9.483
  203    HE1  MET  30           3HE      MET  30  -2.040   9.055  10.804
  204    HE2  MET  30           1HE      MET  30  -3.735   9.352  11.193
  205    HE3  MET  30           2HE      MET  30  -3.135   7.698  11.071
  206    H    HIS  31           H        HIS  31  -1.171   4.261   6.460
  207    HA   HIS  31           HA       HIS  31   1.371   3.739   7.381
  208    HB2  HIS  31           1HB      HIS  31  -0.097   1.983   6.546
  209    HB3  HIS  31           2HB      HIS  31   0.023   2.626   4.911
  210    HD1  HIS  31           HD1      HIS  31   2.666   1.651   7.481
  211    HD2  HIS  31           HD2      HIS  31   1.632   0.979   3.514
  212    HE1  HIS  31           HE1      HIS  31   4.462   0.148   6.564
  213    H    GLN  32           H        GLN  32   0.514   4.690   4.050
  214    HA   GLN  32           HA       GLN  32   2.872   4.823   2.801
  215    HB2  GLN  32           1HB      GLN  32   0.787   7.011   2.794
  216    HB3  GLN  32           2HB      GLN  32   2.074   6.855   1.607
  217    HG2  GLN  32           1HG      GLN  32   1.133   4.531   1.147
  218    HG3  GLN  32           2HG      GLN  32  -0.283   5.061   2.054
  219   HE21  GLN  32          1HE2      GLN  32  -0.218   4.298  -0.686
  220   HE22  GLN  32          2HE2      GLN  32  -0.688   5.673  -1.619
  221    H    LYS  33           H        LYS  33   1.697   7.444   4.912
  222    HA   LYS  33           HA       LYS  33   3.732   9.222   4.807
  223    HB2  LYS  33           1HB      LYS  33   2.395   8.289   7.353
  224    HB3  LYS  33           2HB      LYS  33   3.244   9.813   7.138
  225    HG2  LYS  33           1HG      LYS  33   0.976   9.176   5.323
  226    HG3  LYS  33           2HG      LYS  33   0.631   9.677   6.980
  227    HD2  LYS  33           1HD      LYS  33   2.525  11.253   5.276
  228    HD3  LYS  33           2HD      LYS  33   0.781  11.475   5.116
  229    HE2  LYS  33           1HE      LYS  33   0.565  12.359   7.229
  230    HE3  LYS  33           2HE      LYS  33   2.007  11.544   7.833
  231    HZ1  LYS  33           3HZ      LYS  33   3.109  13.418   7.495
  232    HZ2  LYS  33           1HZ      LYS  33   1.761  14.151   6.782
  233    HZ3  LYS  33           2HZ      LYS  33   2.844  13.267   5.831
  234    H    VAL  34           H        VAL  34   3.712   6.248   6.743
  235    HA   VAL  34           HA       VAL  34   5.986   6.424   8.195
  236    HB   VAL  34           HB       VAL  34   5.066   4.028   6.604
  237   HG11  VAL  34          1HG1      VAL  34   7.285   4.377   8.562
  238   HG12  VAL  34          2HG1      VAL  34   6.377   2.863   8.557
  239   HG13  VAL  34          3HG1      VAL  34   7.216   3.395   7.099
  240   HG21  VAL  34          3HG2      VAL  34   4.716   4.571   9.542
  241   HG22  VAL  34          1HG2      VAL  34   3.525   5.052   8.333
  242   HG23  VAL  34          2HG2      VAL  34   3.918   3.347   8.555
  243    H    HIS  35           H        HIS  35   5.965   5.075   4.888
  244    HA   HIS  35           HA       HIS  35   8.746   4.988   4.590
  245    HB2  HIS  35           1HB      HIS  35   6.777   5.393   2.337
  246    HB3  HIS  35           2HB      HIS  35   8.352   4.607   2.262
  247    HD1  HIS  35           HD1      HIS  35   8.388   2.423   4.108
  248    HD2  HIS  35           HD2      HIS  35   4.809   3.559   2.329
  249    HE1  HIS  35           HE1      HIS  35   6.879   0.420   4.294
  250    H    THR  36           H        THR  36   6.416   7.533   3.868
  251    HA   THR  36           HA       THR  36   8.011   9.271   2.414
  252    HB   THR  36           HB       THR  36   5.955  10.096   4.471
  253    HG1  THR  36           HG1      THR  36   4.443   9.661   2.976
  254   HG21  THR  36          3HG2      THR  36   5.759  12.121   3.282
  255   HG22  THR  36          1HG2      THR  36   6.671  11.499   1.908
  256   HG23  THR  36          2HG2      THR  36   7.494  11.846   3.429
  257    H    GLY  37           H        GLY  37   7.245   9.853   5.845
  258    HA2  GLY  37           1HA      GLY  37   9.798  11.241   6.130
  259    HA3  GLY  37           2HA      GLY  37   8.471  11.255   7.283
  260    H    GLU  38           H        GLU  38  10.343  10.940   8.779
  261    HA   GLU  38           HA       GLU  38  11.786   9.636  10.007
  262    HB2  GLU  38           1HB      GLU  38   9.367   9.080  10.699
  263    HB3  GLU  38           2HB      GLU  38   9.606   7.572   9.827
  264    HG2  GLU  38           1HG      GLU  38  11.355   6.906  11.285
  265    HG3  GLU  38           2HG      GLU  38  11.418   8.499  12.037
  266    H    ARG  39           H        ARG  39  12.628   9.464   7.456
  267    HA   ARG  39           HA       ARG  39  12.713   7.183   6.030
  268    HB2  ARG  39           1HB      ARG  39  14.796   9.213   6.671
  269    HB3  ARG  39           2HB      ARG  39  15.311   7.745   5.851
  270    HG2  ARG  39           1HG      ARG  39  13.500   8.223   4.149
  271    HG3  ARG  39           2HG      ARG  39  13.359   9.815   4.897
  272    HD2  ARG  39           1HD      ARG  39  15.753  10.201   4.464
  273    HD3  ARG  39           2HD      ARG  39  15.844   8.632   3.664
  274    HE   ARG  39           HE       ARG  39  13.824  10.076   2.419
  275   HH11  ARG  39          1HH1      ARG  39  17.269  10.286   2.874
  276   HH12  ARG  39          2HH1      ARG  39  17.546  11.121   1.382
  277   HH21  ARG  39          1HH2      ARG  39  14.176  11.176   0.452
  278   HH22  ARG  39          2HH2      ARG  39  15.786  11.628   0.005
  279    HA   PRO  40           HA       PRO  40  14.197   3.920   8.583
  280    HB2  PRO  40           1HB      PRO  40  15.116   2.244   6.655
  281    HB3  PRO  40           2HB      PRO  40  13.395   2.495   6.970
  282    HG2  PRO  40           1HG      PRO  40  15.129   3.706   4.852
  283    HG3  PRO  40           2HG      PRO  40  13.482   3.063   4.716
  284    HD2  PRO  40           1HD      PRO  40  14.000   5.714   4.904
  285    HD3  PRO  40           2HD      PRO  40  12.529   4.979   5.572
  286    H    SER  41           H        SER  41  16.155   6.047   6.988
  287    HA   SER  41           HA       SER  41  18.360   6.589   7.149
  288    HB2  SER  41           1HB      SER  41  17.880   5.917   9.589
  289    HB3  SER  41           2HB      SER  41  18.699   4.405   9.198
  290    HG   SER  41           HG       SER  41  20.309   5.671   9.896
  291    H    GLY  42           H        GLY  42  17.551   4.746   5.175
  292    HA2  GLY  42           1HA      GLY  42  19.499   3.969   3.713
  293    HA3  GLY  42           2HA      GLY  42  19.830   2.878   5.051
  294    HA   PRO  43           HA       PRO  43  15.635   1.453   3.082
  295    HB2  PRO  43           1HB      PRO  43  15.024   2.539   0.670
  296    HB3  PRO  43           2HB      PRO  43  14.492   3.241   2.203
  297    HG2  PRO  43           1HG      PRO  43  16.796   4.024   0.459
  298    HG3  PRO  43           2HG      PRO  43  15.623   5.059   1.295
  299    HD2  PRO  43           1HD      PRO  43  18.114   4.610   2.256
  300    HD3  PRO  43           2HD      PRO  43  16.716   4.880   3.316
  301    H    SER  44           H        SER  44  17.054  -0.354   2.856
  302    HA   SER  44           HA       SER  44  18.791  -0.828   0.737
  303    HB2  SER  44           1HB      SER  44  18.353  -2.181   2.934
  304    HB3  SER  44           2HB      SER  44  17.203  -3.074   1.937
  305    HG   SER  44           HG       SER  44  19.998  -2.816   1.601
  306    H    SER  45           H        SER  45  18.254  -0.630  -1.340
  307    HA   SER  45           HA       SER  45  15.827  -2.014  -2.276
  308    HB2  SER  45           1HB      SER  45  15.609  -0.284  -4.025
  309    HB3  SER  45           2HB      SER  45  15.509   0.412  -2.408
  310    HG   SER  45           HG       SER  45  16.905   1.697  -3.497
  311    H    GLY  46           H        GLY  46  16.045  -3.374  -3.971
  312    HA2  GLY  46           1HA      GLY  46  18.175  -3.217  -5.860
  313    HA3  GLY  46           2HA      GLY  46  18.484  -4.466  -4.663
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1  12.638 -18.481   2.379
    2    HA2  GLY   1           1HA      GLY   1  11.748 -19.796   4.679
    3    HA3  GLY   1           2HA      GLY   1  12.462 -18.190   4.648
    4    H    SER   2           H        SER   2   9.380 -19.675   3.630
    5    HA   SER   2           HA       SER   2   7.998 -17.407   4.905
    6    HB2  SER   2           1HB      SER   2   7.430 -18.982   2.426
    7    HB3  SER   2           2HB      SER   2   6.077 -18.288   3.319
    8    HG   SER   2           HG       SER   2   7.508 -16.286   3.212
    9    H    SER   3           H        SER   3   6.039 -17.821   6.034
   10    HA   SER   3           HA       SER   3   5.930 -20.536   7.157
   11    HB2  SER   3           1HB      SER   3   5.340 -17.822   8.265
   12    HB3  SER   3           2HB      SER   3   4.479 -19.211   8.927
   13    HG   SER   3           HG       SER   3   6.870 -18.412   9.573
   14    H    GLY   4           H        GLY   4   4.743 -20.138   4.669
   15    HA2  GLY   4           1HA      GLY   4   2.787 -20.775   3.628
   16    HA3  GLY   4           2HA      GLY   4   2.085 -21.035   5.217
   17    H    SER   5           H        SER   5   0.908 -19.806   2.833
   18    HA   SER   5           HA       SER   5   0.681 -16.989   3.489
   19    HB2  SER   5           1HB      SER   5  -0.604 -18.677   1.332
   20    HB3  SER   5           2HB      SER   5  -0.878 -16.945   1.522
   21    HG   SER   5           HG       SER   5   1.207 -18.238   0.380
   22    H    SER   6           H        SER   6  -1.386 -19.868   3.470
   23    HA   SER   6           HA       SER   6  -3.318 -20.365   4.563
   24    HB2  SER   6           1HB      SER   6  -2.684 -17.979   6.312
   25    HB3  SER   6           2HB      SER   6  -3.738 -19.335   6.711
   26    HG   SER   6           HG       SER   6  -1.270 -19.187   7.324
   27    H    GLY   7           H        GLY   7  -3.623 -18.951   2.247
   28    HA2  GLY   7           1HA      GLY   7  -5.953 -18.266   1.632
   29    HA3  GLY   7           2HA      GLY   7  -5.794 -17.053   2.894
   30    H    THR   8           H        THR   8  -6.090 -17.110  -0.196
   31    HA   THR   8           HA       THR   8  -3.846 -15.986  -1.390
   32    HB   THR   8           HB       THR   8  -6.686 -15.219  -2.072
   33    HG1  THR   8           HG1      THR   8  -6.644 -17.449  -2.044
   34   HG21  THR   8          3HG2      THR   8  -5.513 -15.396  -4.420
   35   HG22  THR   8          1HG2      THR   8  -4.052 -15.123  -3.472
   36   HG23  THR   8          2HG2      THR   8  -5.356 -13.936  -3.444
   37    H    GLY   9           H        GLY   9  -6.565 -14.366   0.236
   38    HA2  GLY   9           1HA      GLY   9  -6.662 -12.316   1.279
   39    HA3  GLY   9           2HA      GLY   9  -4.910 -12.243   1.164
   40    H    GLU  10           H        GLU  10  -7.931 -11.416  -0.365
   41    HA   GLU  10           HA       GLU  10  -6.492  -9.897  -2.426
   42    HB2  GLU  10           1HB      GLU  10  -9.000  -9.639  -3.242
   43    HB3  GLU  10           2HB      GLU  10  -8.057 -11.076  -3.609
   44    HG2  GLU  10           1HG      GLU  10  -9.085 -12.258  -1.763
   45    HG3  GLU  10           2HG      GLU  10  -9.985 -10.811  -1.313
   46    H    LYS  11           H        LYS  11  -6.460  -7.736  -2.414
   47    HA   LYS  11           HA       LYS  11  -8.418  -6.265  -0.818
   48    HB2  LYS  11           1HB      LYS  11  -5.484  -5.632  -0.572
   49    HB3  LYS  11           2HB      LYS  11  -6.812  -5.045   0.420
   50    HG2  LYS  11           1HG      LYS  11  -7.106  -7.546   1.049
   51    HG3  LYS  11           2HG      LYS  11  -5.449  -7.700   0.463
   52    HD2  LYS  11           1HD      LYS  11  -4.587  -6.405   2.152
   53    HD3  LYS  11           2HD      LYS  11  -6.090  -5.507   2.375
   54    HE2  LYS  11           1HE      LYS  11  -6.019  -6.830   4.271
   55    HE3  LYS  11           2HE      LYS  11  -7.034  -7.781   3.188
   56    HZ1  LYS  11           3HZ      LYS  11  -5.006  -8.830   4.477
   57    HZ2  LYS  11           1HZ      LYS  11  -4.156  -8.279   3.122
   58    HZ3  LYS  11           2HZ      LYS  11  -5.445  -9.358   2.931
   59    HA   PRO  12           HA       PRO  12  -8.362  -3.577  -4.303
   60    HB2  PRO  12           1HB      PRO  12  -9.402  -1.351  -3.149
   61    HB3  PRO  12           2HB      PRO  12 -10.373  -2.778  -3.531
   62    HG2  PRO  12           1HG      PRO  12  -9.184  -1.941  -0.914
   63    HG3  PRO  12           2HG      PRO  12 -10.796  -2.598  -1.252
   64    HD2  PRO  12           1HD      PRO  12  -8.783  -4.114  -0.262
   65    HD3  PRO  12           2HD      PRO  12 -10.030  -4.770  -1.343
   66    H    TYR  13           H        TYR  13  -7.302  -2.018  -1.270
   67    HA   TYR  13           HA       TYR  13  -5.454  -0.336  -2.765
   68    HB2  TYR  13           1HB      TYR  13  -5.721  -0.345   0.227
   69    HB3  TYR  13           2HB      TYR  13  -5.266   0.981  -0.838
   70    HD1  TYR  13           HD2      TYR  13  -7.433   0.908  -2.833
   71    HD2  TYR  13           HD1      TYR  13  -7.581   0.437   1.393
   72    HE1  TYR  13           HE2      TYR  13  -9.757   1.713  -2.831
   73    HE2  TYR  13           HE1      TYR  13  -9.905   1.240   1.407
   74    HH   TYR  13           HH       TYR  13 -11.715   1.679  -1.506
   75    H    LYS  14           H        LYS  14  -3.372  -0.787  -3.015
   76    HA   LYS  14           HA       LYS  14  -2.072  -2.614  -1.112
   77    HB2  LYS  14           1HB      LYS  14  -0.762  -3.446  -3.178
   78    HB3  LYS  14           2HB      LYS  14  -2.391  -4.055  -2.917
   79    HG2  LYS  14           1HG      LYS  14  -3.260  -2.474  -4.551
   80    HG3  LYS  14           2HG      LYS  14  -1.636  -1.828  -4.799
   81    HD2  LYS  14           1HD      LYS  14  -2.049  -4.754  -5.137
   82    HD3  LYS  14           2HD      LYS  14  -2.660  -3.677  -6.395
   83    HE2  LYS  14           1HE      LYS  14  -0.423  -2.681  -6.603
   84    HE3  LYS  14           2HE      LYS  14   0.177  -3.790  -5.371
   85    HZ1  LYS  14           3HZ      LYS  14   0.697  -5.033  -7.149
   86    HZ2  LYS  14           1HZ      LYS  14  -0.426  -4.277  -8.164
   87    HZ3  LYS  14           2HZ      LYS  14  -0.930  -5.491  -7.101
   88    H    CYS  15           H        CYS  15   0.046  -2.167  -0.618
   89    HA   CYS  15           HA       CYS  15   0.972   0.486  -1.372
   90    HB2  CYS  15           1HB      CYS  15   0.970  -0.645   1.018
   91    HB3  CYS  15           2HB      CYS  15   2.509  -1.299   0.467
   92    H    GLU  16           H        GLU  16   3.070   0.903  -2.191
   93    HA   GLU  16           HA       GLU  16   4.195  -1.354  -3.711
   94    HB2  GLU  16           1HB      GLU  16   5.003   0.274  -5.326
   95    HB3  GLU  16           2HB      GLU  16   3.270   0.460  -5.097
   96    HG2  GLU  16           1HG      GLU  16   4.002   2.261  -3.347
   97    HG3  GLU  16           2HG      GLU  16   5.495   2.260  -4.284
   98    H    LYS  17           H        LYS  17   4.903   1.284  -1.539
   99    HA   LYS  17           HA       LYS  17   7.690   1.333  -1.711
  100    HB2  LYS  17           1HB      LYS  17   5.740   2.010   0.466
  101    HB3  LYS  17           2HB      LYS  17   7.468   2.064   0.783
  102    HG2  LYS  17           1HG      LYS  17   7.056   4.234   0.187
  103    HG3  LYS  17           2HG      LYS  17   7.526   3.542  -1.367
  104    HD2  LYS  17           1HD      LYS  17   5.367   3.569  -2.181
  105    HD3  LYS  17           2HD      LYS  17   4.648   3.537  -0.570
  106    HE2  LYS  17           1HE      LYS  17   4.935   5.802  -0.254
  107    HE3  LYS  17           2HE      LYS  17   6.270   5.900  -1.401
  108    HZ1  LYS  17           3HZ      LYS  17   3.977   5.081  -2.782
  109    HZ2  LYS  17           1HZ      LYS  17   4.843   6.525  -2.952
  110    HZ3  LYS  17           2HZ      LYS  17   3.562   6.432  -1.851
  111    H    CYS  18           H        CYS  18   5.538  -0.718   0.197
  112    HA   CYS  18           HA       CYS  18   7.879  -2.314   1.005
  113    HB2  CYS  18           1HB      CYS  18   6.483  -3.117   2.890
  114    HB3  CYS  18           2HB      CYS  18   6.738  -1.375   2.931
  115    H    GLY  19           H        GLY  19   4.474  -2.526   0.010
  116    HA2  GLY  19           1HA      GLY  19   3.812  -4.048  -1.732
  117    HA3  GLY  19           2HA      GLY  19   5.105  -5.125  -1.224
  118    H    LYS  20           H        LYS  20   2.469  -3.505   0.542
  119    HA   LYS  20           HA       LYS  20   1.571  -6.166   1.433
  120    HB2  LYS  20           1HB      LYS  20   2.774  -4.516   3.114
  121    HB3  LYS  20           2HB      LYS  20   1.182  -3.771   3.175
  122    HG2  LYS  20           1HG      LYS  20   1.380  -6.713   3.547
  123    HG3  LYS  20           2HG      LYS  20   1.885  -5.655   4.867
  124    HD2  LYS  20           1HD      LYS  20  -0.429  -4.484   4.314
  125    HD3  LYS  20           2HD      LYS  20  -0.815  -6.093   3.699
  126    HE2  LYS  20           1HE      LYS  20   0.149  -6.891   5.985
  127    HE3  LYS  20           2HE      LYS  20  -0.160  -5.229   6.486
  128    HZ1  LYS  20           3HZ      LYS  20  -1.967  -7.160   6.657
  129    HZ2  LYS  20           1HZ      LYS  20  -2.336  -6.579   5.111
  130    HZ3  LYS  20           2HZ      LYS  20  -2.377  -5.533   6.440
  131    H    GLY  21           H        GLY  21  -0.675  -6.414   1.822
  132    HA2  GLY  21           1HA      GLY  21  -2.297  -4.649   0.154
  133    HA3  GLY  21           2HA      GLY  21  -2.775  -6.222   0.777
  134    H    TYR  22           H        TYR  22  -4.288  -3.759   0.836
  135    HA   TYR  22           HA       TYR  22  -4.834  -3.704   3.699
  136    HB2  TYR  22           1HB      TYR  22  -4.394  -1.173   2.101
  137    HB3  TYR  22           2HB      TYR  22  -4.899  -1.259   3.785
  138    HD1  TYR  22           HD2      TYR  22  -2.105  -2.180   1.506
  139    HD2  TYR  22           HD1      TYR  22  -3.303  -1.286   5.489
  140    HE1  TYR  22           HE2      TYR  22   0.253  -2.169   2.206
  141    HE2  TYR  22           HE1      TYR  22  -0.949  -1.271   6.200
  142    HH   TYR  22           HH       TYR  22   1.167  -1.905   5.579
  143    H    ASN  23           H        ASN  23  -6.963  -3.364   4.195
  144    HA   ASN  23           HA       ASN  23  -8.811  -3.412   1.937
  145    HB2  ASN  23           1HB      ASN  23  -8.940  -4.234   4.798
  146    HB3  ASN  23           2HB      ASN  23 -10.444  -3.750   4.020
  147   HD21  ASN  23          1HD2      ASN  23 -10.765  -4.780   1.807
  148   HD22  ASN  23          2HD2      ASN  23 -10.412  -6.468   1.700
  149    H    SER  24           H        SER  24  -8.020  -1.484   4.772
  150    HA   SER  24           HA       SER  24 -10.174   0.389   4.260
  151    HB2  SER  24           1HB      SER  24  -7.973   0.318   6.331
  152    HB3  SER  24           2HB      SER  24  -9.153   1.623   6.216
  153    HG   SER  24           HG       SER  24 -10.394   0.389   7.362
  154    H    LYS  25           H        LYS  25  -9.932   2.516   3.597
  155    HA   LYS  25           HA       LYS  25  -7.661   3.006   1.884
  156    HB2  LYS  25           1HB      LYS  25 -10.188   3.615   1.513
  157    HB3  LYS  25           2HB      LYS  25  -9.776   5.052   2.439
  158    HG2  LYS  25           1HG      LYS  25  -8.193   4.221   0.032
  159    HG3  LYS  25           2HG      LYS  25  -9.656   5.201  -0.101
  160    HD2  LYS  25           1HD      LYS  25  -8.422   6.624   1.765
  161    HD3  LYS  25           2HD      LYS  25  -6.994   5.891   1.030
  162    HE2  LYS  25           1HE      LYS  25  -9.120   7.333  -0.542
  163    HE3  LYS  25           2HE      LYS  25  -7.675   8.123   0.088
  164    HZ1  LYS  25           3HZ      LYS  25  -7.658   7.234  -2.306
  165    HZ2  LYS  25           1HZ      LYS  25  -7.444   5.714  -1.594
  166    HZ3  LYS  25           2HZ      LYS  25  -6.309   6.940  -1.329
  167    H    PHE  26           H        PHE  26  -9.179   4.770   4.588
  168    HA   PHE  26           HA       PHE  26  -7.196   6.714   4.871
  169    HB2  PHE  26           1HB      PHE  26  -9.540   6.569   5.954
  170    HB3  PHE  26           2HB      PHE  26  -8.741   5.635   7.215
  171    HD1  PHE  26           HD1      PHE  26  -6.970   6.683   8.589
  172    HD2  PHE  26           HD2      PHE  26  -9.302   8.920   5.819
  173    HE1  PHE  26           HE1      PHE  26  -6.284   8.768   9.701
  174    HE2  PHE  26           HE2      PHE  26  -8.620  11.008   6.925
  175    HZ   PHE  26           HZ       PHE  26  -7.108  10.935   8.868
  176    H    ASN  27           H        ASN  27  -7.482   3.495   6.288
  177    HA   ASN  27           HA       ASN  27  -5.410   3.627   8.141
  178    HB2  ASN  27           1HB      ASN  27  -7.051   1.757   7.930
  179    HB3  ASN  27           2HB      ASN  27  -6.188   1.210   6.495
  180   HD21  ASN  27          1HD2      ASN  27  -6.387   1.083   9.856
  181   HD22  ASN  27          2HD2      ASN  27  -4.926   0.212  10.159
  182    H    LEU  28           H        LEU  28  -5.328   2.883   4.687
  183    HA   LEU  28           HA       LEU  28  -2.611   2.151   4.548
  184    HB2  LEU  28           1HB      LEU  28  -4.107   1.592   2.764
  185    HB3  LEU  28           2HB      LEU  28  -4.481   3.291   2.481
  186    HG   LEU  28           HG       LEU  28  -1.888   3.411   1.975
  187   HD11  LEU  28          1HD1      LEU  28  -1.673   0.956   2.595
  188   HD12  LEU  28          2HD1      LEU  28  -0.952   1.459   1.067
  189   HD13  LEU  28          3HD1      LEU  28  -2.499   0.612   1.075
  190   HD21  LEU  28          3HD2      LEU  28  -4.002   2.363   0.100
  191   HD22  LEU  28          1HD2      LEU  28  -2.431   2.981  -0.410
  192   HD23  LEU  28          2HD2      LEU  28  -3.580   4.050   0.396
  193    H    ASP  29           H        ASP  29  -4.144   5.211   3.531
  194    HA   ASP  29           HA       ASP  29  -2.037   6.739   2.880
  195    HB2  ASP  29           1HB      ASP  29  -3.994   7.934   2.768
  196    HB3  ASP  29           2HB      ASP  29  -4.562   7.356   4.332
  197    H    MET  30           H        MET  30  -3.136   6.300   6.242
  198    HA   MET  30           HA       MET  30  -1.137   7.790   7.481
  199    HB2  MET  30           1HB      MET  30  -2.610   5.354   8.497
  200    HB3  MET  30           2HB      MET  30  -1.638   6.422   9.500
  201    HG2  MET  30           1HG      MET  30  -3.238   8.252   8.459
  202    HG3  MET  30           2HG      MET  30  -4.303   6.859   8.284
  203    HE1  MET  30           3HE      MET  30  -4.282   9.753  10.419
  204    HE2  MET  30           1HE      MET  30  -3.542   9.301  11.955
  205    HE3  MET  30           2HE      MET  30  -2.565   9.352  10.487
  206    H    HIS  31           H        HIS  31  -1.173   4.395   6.502
  207    HA   HIS  31           HA       HIS  31   1.274   3.662   7.695
  208    HB2  HIS  31           1HB      HIS  31  -0.080   1.864   7.053
  209    HB3  HIS  31           2HB      HIS  31  -0.372   2.532   5.450
  210    HD1  HIS  31           HD1      HIS  31   2.675   1.294   7.383
  211    HD2  HIS  31           HD2      HIS  31   1.027   1.206   3.569
  212    HE1  HIS  31           HE1      HIS  31   4.251  -0.095   6.001
  213    H    GLN  32           H        GLN  32   0.477   4.961   4.507
  214    HA   GLN  32           HA       GLN  32   2.867   4.662   3.187
  215    HB2  GLN  32           1HB      GLN  32   0.851   6.897   3.119
  216    HB3  GLN  32           2HB      GLN  32   2.254   6.880   2.060
  217    HG2  GLN  32           1HG      GLN  32   0.480   4.492   2.152
  218    HG3  GLN  32           2HG      GLN  32  -0.041   5.923   1.264
  219   HE21  GLN  32          1HE2      GLN  32   0.442   3.442   0.075
  220   HE22  GLN  32          2HE2      GLN  32   1.796   3.597  -0.986
  221    H    LYS  33           H        LYS  33   1.943   7.305   5.376
  222    HA   LYS  33           HA       LYS  33   4.104   8.954   5.207
  223    HB2  LYS  33           1HB      LYS  33   2.455   8.123   7.581
  224    HB3  LYS  33           2HB      LYS  33   3.755   9.296   7.744
  225    HG2  LYS  33           1HG      LYS  33   2.631  10.647   5.955
  226    HG3  LYS  33           2HG      LYS  33   1.266   9.534   6.075
  227    HD2  LYS  33           1HD      LYS  33   2.323  10.829   8.549
  228    HD3  LYS  33           2HD      LYS  33   1.295  11.760   7.457
  229    HE2  LYS  33           1HE      LYS  33   0.466   9.034   8.376
  230    HE3  LYS  33           2HE      LYS  33   0.213  10.440   9.409
  231    HZ1  LYS  33           3HZ      LYS  33  -0.837  11.400   7.234
  232    HZ2  LYS  33           1HZ      LYS  33  -1.738  10.397   8.256
  233    HZ3  LYS  33           2HZ      LYS  33  -1.044   9.766   6.849
  234    H    VAL  34           H        VAL  34   3.896   5.930   7.033
  235    HA   VAL  34           HA       VAL  34   6.230   5.962   8.459
  236    HB   VAL  34           HB       VAL  34   5.124   3.587   6.955
  237   HG11  VAL  34          1HG1      VAL  34   6.934   3.695   9.366
  238   HG12  VAL  34          2HG1      VAL  34   6.276   2.235   8.624
  239   HG13  VAL  34          3HG1      VAL  34   7.420   3.241   7.733
  240   HG21  VAL  34          3HG2      VAL  34   4.417   4.870   9.561
  241   HG22  VAL  34          1HG2      VAL  34   3.360   4.254   8.290
  242   HG23  VAL  34          2HG2      VAL  34   4.212   3.131   9.351
  243    H    HIS  35           H        HIS  35   5.825   5.382   5.015
  244    HA   HIS  35           HA       HIS  35   8.571   4.649   4.592
  245    HB2  HIS  35           1HB      HIS  35   6.470   5.470   2.576
  246    HB3  HIS  35           2HB      HIS  35   8.003   4.682   2.215
  247    HD1  HIS  35           HD1      HIS  35   7.947   2.450   4.330
  248    HD2  HIS  35           HD2      HIS  35   4.703   3.496   1.954
  249    HE1  HIS  35           HE1      HIS  35   6.474   0.413   4.269
  250    H    THR  36           H        THR  36   6.772   7.290   3.034
  251    HA   THR  36           HA       THR  36   8.918   8.838   2.309
  252    HB   THR  36           HB       THR  36   6.511   9.232   1.676
  253    HG1  THR  36           HG1      THR  36   8.008  10.790   1.095
  254   HG21  THR  36          3HG2      THR  36   6.027   9.399   4.325
  255   HG22  THR  36          1HG2      THR  36   4.989  10.122   3.098
  256   HG23  THR  36          2HG2      THR  36   6.188  11.110   3.931
  257    H    GLY  37           H        GLY  37  10.176  10.401   3.236
  258    HA2  GLY  37           1HA      GLY  37  10.134  12.057   5.204
  259    HA3  GLY  37           2HA      GLY  37   9.997  10.595   6.169
  260    H    GLU  38           H        GLU  38  11.765   9.031   6.029
  261    HA   GLU  38           HA       GLU  38  14.298  10.370   6.157
  262    HB2  GLU  38           1HB      GLU  38  13.515   8.446   7.639
  263    HB3  GLU  38           2HB      GLU  38  13.850   7.392   6.273
  264    HG2  GLU  38           1HG      GLU  38  15.682   7.458   7.908
  265    HG3  GLU  38           2HG      GLU  38  16.174   8.001   6.304
  266    H    ARG  39           H        ARG  39  15.032  11.032   4.200
  267    HA   ARG  39           HA       ARG  39  14.766  10.141   1.714
  268    HB2  ARG  39           1HB      ARG  39  17.439  10.848   2.940
  269    HB3  ARG  39           2HB      ARG  39  17.080  10.840   1.219
  270    HG2  ARG  39           1HG      ARG  39  15.559  12.551   3.159
  271    HG3  ARG  39           2HG      ARG  39  17.060  13.085   2.399
  272    HD2  ARG  39           1HD      ARG  39  14.620  12.149   0.895
  273    HD3  ARG  39           2HD      ARG  39  15.002  13.839   1.220
  274    HE   ARG  39           HE       ARG  39  17.230  12.777  -0.010
  275   HH11  ARG  39          1HH1      ARG  39  13.866  13.221  -0.788
  276   HH12  ARG  39          2HH1      ARG  39  14.145  13.373  -2.491
  277   HH21  ARG  39          1HH2      ARG  39  17.610  12.976  -2.251
  278   HH22  ARG  39          2HH2      ARG  39  16.275  13.233  -3.322
  279    HA   PRO  40           HA       PRO  40  15.988   5.806   2.333
  280    HB2  PRO  40           1HB      PRO  40  14.578   4.891   0.202
  281    HB3  PRO  40           2HB      PRO  40  13.844   5.195   1.781
  282    HG2  PRO  40           1HG      PRO  40  13.845   6.915  -0.670
  283    HG3  PRO  40           2HG      PRO  40  12.514   6.559   0.446
  284    HD2  PRO  40           1HD      PRO  40  13.926   8.867   0.552
  285    HD3  PRO  40           2HD      PRO  40  13.235   8.103   1.998
  286    H    SER  41           H        SER  41  18.170   6.257   1.757
  287    HA   SER  41           HA       SER  41  18.816   6.439  -1.079
  288    HB2  SER  41           1HB      SER  41  20.350   6.822   1.465
  289    HB3  SER  41           2HB      SER  41  21.226   6.484  -0.027
  290    HG   SER  41           HG       SER  41  20.349   8.323  -0.935
  291    H    GLY  42           H        GLY  42  17.646   4.059  -0.630
  292    HA2  GLY  42           1HA      GLY  42  18.733   2.071  -1.777
  293    HA3  GLY  42           2HA      GLY  42  19.875   2.133  -0.443
  294    HA   PRO  43           HA       PRO  43  15.797  -0.251   0.524
  295    HB2  PRO  43           1HB      PRO  43  16.392  -2.738  -0.389
  296    HB3  PRO  43           2HB      PRO  43  15.547  -1.532  -1.367
  297    HG2  PRO  43           1HG      PRO  43  18.441  -2.298  -1.389
  298    HG3  PRO  43           2HG      PRO  43  17.356  -1.985  -2.756
  299    HD2  PRO  43           1HD      PRO  43  19.132  -0.150  -1.856
  300    HD3  PRO  43           2HD      PRO  43  17.567   0.302  -2.563
  301    H    SER  44           H        SER  44  15.619  -1.578   2.329
  302    HA   SER  44           HA       SER  44  17.959  -1.770   3.964
  303    HB2  SER  44           1HB      SER  44  15.565  -1.319   4.752
  304    HB3  SER  44           2HB      SER  44  15.291  -3.050   4.557
  305    HG   SER  44           HG       SER  44  16.884  -3.444   6.084
  306    H    SER  45           H        SER  45  15.821  -4.128   2.392
  307    HA   SER  45           HA       SER  45  17.507  -6.337   3.211
  308    HB2  SER  45           1HB      SER  45  14.914  -6.336   2.937
  309    HB3  SER  45           2HB      SER  45  15.264  -6.572   1.225
  310    HG   SER  45           HG       SER  45  15.637  -8.292   3.377
  311    H    GLY  46           H        GLY  46  16.494  -4.860   0.129
  312    HA2  GLY  46           1HA      GLY  46  18.424  -4.436  -1.424
  313    HA3  GLY  46           2HA      GLY  46  18.864  -6.110  -1.119
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1   6.231   1.458  -8.943
    2    HA2  GLY   1           1HA      GLY   1   5.262   1.511 -11.482
    3    HA3  GLY   1           2HA      GLY   1   6.619   2.627 -11.548
    4    H    SER   2           H        SER   2   5.794  -0.672 -10.506
    5    HA   SER   2           HA       SER   2   8.303  -1.597 -11.697
    6    HB2  SER   2           1HB      SER   2   8.343  -1.215  -9.077
    7    HB3  SER   2           2HB      SER   2   7.515  -2.772  -9.064
    8    HG   SER   2           HG       SER   2   9.262  -3.729  -9.929
    9    H    SER   3           H        SER   3   8.347  -4.078 -11.700
   10    HA   SER   3           HA       SER   3   5.949  -4.972 -12.982
   11    HB2  SER   3           1HB      SER   3   8.574  -6.308 -12.327
   12    HB3  SER   3           2HB      SER   3   7.240  -7.183 -13.080
   13    HG   SER   3           HG       SER   3   7.516  -6.084 -14.892
   14    H    GLY   4           H        GLY   4   7.728  -6.125 -10.107
   15    HA2  GLY   4           1HA      GLY   4   7.003  -7.213  -8.221
   16    HA3  GLY   4           2HA      GLY   4   5.456  -6.425  -8.492
   17    H    SER   5           H        SER   5   4.277  -8.227  -7.829
   18    HA   SER   5           HA       SER   5   4.502 -10.608  -9.543
   19    HB2  SER   5           1HB      SER   5   3.365 -11.834  -7.757
   20    HB3  SER   5           2HB      SER   5   4.789 -11.012  -7.120
   21    HG   SER   5           HG       SER   5   2.323 -10.815  -6.254
   22    H    SER   6           H        SER   6   2.380 -11.757  -9.915
   23    HA   SER   6           HA       SER   6   0.646 -10.129 -11.366
   24    HB2  SER   6           1HB      SER   6  -0.714 -12.065 -11.674
   25    HB3  SER   6           2HB      SER   6   0.950 -12.641 -11.578
   26    HG   SER   6           HG       SER   6  -1.142 -12.906  -9.738
   27    H    GLY   7           H        GLY   7  -1.493  -9.439 -10.999
   28    HA2  GLY   7           1HA      GLY   7  -1.976  -8.487  -8.350
   29    HA3  GLY   7           2HA      GLY   7  -3.046  -8.304  -9.732
   30    H    THR   8           H        THR   8  -1.874 -10.859  -7.540
   31    HA   THR   8           HA       THR   8  -4.353 -12.326  -7.848
   32    HB   THR   8           HB       THR   8  -2.261 -13.581  -7.685
   33    HG1  THR   8           HG1      THR   8  -4.296 -13.870  -5.787
   34   HG21  THR   8          3HG2      THR   8  -2.072 -12.527  -4.862
   35   HG22  THR   8          1HG2      THR   8  -1.070 -11.982  -6.207
   36   HG23  THR   8          2HG2      THR   8  -0.963 -13.651  -5.646
   37    H    GLY   9           H        GLY   9  -2.612 -10.687  -5.209
   38    HA2  GLY   9           1HA      GLY   9  -4.095 -11.105  -3.026
   39    HA3  GLY   9           2HA      GLY   9  -3.531  -9.492  -3.437
   40    H    GLU  10           H        GLU  10  -6.075 -10.708  -2.204
   41    HA   GLU  10           HA       GLU  10  -8.054  -9.570  -4.042
   42    HB2  GLU  10           1HB      GLU  10  -8.292 -11.383  -1.648
   43    HB3  GLU  10           2HB      GLU  10  -9.691 -10.605  -2.374
   44    HG2  GLU  10           1HG      GLU  10  -9.744 -12.600  -3.457
   45    HG3  GLU  10           2HG      GLU  10  -8.739 -11.678  -4.573
   46    H    LYS  11           H        LYS  11  -6.800  -7.504  -3.239
   47    HA   LYS  11           HA       LYS  11  -8.485  -6.320  -1.150
   48    HB2  LYS  11           1HB      LYS  11  -6.458  -5.068  -0.326
   49    HB3  LYS  11           2HB      LYS  11  -6.472  -6.789   0.033
   50    HG2  LYS  11           1HG      LYS  11  -5.097  -5.837  -2.431
   51    HG3  LYS  11           2HG      LYS  11  -4.312  -5.627  -0.864
   52    HD2  LYS  11           1HD      LYS  11  -4.867  -8.132  -0.520
   53    HD3  LYS  11           2HD      LYS  11  -5.082  -8.159  -2.272
   54    HE2  LYS  11           1HE      LYS  11  -2.598  -7.326  -0.777
   55    HE3  LYS  11           2HE      LYS  11  -2.821  -8.819  -1.688
   56    HZ1  LYS  11           3HZ      LYS  11  -1.636  -6.770  -2.753
   57    HZ2  LYS  11           1HZ      LYS  11  -3.220  -6.261  -3.065
   58    HZ3  LYS  11           2HZ      LYS  11  -2.671  -7.739  -3.677
   59    HA   PRO  12           HA       PRO  12  -8.983  -3.115  -4.131
   60    HB2  PRO  12           1HB      PRO  12  -9.861  -1.147  -2.479
   61    HB3  PRO  12           2HB      PRO  12 -10.865  -2.523  -2.953
   62    HG2  PRO  12           1HG      PRO  12  -9.310  -2.091  -0.431
   63    HG3  PRO  12           2HG      PRO  12 -10.948  -2.738  -0.639
   64    HD2  PRO  12           1HD      PRO  12  -8.797  -4.328  -0.220
   65    HD3  PRO  12           2HD      PRO  12 -10.184  -4.837  -1.205
   66    H    TYR  13           H        TYR  13  -7.193  -2.436  -1.154
   67    HA   TYR  13           HA       TYR  13  -5.668  -0.367  -2.586
   68    HB2  TYR  13           1HB      TYR  13  -5.914  -0.848   0.391
   69    HB3  TYR  13           2HB      TYR  13  -5.002   0.453  -0.365
   70    HD1  TYR  13           HD2      TYR  13  -6.213   2.258  -1.583
   71    HD2  TYR  13           HD1      TYR  13  -8.271  -0.693   0.689
   72    HE1  TYR  13           HE2      TYR  13  -8.218   3.681  -1.562
   73    HE2  TYR  13           HE1      TYR  13 -10.282   0.722   0.716
   74    HH   TYR  13           HH       TYR  13 -10.257   3.969  -0.130
   75    H    LYS  14           H        LYS  14  -3.333  -0.200  -1.831
   76    HA   LYS  14           HA       LYS  14  -2.002  -2.491  -0.827
   77    HB2  LYS  14           1HB      LYS  14  -0.918  -3.304  -2.813
   78    HB3  LYS  14           2HB      LYS  14  -2.656  -3.333  -3.083
   79    HG2  LYS  14           1HG      LYS  14  -2.444  -1.183  -4.308
   80    HG3  LYS  14           2HG      LYS  14  -0.691  -1.311  -4.137
   81    HD2  LYS  14           1HD      LYS  14  -1.021  -3.655  -5.211
   82    HD3  LYS  14           2HD      LYS  14  -2.568  -2.997  -5.749
   83    HE2  LYS  14           1HE      LYS  14  -1.424  -1.171  -6.871
   84    HE3  LYS  14           2HE      LYS  14   0.130  -1.754  -6.279
   85    HZ1  LYS  14           3HZ      LYS  14  -0.166  -2.463  -8.529
   86    HZ2  LYS  14           1HZ      LYS  14  -1.677  -3.141  -8.182
   87    HZ3  LYS  14           2HZ      LYS  14  -0.275  -3.826  -7.532
   88    H    CYS  15           H        CYS  15   0.431  -2.295  -1.172
   89    HA   CYS  15           HA       CYS  15   1.208   0.535  -1.419
   90    HB2  CYS  15           1HB      CYS  15   1.118  -0.087   0.956
   91    HB3  CYS  15           2HB      CYS  15   2.209  -1.434   0.649
   92    H    GLU  16           H        GLU  16   3.017   0.945  -2.570
   93    HA   GLU  16           HA       GLU  16   4.438  -1.382  -3.677
   94    HB2  GLU  16           1HB      GLU  16   3.980   1.389  -4.777
   95    HB3  GLU  16           2HB      GLU  16   5.134   0.265  -5.480
   96    HG2  GLU  16           1HG      GLU  16   2.251  -0.459  -5.100
   97    HG3  GLU  16           2HG      GLU  16   2.822   0.399  -6.531
   98    H    LYS  17           H        LYS  17   5.001  -0.103  -1.099
   99    HA   LYS  17           HA       LYS  17   7.723   0.890  -1.643
  100    HB2  LYS  17           1HB      LYS  17   5.810   1.540   0.598
  101    HB3  LYS  17           2HB      LYS  17   7.525   1.926   0.673
  102    HG2  LYS  17           1HG      LYS  17   6.480   3.893  -0.043
  103    HG3  LYS  17           2HG      LYS  17   7.186   3.190  -1.501
  104    HD2  LYS  17           1HD      LYS  17   5.049   2.327  -2.185
  105    HD3  LYS  17           2HD      LYS  17   4.312   2.822  -0.659
  106    HE2  LYS  17           1HE      LYS  17   3.669   4.478  -2.182
  107    HE3  LYS  17           2HE      LYS  17   5.016   5.195  -1.300
  108    HZ1  LYS  17           3HZ      LYS  17   6.176   5.387  -3.165
  109    HZ2  LYS  17           1HZ      LYS  17   4.782   4.956  -4.022
  110    HZ3  LYS  17           2HZ      LYS  17   5.913   3.773  -3.597
  111    H    CYS  18           H        CYS  18   5.737  -1.099   0.508
  112    HA   CYS  18           HA       CYS  18   8.192  -2.473   1.387
  113    HB2  CYS  18           1HB      CYS  18   6.802  -3.187   3.373
  114    HB3  CYS  18           2HB      CYS  18   7.172  -1.468   3.293
  115    H    GLY  19           H        GLY  19   4.731  -3.009   0.722
  116    HA2  GLY  19           1HA      GLY  19   4.231  -4.757  -0.957
  117    HA3  GLY  19           2HA      GLY  19   5.449  -5.739  -0.156
  118    H    LYS  20           H        LYS  20   2.482  -3.945   0.682
  119    HA   LYS  20           HA       LYS  20   1.476  -6.346   2.013
  120    HB2  LYS  20           1HB      LYS  20   1.572  -3.630   3.339
  121    HB3  LYS  20           2HB      LYS  20   0.806  -5.068   4.001
  122    HG2  LYS  20           1HG      LYS  20   3.147  -6.132   3.795
  123    HG3  LYS  20           2HG      LYS  20   3.715  -4.465   3.666
  124    HD2  LYS  20           1HD      LYS  20   2.508  -3.972   5.798
  125    HD3  LYS  20           2HD      LYS  20   2.166  -5.698   5.941
  126    HE2  LYS  20           1HE      LYS  20   4.934  -4.523   5.721
  127    HE3  LYS  20           2HE      LYS  20   4.149  -4.934   7.245
  128    HZ1  LYS  20           3HZ      LYS  20   4.614  -7.078   6.968
  129    HZ2  LYS  20           1HZ      LYS  20   5.675  -6.604   5.739
  130    HZ3  LYS  20           2HZ      LYS  20   4.100  -7.087   5.356
  131    H    GLY  21           H        GLY  21  -0.824  -6.334   2.354
  132    HA2  GLY  21           1HA      GLY  21  -2.198  -4.481   0.510
  133    HA3  GLY  21           2HA      GLY  21  -2.718  -6.128   0.834
  134    H    TYR  22           H        TYR  22  -3.834  -3.246   1.209
  135    HA   TYR  22           HA       TYR  22  -4.800  -3.693   3.958
  136    HB2  TYR  22           1HB      TYR  22  -4.605  -0.999   2.612
  137    HB3  TYR  22           2HB      TYR  22  -4.922  -1.335   4.310
  138    HD1  TYR  22           HD1      TYR  22  -2.754  -3.493   4.601
  139    HD2  TYR  22           HD2      TYR  22  -2.713   0.419   2.929
  140    HE1  TYR  22           HE1      TYR  22  -0.349  -3.317   5.087
  141    HE2  TYR  22           HE2      TYR  22  -0.308   0.605   3.409
  142    HH   TYR  22           HH       TYR  22   1.514  -2.112   4.751
  143    H    ASN  23           H        ASN  23  -6.985  -3.215   4.389
  144    HA   ASN  23           HA       ASN  23  -8.701  -3.454   2.035
  145    HB2  ASN  23           1HB      ASN  23  -8.836  -4.968   4.136
  146    HB3  ASN  23           2HB      ASN  23  -9.654  -3.600   4.883
  147   HD21  ASN  23          1HD2      ASN  23 -10.131  -6.411   3.290
  148   HD22  ASN  23          2HD2      ASN  23 -11.702  -6.118   2.634
  149    H    SER  24           H        SER  24  -8.471  -1.523   5.016
  150    HA   SER  24           HA       SER  24 -10.500   0.318   4.173
  151    HB2  SER  24           1HB      SER  24 -10.140   1.428   6.225
  152    HB3  SER  24           2HB      SER  24  -9.834  -0.270   6.586
  153    HG   SER  24           HG       SER  24  -8.201   1.085   7.433
  154    H    LYS  25           H        LYS  25 -10.055   2.692   4.058
  155    HA   LYS  25           HA       LYS  25  -7.886   3.146   2.185
  156    HB2  LYS  25           1HB      LYS  25 -10.270   4.005   1.895
  157    HB3  LYS  25           2HB      LYS  25  -9.895   5.176   3.153
  158    HG2  LYS  25           1HG      LYS  25  -8.045   4.984   0.841
  159    HG3  LYS  25           2HG      LYS  25  -9.622   5.737   0.588
  160    HD2  LYS  25           1HD      LYS  25  -8.097   6.586   2.981
  161    HD3  LYS  25           2HD      LYS  25  -7.473   7.101   1.413
  162    HE2  LYS  25           1HE      LYS  25  -8.898   8.828   1.780
  163    HE3  LYS  25           2HE      LYS  25 -10.045   7.705   1.051
  164    HZ1  LYS  25           3HZ      LYS  25 -11.139   8.373   2.943
  165    HZ2  LYS  25           1HZ      LYS  25  -9.732   8.458   3.878
  166    HZ3  LYS  25           2HZ      LYS  25 -10.395   6.953   3.484
  167    H    PHE  26           H        PHE  26  -9.061   4.748   5.150
  168    HA   PHE  26           HA       PHE  26  -7.085   6.559   5.583
  169    HB2  PHE  26           1HB      PHE  26  -8.790   6.607   7.165
  170    HB3  PHE  26           2HB      PHE  26  -8.690   4.876   7.473
  171    HD1  PHE  26           HD2      PHE  26  -6.207   7.660   7.595
  172    HD2  PHE  26           HD1      PHE  26  -8.132   4.473   9.656
  173    HE1  PHE  26           HE2      PHE  26  -4.807   8.097   9.571
  174    HE2  PHE  26           HE1      PHE  26  -6.736   4.905  11.636
  175    HZ   PHE  26           HZ       PHE  26  -5.070   6.718  11.594
  176    H    ASN  27           H        ASN  27  -7.005   3.209   6.806
  177    HA   ASN  27           HA       ASN  27  -4.590   3.107   8.013
  178    HB2  ASN  27           1HB      ASN  27  -6.185   1.190   7.703
  179    HB3  ASN  27           2HB      ASN  27  -5.529   0.978   6.083
  180   HD21  ASN  27          1HD2      ASN  27  -5.010  -1.169   6.857
  181   HD22  ASN  27          2HD2      ASN  27  -3.548  -1.416   7.745
  182    H    LEU  28           H        LEU  28  -5.006   2.384   4.541
  183    HA   LEU  28           HA       LEU  28  -2.357   2.174   3.834
  184    HB2  LEU  28           1HB      LEU  28  -4.186   1.658   2.321
  185    HB3  LEU  28           2HB      LEU  28  -4.615   3.365   2.231
  186    HG   LEU  28           HG       LEU  28  -2.345   3.757   1.193
  187   HD11  LEU  28          1HD1      LEU  28  -2.398   0.760   0.880
  188   HD12  LEU  28          2HD1      LEU  28  -1.329   1.647   1.966
  189   HD13  LEU  28          3HD1      LEU  28  -1.197   1.871   0.221
  190   HD21  LEU  28          3HD2      LEU  28  -3.196   2.371  -0.960
  191   HD22  LEU  28          1HD2      LEU  28  -3.879   3.914  -0.448
  192   HD23  LEU  28          2HD2      LEU  28  -4.675   2.406   0.002
  193    H    ASP  29           H        ASP  29  -4.258   5.074   4.362
  194    HA   ASP  29           HA       ASP  29  -2.353   6.898   3.292
  195    HB2  ASP  29           1HB      ASP  29  -4.849   7.301   3.722
  196    HB3  ASP  29           2HB      ASP  29  -4.396   7.568   5.403
  197    H    MET  30           H        MET  30  -3.203   6.008   6.638
  198    HA   MET  30           HA       MET  30  -1.202   7.550   7.871
  199    HB2  MET  30           1HB      MET  30  -1.905   6.617   9.842
  200    HB3  MET  30           2HB      MET  30  -3.300   6.256   8.835
  201    HG2  MET  30           1HG      MET  30  -2.544   4.005   8.496
  202    HG3  MET  30           2HG      MET  30  -1.035   4.344   9.340
  203    HE1  MET  30           3HE      MET  30  -0.764   3.450  11.782
  204    HE2  MET  30           1HE      MET  30  -0.980   5.200  11.819
  205    HE3  MET  30           2HE      MET  30  -1.817   4.184  12.993
  206    H    HIS  31           H        HIS  31  -1.120   4.455   6.315
  207    HA   HIS  31           HA       HIS  31   1.379   3.632   7.485
  208    HB2  HIS  31           1HB      HIS  31   0.013   1.832   6.848
  209    HB3  HIS  31           2HB      HIS  31  -0.374   2.558   5.291
  210    HD1  HIS  31           HD1      HIS  31   2.470   0.828   7.080
  211    HD2  HIS  31           HD2      HIS  31   1.281   1.832   3.228
  212    HE1  HIS  31           HE1      HIS  31   4.087  -0.342   5.550
  213    H    GLN  32           H        GLN  32   0.319   5.039   4.421
  214    HA   GLN  32           HA       GLN  32   2.634   4.886   2.942
  215    HB2  GLN  32           1HB      GLN  32   0.359   6.801   3.040
  216    HB3  GLN  32           2HB      GLN  32   1.787   7.286   2.134
  217    HG2  GLN  32           1HG      GLN  32   0.471   4.636   1.673
  218    HG3  GLN  32           2HG      GLN  32  -0.101   6.104   0.881
  219   HE21  GLN  32          1HE2      GLN  32   0.475   5.728  -1.174
  220   HE22  GLN  32          2HE2      GLN  32   2.095   5.461  -1.709
  221    H    LYS  33           H        LYS  33   1.709   7.489   5.189
  222    HA   LYS  33           HA       LYS  33   3.775   9.218   4.974
  223    HB2  LYS  33           1HB      LYS  33   3.313   9.959   7.140
  224    HB3  LYS  33           2HB      LYS  33   1.807   9.199   6.642
  225    HG2  LYS  33           1HG      LYS  33   2.670   7.108   7.817
  226    HG3  LYS  33           2HG      LYS  33   3.881   8.166   8.545
  227    HD2  LYS  33           1HD      LYS  33   2.103   9.567   9.471
  228    HD3  LYS  33           2HD      LYS  33   0.889   8.520   8.733
  229    HE2  LYS  33           1HE      LYS  33   0.989   7.752  10.922
  230    HE3  LYS  33           2HE      LYS  33   2.038   6.630  10.057
  231    HZ1  LYS  33           3HZ      LYS  33   3.918   8.142  10.750
  232    HZ2  LYS  33           1HZ      LYS  33   3.198   7.235  11.984
  233    HZ3  LYS  33           2HZ      LYS  33   2.827   8.877  11.814
  234    H    VAL  34           H        VAL  34   3.886   6.034   6.438
  235    HA   VAL  34           HA       VAL  34   6.265   6.125   7.829
  236    HB   VAL  34           HB       VAL  34   5.249   3.830   6.146
  237   HG11  VAL  34          1HG1      VAL  34   6.727   3.142   8.538
  238   HG12  VAL  34          2HG1      VAL  34   6.948   2.589   6.877
  239   HG13  VAL  34          3HG1      VAL  34   7.703   4.090   7.415
  240   HG21  VAL  34          3HG2      VAL  34   4.837   4.387   9.082
  241   HG22  VAL  34          1HG2      VAL  34   3.638   4.682   7.823
  242   HG23  VAL  34          2HG2      VAL  34   4.178   3.037   8.158
  243    H    HIS  35           H        HIS  35   5.806   5.408   4.374
  244    HA   HIS  35           HA       HIS  35   8.647   5.294   3.897
  245    HB2  HIS  35           1HB      HIS  35   6.483   5.454   1.801
  246    HB3  HIS  35           2HB      HIS  35   8.097   4.767   1.644
  247    HD1  HIS  35           HD1      HIS  35   8.474   2.565   3.273
  248    HD2  HIS  35           HD2      HIS  35   4.573   3.605   2.293
  249    HE1  HIS  35           HE1      HIS  35   7.099   0.507   3.714
  250    H    THR  36           H        THR  36   9.049   7.469   4.780
  251    HA   THR  36           HA       THR  36   9.225   9.389   2.646
  252    HB   THR  36           HB       THR  36   7.621  10.139   5.099
  253    HG1  THR  36           HG1      THR  36   6.387   8.887   3.650
  254   HG21  THR  36          3HG2      THR  36   7.674  12.297   4.414
  255   HG22  THR  36          1HG2      THR  36   7.691  11.867   2.704
  256   HG23  THR  36          2HG2      THR  36   9.180  11.794   3.647
  257    H    GLY  37           H        GLY  37  10.944  10.723   2.908
  258    HA2  GLY  37           1HA      GLY  37  12.687  10.212   5.151
  259    HA3  GLY  37           2HA      GLY  37  13.034  11.243   3.771
  260    H    GLU  38           H        GLU  38  13.860  12.144   6.139
  261    HA   GLU  38           HA       GLU  38  12.115  13.579   7.744
  262    HB2  GLU  38           1HB      GLU  38  14.969  14.208   6.977
  263    HB3  GLU  38           2HB      GLU  38  14.090  15.031   8.258
  264    HG2  GLU  38           1HG      GLU  38  14.490  12.057   8.229
  265    HG3  GLU  38           2HG      GLU  38  15.649  13.169   8.957
  266    H    ARG  39           H        ARG  39  14.006  14.835   4.991
  267    HA   ARG  39           HA       ARG  39  13.267  17.396   4.824
  268    HB2  ARG  39           1HB      ARG  39  14.520  15.863   3.108
  269    HB3  ARG  39           2HB      ARG  39  12.946  15.769   2.330
  270    HG2  ARG  39           1HG      ARG  39  12.900  18.214   2.150
  271    HG3  ARG  39           2HG      ARG  39  14.497  18.287   2.898
  272    HD2  ARG  39           1HD      ARG  39  15.358  16.874   1.036
  273    HD3  ARG  39           2HD      ARG  39  13.774  16.998   0.270
  274    HE   ARG  39           HE       ARG  39  14.669  19.584   0.796
  275   HH11  ARG  39          1HH1      ARG  39  15.547  16.856  -1.180
  276   HH12  ARG  39          2HH1      ARG  39  16.260  17.824  -2.428
  277   HH21  ARG  39          1HH2      ARG  39  15.605  20.869  -0.840
  278   HH22  ARG  39          2HH2      ARG  39  16.293  20.106  -2.233
  279    HA   PRO  40           HA       PRO  40   8.851  17.560   4.771
  280    HB2  PRO  40           1HB      PRO  40   8.597  20.156   4.018
  281    HB3  PRO  40           2HB      PRO  40   9.081  19.672   5.647
  282    HG2  PRO  40           1HG      PRO  40  10.782  20.579   3.356
  283    HG3  PRO  40           2HG      PRO  40  10.887  21.019   5.071
  284    HD2  PRO  40           1HD      PRO  40  12.521  19.182   3.935
  285    HD3  PRO  40           2HD      PRO  40  12.001  19.080   5.629
  286    H    SER  41           H        SER  41   7.182  17.448   3.305
  287    HA   SER  41           HA       SER  41   7.922  17.039   0.555
  288    HB2  SER  41           1HB      SER  41   5.476  16.508   0.280
  289    HB3  SER  41           2HB      SER  41   6.302  15.531   1.493
  290    HG   SER  41           HG       SER  41   5.153  16.440   3.026
  291    H    GLY  42           H        GLY  42   8.576  19.104  -0.143
  292    HA2  GLY  42           1HA      GLY  42   8.099  20.967  -1.445
  293    HA3  GLY  42           2HA      GLY  42   6.393  20.742  -1.090
  294    HA   PRO  43           HA       PRO  43   8.569  24.091   1.608
  295    HB2  PRO  43           1HB      PRO  43   8.309  26.291   0.039
  296    HB3  PRO  43           2HB      PRO  43   9.746  25.262   0.020
  297    HG2  PRO  43           1HG      PRO  43   7.420  25.302  -1.864
  298    HG3  PRO  43           2HG      PRO  43   9.151  25.168  -2.226
  299    HD2  PRO  43           1HD      PRO  43   7.498  23.024  -2.202
  300    HD3  PRO  43           2HD      PRO  43   9.208  22.917  -1.737
  301    H    SER  44           H        SER  44   5.684  23.342   0.178
  302    HA   SER  44           HA       SER  44   3.903  25.337   0.392
  303    HB2  SER  44           1HB      SER  44   3.659  22.487   1.338
  304    HB3  SER  44           2HB      SER  44   2.293  23.601   1.401
  305    HG   SER  44           HG       SER  44   2.194  23.636  -0.744
  306    H    SER  45           H        SER  45   3.237  26.755   1.864
  307    HA   SER  45           HA       SER  45   3.301  26.111   4.693
  308    HB2  SER  45           1HB      SER  45   5.035  28.239   3.450
  309    HB3  SER  45           2HB      SER  45   4.517  28.342   5.132
  310    HG   SER  45           HG       SER  45   6.562  27.016   4.205
  311    H    GLY  46           H        GLY  46   1.768  27.187   5.848
  312    HA2  GLY  46           1HA      GLY  46  -0.159  28.721   4.322
  313    HA3  GLY  46           2HA      GLY  46  -0.328  28.191   5.989
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1   9.161 -11.087   9.385
    2    HA2  GLY   1           1HA      GLY   1   6.224 -11.345   9.178
    3    HA3  GLY   1           2HA      GLY   1   7.252 -11.041   7.785
    4    H    SER   2           H        SER   2   5.377 -13.295   8.665
    5    HA   SER   2           HA       SER   2   7.265 -15.537   8.533
    6    HB2  SER   2           1HB      SER   2   5.404 -16.943   9.249
    7    HB3  SER   2           2HB      SER   2   5.572 -15.571  10.345
    8    HG   SER   2           HG       SER   2   3.891 -14.550   9.062
    9    H    SER   3           H        SER   3   4.949 -13.803   6.686
   10    HA   SER   3           HA       SER   3   4.267 -13.974   4.522
   11    HB2  SER   3           1HB      SER   3   6.206 -16.242   4.115
   12    HB3  SER   3           2HB      SER   3   5.666 -15.033   2.951
   13    HG   SER   3           HG       SER   3   7.858 -14.859   4.088
   14    H    GLY   4           H        GLY   4   3.105 -15.609   6.678
   15    HA2  GLY   4           1HA      GLY   4   2.190 -17.971   5.183
   16    HA3  GLY   4           2HA      GLY   4   2.029 -17.734   6.916
   17    H    SER   5           H        SER   5   1.011 -16.147   3.888
   18    HA   SER   5           HA       SER   5  -1.419 -15.208   5.155
   19    HB2  SER   5           1HB      SER   5  -0.244 -14.871   2.398
   20    HB3  SER   5           2HB      SER   5  -1.867 -14.309   2.796
   21    HG   SER   5           HG       SER   5   0.556 -13.230   3.432
   22    H    SER   6           H        SER   6  -3.431 -16.010   4.889
   23    HA   SER   6           HA       SER   6  -3.888 -18.102   2.897
   24    HB2  SER   6           1HB      SER   6  -4.468 -18.435   5.850
   25    HB3  SER   6           2HB      SER   6  -4.979 -19.552   4.585
   26    HG   SER   6           HG       SER   6  -2.433 -19.083   5.634
   27    H    GLY   7           H        GLY   7  -5.949 -18.168   2.101
   28    HA2  GLY   7           1HA      GLY   7  -8.297 -17.754   2.214
   29    HA3  GLY   7           2HA      GLY   7  -7.987 -16.504   3.410
   30    H    THR   8           H        THR   8  -9.471 -16.505   0.806
   31    HA   THR   8           HA       THR   8  -8.178 -15.151  -1.216
   32    HB   THR   8           HB       THR   8 -11.018 -14.607  -0.334
   33    HG1  THR   8           HG1      THR   8 -11.528 -16.344  -1.758
   34   HG21  THR   8          3HG2      THR   8 -11.274 -14.332  -2.867
   35   HG22  THR   8          1HG2      THR   8  -9.515 -14.213  -2.909
   36   HG23  THR   8          2HG2      THR   8 -10.457 -13.037  -1.992
   37    H    GLY   9           H        GLY   9  -6.972 -13.376  -1.088
   38    HA2  GLY   9           1HA      GLY   9  -7.446 -11.400   0.981
   39    HA3  GLY   9           2HA      GLY   9  -6.122 -11.407  -0.174
   40    H    GLU  10           H        GLU  10  -6.900 -11.044  -2.524
   41    HA   GLU  10           HA       GLU  10  -7.625  -9.454  -3.991
   42    HB2  GLU  10           1HB      GLU  10 -10.119 -10.133  -2.448
   43    HB3  GLU  10           2HB      GLU  10 -10.148  -9.002  -3.794
   44    HG2  GLU  10           1HG      GLU  10  -9.564 -11.934  -3.815
   45    HG3  GLU  10           2HG      GLU  10 -10.761 -11.031  -4.742
   46    H    LYS  11           H        LYS  11  -6.271  -8.342  -1.848
   47    HA   LYS  11           HA       LYS  11  -7.557  -6.311  -0.449
   48    HB2  LYS  11           1HB      LYS  11  -5.346  -5.289  -0.205
   49    HB3  LYS  11           2HB      LYS  11  -5.265  -7.029   0.034
   50    HG2  LYS  11           1HG      LYS  11  -4.515  -7.221  -2.354
   51    HG3  LYS  11           2HG      LYS  11  -4.382  -5.461  -2.374
   52    HD2  LYS  11           1HD      LYS  11  -2.237  -6.015  -1.798
   53    HD3  LYS  11           2HD      LYS  11  -2.960  -5.890  -0.192
   54    HE2  LYS  11           1HE      LYS  11  -1.677  -7.899  -0.251
   55    HE3  LYS  11           2HE      LYS  11  -3.380  -8.355  -0.284
   56    HZ1  LYS  11           3HZ      LYS  11  -1.562  -8.237  -2.630
   57    HZ2  LYS  11           1HZ      LYS  11  -3.206  -8.635  -2.688
   58    HZ3  LYS  11           2HZ      LYS  11  -2.120  -9.643  -1.873
   59    HA   PRO  12           HA       PRO  12  -8.697  -3.575  -3.760
   60    HB2  PRO  12           1HB      PRO  12  -9.629  -1.572  -2.182
   61    HB3  PRO  12           2HB      PRO  12 -10.537  -3.058  -2.485
   62    HG2  PRO  12           1HG      PRO  12  -8.854  -2.313  -0.123
   63    HG3  PRO  12           2HG      PRO  12 -10.439  -3.108  -0.162
   64    HD2  PRO  12           1HD      PRO  12  -8.130  -4.477   0.198
   65    HD3  PRO  12           2HD      PRO  12  -9.532  -5.172  -0.641
   66    H    TYR  13           H        TYR  13  -6.430  -2.925  -1.230
   67    HA   TYR  13           HA       TYR  13  -5.166  -0.885  -2.917
   68    HB2  TYR  13           1HB      TYR  13  -5.657  -0.623   0.056
   69    HB3  TYR  13           2HB      TYR  13  -4.642   0.459  -0.890
   70    HD1  TYR  13           HD2      TYR  13  -6.007   1.224  -3.181
   71    HD2  TYR  13           HD1      TYR  13  -7.698   0.276   0.606
   72    HE1  TYR  13           HE2      TYR  13  -7.972   2.601  -3.720
   73    HE2  TYR  13           HE1      TYR  13  -9.669   1.650   0.077
   74    HH   TYR  13           HH       TYR  13  -9.857   3.895  -1.938
   75    H    LYS  14           H        LYS  14  -3.092  -1.311  -3.253
   76    HA   LYS  14           HA       LYS  14  -1.674  -3.017  -1.312
   77    HB2  LYS  14           1HB      LYS  14  -2.236  -4.103  -3.531
   78    HB3  LYS  14           2HB      LYS  14  -1.143  -2.948  -4.283
   79    HG2  LYS  14           1HG      LYS  14   0.643  -3.822  -2.722
   80    HG3  LYS  14           2HG      LYS  14  -0.479  -5.125  -2.323
   81    HD2  LYS  14           1HD      LYS  14   0.263  -4.491  -5.164
   82    HD3  LYS  14           2HD      LYS  14   1.249  -5.560  -4.164
   83    HE2  LYS  14           1HE      LYS  14  -0.154  -7.056  -5.223
   84    HE3  LYS  14           2HE      LYS  14  -1.008  -6.770  -3.707
   85    HZ1  LYS  14           3HZ      LYS  14  -2.746  -6.282  -4.983
   86    HZ2  LYS  14           1HZ      LYS  14  -1.812  -6.174  -6.389
   87    HZ3  LYS  14           2HZ      LYS  14  -1.958  -4.835  -5.366
   88    H    CYS  15           H        CYS  15   0.048  -2.112  -0.409
   89    HA   CYS  15           HA       CYS  15   0.967   0.469  -1.260
   90    HB2  CYS  15           1HB      CYS  15   0.827  -0.322   1.140
   91    HB3  CYS  15           2HB      CYS  15   2.234  -1.328   0.811
   92    H    GLU  16           H        GLU  16   2.101   0.542  -3.109
   93    HA   GLU  16           HA       GLU  16   3.786  -1.504  -4.065
   94    HB2  GLU  16           1HB      GLU  16   2.705   0.410  -5.376
   95    HB3  GLU  16           2HB      GLU  16   4.038   1.404  -4.808
   96    HG2  GLU  16           1HG      GLU  16   4.290   0.399  -7.102
   97    HG3  GLU  16           2HG      GLU  16   5.627   0.137  -5.984
   98    H    LYS  17           H        LYS  17   4.390   1.357  -2.114
   99    HA   LYS  17           HA       LYS  17   7.087   1.662  -2.208
  100    HB2  LYS  17           1HB      LYS  17   5.211   1.783   0.144
  101    HB3  LYS  17           2HB      LYS  17   6.918   2.177   0.305
  102    HG2  LYS  17           1HG      LYS  17   5.147   3.524  -1.710
  103    HG3  LYS  17           2HG      LYS  17   5.315   4.107  -0.052
  104    HD2  LYS  17           1HD      LYS  17   7.714   3.610  -1.787
  105    HD3  LYS  17           2HD      LYS  17   6.827   5.135  -1.859
  106    HE2  LYS  17           1HE      LYS  17   7.364   5.686   0.343
  107    HE3  LYS  17           2HE      LYS  17   7.777   4.023   0.758
  108    HZ1  LYS  17           3HZ      LYS  17   9.356   5.444  -1.276
  109    HZ2  LYS  17           1HZ      LYS  17   9.820   4.184  -0.246
  110    HZ3  LYS  17           2HZ      LYS  17   9.643   5.752   0.362
  111    H    CYS  18           H        CYS  18   5.449  -0.540   0.076
  112    HA   CYS  18           HA       CYS  18   7.951  -2.086   0.229
  113    HB2  CYS  18           1HB      CYS  18   7.056  -2.928   2.407
  114    HB3  CYS  18           2HB      CYS  18   7.361  -1.194   2.387
  115    H    GLY  19           H        GLY  19   4.408  -2.440   0.240
  116    HA2  GLY  19           1HA      GLY  19   3.537  -4.028  -1.468
  117    HA3  GLY  19           2HA      GLY  19   4.792  -5.131  -0.922
  118    H    LYS  20           H        LYS  20   2.809  -3.103   1.161
  119    HA   LYS  20           HA       LYS  20   1.813  -5.534   2.461
  120    HB2  LYS  20           1HB      LYS  20   2.969  -3.858   3.863
  121    HB3  LYS  20           2HB      LYS  20   1.753  -2.667   3.420
  122    HG2  LYS  20           1HG      LYS  20   0.905  -3.334   5.415
  123    HG3  LYS  20           2HG      LYS  20   0.117  -4.517   4.367
  124    HD2  LYS  20           1HD      LYS  20   0.954  -5.926   5.956
  125    HD3  LYS  20           2HD      LYS  20   2.336  -5.880   4.858
  126    HE2  LYS  20           1HE      LYS  20   2.076  -3.949   7.141
  127    HE3  LYS  20           2HE      LYS  20   2.769  -5.554   7.368
  128    HZ1  LYS  20           3HZ      LYS  20   3.789  -3.337   5.701
  129    HZ2  LYS  20           1HZ      LYS  20   4.296  -4.933   5.456
  130    HZ3  LYS  20           2HZ      LYS  20   4.580  -4.175   6.940
  131    H    GLY  21           H        GLY  21  -0.373  -5.895   2.833
  132    HA2  GLY  21           1HA      GLY  21  -2.148  -4.489   0.981
  133    HA3  GLY  21           2HA      GLY  21  -2.483  -6.019   1.779
  134    H    TYR  22           H        TYR  22  -4.232  -3.748   1.604
  135    HA   TYR  22           HA       TYR  22  -4.818  -3.465   4.428
  136    HB2  TYR  22           1HB      TYR  22  -4.174  -1.099   2.669
  137    HB3  TYR  22           2HB      TYR  22  -5.093  -0.953   4.163
  138    HD1  TYR  22           HD1      TYR  22  -4.007  -1.493   6.335
  139    HD2  TYR  22           HD2      TYR  22  -1.807  -1.353   2.696
  140    HE1  TYR  22           HE1      TYR  22  -1.912  -1.335   7.615
  141    HE2  TYR  22           HE2      TYR  22   0.294  -1.196   3.965
  142    HH   TYR  22           HH       TYR  22   0.409  -1.666   7.396
  143    H    ASN  23           H        ASN  23  -6.958  -3.437   4.793
  144    HA   ASN  23           HA       ASN  23  -8.720  -3.377   2.455
  145    HB2  ASN  23           1HB      ASN  23  -8.868  -5.353   3.900
  146    HB3  ASN  23           2HB      ASN  23  -9.246  -4.326   5.280
  147   HD21  ASN  23          1HD2      ASN  23 -11.275  -4.790   5.778
  148   HD22  ASN  23          2HD2      ASN  23 -12.610  -4.763   4.681
  149    H    SER  24           H        SER  24  -7.723  -0.905   3.319
  150    HA   SER  24           HA       SER  24 -10.119   0.574   3.582
  151    HB2  SER  24           1HB      SER  24  -8.534   0.049   6.058
  152    HB3  SER  24           2HB      SER  24  -9.237   1.652   5.842
  153    HG   SER  24           HG       SER  24 -10.439  -0.617   6.595
  154    H    LYS  25           H        LYS  25  -9.771   2.423   2.553
  155    HA   LYS  25           HA       LYS  25  -7.234   3.194   1.619
  156    HB2  LYS  25           1HB      LYS  25  -8.363   5.256   0.857
  157    HB3  LYS  25           2HB      LYS  25  -9.256   3.804   0.425
  158    HG2  LYS  25           1HG      LYS  25 -10.872   4.186   2.114
  159    HG3  LYS  25           2HG      LYS  25  -9.895   5.456   2.853
  160    HD2  LYS  25           1HD      LYS  25 -11.478   6.666   1.669
  161    HD3  LYS  25           2HD      LYS  25 -10.117   6.622   0.546
  162    HE2  LYS  25           1HE      LYS  25 -12.105   6.130  -0.686
  163    HE3  LYS  25           2HE      LYS  25 -11.175   4.640  -0.540
  164    HZ1  LYS  25           3HZ      LYS  25 -12.690   4.343   1.560
  165    HZ2  LYS  25           1HZ      LYS  25 -13.237   3.897   0.023
  166    HZ3  LYS  25           2HZ      LYS  25 -13.725   5.368   0.700
  167    H    PHE  26           H        PHE  26  -9.212   4.377   4.302
  168    HA   PHE  26           HA       PHE  26  -7.660   6.577   5.030
  169    HB2  PHE  26           1HB      PHE  26  -9.872   6.209   5.969
  170    HB3  PHE  26           2HB      PHE  26  -9.319   4.741   6.769
  171    HD1  PHE  26           HD2      PHE  26  -8.513   8.377   6.592
  172    HD2  PHE  26           HD1      PHE  26  -8.718   4.861   8.982
  173    HE1  PHE  26           HE2      PHE  26  -7.903   9.695   8.578
  174    HE2  PHE  26           HE1      PHE  26  -8.110   6.174  10.972
  175    HZ   PHE  26           HZ       PHE  26  -7.700   8.594  10.771
  176    H    ASN  27           H        ASN  27  -7.453   3.198   6.095
  177    HA   ASN  27           HA       ASN  27  -5.377   3.529   7.947
  178    HB2  ASN  27           1HB      ASN  27  -6.301   1.168   6.317
  179    HB3  ASN  27           2HB      ASN  27  -4.947   1.046   7.436
  180   HD21  ASN  27          1HD2      ASN  27  -7.118  -0.523   7.800
  181   HD22  ASN  27          2HD2      ASN  27  -8.001  -0.012   9.194
  182    H    LEU  28           H        LEU  28  -5.160   2.268   4.614
  183    HA   LEU  28           HA       LEU  28  -2.480   2.003   4.321
  184    HB2  LEU  28           1HB      LEU  28  -4.195   1.547   2.586
  185    HB3  LEU  28           2HB      LEU  28  -4.279   3.278   2.266
  186    HG   LEU  28           HG       LEU  28  -1.800   3.126   1.691
  187   HD11  LEU  28          1HD1      LEU  28  -1.613   0.828   2.769
  188   HD12  LEU  28          2HD1      LEU  28  -0.847   1.043   1.195
  189   HD13  LEU  28          3HD1      LEU  28  -2.395   0.208   1.314
  190   HD21  LEU  28          3HD2      LEU  28  -2.504   3.182  -0.417
  191   HD22  LEU  28          1HD2      LEU  28  -4.109   2.768   0.185
  192   HD23  LEU  28          2HD2      LEU  28  -3.017   1.495  -0.360
  193    H    ASP  29           H        ASP  29  -4.296   5.030   4.154
  194    HA   ASP  29           HA       ASP  29  -2.321   6.757   3.293
  195    HB2  ASP  29           1HB      ASP  29  -4.395   7.358   5.412
  196    HB3  ASP  29           2HB      ASP  29  -3.563   8.533   4.397
  197    H    MET  30           H        MET  30  -3.160   6.099   6.702
  198    HA   MET  30           HA       MET  30  -1.061   7.498   7.861
  199    HB2  MET  30           1HB      MET  30  -2.801   5.239   8.733
  200    HB3  MET  30           2HB      MET  30  -1.385   5.615   9.706
  201    HG2  MET  30           1HG      MET  30  -3.331   6.740  10.580
  202    HG3  MET  30           2HG      MET  30  -2.172   7.914   9.960
  203    HE1  MET  30           3HE      MET  30  -5.747   6.609   9.897
  204    HE2  MET  30           1HE      MET  30  -6.319   6.939   8.261
  205    HE3  MET  30           2HE      MET  30  -5.123   5.673   8.538
  206    H    HIS  31           H        HIS  31  -1.112   4.338   6.389
  207    HA   HIS  31           HA       HIS  31   1.437   3.524   7.438
  208    HB2  HIS  31           1HB      HIS  31  -0.038   1.750   6.913
  209    HB3  HIS  31           2HB      HIS  31  -0.399   2.413   5.322
  210    HD1  HIS  31           HD1      HIS  31   2.688   1.097   7.132
  211    HD2  HIS  31           HD2      HIS  31   0.929   1.117   3.367
  212    HE1  HIS  31           HE1      HIS  31   4.190  -0.303   5.680
  213    H    GLN  32           H        GLN  32   0.260   5.097   4.540
  214    HA   GLN  32           HA       GLN  32   2.532   4.802   2.925
  215    HB2  GLN  32           1HB      GLN  32   0.278   6.770   3.018
  216    HB3  GLN  32           2HB      GLN  32   1.639   7.061   1.943
  217    HG2  GLN  32           1HG      GLN  32   1.218   5.096   0.713
  218    HG3  GLN  32           2HG      GLN  32   0.095   4.488   1.928
  219   HE21  GLN  32          1HE2      GLN  32  -0.970   4.358  -0.376
  220   HE22  GLN  32          2HE2      GLN  32  -2.046   5.663  -0.730
  221    H    LYS  33           H        LYS  33   1.792   7.023   5.520
  222    HA   LYS  33           HA       LYS  33   4.146   8.644   4.994
  223    HB2  LYS  33           1HB      LYS  33   3.404   9.947   6.953
  224    HB3  LYS  33           2HB      LYS  33   2.135   9.779   5.747
  225    HG2  LYS  33           1HG      LYS  33   1.101   8.011   7.073
  226    HG3  LYS  33           2HG      LYS  33   2.378   8.170   8.282
  227    HD2  LYS  33           1HD      LYS  33   1.676  10.616   8.457
  228    HD3  LYS  33           2HD      LYS  33   0.234  10.148   7.552
  229    HE2  LYS  33           1HE      LYS  33  -0.497   9.929   9.725
  230    HE3  LYS  33           2HE      LYS  33   0.043   8.288   9.371
  231    HZ1  LYS  33           3HZ      LYS  33   2.267   9.140  10.349
  232    HZ2  LYS  33           1HZ      LYS  33   1.015   8.695  11.396
  233    HZ3  LYS  33           2HZ      LYS  33   1.305  10.329  11.071
  234    H    VAL  34           H        VAL  34   4.727   5.947   5.506
  235    HA   VAL  34           HA       VAL  34   5.964   6.076   8.179
  236    HB   VAL  34           HB       VAL  34   5.137   3.661   6.567
  237   HG11  VAL  34          1HG1      VAL  34   7.321   3.379   7.755
  238   HG12  VAL  34          2HG1      VAL  34   6.468   3.678   9.270
  239   HG13  VAL  34          3HG1      VAL  34   6.050   2.276   8.283
  240   HG21  VAL  34          3HG2      VAL  34   3.538   3.256   8.261
  241   HG22  VAL  34          1HG2      VAL  34   4.245   4.474   9.322
  242   HG23  VAL  34          2HG2      VAL  34   3.393   4.967   7.858
  243    H    HIS  35           H        HIS  35   6.458   4.986   4.839
  244    HA   HIS  35           HA       HIS  35   9.213   4.362   5.190
  245    HB2  HIS  35           1HB      HIS  35   7.974   5.067   2.543
  246    HB3  HIS  35           2HB      HIS  35   9.263   3.917   2.883
  247    HD1  HIS  35           HD1      HIS  35   8.465   1.681   4.173
  248    HD2  HIS  35           HD2      HIS  35   5.480   3.977   2.418
  249    HE1  HIS  35           HE1      HIS  35   6.460   0.171   4.017
  250    H    THR  36           H        THR  36   7.622   7.033   3.436
  251    HA   THR  36           HA       THR  36   9.759   8.532   2.698
  252    HB   THR  36           HB       THR  36   8.348  10.560   2.979
  253    HG1  THR  36           HG1      THR  36   6.637  10.509   4.239
  254   HG21  THR  36          3HG2      THR  36   8.007   8.481   1.241
  255   HG22  THR  36          1HG2      THR  36   7.183  10.035   1.127
  256   HG23  THR  36          2HG2      THR  36   6.384   8.667   1.903
  257    H    GLY  37           H        GLY  37   8.203   8.614   5.898
  258    HA2  GLY  37           1HA      GLY  37   9.627   8.753   7.866
  259    HA3  GLY  37           2HA      GLY  37  10.691   9.807   6.947
  260    H    GLU  38           H        GLU  38  10.641  11.760   7.837
  261    HA   GLU  38           HA       GLU  38   8.110  12.785   8.898
  262    HB2  GLU  38           1HB      GLU  38  10.419  12.789  10.144
  263    HB3  GLU  38           2HB      GLU  38  10.724  14.220   9.170
  264    HG2  GLU  38           1HG      GLU  38   9.004  15.424  10.178
  265    HG3  GLU  38           2HG      GLU  38   8.239  13.971  10.819
  266    H    ARG  39           H        ARG  39   8.226  12.663   6.138
  267    HA   ARG  39           HA       ARG  39   8.353  15.519   5.435
  268    HB2  ARG  39           1HB      ARG  39   9.490  13.161   4.017
  269    HB3  ARG  39           2HB      ARG  39   8.800  14.447   3.036
  270    HG2  ARG  39           1HG      ARG  39  10.298  15.984   4.529
  271    HG3  ARG  39           2HG      ARG  39  11.192  14.488   4.808
  272    HD2  ARG  39           1HD      ARG  39  10.478  15.273   2.019
  273    HD3  ARG  39           2HD      ARG  39  11.828  16.073   2.823
  274    HE   ARG  39           HE       ARG  39  11.946  13.210   2.974
  275   HH11  ARG  39          1HH1      ARG  39  12.701  15.997   1.030
  276   HH12  ARG  39          2HH1      ARG  39  13.978  15.209   0.164
  277   HH21  ARG  39          1HH2      ARG  39  13.625  12.161   1.841
  278   HH22  ARG  39          2HH2      ARG  39  14.502  13.027   0.625
  279    HA   PRO  40           HA       PRO  40   4.077  13.961   4.705
  280    HB2  PRO  40           1HB      PRO  40   2.873  16.248   5.534
  281    HB3  PRO  40           2HB      PRO  40   3.361  14.963   6.645
  282    HG2  PRO  40           1HG      PRO  40   4.756  17.529   5.988
  283    HG3  PRO  40           2HG      PRO  40   4.520  16.756   7.566
  284    HD2  PRO  40           1HD      PRO  40   6.848  16.587   6.195
  285    HD3  PRO  40           2HD      PRO  40   6.262  15.281   7.245
  286    H    SER  41           H        SER  41   2.843  14.326   2.923
  287    HA   SER  41           HA       SER  41   3.817  16.339   1.043
  288    HB2  SER  41           1HB      SER  41   2.407  15.104  -0.610
  289    HB3  SER  41           2HB      SER  41   3.632  14.094   0.157
  290    HG   SER  41           HG       SER  41   2.047  12.858   0.734
  291    H    GLY  42           H        GLY  42   2.916  18.276   1.510
  292    HA2  GLY  42           1HA      GLY  42   0.321  18.680   2.521
  293    HA3  GLY  42           2HA      GLY  42   1.312  19.901   1.737
  294    HA   PRO  43           HA       PRO  43  -2.380  19.276  -0.942
  295    HB2  PRO  43           1HB      PRO  43  -2.653  21.908  -1.548
  296    HB3  PRO  43           2HB      PRO  43  -3.345  21.181  -0.094
  297    HG2  PRO  43           1HG      PRO  43  -0.819  22.757  -0.405
  298    HG3  PRO  43           2HG      PRO  43  -2.050  22.856   0.868
  299    HD2  PRO  43           1HD      PRO  43   0.288  21.532   1.202
  300    HD3  PRO  43           2HD      PRO  43  -1.220  21.021   1.988
  301    H    SER  44           H        SER  44   0.219  21.647  -1.557
  302    HA   SER  44           HA       SER  44   1.141  22.301  -3.576
  303    HB2  SER  44           1HB      SER  44   2.491  20.442  -4.542
  304    HB3  SER  44           2HB      SER  44   2.639  20.560  -2.789
  305    HG   SER  44           HG       SER  44   2.085  18.422  -4.045
  306    H    SER  45           H        SER  45  -1.594  22.090  -3.941
  307    HA   SER  45           HA       SER  45  -1.957  20.606  -6.439
  308    HB2  SER  45           1HB      SER  45  -3.622  20.569  -4.446
  309    HB3  SER  45           2HB      SER  45  -4.124  22.152  -5.039
  310    HG   SER  45           HG       SER  45  -5.330  20.340  -5.901
  311    H    GLY  46           H        GLY  46  -1.688  21.609  -8.312
  312    HA2  GLY  46           1HA      GLY  46  -0.924  24.138  -8.818
  313    HA3  GLY  46           2HA      GLY  46  -1.939  23.243  -9.939
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1  -0.895 -26.735   5.904
    2    HA2  GLY   1           1HA      GLY   1   0.834 -24.891   6.435
    3    HA3  GLY   1           2HA      GLY   1   1.853 -25.835   5.359
    4    H    SER   2           H        SER   2   0.215 -23.108   5.415
    5    HA   SER   2           HA       SER   2  -0.672 -23.347   2.614
    6    HB2  SER   2           1HB      SER   2  -2.342 -21.605   3.075
    7    HB3  SER   2           2HB      SER   2  -2.577 -22.995   4.133
    8    HG   SER   2           HG       SER   2  -1.473 -20.470   4.755
    9    H    SER   3           H        SER   3   1.339 -22.711   1.799
   10    HA   SER   3           HA       SER   3   2.250 -20.011   2.507
   11    HB2  SER   3           1HB      SER   3   3.641 -22.293   1.093
   12    HB3  SER   3           2HB      SER   3   4.332 -20.678   1.246
   13    HG   SER   3           HG       SER   3   4.365 -20.924   3.462
   14    H    GLY   4           H        GLY   4   2.522 -18.413   0.967
   15    HA2  GLY   4           1HA      GLY   4   1.940 -17.211  -0.902
   16    HA3  GLY   4           2HA      GLY   4   2.422 -18.651  -1.786
   17    H    SER   5           H        SER   5   0.594 -17.428  -3.082
   18    HA   SER   5           HA       SER   5  -1.599 -17.296  -3.763
   19    HB2  SER   5           1HB      SER   5  -1.250 -20.234  -3.132
   20    HB3  SER   5           2HB      SER   5  -2.615 -19.582  -4.039
   21    HG   SER   5           HG       SER   5   0.118 -19.302  -4.759
   22    H    SER   6           H        SER   6  -1.397 -16.485  -1.110
   23    HA   SER   6           HA       SER   6  -3.526 -17.808   0.368
   24    HB2  SER   6           1HB      SER   6  -1.659 -17.167   1.710
   25    HB3  SER   6           2HB      SER   6  -1.653 -15.535   1.042
   26    HG   SER   6           HG       SER   6  -3.297 -14.993   2.298
   27    H    GLY   7           H        GLY   7  -2.854 -14.645  -1.093
   28    HA2  GLY   7           1HA      GLY   7  -5.678 -14.234  -1.548
   29    HA3  GLY   7           2HA      GLY   7  -4.979 -13.137  -0.367
   30    H    THR   8           H        THR   8  -4.928 -14.154  -3.724
   31    HA   THR   8           HA       THR   8  -3.226 -11.893  -4.448
   32    HB   THR   8           HB       THR   8  -3.378 -12.859  -6.766
   33    HG1  THR   8           HG1      THR   8  -5.396 -14.126  -5.928
   34   HG21  THR   8          3HG2      THR   8  -1.492 -13.930  -6.253
   35   HG22  THR   8          1HG2      THR   8  -2.383 -15.185  -5.393
   36   HG23  THR   8          2HG2      THR   8  -1.889 -13.717  -4.548
   37    H    GLY   9           H        GLY   9  -3.865 -10.262  -5.876
   38    HA2  GLY   9           1HA      GLY   9  -5.415  -8.594  -6.370
   39    HA3  GLY   9           2HA      GLY   9  -6.018  -9.881  -7.405
   40    H    GLU  10           H        GLU  10  -6.115  -9.372  -3.880
   41    HA   GLU  10           HA       GLU  10  -9.042  -9.679  -4.033
   42    HB2  GLU  10           1HB      GLU  10  -7.025 -10.723  -2.095
   43    HB3  GLU  10           2HB      GLU  10  -8.636 -10.338  -1.504
   44    HG2  GLU  10           1HG      GLU  10  -9.509 -11.812  -3.378
   45    HG3  GLU  10           2HG      GLU  10  -7.846 -12.366  -3.567
   46    H    LYS  11           H        LYS  11  -6.449  -8.201  -2.093
   47    HA   LYS  11           HA       LYS  11  -8.161  -6.415  -0.710
   48    HB2  LYS  11           1HB      LYS  11  -6.113  -5.314   0.023
   49    HB3  LYS  11           2HB      LYS  11  -5.947  -7.061   0.140
   50    HG2  LYS  11           1HG      LYS  11  -4.904  -6.769  -2.268
   51    HG3  LYS  11           2HG      LYS  11  -4.588  -5.139  -1.667
   52    HD2  LYS  11           1HD      LYS  11  -3.247  -5.931   0.092
   53    HD3  LYS  11           2HD      LYS  11  -3.848  -7.582  -0.081
   54    HE2  LYS  11           1HE      LYS  11  -2.739  -7.727  -2.276
   55    HE3  LYS  11           2HE      LYS  11  -2.101  -6.099  -2.045
   56    HZ1  LYS  11           3HZ      LYS  11  -1.313  -7.335   0.205
   57    HZ2  LYS  11           1HZ      LYS  11  -0.356  -7.171  -1.181
   58    HZ3  LYS  11           2HZ      LYS  11  -1.216  -8.602  -0.911
   59    HA   PRO  12           HA       PRO  12  -8.830  -3.288  -3.735
   60    HB2  PRO  12           1HB      PRO  12  -9.367  -1.201  -2.084
   61    HB3  PRO  12           2HB      PRO  12 -10.504  -2.526  -2.359
   62    HG2  PRO  12           1HG      PRO  12  -8.613  -2.095  -0.079
   63    HG3  PRO  12           2HG      PRO  12 -10.300  -2.640  -0.045
   64    HD2  PRO  12           1HD      PRO  12  -8.213  -4.350   0.175
   65    HD3  PRO  12           2HD      PRO  12  -9.744  -4.807  -0.600
   66    H    TYR  13           H        TYR  13  -6.919  -2.169  -0.934
   67    HA   TYR  13           HA       TYR  13  -5.351  -0.462  -2.717
   68    HB2  TYR  13           1HB      TYR  13  -5.578  -0.619   0.288
   69    HB3  TYR  13           2HB      TYR  13  -4.379   0.381  -0.525
   70    HD1  TYR  13           HD2      TYR  13  -5.300   2.086  -2.263
   71    HD2  TYR  13           HD1      TYR  13  -7.678   0.257   0.755
   72    HE1  TYR  13           HE2      TYR  13  -6.948   3.901  -2.469
   73    HE2  TYR  13           HE1      TYR  13  -9.333   2.066   0.556
   74    HH   TYR  13           HH       TYR  13 -10.017   3.798  -0.770
   75    H    LYS  14           H        LYS  14  -3.066  -0.516  -2.743
   76    HA   LYS  14           HA       LYS  14  -1.731  -2.781  -1.492
   77    HB2  LYS  14           1HB      LYS  14  -2.407  -3.787  -3.555
   78    HB3  LYS  14           2HB      LYS  14  -1.898  -2.379  -4.479
   79    HG2  LYS  14           1HG      LYS  14   0.113  -3.886  -2.874
   80    HG3  LYS  14           2HG      LYS  14  -0.426  -4.524  -4.430
   81    HD2  LYS  14           1HD      LYS  14   0.068  -2.038  -5.202
   82    HD3  LYS  14           2HD      LYS  14   1.158  -2.082  -3.815
   83    HE2  LYS  14           1HE      LYS  14   1.141  -4.064  -6.089
   84    HE3  LYS  14           2HE      LYS  14   2.275  -2.725  -5.913
   85    HZ1  LYS  14           3HZ      LYS  14   2.170  -5.265  -4.502
   86    HZ2  LYS  14           1HZ      LYS  14   2.581  -3.917  -3.566
   87    HZ3  LYS  14           2HZ      LYS  14   3.504  -4.315  -4.927
   88    H    CYS  15           H        CYS  15   0.128  -2.102  -0.668
   89    HA   CYS  15           HA       CYS  15   1.187   0.482  -1.395
   90    HB2  CYS  15           1HB      CYS  15   1.095  -0.365   0.965
   91    HB3  CYS  15           2HB      CYS  15   2.334  -1.540   0.538
   92    H    GLU  16           H        GLU  16   2.577   0.790  -2.993
   93    HA   GLU  16           HA       GLU  16   4.142  -1.471  -3.989
   94    HB2  GLU  16           1HB      GLU  16   2.710   0.052  -5.485
   95    HB3  GLU  16           2HB      GLU  16   3.973   1.253  -5.257
   96    HG2  GLU  16           1HG      GLU  16   5.612  -0.349  -6.175
   97    HG3  GLU  16           2HG      GLU  16   4.291  -1.475  -6.486
   98    H    LYS  17           H        LYS  17   4.985  -0.461  -1.540
   99    HA   LYS  17           HA       LYS  17   7.584   0.691  -2.289
  100    HB2  LYS  17           1HB      LYS  17   5.844   1.499   0.045
  101    HB3  LYS  17           2HB      LYS  17   7.536   1.953  -0.113
  102    HG2  LYS  17           1HG      LYS  17   5.709   2.577  -2.368
  103    HG3  LYS  17           2HG      LYS  17   5.585   3.544  -0.897
  104    HD2  LYS  17           1HD      LYS  17   7.662   4.463  -1.164
  105    HD3  LYS  17           2HD      LYS  17   8.293   3.057  -2.025
  106    HE2  LYS  17           1HE      LYS  17   7.202   3.693  -4.034
  107    HE3  LYS  17           2HE      LYS  17   6.241   4.916  -3.205
  108    HZ1  LYS  17           3HZ      LYS  17   7.930   6.387  -3.227
  109    HZ2  LYS  17           1HZ      LYS  17   8.453   5.473  -4.551
  110    HZ3  LYS  17           2HZ      LYS  17   9.128   5.210  -3.022
  111    H    CYS  18           H        CYS  18   5.727  -1.068   0.165
  112    HA   CYS  18           HA       CYS  18   8.214  -2.450   0.937
  113    HB2  CYS  18           1HB      CYS  18   7.230  -2.787   3.155
  114    HB3  CYS  18           2HB      CYS  18   7.315  -1.073   2.761
  115    H    GLY  19           H        GLY  19   4.699  -2.821   0.568
  116    HA2  GLY  19           1HA      GLY  19   3.922  -4.711  -0.783
  117    HA3  GLY  19           2HA      GLY  19   5.180  -5.675  -0.024
  118    H    LYS  20           H        LYS  20   2.405  -3.652   0.935
  119    HA   LYS  20           HA       LYS  20   1.665  -5.771   2.845
  120    HB2  LYS  20           1HB      LYS  20   1.425  -2.780   3.224
  121    HB3  LYS  20           2HB      LYS  20   0.778  -3.988   4.327
  122    HG2  LYS  20           1HG      LYS  20   3.689  -3.943   3.632
  123    HG3  LYS  20           2HG      LYS  20   3.030  -2.885   4.882
  124    HD2  LYS  20           1HD      LYS  20   2.063  -4.932   5.966
  125    HD3  LYS  20           2HD      LYS  20   2.974  -5.899   4.804
  126    HE2  LYS  20           1HE      LYS  20   4.244  -3.870   6.632
  127    HE3  LYS  20           2HE      LYS  20   4.065  -5.573   7.053
  128    HZ1  LYS  20           3HZ      LYS  20   5.683  -4.393   4.874
  129    HZ2  LYS  20           1HZ      LYS  20   5.289  -6.038   4.910
  130    HZ3  LYS  20           2HZ      LYS  20   6.205  -5.360   6.160
  131    H    GLY  21           H        GLY  21  -0.727  -5.337   3.604
  132    HA2  GLY  21           1HA      GLY  21  -2.349  -4.562   1.268
  133    HA3  GLY  21           2HA      GLY  21  -2.612  -6.113   2.051
  134    H    TYR  22           H        TYR  22  -4.087  -3.367   1.723
  135    HA   TYR  22           HA       TYR  22  -5.180  -3.415   4.441
  136    HB2  TYR  22           1HB      TYR  22  -4.538  -0.851   2.973
  137    HB3  TYR  22           2HB      TYR  22  -5.213  -0.998   4.591
  138    HD1  TYR  22           HD1      TYR  22  -3.767  -2.128   6.378
  139    HD2  TYR  22           HD2      TYR  22  -2.222  -0.761   2.656
  140    HE1  TYR  22           HE1      TYR  22  -1.498  -2.120   7.329
  141    HE2  TYR  22           HE2      TYR  22   0.050  -0.751   3.596
  142    HH   TYR  22           HH       TYR  22   0.859  -0.575   6.450
  143    H    ASN  23           H        ASN  23  -7.348  -3.345   4.507
  144    HA   ASN  23           HA       ASN  23  -8.793  -3.330   2.006
  145    HB2  ASN  23           1HB      ASN  23 -10.695  -4.046   3.290
  146    HB3  ASN  23           2HB      ASN  23  -9.289  -4.934   3.872
  147   HD21  ASN  23          1HD2      ASN  23 -11.950  -3.958   5.038
  148   HD22  ASN  23          2HD2      ASN  23 -11.490  -3.269   6.554
  149    H    SER  24           H        SER  24  -8.507  -1.291   4.864
  150    HA   SER  24           HA       SER  24 -10.410   0.623   3.734
  151    HB2  SER  24           1HB      SER  24  -9.020   0.688   6.422
  152    HB3  SER  24           2HB      SER  24 -10.357   1.714   5.905
  153    HG   SER  24           HG       SER  24 -10.366  -1.049   6.479
  154    H    LYS  25           H        LYS  25  -9.858   2.639   3.055
  155    HA   LYS  25           HA       LYS  25  -7.234   3.097   2.148
  156    HB2  LYS  25           1HB      LYS  25  -8.017   5.234   1.409
  157    HB3  LYS  25           2HB      LYS  25  -9.324   4.081   1.172
  158    HG2  LYS  25           1HG      LYS  25  -9.245   5.643   3.702
  159    HG3  LYS  25           2HG      LYS  25  -9.763   6.447   2.218
  160    HD2  LYS  25           1HD      LYS  25 -11.347   4.459   1.914
  161    HD3  LYS  25           2HD      LYS  25 -10.998   4.083   3.603
  162    HE2  LYS  25           1HE      LYS  25 -12.957   5.380   3.651
  163    HE3  LYS  25           2HE      LYS  25 -11.662   6.482   4.114
  164    HZ1  LYS  25           3HZ      LYS  25 -13.176   7.491   2.518
  165    HZ2  LYS  25           1HZ      LYS  25 -12.848   6.266   1.399
  166    HZ3  LYS  25           2HZ      LYS  25 -11.625   7.338   1.861
  167    H    PHE  26           H        PHE  26  -8.760   3.716   5.167
  168    HA   PHE  26           HA       PHE  26  -7.247   5.879   6.102
  169    HB2  PHE  26           1HB      PHE  26  -9.037   5.419   7.481
  170    HB3  PHE  26           2HB      PHE  26  -8.796   3.678   7.391
  171    HD1  PHE  26           HD2      PHE  26  -7.062   6.721   8.676
  172    HD2  PHE  26           HD1      PHE  26  -7.991   2.607   9.252
  173    HE1  PHE  26           HE2      PHE  26  -5.921   6.772  10.855
  174    HE2  PHE  26           HE1      PHE  26  -6.852   2.652  11.433
  175    HZ   PHE  26           HZ       PHE  26  -5.815   4.736  12.236
  176    H    ASN  27           H        ASN  27  -6.720   2.385   6.559
  177    HA   ASN  27           HA       ASN  27  -4.347   2.547   8.003
  178    HB2  ASN  27           1HB      ASN  27  -5.239   0.416   6.048
  179    HB3  ASN  27           2HB      ASN  27  -3.918   0.234   7.198
  180   HD21  ASN  27          1HD2      ASN  27  -6.759  -0.914   6.758
  181   HD22  ASN  27          2HD2      ASN  27  -7.420  -0.919   8.355
  182    H    LEU  28           H        LEU  28  -4.849   2.379   4.496
  183    HA   LEU  28           HA       LEU  28  -2.113   2.335   3.796
  184    HB2  LEU  28           1HB      LEU  28  -4.008   1.694   2.313
  185    HB3  LEU  28           2HB      LEU  28  -4.413   3.403   2.167
  186    HG   LEU  28           HG       LEU  28  -2.025   3.675   1.246
  187   HD11  LEU  28          1HD1      LEU  28  -0.787   1.880   0.698
  188   HD12  LEU  28          2HD1      LEU  28  -2.194   0.908   0.265
  189   HD13  LEU  28          3HD1      LEU  28  -1.734   1.088   1.958
  190   HD21  LEU  28          3HD2      LEU  28  -3.084   2.356  -0.939
  191   HD22  LEU  28          1HD2      LEU  28  -3.353   4.044  -0.503
  192   HD23  LEU  28          2HD2      LEU  28  -4.502   2.807   0.009
  193    H    ASP  29           H        ASP  29  -4.455   4.983   4.083
  194    HA   ASP  29           HA       ASP  29  -2.898   7.081   3.171
  195    HB2  ASP  29           1HB      ASP  29  -5.386   6.964   4.066
  196    HB3  ASP  29           2HB      ASP  29  -4.637   7.522   5.559
  197    H    MET  30           H        MET  30  -3.249   5.988   6.549
  198    HA   MET  30           HA       MET  30  -1.256   7.719   7.566
  199    HB2  MET  30           1HB      MET  30  -2.671   5.293   8.608
  200    HB3  MET  30           2HB      MET  30  -1.295   5.943   9.490
  201    HG2  MET  30           1HG      MET  30  -3.495   7.779   8.689
  202    HG3  MET  30           2HG      MET  30  -3.735   6.690  10.052
  203    HE1  MET  30           3HE      MET  30  -3.809   9.605  11.601
  204    HE2  MET  30           1HE      MET  30  -2.754  10.635  10.631
  205    HE3  MET  30           2HE      MET  30  -3.978   9.637   9.845
  206    H    HIS  31           H        HIS  31  -1.202   4.276   6.687
  207    HA   HIS  31           HA       HIS  31   1.371   3.629   7.429
  208    HB2  HIS  31           1HB      HIS  31  -0.063   1.899   6.637
  209    HB3  HIS  31           2HB      HIS  31  -0.279   2.695   5.080
  210    HD1  HIS  31           HD1      HIS  31   2.801   1.526   7.006
  211    HD2  HIS  31           HD2      HIS  31   1.095   1.313   3.223
  212    HE1  HIS  31           HE1      HIS  31   4.421   0.202   5.611
  213    H    GLN  32           H        GLN  32   0.324   4.912   4.273
  214    HA   GLN  32           HA       GLN  32   2.600   5.012   2.852
  215    HB2  GLN  32           1HB      GLN  32   0.402   7.024   3.145
  216    HB3  GLN  32           2HB      GLN  32   1.787   7.396   2.127
  217    HG2  GLN  32           1HG      GLN  32   1.316   5.174   0.970
  218    HG3  GLN  32           2HG      GLN  32  -0.237   5.210   1.803
  219   HE21  GLN  32          1HE2      GLN  32  -1.846   6.155   0.780
  220   HE22  GLN  32          2HE2      GLN  32  -1.703   7.295  -0.510
  221    H    LYS  33           H        LYS  33   1.714   7.457   5.285
  222    HA   LYS  33           HA       LYS  33   3.810   9.173   5.154
  223    HB2  LYS  33           1HB      LYS  33   2.630   8.069   7.711
  224    HB3  LYS  33           2HB      LYS  33   3.529   9.573   7.560
  225    HG2  LYS  33           1HG      LYS  33   1.745  10.330   5.940
  226    HG3  LYS  33           2HG      LYS  33   0.815   8.920   6.453
  227    HD2  LYS  33           1HD      LYS  33  -0.003  10.505   7.895
  228    HD3  LYS  33           2HD      LYS  33   1.331   9.860   8.855
  229    HE2  LYS  33           1HE      LYS  33   1.875  12.142   7.025
  230    HE3  LYS  33           2HE      LYS  33   0.991  12.460   8.516
  231    HZ1  LYS  33           3HZ      LYS  33   2.868  12.348   9.662
  232    HZ2  LYS  33           1HZ      LYS  33   3.727  12.211   8.210
  233    HZ3  LYS  33           2HZ      LYS  33   3.236  10.820   9.037
  234    H    VAL  34           H        VAL  34   3.812   6.007   6.739
  235    HA   VAL  34           HA       VAL  34   6.173   5.951   8.061
  236    HB   VAL  34           HB       VAL  34   5.139   3.772   6.241
  237   HG11  VAL  34          1HG1      VAL  34   6.474   2.240   7.567
  238   HG12  VAL  34          2HG1      VAL  34   7.508   3.466   6.831
  239   HG13  VAL  34          3HG1      VAL  34   7.083   3.579   8.539
  240   HG21  VAL  34          3HG2      VAL  34   3.672   4.701   8.141
  241   HG22  VAL  34          1HG2      VAL  34   3.910   2.956   8.046
  242   HG23  VAL  34          2HG2      VAL  34   4.820   3.908   9.219
  243    H    HIS  35           H        HIS  35   5.781   5.519   4.558
  244    HA   HIS  35           HA       HIS  35   8.647   5.393   4.160
  245    HB2  HIS  35           1HB      HIS  35   6.538   5.599   2.013
  246    HB3  HIS  35           2HB      HIS  35   8.167   4.943   1.873
  247    HD1  HIS  35           HD1      HIS  35   8.467   2.772   3.698
  248    HD2  HIS  35           HD2      HIS  35   4.719   3.619   2.119
  249    HE1  HIS  35           HE1      HIS  35   7.133   0.656   3.960
  250    H    THR  36           H        THR  36   9.339   6.776   2.081
  251    HA   THR  36           HA       THR  36  10.225   8.908   1.777
  252    HB   THR  36           HB       THR  36   8.357   8.555   0.135
  253    HG1  THR  36           HG1      THR  36   8.165  10.944  -0.229
  254   HG21  THR  36          3HG2      THR  36   6.606   8.767   2.038
  255   HG22  THR  36          1HG2      THR  36   6.231   9.445   0.454
  256   HG23  THR  36          2HG2      THR  36   6.761  10.502   1.762
  257    H    GLY  37           H        GLY  37   9.787   8.573   4.530
  258    HA2  GLY  37           1HA      GLY  37   8.324  10.866   5.516
  259    HA3  GLY  37           2HA      GLY  37   9.233   9.712   6.480
  260    H    GLU  38           H        GLU  38  11.594   9.913   6.468
  261    HA   GLU  38           HA       GLU  38  13.420  11.184   6.982
  262    HB2  GLU  38           1HB      GLU  38  13.248  11.165   4.387
  263    HB3  GLU  38           2HB      GLU  38  12.780  12.850   4.568
  264    HG2  GLU  38           1HG      GLU  38  15.051  12.993   4.218
  265    HG3  GLU  38           2HG      GLU  38  14.931  13.058   5.976
  266    H    ARG  39           H        ARG  39  11.188  11.996   8.392
  267    HA   ARG  39           HA       ARG  39  10.540  14.709   8.231
  268    HB2  ARG  39           1HB      ARG  39  10.453  12.671  10.422
  269    HB3  ARG  39           2HB      ARG  39  10.133  14.358  10.801
  270    HG2  ARG  39           1HG      ARG  39   8.270  14.412   9.305
  271    HG3  ARG  39           2HG      ARG  39   8.656  12.802   8.693
  272    HD2  ARG  39           1HD      ARG  39   6.773  13.007  10.417
  273    HD3  ARG  39           2HD      ARG  39   7.994  11.762  10.676
  274    HE   ARG  39           HE       ARG  39   7.588  14.171  12.251
  275   HH11  ARG  39          1HH1      ARG  39   9.588  11.412  11.539
  276   HH12  ARG  39          2HH1      ARG  39  10.438  11.474  13.047
  277   HH21  ARG  39          1HH2      ARG  39   8.700  14.263  14.241
  278   HH22  ARG  39          2HH2      ARG  39   9.931  13.096  14.584
  279    HA   PRO  40           HA       PRO  40  14.182  16.768   9.604
  280    HB2  PRO  40           1HB      PRO  40  13.062  19.088  10.459
  281    HB3  PRO  40           2HB      PRO  40  13.239  18.681   8.749
  282    HG2  PRO  40           1HG      PRO  40  10.833  18.441  10.513
  283    HG3  PRO  40           2HG      PRO  40  10.943  19.033   8.845
  284    HD2  PRO  40           1HD      PRO  40  10.093  16.534   9.451
  285    HD3  PRO  40           2HD      PRO  40  10.981  16.905   7.959
  286    H    SER  41           H        SER  41  11.378  16.672  11.767
  287    HA   SER  41           HA       SER  41  12.214  17.568  14.129
  288    HB2  SER  41           1HB      SER  41  11.122  14.771  14.104
  289    HB3  SER  41           2HB      SER  41  10.738  16.105  15.191
  290    HG   SER  41           HG       SER  41   9.617  15.430  12.798
  291    H    GLY  42           H        GLY  42  12.767  14.111  13.451
  292    HA2  GLY  42           1HA      GLY  42  14.954  13.107  13.533
  293    HA3  GLY  42           2HA      GLY  42  15.456  14.394  14.619
  294    HA   PRO  43           HA       PRO  43  14.884  11.470  17.872
  295    HB2  PRO  43           1HB      PRO  43  15.051  13.205  19.953
  296    HB3  PRO  43           2HB      PRO  43  16.460  12.683  19.023
  297    HG2  PRO  43           1HG      PRO  43  14.871  15.210  18.796
  298    HG3  PRO  43           2HG      PRO  43  16.630  14.987  18.757
  299    HD2  PRO  43           1HD      PRO  43  15.153  15.327  16.512
  300    HD3  PRO  43           2HD      PRO  43  16.623  14.332  16.547
  301    H    SER  44           H        SER  44  12.773  14.068  17.158
  302    HA   SER  44           HA       SER  44  10.941  14.207  19.146
  303    HB2  SER  44           1HB      SER  44  10.635  15.496  17.139
  304    HB3  SER  44           2HB      SER  44  10.426  14.037  16.170
  305    HG   SER  44           HG       SER  44   8.565  15.437  17.423
  306    H    SER  45           H        SER  45  10.682  11.838  16.488
  307    HA   SER  45           HA       SER  45   9.713   9.839  18.367
  308    HB2  SER  45           1HB      SER  45   8.049  11.052  16.187
  309    HB3  SER  45           2HB      SER  45   7.812   9.360  16.624
  310    HG   SER  45           HG       SER  45   7.907  11.243  18.683
  311    H    GLY  46           H        GLY  46   9.768   7.687  17.534
  312    HA2  GLY  46           1HA      GLY  46  11.432   7.436  15.104
  313    HA3  GLY  46           2HA      GLY  46  11.623   6.406  16.515