*HEADER    TRANSCRIPTION                           29-MAR-07   2EOV              
*TITLE     SOLUTION STRUCTURE OF THE C2H2 TYPE ZINC FINGER (REGION 519-          
*TITLE    2 551) OF HUMAN ZINC FINGER PROTEIN 484                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER PROTEIN 484;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-C2H2, UNP RESIDUES 519-551;                             
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: ZNF484;                                                        
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P070115-43;                               
*SOURCE   8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
*KEYWDS    ZF-C2H2, NMR, STRUCTURAL GENOMICS, NPPSFA, NATIONAL PROJECT           
*KEYWDS   2 ON PROTEIN STRUCTURAL AND FUNCTIONAL ANALYSES, RIKEN                 
*KEYWDS   3 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI,                     
*KEYWDS   4 TRANSCRIPTION                                                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    N.TOCHIO, T.TOMIZAWA, H.ABE, K.SAITO, H.LI, M.SATO,                   
*AUTHOR   2 S.KOSHIBA, N.KOBAYASHI, T.KIGAWA, S.YOKOYAMA, RIKEN                  
*AUTHOR   3 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI)                     
*REVDAT   1   12-MAY-09 2EOV    0                                                

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

15 CYSS SG   201 ZN   ZN   2.19  5.00E+00
15 CYSS CB   201 ZN   ZN   3.25  5.00E+00
18 CYSS SG   201 ZN   ZN   2.19  5.00E+00
18 CYSS CB   201 ZN   ZN   3.25  5.00E+00
31 HIS NE2   201 ZN   ZN   1.90  5.00E+00
35 HIS NE2   201 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 SG   201 ZN   ZN   2.39  5.00E+00
15 CYSS CB   201 ZN   ZN   3.51  5.00E+00
18 CYSS SG   201 ZN   ZN   2.39  5.00E+00
18 CYSS CB   201 ZN   ZN   3.51  5.00E+00
31 HIS NE2   201 ZN   ZN   2.10  5.00E+00
35 HIS NE2   201 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

  26  SER   PHI  -97.3  -37.3
  26  SER   PSI  -63.8   -3.8
  27  ARG  PHI  -96.7  -36.7
  27  ARG  PSI  -70.1  -10.1
  28  LEU   PHI  -98.9  -38.9
  28  LEU   PSI  -69.0   -9.0
  29  ARG  PHI  -90.4  -30.4
  29  ARG  PSI  -69.7   -9.7
  30  ILE   PHI  -95.2  -35.2
  30  ILE   PSI  -70.0  -10.0
  31  HIS   PHI  -94.2  -34.2
  31  HIS   PSI  -68.9   -8.9
  32  GLN   PHI  -94.3  -34.3
  32  GLN   PSI  -70.4  -10.4
  33  LYS  PHI  -94.4  -34.4
  33  LYS  PSI  -72.1  -12.1

35 HIS CHI1 -90 -30
 15 CYSS HN     20 LYS  HN      4.44 #SUP  0.99  #QF  0.99
 19 GLY  HN     20 LYS  HN      3.69 #SUP  0.74  #QF  0.74
 18 CYSS HN     20 LYS  HN      4.11 #SUP  0.38  #QF  0.38
 15 CYSS HB3    20 LYS  HN      3.40 #SUP  0.93  #QF  0.93
 15 CYSS HB2    20 LYS  HN      3.89 #SUP  0.98  #QF  0.98
 20 LYS  HN     20 LYS  HB2     3.66 #SUP  0.99  #QF  0.99
 20 LYS  HN     20 LYS  HB3     3.66 #SUP  0.95  #QF  0.95
 20 LYS  HN     20 LYS  HG3     4.80 #SUP  0.98  #QF  0.98
 15 CYSS HB2    17 ASP  HN      4.81 #SUP  0.73  #QF  0.73
 32 GLN  QG     32 GLN  HE21    4.00 #SUP  0.99  #QF  0.99
 32 GLN  QG     32 GLN  HE22    4.00 #SUP  0.89  #QF  0.89
 17 ASP  HN     17 ASP  HB3     3.81 #SUP  0.96  #QF  0.96
 11 LYS  HN     11 LYS  HG2     5.31 #SUP  1.00  #QF  0.79
 11 LYS  HN     11 LYS  HG3     5.31 #SUP  1.00  #QF  0.79
 16 SER  HB2    17 ASP  HN      5.04 #SUP  0.85  #QF  0.49
 16 SER  HB3    17 ASP  HN      5.04 #SUP  0.85  #QF  0.49
 11 LYS  HN     21 SER  QB      4.92 #SUP  0.97  #QF  0.95
 15 CYSS HB3    17 ASP  HN      4.60 #SUP  0.83  #QF  0.83
 36 THR  HN     36 THR  QG2     4.64 #SUP  0.78  #QF  0.78
 17 ASP  HN     19 GLY  HN      4.28 #SUP  0.97  #QF  0.97
 15 CYSS HB3    19 GLY  HN      3.71 #SUP  0.97  #QF  0.74
 14 LYS  QG     19 GLY  HN      4.80 #SUP  0.92  #QF  0.92
 15 CYSS HB2    19 GLY  HN      4.43 #SUP  0.94  #QF  0.25
 28 LEU  HN     29 ARG  HN      3.26 #SUP  0.99  #QF  0.99
 22 PHE  QD     28 LEU  HN      4.50 #SUP  0.96  #QF  0.94
 28 LEU  HN     30 ILE  HN      4.96 #SUP  0.96  #QF  0.94
 27 ARG  HN     28 LEU  HN      3.26 #SUP  0.97  #QF  0.97
 27 ARG  HB2    28 LEU  HN      3.84 #SUP  0.97  #QF  0.97
 28 LEU  HN     28 LEU  HB3     3.15 #SUP  0.99  #QF  0.99
 28 LEU  HN     29 ARG  QB      5.50 #SUP  0.96  #QF  0.61
 28 LEU  HN     28 LEU  HB2     3.33 #SUP  0.98  #QF  0.98
 28 LEU  HN     28 LEU  QD1     4.56 #SUP  1.00  #QF  0.58
 28 LEU  HN     28 LEU  QD2     4.91 #SUP  1.00  #QF  0.58
 22 PHE  HB3    28 LEU  HN      4.34 #SUP  0.72  #QF  0.72
 22 PHE  HB2    28 LEU  HN      4.46 #SUP  0.95  #QF  0.95
 28 LEU  HN     28 LEU  HG      4.67 #SUP  1.00
 36 THR  HB     37 GLY  HN      5.50 #SUP  0.97  #QF  0.95
 27 ARG  HN     30 ILE  HN      5.50 #SUP  0.72  #QF  0.60
 24 TRP  HA     27 ARG  HN      4.94 #SUP  0.99  #QF  0.99
 24 TRP  HB2    27 ARG  HN      3.55 #SUP  0.97  #QF  0.97
 27 ARG  HN     29 ARG  HN      4.55 #SUP  0.77  #QF  0.77
 24 TRP  HB3    27 ARG  HN      3.81 #SUP  0.99  #QF  0.99
 27 ARG  HN     27 ARG  QD      4.48 #SUP  0.94  #QF  0.94
 27 ARG  HN     27 ARG  HB2     3.42 #SUP  0.99  #QF  0.99
 27 ARG  HN     27 ARG  HG2     3.84 #SUP  0.97  #QF  0.97
 27 ARG  HN     27 ARG  HG3     3.84 #SUP  0.99  #QF  0.99
 27 ARG  HN     30 ILE  QD1     4.93 #SUP  0.94  #QF  0.94
 31 HIS  HN     32 GLN  HN      3.56 #SUP  1.00
 22 PHE  QE     31 HIS  HN      5.01 #SUP  0.77  #QF  0.77
 27 ARG  HA     31 HIS  HN      5.16 #SUP  0.99  #QF  0.98
 29 ARG  HA     31 HIS  HN      5.50 #SUP  0.99  #QF  0.98
 31 HIS  HN     31 HIS  HB3     3.20 #SUP  0.96  #QF  0.96
 31 HIS  HN     31 HIS  HB2     3.20 #SUP  0.98  #QF  0.98
 31 HIS  HN     32 GLN  QG      5.09 #SUP  0.86  #QF  0.86
 30 ILE  HB     31 HIS  HN      3.41 #SUP  0.85  #QF  0.85
 30 ILE  QG2    31 HIS  HN      3.96 #SUP  0.99  #QF  0.99
 23 THR  QG2    24 TRP  HE1     4.70 #SUP  0.73  #QF  0.73
 33 LYS  HA     35 HIS  HN      4.72 #SUP  0.95  #QF  0.95
 35 HIS  HN     36 THR  QG2     5.09 #SUP  0.66  #QF  0.66
 35 HIS  HN     36 THR  HN      4.24 #SUP  0.65  #QF  0.65
 35 HIS  HN     35 HIS  HD2     4.58 #SUP  0.90  #QF  0.90
 32 GLN  HA     35 HIS  HN      4.47 #SUP  0.86  #QF  0.86
 34 CYS  HB2    35 HIS  HN      4.75 #SUP  0.99  #QF  0.99
 34 CYS  HB3    35 HIS  HN      4.75 #SUP  0.97  #QF  0.97
 13 TYR  QE     25 LYS  HN      4.91 #SUP  0.87  #QF  0.87
 33 LYS  HN     34 CYS  HN      3.52 #SUP  1.00
 31 HIS  HA     33 LYS  HN      4.80 #SUP  0.88  #QF  0.88
 30 ILE  HN     31 HIS  HA      5.46 #SUP  0.97  #QF  0.97
 30 ILE  HA     33 LYS  HN      4.28 #SUP  0.91  #QF  0.66
 32 GLN  HB2    33 LYS  HN      4.43 #SUP  0.93  #QF  0.93
 32 GLN  HB3    33 LYS  HN      4.43 #SUP  0.96  #QF  0.96
 33 LYS  HN     33 LYS  QB      3.11 #SUP  0.88  #QF  0.88
 33 LYS  HN     33 LYS  HG2     4.00 #SUP  0.96  #QF  0.94
 33 LYS  HN     33 LYS  HG3     4.00 #SUP  0.99  #QF  0.99
 30 ILE  HN     32 GLN  HN      4.82 #SUP  0.65  #QF  0.65
 29 ARG  QD     30 ILE  HN      5.33 #SUP  0.98  #QF  0.82
 30 ILE  HN     30 ILE  HB      3.10 #SUP  0.75  #QF  0.58
 30 ILE  HN     30 ILE  HG13    3.66 #SUP  0.75  #QF  0.58
 30 ILE  HN     30 ILE  HG12    3.66 #SUP  0.98  #QF  0.98
 30 ILE  HN     30 ILE  QG2     3.85 #SUP  0.69  #QF  0.69
 15 CYSS HN     22 PHE  HN      4.82 #SUP  0.83  #QF  0.83
 29 ARG  HN     31 HIS  HN      4.68 #SUP  0.27  #QF  0.27
 29 ARG  HN     30 ILE  HN      3.55 #SUP  0.99  #QF  0.99
 25 LYS  HA     29 ARG  HN      4.91 #SUP  0.84  #QF  0.41
 29 ARG  HN     29 ARG  QD      5.12 #SUP  0.84  #QF  0.41
 28 LEU  HB3    29 ARG  HN      3.43 #SUP  0.98  #QF  0.98
 29 ARG  HN     29 ARG  QB      2.95 #SUP  0.96  #QF  0.96
 29 ARG  HN     29 ARG  HG2     3.78 #SUP  0.95  #QF  0.95
 29 ARG  HN     29 ARG  HG3     3.78 #SUP  0.77  #QF  0.77
 28 LEU  HB2    29 ARG  HN      3.87 #SUP  0.92  #QF  0.92
 28 LEU  QD2    29 ARG  HN      4.11 #SUP  0.87  #QF  0.87
 22 PHE  HN     22 PHE  QD      3.34 #SUP  0.95  #QF  0.95
 22 PHE  HN     22 PHE  QE      4.58 #SUP  0.97  #QF  0.97
 21 SER  HA     22 PHE  HN      2.95 #SUP  0.90  #QF  0.90
 21 SER  QB     22 PHE  HN      3.32 #SUP  0.84  #QF  0.84
 22 PHE  HN     22 PHE  HB3     3.97 #SUP  1.00
 13 TYR  HB3    22 PHE  HN      4.74 #SUP  0.99  #QF  0.99
 13 TYR  HB2    22 PHE  HN      4.18 #SUP  0.97  #QF  0.97
 22 PHE  HN     22 PHE  HB2     3.46 #SUP  0.95  #QF  0.95
 14 LYS  QG     22 PHE  HN      5.50 #SUP  0.97  #QF  0.61
 22 PHE  HN     28 LEU  QD1     5.31 #SUP  0.97  #QF  0.96
 22 PHE  HN     28 LEU  QD2     5.50 #SUP  0.97  #QF  0.96
 13 TYR  HN     13 TYR  QD      3.57 #SUP  0.95  #QF  0.95
 11 LYS  HA     13 TYR  HN      4.60 #SUP  0.99  #QF  0.99
 12 PRO  QD     13 TYR  HN      3.59 #SUP  0.96  #QF  0.96
 13 TYR  HN     13 TYR  HB2     3.33 #SUP  0.93  #QF  0.93
 13 TYR  HN     22 PHE  HB2     5.23 #SUP  0.98  #QF  0.98
 12 PRO  HB3    13 TYR  HN      4.56 #SUP  0.97  #QF  0.97
 12 PRO  HB2    13 TYR  HN      4.18 #SUP  0.99  #QF  0.99
 13 TYR  HN     22 PHE  HN      4.01 #SUP  0.98  #QF  0.98
 14 LYS  HN     15 CYSS HN      4.50 #SUP  0.92  #QF  0.92
 11 LYS  HN     13 TYR  HN      4.96 #SUP  0.60  #QF  0.60
 15 CYSS HN     19 GLY  HN      4.69 #SUP  0.73  #QF  0.73
 15 CYSS HN     22 PHE  QD      4.71 #SUP  0.99  #QF  0.99
 15 CYSS HN     22 PHE  QE      4.36 #SUP  0.99  #QF  0.99
 15 CYSS HN     21 SER  HA      3.76 #SUP  0.92  #QF  0.92
 12 PRO  HA     13 TYR  HN      3.46 #SUP  0.97  #QF  0.97
 15 CYSS HN     15 CYSS HB3     3.16 #SUP  0.98  #QF  0.98
 13 TYR  HN     13 TYR  HB3     4.06 #SUP  0.96  #QF  0.96
 15 CYSS HN     15 CYSS HB2     3.27 #SUP  0.97  #QF  0.97
 14 LYS  HB3    15 CYSS HN      4.83 #SUP  1.00
 14 LYS  QD     15 CYSS HN      5.13 #SUP  1.00
 14 LYS  QG     15 CYSS HN      3.85 #SUP  0.96  #QF  0.96
 15 CYSS HN     28 LEU  QD1     3.94 #SUP  0.95  #QF  0.95
 24 TRP  HN     27 ARG  HN      5.00 #SUP  0.98  #QF  0.98
 23 THR  HN     24 TRP  HN      4.72 #SUP  0.96  #QF  0.96
 23 THR  HB     24 TRP  HN      3.67 #SUP  0.90  #QF  0.90
 22 PHE  HB3    24 TRP  HN      3.64 #SUP  0.67  #QF  0.67
 24 TRP  HN     24 TRP  HB2     3.50 #SUP  0.96  #QF  0.96
 22 PHE  HB2    24 TRP  HN      4.65 #SUP  0.94  #QF  0.94
 24 TRP  HN     27 ARG  HB2     4.34 #SUP  0.96  #QF  0.96
 24 TRP  HN     27 ARG  HB3     5.16 #SUP  0.97  #QF  0.30
 23 THR  QG2    24 TRP  HN      4.50 #SUP  0.89  #QF  0.89
 31 HIS  HD2    32 GLN  HN      4.15 #SUP  0.90  #QF  0.90
 29 ARG  HA     32 GLN  HN      4.04 #SUP  0.93  #QF  0.93
 29 ARG  QB     32 GLN  HN      5.45 #SUP  0.94  #QF  0.82
 32 GLN  HN     33 LYS  QB      5.50 #SUP  0.94  #QF  0.82
 28 LEU  HG     32 GLN  HN      4.73 #SUP  0.91  #QF  0.91
 32 GLN  HN     33 LYS  HN      3.57 #SUP  0.99  #QF  0.99
 31 HIS  HB3    32 GLN  HN      4.24 #SUP  0.97  #QF  0.97
 31 HIS  HB2    32 GLN  HN      4.24 #SUP  1.00
 32 GLN  HN     32 GLN  QG      3.37 #SUP  0.99  #QF  0.99
 32 GLN  HN     32 GLN  HB2     3.74 #SUP  0.99  #QF  0.99
 32 GLN  HN     32 GLN  HB3     3.74 #SUP  1.00
 28 LEU  QD1    32 GLN  HN      4.34 #SUP  0.88  #QF  0.88
 21 SER  HN     22 PHE  HN      4.91 #SUP  0.99  #QF  0.99
 20 LYS  HA     21 SER  HN      2.77 #SUP  0.87  #QF  0.87
 21 SER  HN     21 SER  QB      3.39 #SUP  0.82  #QF  0.82
 34 CYS  HN     35 HIS  HN      3.48 #SUP  0.99  #QF  0.99
 30 ILE  HA     34 CYS  HN      5.14 #SUP  0.69  #QF  0.22
 34 CYS  HN     34 CYS  HB2     3.72 #SUP  0.97  #QF  0.97
 34 CYS  HN     34 CYS  HB3     3.72 #SUP  0.96  #QF  0.96
 33 LYS  QB     34 CYS  HN      3.90 #SUP  0.91  #QF  0.91
 33 LYS  QD     34 CYS  HN      5.50 #SUP  0.96  #QF  0.90
 13 TYR  HN     14 LYS  HN      4.63 #SUP  0.67  #QF  0.67
 13 TYR  QD     14 LYS  HN      4.34 #SUP  0.90  #QF  0.90
 13 TYR  HB3    14 LYS  HN      4.09 #SUP  0.94  #QF  0.94
 13 TYR  HB2    14 LYS  HN      4.53 #SUP  0.99  #QF  0.99
 14 LYS  HN     14 LYS  QG      4.46 #SUP  0.97  #QF  0.97
 14 LYS  HN     28 LEU  QD2     4.02 #SUP  0.76  #QF  0.76
 18 CYSS HN     18 CYSS HB2     3.84 #SUP  0.95  #QF  0.95
 17 ASP  HN     18 CYSS HN      3.26 #SUP  1.00
 18 CYSS HN     19 GLY  HN      3.02 #SUP  1.00
 16 SER  HA     18 CYSS HN      5.50 #SUP  1.00  #QF  0.90
 15 CYSS HB3    18 CYSS HN      4.09 #SUP  1.00  #QF  0.73
 18 CYSS HN     18 CYSS HB3     3.84 #SUP  0.98  #QF  0.98
 17 ASP  HB3    18 CYSS HN      3.83 #SUP  0.96  #QF  0.96
 30 ILE  HN     31 HIS  HN      3.32 #SUP  0.99  #QF  0.99
 17 ASP  HN     17 ASP  HB2     3.81 #SUP  1.00
 17 ASP  HB2    18 CYSS HN      3.83 #SUP  0.98  #QF  0.98
 29 ARG  QB     30 ILE  HN      3.35 #SUP  0.92  #QF  0.92
 28 LEU  QD1    32 GLN  HE22    4.75 #SUP  0.71  #QF  0.71
 28 LEU  QD1    31 HIS  HD2     3.64 #SUP  0.93  #QF  0.89
 28 LEU  QD1    32 GLN  HE21    4.75 #SUP  0.93  #QF  0.89
 15 CYSS HA     28 LEU  QD1     3.60 #SUP  0.94  #QF  0.94
 22 PHE  HB3    28 LEU  QD1     4.84 #SUP  1.00
 15 CYSS HB2    28 LEU  QD1     3.45 #SUP  0.81  #QF  0.71
 28 LEU  QD1    32 GLN  QG      3.87 #SUP  0.81  #QF  0.71
 28 LEU  HB3    28 LEU  QD1     4.05 #SUP  1.00
 12 PRO  QD     13 TYR  QE      4.48 #SUP  0.61  #QF  0.61
 13 TYR  QE     25 LYS  QE      4.14 #SUP  0.70  #QF  0.70
 12 PRO  HB2    13 TYR  QE      4.29 #SUP  0.78  #QF  0.56
 13 TYR  QE     25 LYS  HG3     4.72 #SUP  0.78  #QF  0.56
 13 TYR  QE     25 LYS  QD      3.87 #SUP  0.90  #QF  0.90
 13 TYR  QE     25 LYS  HG2     4.72 #SUP  0.92  #QF  0.92
 14 LYS  QG     19 GLY  HA1     4.83 #SUP  0.99  #QF  0.99
 36 THR  HA     36 THR  QG2     3.48 #SUP  0.98  #QF  0.41
 22 PHE  HB3    27 ARG  HN      5.48 #SUP  0.99  #QF  0.99
 13 TYR  HB2    22 PHE  HB3     4.29 #SUP  0.99  #QF  0.99
 22 PHE  HB2    28 LEU  HB3     4.64 #SUP  0.87  #QF  0.87
 22 PHE  HB3    28 LEU  HB2     4.52 #SUP  0.98  #QF  0.98
 22 PHE  HB2    28 LEU  HB2     4.23 #SUP  1.00
 22 PHE  HB2    28 LEU  QD1     4.77 #SUP  0.99  #QF  0.88
 22 PHE  HB2    28 LEU  QD2     5.46 #SUP  0.99  #QF  0.88
 29 ARG  QB     29 ARG  QD      3.61 #SUP  0.99  #QF  0.98
 27 ARG  HA     27 ARG  QD      3.73 #SUP  1.00
 27 ARG  HB2    27 ARG  QD      4.20 #SUP  1.00
 27 ARG  HB3    27 ARG  QD      3.80 #SUP  0.99  #QF  0.79
 24 TRP  HB2    27 ARG  QD      3.87 #SUP  0.95  #QF  0.95
 23 THR  QG2    24 TRP  HZ2     5.50 #SUP  0.58  #QF  0.58
 11 LYS  HG2    11 LYS  QE      4.10 #SUP  0.99  #QF  0.89
 11 LYS  HG3    11 LYS  QE      4.10 #SUP  0.99  #QF  0.89
 14 LYS  QE     19 GLY  HA2     4.48 #SUP  0.96  #QF  0.96
 14 LYS  QE     19 GLY  HA1     4.48 #SUP  1.00
 14 LYS  QG     21 SER  QB      5.30 #SUP  0.90  #QF  0.79
 14 LYS  QG     14 LYS  QE      3.64 #SUP  0.92  #QF  0.92
 25 LYS  HG3    25 LYS  QE      4.16 #SUP  1.00  #QF  0.87
 25 LYS  HG2    25 LYS  QE      4.16 #SUP  1.00
 13 TYR  QD     23 THR  HA      4.46 #SUP  0.97  #QF  0.97
 27 ARG  HA     30 ILE  QG2     4.77 #SUP  0.97  #QF  0.97
 12 PRO  QD     23 THR  HA      3.31 #SUP  0.97  #QF  0.97
 11 LYS  HG2    23 THR  HA      5.31 #SUP  0.87  #QF  0.44
 11 LYS  HG3    23 THR  HA      5.31 #SUP  0.87  #QF  0.44
 23 THR  HA     23 THR  QG2     3.55 #SUP  0.99  #QF  0.99
 30 ILE  HA     33 LYS  QE      4.65 #SUP  0.83  #QF  0.83
 30 ILE  HA     33 LYS  HG2     4.79 #SUP  0.99  #QF  0.95
 30 ILE  HA     33 LYS  HG3     4.79 #SUP  0.95  #QF  0.95
 30 ILE  HA     30 ILE  HG12    3.99 #SUP  1.00
 30 ILE  HA     30 ILE  QG2     3.40 #SUP  0.99  #QF  0.99
 22 PHE  QD     28 LEU  HB3     5.50 #SUP  1.00
 28 LEU  HB3    30 ILE  HN      5.50 #SUP  1.00
 25 LYS  HA     28 LEU  HB2     3.92 #SUP  0.77  #QF  0.77
 28 LEU  HB3    28 LEU  QD2     3.50 #SUP  1.00  #QF  0.79
 28 LEU  HB2    28 LEU  QD1     3.69 #SUP  1.00  #QF  0.85
 13 TYR  HB3    22 PHE  HB2     4.21 #SUP  0.99  #QF  0.99
 13 TYR  HB2    22 PHE  HB2     3.95 #SUP  1.00
 13 TYR  HB3    28 LEU  HB3     4.70 #SUP  0.99  #QF  0.99
 13 TYR  HB3    28 LEU  HB2     4.41 #SUP  0.99  #QF  0.99
 13 TYR  HB2    28 LEU  HB2     4.56 #SUP  1.00
 13 TYR  HB2    28 LEU  QD1     4.89 #SUP  1.00  #QF  0.31
 13 TYR  QD     24 TRP  HA      4.45 #SUP  0.67  #QF  0.67
 12 PRO  QD     13 TYR  QD      4.06 #SUP  0.99  #QF  0.99
 13 TYR  QD     22 PHE  HB2     4.51 #SUP  0.88  #QF  0.88
 12 PRO  HB3    13 TYR  QD      5.50 #SUP  1.00
 13 TYR  QD     28 LEU  HB3     5.50 #SUP  1.00
 12 PRO  HB2    13 TYR  QD      4.17 #SUP  0.90  #QF  0.90
 13 TYR  QD     28 LEU  QD2     3.80 #SUP  0.88  #QF  0.88
 30 ILE  HN     30 ILE  QD1     4.28 #SUP  0.99  #QF  0.99
 27 ARG  HA     30 ILE  QD1     3.78 #SUP  0.98  #QF  0.98
 30 ILE  HA     30 ILE  QD1     4.03 #SUP  0.99  #QF  0.99
 27 ARG  QD     30 ILE  QD1     4.37 #SUP  0.98  #QF  0.98
 26 SER  HA     29 ARG  QD      4.53 #SUP  0.70  #QF  0.70
 26 SER  HA     29 ARG  HN      4.62 #SUP  0.85  #QF  0.85
 26 SER  HA     29 ARG  QB      3.60 #SUP  0.54  #QF  0.54
 21 SER  HA     22 PHE  QD      3.98 #SUP  1.00
 22 PHE  QD     28 LEU  HA      4.13 #SUP  0.94  #QF  0.94
 15 CYSS HB2    22 PHE  QD      4.52 #SUP  0.40  #QF  0.40
 22 PHE  QD     27 ARG  HB2     4.15 #SUP  0.98  #QF  0.98
 22 PHE  QD     27 ARG  HB3     3.84 #SUP  0.94  #QF  0.94
 22 PHE  QD     28 LEU  HG      5.50 #SUP  0.84  #QF  0.22
 22 PHE  QD     28 LEU  HB2     3.95 #SUP  1.00
 22 PHE  QD     28 LEU  QD1     3.49 #SUP  0.99  #QF  0.99
 25 LYS  HA     28 LEU  HN      4.22 #SUP  0.86  #QF  0.86
 13 TYR  QD     25 LYS  HA      4.41 #SUP  0.23  #QF  0.23
 25 LYS  HA     28 LEU  HB3     3.59 #SUP  0.75  #QF  0.75
 25 LYS  HA     25 LYS  HG3     3.96 #SUP  1.00
 25 LYS  HA     25 LYS  HG2     3.96 #SUP  0.91  #QF  0.84
 32 GLN  HA     34 CYS  HN      4.77 #SUP  0.96  #QF  0.96
 31 HIS  HD2    32 GLN  HA      3.93 #SUP  0.99  #QF  0.99
 32 GLN  HA     35 HIS  HD2     3.47 #SUP  0.98  #QF  0.98
 32 GLN  HA     32 GLN  QG      3.45 #SUP  1.00
 14 LYS  HB2    15 CYSS HN      4.83 #SUP  1.00
 32 GLN  HA     33 LYS  HA      5.06 #SUP  0.98  #QF  0.98
 30 ILE  QG2    31 HIS  HA      4.48 #SUP  1.00
 29 ARG  HA     29 ARG  QD      4.16 #SUP  1.00
 29 ARG  HA     32 GLN  QG      4.28 #SUP  0.98  #QF  0.98
 28 LEU  QD1    29 ARG  HA      5.34 #SUP  0.93  #QF  0.77
 28 LEU  QD2    29 ARG  HA      5.50 #SUP  0.93  #QF  0.77
 29 ARG  HA     29 ARG  HG2     4.07 #SUP  0.99  #QF  0.99
 15 CYSS HB3    22 PHE  QE      4.11 #SUP  0.97  #QF  0.97
 22 PHE  QE     31 HIS  HB3     4.54 #SUP  0.92  #QF  0.92
 22 PHE  QE     31 HIS  HB2     4.54 #SUP  0.89  #QF  0.89
 15 CYSS HB2    22 PHE  QE      3.92 #SUP  0.94  #QF  0.94
 22 PHE  QE     27 ARG  HB3     4.87 #SUP  0.87  #QF  0.87
 20 LYS  HB2    22 PHE  QE      4.23 #SUP  0.97  #QF  0.96
 20 LYS  HB3    22 PHE  QE      4.23 #SUP  0.97  #QF  0.97
 22 PHE  QE     28 LEU  QD1     3.85 #SUP  0.96  #QF  0.96
 33 LYS  HA     36 THR  QG2     4.38 #SUP  0.95  #QF  0.95
 28 LEU  HA     31 HIS  HN      4.43 #SUP  0.71  #QF  0.71
 27 ARG  HA     30 ILE  HN      4.05 #SUP  0.96  #QF  0.96
 22 PHE  QE     28 LEU  HA      4.40 #SUP  0.74  #QF  0.74
 28 LEU  HA     31 HIS  HA      5.49 #SUP  0.69  #QF  0.69
 27 ARG  HA     30 ILE  HB      3.49 #SUP  0.95  #QF  0.95
 28 LEU  HA     28 LEU  HG      4.15 #SUP  1.00
 28 LEU  HA     28 LEU  QD1     3.35 #SUP  0.99  #QF  0.99
 14 LYS  QD     21 SER  HA      5.50 #SUP  0.90  #QF  0.78
 14 LYS  QG     21 SER  HA      4.49 #SUP  0.84  #QF  0.23
 22 PHE  HZ     31 HIS  HB3     4.53 #SUP  1.00
 22 PHE  HZ     31 HIS  HB2     4.53 #SUP  0.99  #QF  0.99
 20 LYS  HB2    22 PHE  HZ      4.57 #SUP  0.94  #QF  0.90
 20 LYS  HB3    22 PHE  HZ      4.57 #SUP  0.99  #QF  0.99
 24 TRP  HB3    27 ARG  QD      4.69 #SUP  0.67  #QF  0.67
 32 GLN  QG     35 HIS  HD2     4.27 #SUP  0.92  #QF  0.92
 24 TRP  HB3    27 ARG  HB2     4.79 #SUP  1.00
 24 TRP  HB2    27 ARG  HB2     4.36 #SUP  1.00
 24 TRP  HB3    27 ARG  HG2     4.84 #SUP  0.99  #QF  0.99
 24 TRP  HB2    27 ARG  HG2     4.50 #SUP  1.00  #QF  0.34
 24 TRP  HB3    27 ARG  HG3     4.84 #SUP  1.00
 39 ARG  HA     39 ARG  QG      4.02 #SUP  0.93  #QF  0.93
 39 ARG  HA     39 ARG  QD      4.76 #SUP  0.97  #QF  0.97
 24 TRP  HA     24 TRP  HD1     4.33 #SUP  0.98  #QF  0.98
 23 THR  HB     24 TRP  HD1     4.51 #SUP  0.81  #QF  0.81
 24 TRP  HD1    27 ARG  QD      5.20 #SUP  0.93  #QF  0.93
 23 THR  QG2    24 TRP  HD1     4.35 #SUP  0.85  #QF  0.85
 31 HIS  HD2    35 HIS  HD2     4.32 #SUP  0.68  #QF  0.68
 15 CYSS HB2    31 HIS  HD2     3.55 #SUP  0.66  #QF  0.56
 31 HIS  HD2    32 GLN  QG      4.08 #SUP  0.66  #QF  0.56
 24 TRP  HA     24 TRP  HE3     4.24 #SUP  1.00
 13 TYR  QE     24 TRP  HA      4.08 #SUP  0.93  #QF  0.93
 11 LYS  HA     23 THR  HA      4.19 #SUP  0.99  #QF  0.99
 15 CYSS HB3    31 HIS  HD2     4.16 #SUP  0.48  #QF  0.48
 22 PHE  HB3    27 ARG  HB2     4.26 #SUP  1.00  #QF  0.81
 15 CYSS HB3    28 LEU  QD1     4.10 #SUP  1.00
 27 ARG  HB3    28 LEU  HN      4.90 #SUP  1.00
 30 ILE  HA     30 ILE  HG13    3.99 #SUP  1.00
 30 ILE  HA     33 LYS  QD      4.35 #SUP  1.00
 33 LYS  QB     33 LYS  QD      3.46 #SUP  0.99  #QF  0.99
 24 TRP  HB2    27 ARG  HG3     4.50 #SUP  1.00
 28 LEU  HG     29 ARG  HA      4.74 #SUP  0.99  #QF  0.99
 28 LEU  HG     32 GLN  QG      4.24 #SUP  0.95  #QF  0.95
 29 ARG  HA     29 ARG  HG3     4.07 #SUP  1.00
 22 PHE  QD     28 LEU  QD2     4.69 #SUP  0.97  #QF  0.97
 28 LEU  HB2    28 LEU  QD2     3.98 #SUP  0.82  #QF  0.82
 11 LYS  HA     12 PRO  QD      3.02 #SUP  0.99  #QF  0.99
 13 TYR  HB3    28 LEU  QD2     3.45 #SUP  0.97  #QF  0.97
 13 TYR  HB2    28 LEU  QD2     4.18 #SUP  0.74  #QF  0.58
 28 LEU  QD2    32 GLN  QG      4.43 #SUP  0.74  #QF  0.58
 11 LYS  HG2    12 PRO  QD      4.88 #SUP  0.94  #QF  0.74
 12 PRO  QD     23 THR  QG2     4.51 #SUP  0.76  #QF  0.76
 20 LYS  HN     20 LYS  HG2     4.80 #SUP  0.99  #QF  0.99
 42 GLY  QA     43 PRO  QD      3.34 #SUP  0.94  #QF  0.94
 14 LYS  QG     19 GLY  HA2     4.83 #SUP  0.97  #QF  0.97
 11 LYS  HG3    12 PRO  QD      4.88 #SUP  0.98  #QF  0.85
 22 PHE  HB3    27 ARG  HB3     4.48 #SUP  0.86  #QF  0.86
 18 CYSS HB2    35 HIS  HE1     3.99 #SUP  0.97  #QF  0.97
 18 CYSS HB3    35 HIS  HE1     3.99 #SUP  1.00
 33 LYS  HA     33 LYS  QD      4.71 #SUP  0.97  #QF  0.94
 18 CYSS HA     35 HIS  HE1     4.98 #SUP  0.98  #QF  0.98
 11 LYS  HN     11 LYS  QG      4.53 
 11 LYS  HA     11 LYS  QG      3.70 
 11 LYS  QB     12 PRO  QD      3.67 
 11 LYS  QB     13 TYR  HN      4.45 
 11 LYS  QB     21 SER  QB      3.73 
 11 LYS  QB     22 PHE  HN      4.12 
 11 LYS  QB     23 THR  HA      4.45 
 11 LYS  QG     11 LYS  QE      3.50 
 11 LYS  QG     12 PRO  QD      4.22 
 11 LYS  QG     21 SER  QB      4.71 
 11 LYS  QG     22 PHE  HN      5.34 
 11 LYS  QG     23 THR  HA      4.55 
 12 PRO  QG     13 TYR  HN      3.90 
 12 PRO  QG     13 TYR  QD      3.95 
 13 TYR  QE     25 LYS  QB      5.22 
 13 TYR  QE     25 LYS  QG      3.99 
 14 LYS  HN     14 LYS  QB      3.12 
 14 LYS  QB     15 CYSS HN      4.21 
 14 LYS  QB     21 SER  HA      5.26 
 14 LYS  QG     19 GLY  QA      4.06 
 14 LYS  QD     19 GLY  QA      4.65 
 15 CYSS HB2    20 LYS  QB      4.51 
 15 CYSS HB3    20 LYS  QB      4.39 
 16 SER  QB     17 ASP  HN      4.36 
 17 ASP  HN     17 ASP  QB      3.06 
 17 ASP  QB     18 CYSS HN      3.29 
 17 ASP  QB     35 HIS  HD2     4.26 
 18 CYSS HN     18 CYSS QB      3.32 
 18 CYSS HN     19 GLY  QA      4.39 
 18 CYSS QB     35 HIS  HE1     3.30 
 20 LYS  HN     20 LYS  QB      2.93 
 20 LYS  HN     20 LYS  QG      4.01 
 20 LYS  HA     20 LYS  QG      3.58 
 20 LYS  QB     21 SER  HN      3.53 
 20 LYS  QB     22 PHE  QD      5.34 
 20 LYS  QB     22 PHE  QE      3.66 
 20 LYS  QB     22 PHE  HZ      3.85 
 20 LYS  QG     20 LYS  QE      3.32 
 20 LYS  QG     21 SER  HN      4.06 
 20 LYS  QD     21 SER  HN      4.89 
 20 LYS  QD     22 PHE  HZ      4.54 
 20 LYS  QD     31 HIS  HE1     3.71 
 22 PHE  QE     31 HIS  QB      3.83 
 22 PHE  HZ     31 HIS  QB      3.79 
 24 TRP  HN     27 ARG  QG      5.17 
 24 TRP  HB2    27 ARG  QG      3.85 
 24 TRP  HB3    27 ARG  QG      4.23 
 24 TRP  HD1    27 ARG  QG      4.56 
 24 TRP  HE3    27 ARG  QG      5.19 
 25 LYS  HA     25 LYS  QG      3.42 
 25 LYS  QB     25 LYS  QD      3.50 
 26 SER  QB     27 ARG  HN      4.34 
 27 ARG  HN     27 ARG  QG      3.23 
 27 ARG  HA     27 ARG  QG      3.67 
 27 ARG  HA     30 ILE  QG1     4.59 
 27 ARG  QG     28 LEU  HN      5.07 
 28 LEU  QD1    31 HIS  QB      4.36 
 28 LEU  QD1    32 GLN  QE2     3.94 
 28 LEU  QD2    32 GLN  QE2     4.55 
 29 ARG  HN     29 ARG  QG      3.29 
 29 ARG  HA     29 ARG  QG      3.42 
 29 ARG  HA     32 GLN  QB      3.71 
 30 ILE  HN     30 ILE  QG1     3.10 
 30 ILE  HN     31 HIS  QB      5.34 
 30 ILE  HA     30 ILE  QG1     3.31 
 30 ILE  HA     33 LYS  QG      4.13 
 31 HIS  QB     32 GLN  HN      3.38 
 31 HIS  QB     32 GLN  QG      4.68 
 32 GLN  HN     32 GLN  QB      3.16 
 32 GLN  HA     35 HIS  QB      4.54 
 32 GLN  QB     33 LYS  HN      3.86 
 32 GLN  QB     33 LYS  HA      5.05 
 32 GLN  QG     32 GLN  QE2     3.29 
 33 LYS  HN     33 LYS  QG      3.41 
 33 LYS  HA     33 LYS  QG      3.48 
 33 LYS  QG     34 CYS  HN      5.01 
 34 CYS  HN     34 CYS  QB      3.23 
 35 HIS  HN     35 HIS  QB      3.31 
 35 HIS  QB     35 HIS  HD2     3.44 
 38 GLU  HN     38 GLU  QG      4.37 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1  -8.944  15.735 -10.079
    2    HA2  GLY   1           1HA      GLY   1  -7.675  14.491 -12.101
    3    HA3  GLY   1           2HA      GLY   1  -6.328  15.032 -11.110
    4    H    SER   2           H        SER   2  -9.374  13.213 -10.928
    5    HA   SER   2           HA       SER   2  -8.184  11.603  -8.768
    6    HB2  SER   2           1HB      SER   2 -10.373  11.145  -7.963
    7    HB3  SER   2           2HB      SER   2 -10.355  12.871  -8.329
    8    HG   SER   2           HG       SER   2 -12.197  11.518  -9.121
    9    H    SER   3           H        SER   3  -7.515   9.649  -9.320
   10    HA   SER   3           HA       SER   3  -8.495   8.439 -11.793
   11    HB2  SER   3           1HB      SER   3  -6.580   6.945 -11.619
   12    HB3  SER   3           2HB      SER   3  -6.045   8.613 -11.415
   13    HG   SER   3           HG       SER   3  -6.719   7.079  -9.161
   14    H    GLY   4           H        GLY   4  -8.881   6.065 -11.799
   15    HA2  GLY   4           1HA      GLY   4  -9.681   4.881  -9.272
   16    HA3  GLY   4           2HA      GLY   4 -10.998   5.239 -10.379
   17    H    SER   5           H        SER   5  -8.493   3.068  -9.567
   18    HA   SER   5           HA       SER   5  -9.137   1.441 -11.938
   19    HB2  SER   5           1HB      SER   5  -6.852   0.534 -11.854
   20    HB3  SER   5           2HB      SER   5  -6.832   2.284 -12.068
   21    HG   SER   5           HG       SER   5  -6.745   1.281  -9.464
   22    H    SER   6           H        SER   6 -10.626   0.084 -11.073
   23    HA   SER   6           HA       SER   6  -9.901  -1.363  -8.617
   24    HB2  SER   6           1HB      SER   6 -12.244  -1.815  -8.302
   25    HB3  SER   6           2HB      SER   6 -12.073  -0.095  -8.646
   26    HG   SER   6           HG       SER   6 -12.404  -1.025 -10.966
   27    H    GLY   7           H        GLY   7  -9.560  -3.508  -8.652
   28    HA2  GLY   7           1HA      GLY   7  -9.690  -4.837 -11.261
   29    HA3  GLY   7           2HA      GLY   7  -8.772  -5.386  -9.866
   30    H    THR   8           H        THR   8  -9.529  -7.189  -9.009
   31    HA   THR   8           HA       THR   8 -12.301  -7.507  -8.358
   32    HB   THR   8           HB       THR   8 -12.402  -8.142 -10.725
   33    HG1  THR   8           HG1      THR   8 -12.567 -10.582  -9.325
   34   HG21  THR   8          3HG2      THR   8 -11.168  -9.965 -11.633
   35   HG22  THR   8          1HG2      THR   8 -10.522 -10.401 -10.051
   36   HG23  THR   8          2HG2      THR   8 -10.002  -8.910 -10.835
   37    H    GLY   9           H        GLY   9 -12.340  -8.541  -6.476
   38    HA2  GLY   9           1HA      GLY   9 -11.900 -10.559  -5.214
   39    HA3  GLY   9           2HA      GLY   9 -10.321 -10.634  -5.982
   40    H    GLU  10           H        GLU  10 -11.646 -10.194  -3.115
   41    HA   GLU  10           HA       GLU  10 -10.579  -7.799  -2.113
   42    HB2  GLU  10           1HB      GLU  10 -12.274  -9.395  -1.027
   43    HB3  GLU  10           2HB      GLU  10 -10.877 -10.312  -0.482
   44    HG2  GLU  10           1HG      GLU  10 -10.951  -7.398   0.081
   45    HG3  GLU  10           2HG      GLU  10 -11.995  -8.464   1.020
   46    H    LYS  11           H        LYS  11  -8.517  -7.222  -2.113
   47    HA   LYS  11           HA       LYS  11  -6.387  -9.140  -2.253
   48    HB2  LYS  11           1HB      LYS  11  -6.586  -6.160  -2.238
   49    HB3  LYS  11           2HB      LYS  11  -5.034  -6.899  -1.866
   50    HG2  LYS  11           1HG      LYS  11  -4.842  -6.611  -4.123
   51    HG3  LYS  11           2HG      LYS  11  -5.495  -8.250  -4.061
   52    HD2  LYS  11           1HD      LYS  11  -7.799  -7.043  -4.192
   53    HD3  LYS  11           2HD      LYS  11  -6.851  -5.693  -4.819
   54    HE2  LYS  11           1HE      LYS  11  -5.863  -7.388  -6.459
   55    HE3  LYS  11           2HE      LYS  11  -7.185  -8.447  -5.972
   56    HZ1  LYS  11           3HZ      LYS  11  -7.238  -6.377  -7.846
   57    HZ2  LYS  11           1HZ      LYS  11  -8.236  -5.916  -6.560
   58    HZ3  LYS  11           2HZ      LYS  11  -8.512  -7.379  -7.362
   59    HA   PRO  12           HA       PRO  12  -5.631  -9.677   2.050
   60    HB2  PRO  12           1HB      PRO  12  -3.015 -10.395   1.945
   61    HB3  PRO  12           2HB      PRO  12  -4.326 -11.469   1.445
   62    HG2  PRO  12           1HG      PRO  12  -2.531  -9.762  -0.235
   63    HG3  PRO  12           2HG      PRO  12  -3.067 -11.430  -0.509
   64    HD2  PRO  12           1HD      PRO  12  -4.191  -9.314  -1.770
   65    HD3  PRO  12           2HD      PRO  12  -5.112 -10.770  -1.342
   66    H    TYR  13           H        TYR  13  -4.440  -7.147   0.260
   67    HA   TYR  13           HA       TYR  13  -3.313  -5.885   2.661
   68    HB2  TYR  13           1HB      TYR  13  -2.152  -5.477  -0.095
   69    HB3  TYR  13           2HB      TYR  13  -1.498  -4.924   1.443
   70    HD1  TYR  13           HD1      TYR  13  -0.904  -6.823   3.155
   71    HD2  TYR  13           HD2      TYR  13  -1.315  -7.419  -1.038
   72    HE1  TYR  13           HE1      TYR  13   0.451  -8.870   3.319
   73    HE2  TYR  13           HE2      TYR  13   0.037  -9.468  -0.885
   74    HH   TYR  13           HH       TYR  13   1.833 -10.281   1.895
   75    H    LYS  14           H        LYS  14  -3.789  -3.738   2.932
   76    HA   LYS  14           HA       LYS  14  -5.156  -2.289   0.808
   77    HB2  LYS  14           1HB      LYS  14  -6.959  -3.464   2.001
   78    HB3  LYS  14           2HB      LYS  14  -6.420  -2.754   3.516
   79    HG2  LYS  14           1HG      LYS  14  -6.794  -0.497   2.261
   80    HG3  LYS  14           2HG      LYS  14  -7.827  -1.479   1.220
   81    HD2  LYS  14           1HD      LYS  14  -9.204  -2.116   3.062
   82    HD3  LYS  14           2HD      LYS  14  -8.077  -1.409   4.223
   83    HE2  LYS  14           1HE      LYS  14  -9.467   0.218   2.108
   84    HE3  LYS  14           2HE      LYS  14 -10.170  -0.069   3.700
   85    HZ1  LYS  14           3HZ      LYS  14  -7.512   0.794   4.008
   86    HZ2  LYS  14           1HZ      LYS  14  -8.934   1.556   4.517
   87    HZ3  LYS  14           2HZ      LYS  14  -8.310   1.872   2.978
   88    H    CYS  15           H        CYS  15  -4.549  -0.220   0.779
   89    HA   CYS  15           HA       CYS  15  -2.685   0.770   2.687
   90    HB2  CYS  15           1HB      CYS  15  -2.736   1.387   0.252
   91    HB3  CYS  15           2HB      CYS  15  -4.174   2.348   0.582
   92    H    SER  16           H        SER  16  -3.271   1.331   4.678
   93    HA   SER  16           HA       SER  16  -5.924   2.295   5.265
   94    HB2  SER  16           1HB      SER  16  -4.524   0.779   6.770
   95    HB3  SER  16           2HB      SER  16  -3.586   2.217   7.174
   96    HG   SER  16           HG       SER  16  -5.941   3.045   7.547
   97    H    ASP  17           H        ASP  17  -4.711   4.014   3.491
   98    HA   ASP  17           HA       ASP  17  -4.446   6.431   5.138
   99    HB2  ASP  17           1HB      ASP  17  -2.555   5.401   3.079
  100    HB3  ASP  17           2HB      ASP  17  -2.830   7.140   3.140
  101    H    CYS  18           H        CYS  18  -4.832   5.247   1.800
  102    HA   CYS  18           HA       CYS  18  -6.651   7.505   1.295
  103    HB2  CYS  18           1HB      CYS  18  -6.221   6.965  -1.138
  104    HB3  CYS  18           2HB      CYS  18  -4.834   7.579  -0.245
  105    H    GLY  19           H        GLY  19  -6.209   4.042   0.590
  106    HA2  GLY  19           1HA      GLY  19  -8.175   2.628   1.173
  107    HA3  GLY  19           2HA      GLY  19  -9.148   3.837   0.348
  108    H    LYS  20           H        LYS  20  -6.112   2.184  -0.508
  109    HA   LYS  20           HA       LYS  20  -7.431   1.277  -2.983
  110    HB2  LYS  20           1HB      LYS  20  -5.822   2.991  -3.531
  111    HB3  LYS  20           2HB      LYS  20  -4.583   2.196  -2.570
  112    HG2  LYS  20           1HG      LYS  20  -4.608   0.298  -4.118
  113    HG3  LYS  20           2HG      LYS  20  -5.834   1.118  -5.089
  114    HD2  LYS  20           1HD      LYS  20  -4.249   2.985  -5.440
  115    HD3  LYS  20           2HD      LYS  20  -3.023   2.079  -4.550
  116    HE2  LYS  20           1HE      LYS  20  -3.494   0.208  -6.266
  117    HE3  LYS  20           2HE      LYS  20  -4.248   1.484  -7.221
  118    HZ1  LYS  20           3HZ      LYS  20  -1.958   1.219  -7.862
  119    HZ2  LYS  20           1HZ      LYS  20  -1.436   1.432  -6.267
  120    HZ3  LYS  20           2HZ      LYS  20  -2.148   2.719  -7.102
  121    H    SER  21           H        SER  21  -6.942  -0.785  -3.742
  122    HA   SER  21           HA       SER  21  -5.839  -2.579  -1.706
  123    HB2  SER  21           1HB      SER  21  -7.619  -3.048  -4.099
  124    HB3  SER  21           2HB      SER  21  -6.888  -4.370  -3.189
  125    HG   SER  21           HG       SER  21  -8.193  -3.988  -1.552
  126    H    PHE  22           H        PHE  22  -4.140  -3.942  -2.087
  127    HA   PHE  22           HA       PHE  22  -2.806  -3.720  -4.701
  128    HB2  PHE  22           1HB      PHE  22  -1.408  -3.757  -2.019
  129    HB3  PHE  22           2HB      PHE  22  -0.638  -3.635  -3.598
  130    HD1  PHE  22           HD1      PHE  22  -3.290  -1.887  -1.635
  131    HD2  PHE  22           HD2      PHE  22   0.049  -1.553  -4.254
  132    HE1  PHE  22           HE1      PHE  22  -3.444   0.566  -1.514
  133    HE2  PHE  22           HE2      PHE  22  -0.100   0.900  -4.136
  134    HZ   PHE  22           HZ       PHE  22  -1.847   1.963  -2.764
  135    H    THR  23           H        THR  23  -2.327  -5.608  -5.616
  136    HA   THR  23           HA       THR  23  -3.056  -8.061  -4.391
  137    HB   THR  23           HB       THR  23  -1.384  -7.664  -6.879
  138    HG1  THR  23           HG1      THR  23  -3.277  -7.516  -7.968
  139   HG21  THR  23          3HG2      THR  23  -2.706  -9.905  -7.366
  140   HG22  THR  23          1HG2      THR  23  -2.708 -10.007  -5.606
  141   HG23  THR  23          2HG2      THR  23  -1.180  -9.912  -6.482
  142    H    TRP  24           H        TRP  24   0.067  -6.545  -5.109
  143    HA   TRP  24           HA       TRP  24   1.431  -8.699  -3.663
  144    HB2  TRP  24           1HB      TRP  24   2.403  -6.544  -5.533
  145    HB3  TRP  24           2HB      TRP  24   3.513  -7.493  -4.548
  146    HD1  TRP  24           HD1      TRP  24   1.710  -7.561  -7.796
  147    HE1  TRP  24           HE1      TRP  24   2.027  -9.844  -8.942
  148    HE3  TRP  24           HE3      TRP  24   3.695 -10.171  -3.873
  149    HZ2  TRP  24           HZ2      TRP  24   2.990 -12.411  -8.272
  150    HZ3  TRP  24           HZ3      TRP  24   4.286 -12.536  -4.209
  151    HH2  TRP  24           HH2      TRP  24   3.939 -13.631  -6.363
  152    H    LYS  25           H        LYS  25   2.609  -8.355  -1.823
  153    HA   LYS  25           HA       LYS  25   1.863  -6.171  -0.175
  154    HB2  LYS  25           1HB      LYS  25   2.527  -8.505   0.577
  155    HB3  LYS  25           2HB      LYS  25   4.195  -8.030   0.287
  156    HG2  LYS  25           1HG      LYS  25   4.088  -6.346   1.970
  157    HG3  LYS  25           2HG      LYS  25   2.345  -6.561   2.150
  158    HD2  LYS  25           1HD      LYS  25   2.585  -8.605   3.235
  159    HD3  LYS  25           2HD      LYS  25   4.218  -8.853   2.614
  160    HE2  LYS  25           1HE      LYS  25   5.045  -7.060   4.042
  161    HE3  LYS  25           2HE      LYS  25   3.412  -6.765   4.637
  162    HZ1  LYS  25           3HZ      LYS  25   4.190  -9.498   4.932
  163    HZ2  LYS  25           1HZ      LYS  25   3.595  -8.417   6.090
  164    HZ3  LYS  25           2HZ      LYS  25   5.249  -8.455   5.739
  165    H    SER  26           H        SER  26   4.901  -7.014  -1.814
  166    HA   SER  26           HA       SER  26   6.515  -4.971  -0.918
  167    HB2  SER  26           1HB      SER  26   6.395  -6.492  -3.499
  168    HB3  SER  26           2HB      SER  26   7.527  -5.150  -3.333
  169    HG   SER  26           HG       SER  26   8.672  -6.822  -2.594
  170    H    ARG  27           H        ARG  27   4.273  -4.915  -3.672
  171    HA   ARG  27           HA       ARG  27   4.811  -2.375  -4.634
  172    HB2  ARG  27           1HB      ARG  27   2.124  -3.757  -4.509
  173    HB3  ARG  27           2HB      ARG  27   2.533  -2.405  -5.557
  174    HG2  ARG  27           1HG      ARG  27   4.091  -4.955  -5.678
  175    HG3  ARG  27           2HG      ARG  27   2.552  -4.789  -6.526
  176    HD2  ARG  27           1HD      ARG  27   4.034  -4.133  -8.157
  177    HD3  ARG  27           2HD      ARG  27   3.620  -2.583  -7.427
  178    HE   ARG  27           HE       ARG  27   5.787  -3.263  -6.027
  179   HH11  ARG  27          1HH1      ARG  27   5.164  -3.318  -9.451
  180   HH12  ARG  27          2HH1      ARG  27   6.815  -3.029  -9.889
  181   HH21  ARG  27          1HH2      ARG  27   7.964  -2.882  -6.590
  182   HH22  ARG  27          2HH2      ARG  27   8.407  -2.782  -8.260
  183    H    LEU  28           H        LEU  28   2.365  -3.309  -2.216
  184    HA   LEU  28           HA       LEU  28   1.284  -0.849  -1.658
  185    HB2  LEU  28           1HB      LEU  28   0.361  -2.800  -0.666
  186    HB3  LEU  28           2HB      LEU  28   1.870  -3.169   0.165
  187    HG   LEU  28           HG       LEU  28   1.505  -1.068   1.515
  188   HD11  LEU  28          1HD1      LEU  28  -1.357  -1.252   0.671
  189   HD12  LEU  28          2HD1      LEU  28  -0.223  -0.241  -0.223
  190   HD13  LEU  28          3HD1      LEU  28  -0.513   0.062   1.490
  191   HD21  LEU  28          3HD2      LEU  28   0.347  -2.225   3.121
  192   HD22  LEU  28          1HD2      LEU  28   0.850  -3.549   2.070
  193   HD23  LEU  28          2HD2      LEU  28  -0.792  -2.913   1.963
  194    H    ARG  29           H        ARG  29   4.039  -2.331   0.060
  195    HA   ARG  29           HA       ARG  29   4.706  -0.366   1.805
  196    HB2  ARG  29           1HB      ARG  29   6.469  -2.156   0.149
  197    HB3  ARG  29           2HB      ARG  29   7.143  -1.044   1.333
  198    HG2  ARG  29           1HG      ARG  29   6.109  -2.157   3.126
  199    HG3  ARG  29           2HG      ARG  29   5.039  -3.059   2.051
  200    HD2  ARG  29           1HD      ARG  29   6.596  -4.670   2.519
  201    HD3  ARG  29           2HD      ARG  29   7.312  -3.951   1.076
  202    HE   ARG  29           HE       ARG  29   8.469  -2.522   3.011
  203   HH11  ARG  29          1HH1      ARG  29   7.993  -5.954   2.668
  204   HH12  ARG  29          2HH1      ARG  29   9.423  -6.372   3.552
  205   HH21  ARG  29          1HH2      ARG  29  10.355  -3.060   4.176
  206   HH22  ARG  29          2HH2      ARG  29  10.765  -4.726   4.411
  207    H    ILE  30           H        ILE  30   5.726  -0.499  -1.600
  208    HA   ILE  30           HA       ILE  30   7.204   1.879  -1.616
  209    HB   ILE  30           HB       ILE  30   5.676   0.613  -3.894
  210   HG12  ILE  30          1HG1      ILE  30   8.636   0.406  -3.442
  211   HG13  ILE  30          2HG1      ILE  30   7.539  -0.679  -2.594
  212   HG21  ILE  30          1HG2      ILE  30   6.526   2.133  -5.306
  213   HG22  ILE  30          2HG2      ILE  30   6.731   3.122  -3.860
  214   HG23  ILE  30          3HG2      ILE  30   8.083   2.175  -4.480
  215   HD11  ILE  30          3HD1      ILE  30   7.282  -1.947  -4.390
  216   HD12  ILE  30          1HD1      ILE  30   6.942  -0.554  -5.416
  217   HD13  ILE  30          2HD1      ILE  30   8.610  -1.040  -5.113
  218    H    HIS  31           H        HIS  31   3.802   1.293  -2.474
  219    HA   HIS  31           HA       HIS  31   3.127   3.889  -3.219
  220    HB2  HIS  31           1HB      HIS  31   1.569   2.166  -3.694
  221    HB3  HIS  31           2HB      HIS  31   1.498   1.659  -2.009
  222    HD1  HIS  31           HD1      HIS  31   0.246   4.324  -4.338
  223    HD2  HIS  31           HD2      HIS  31  -0.300   3.054  -0.420
  224    HE1  HIS  31           HE1      HIS  31  -1.762   5.583  -3.497
  225    H    GLN  32           H        GLN  32   2.823   2.340  -0.026
  226    HA   GLN  32           HA       GLN  32   1.686   4.297   1.460
  227    HB2  GLN  32           1HB      GLN  32   3.888   2.367   2.097
  228    HB3  GLN  32           2HB      GLN  32   3.376   3.540   3.304
  229    HG2  GLN  32           1HG      GLN  32   1.085   2.679   3.147
  230    HG3  GLN  32           2HG      GLN  32   1.630   1.480   1.975
  231   HE21  GLN  32          1HE2      GLN  32   0.368   0.888   4.421
  232   HE22  GLN  32          2HE2      GLN  32   1.490   0.020   5.406
  233    H    LYS  33           H        LYS  33   5.222   4.030   1.048
  234    HA   LYS  33           HA       LYS  33   5.818   6.522   2.196
  235    HB2  LYS  33           1HB      LYS  33   8.032   6.251   1.254
  236    HB3  LYS  33           2HB      LYS  33   7.466   4.703   1.869
  237    HG2  LYS  33           1HG      LYS  33   7.148   3.831  -0.265
  238    HG3  LYS  33           2HG      LYS  33   7.142   5.427  -1.018
  239    HD2  LYS  33           1HD      LYS  33   9.240   4.644  -1.583
  240    HD3  LYS  33           2HD      LYS  33   9.582   5.562  -0.115
  241    HE2  LYS  33           1HE      LYS  33   9.710   3.594   1.194
  242    HE3  LYS  33           2HE      LYS  33   9.012   2.608  -0.090
  243    HZ1  LYS  33           3HZ      LYS  33  10.967   2.680  -1.314
  244    HZ2  LYS  33           1HZ      LYS  33  11.522   2.508   0.276
  245    HZ3  LYS  33           2HZ      LYS  33  11.575   4.021  -0.479
  246    H    CYS  34           H        CYS  34   5.028   5.584  -1.093
  247    HA   CYS  34           HA       CYS  34   5.831   7.745  -2.561
  248    HB2  CYS  34           1HB      CYS  34   4.565   5.656  -3.331
  249    HB3  CYS  34           2HB      CYS  34   3.096   6.529  -2.915
  250    HG   CYS  34           HG       CYS  34   5.166   6.944  -5.531
  251    H    HIS  35           H        HIS  35   2.901   7.485  -0.584
  252    HA   HIS  35           HA       HIS  35   1.510   9.716  -1.160
  253    HB2  HIS  35           1HB      HIS  35   2.127   8.408   1.460
  254    HB3  HIS  35           2HB      HIS  35   1.218   9.916   1.449
  255    HD1  HIS  35           HD1      HIS  35  -0.920   9.753  -0.394
  256    HD2  HIS  35           HD2      HIS  35   0.495   6.268   1.370
  257    HE1  HIS  35           HE1      HIS  35  -2.779   8.076  -0.632
  258    H    THR  36           H        THR  36   4.114   9.742   1.281
  259    HA   THR  36           HA       THR  36   4.247  12.621   1.217
  260    HB   THR  36           HB       THR  36   4.634  11.318   3.307
  261    HG1  THR  36           HG1      THR  36   5.717  13.485   2.596
  262   HG21  THR  36          3HG2      THR  36   6.416   9.877   1.682
  263   HG22  THR  36          1HG2      THR  36   6.125   9.664   3.408
  264   HG23  THR  36          2HG2      THR  36   7.412  10.736   2.857
  265    H    GLY  37           H        GLY  37   5.821  13.895   0.326
  266    HA2  GLY  37           1HA      GLY  37   8.061  14.154  -0.579
  267    HA3  GLY  37           2HA      GLY  37   7.925  12.525  -1.225
  268    H    GLU  38           H        GLU  38   7.427  15.848  -1.805
  269    HA   GLU  38           HA       GLU  38   5.868  15.307  -4.230
  270    HB2  GLU  38           1HB      GLU  38   5.354  17.168  -2.430
  271    HB3  GLU  38           2HB      GLU  38   6.560  18.072  -3.335
  272    HG2  GLU  38           1HG      GLU  38   4.563  18.721  -4.303
  273    HG3  GLU  38           2HG      GLU  38   5.163  17.480  -5.402
  274    H    ARG  39           H        ARG  39   7.576  14.428  -5.462
  275    HA   ARG  39           HA       ARG  39   9.620  16.388  -6.279
  276    HB2  ARG  39           1HB      ARG  39  10.520  14.374  -5.127
  277    HB3  ARG  39           2HB      ARG  39   9.819  13.375  -6.394
  278    HG2  ARG  39           1HG      ARG  39  12.052  13.590  -7.004
  279    HG3  ARG  39           2HG      ARG  39  11.218  14.771  -8.015
  280    HD2  ARG  39           1HD      ARG  39  13.142  15.861  -7.181
  281    HD3  ARG  39           2HD      ARG  39  11.780  16.491  -6.255
  282    HE   ARG  39           HE       ARG  39  12.620  15.472  -4.363
  283   HH11  ARG  39          1HH1      ARG  39  14.380  14.417  -7.175
  284   HH12  ARG  39          2HH1      ARG  39  15.638  13.653  -6.262
  285   HH21  ARG  39          1HH2      ARG  39  14.270  14.469  -3.149
  286   HH22  ARG  39          2HH2      ARG  39  15.574  13.682  -3.972
  287    H    HIS  40           H        HIS  40   8.129  17.237  -7.841
  288    HA   HIS  40           HA       HIS  40   7.070  17.364  -9.864
  289    HB2  HIS  40           1HB      HIS  40   9.588  15.823 -10.423
  290    HB3  HIS  40           2HB      HIS  40   8.456  16.187 -11.722
  291    HD2  HIS  40           HD2      HIS  40   8.290  18.917 -12.429
  292    HE1  HIS  40           HE1      HIS  40  11.648  20.096 -10.120
  293    HE2  HIS  40           HE2      HIS  40   9.946  20.812 -11.833
  294    H    SER  41           H        SER  41   5.912  15.431  -8.237
  295    HA   SER  41           HA       SER  41   4.872  13.600 -10.265
  296    HB2  SER  41           1HB      SER  41   6.651  12.408  -8.936
  297    HB3  SER  41           2HB      SER  41   5.645  12.633  -7.505
  298    HG   SER  41           HG       SER  41   5.437  10.790  -9.467
  299    H    GLY  42           H        GLY  42   2.788  14.117 -10.360
  300    HA2  GLY  42           1HA      GLY  42   1.345  14.501  -7.809
  301    HA3  GLY  42           2HA      GLY  42   1.004  15.464  -9.239
  302    HA   PRO  43           HA       PRO  43  -2.003  12.590 -10.604
  303    HB2  PRO  43           1HB      PRO  43  -1.577  12.459 -13.281
  304    HB3  PRO  43           2HB      PRO  43  -2.272  13.877 -12.488
  305    HG2  PRO  43           1HG      PRO  43   0.545  13.396 -13.378
  306    HG3  PRO  43           2HG      PRO  43  -0.446  14.857 -13.542
  307    HD2  PRO  43           1HD      PRO  43   1.435  14.580 -11.613
  308    HD3  PRO  43           2HD      PRO  43  -0.052  15.519 -11.369
  309    H    SER  44           H        SER  44  -2.355  10.433 -11.029
  310    HA   SER  44           HA       SER  44   0.049   8.771 -11.180
  311    HB2  SER  44           1HB      SER  44  -2.723   8.365 -10.140
  312    HB3  SER  44           2HB      SER  44  -1.814   6.953 -10.680
  313    HG   SER  44           HG       SER  44  -0.500   8.752  -9.010
  314    H    SER  45           H        SER  45  -0.132   6.720 -12.446
  315    HA   SER  45           HA       SER  45  -1.016   7.356 -15.127
  316    HB2  SER  45           1HB      SER  45   1.182   6.302 -14.763
  317    HB3  SER  45           2HB      SER  45   0.387   4.890 -14.067
  318    HG   SER  45           HG       SER  45  -0.789   4.955 -16.238
  319    H    GLY  46           H        GLY  46  -1.548   4.653 -12.857
  320    HA2  GLY  46           1HA      GLY  46  -4.260   4.379 -13.956
  321    HA3  GLY  46           2HA      GLY  46  -3.214   2.968 -13.914
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1 -18.937  12.350 -14.308
    2    HA2  GLY   1           1HA      GLY   1 -21.093  11.881 -16.193
    3    HA3  GLY   1           2HA      GLY   1 -19.599  11.026 -16.547
    4    H    SER   2           H        SER   2 -20.470   8.989 -16.220
    5    HA   SER   2           HA       SER   2 -20.789   8.255 -13.410
    6    HB2  SER   2           1HB      SER   2 -23.072   8.674 -14.445
    7    HB3  SER   2           2HB      SER   2 -22.757   7.287 -15.487
    8    HG   SER   2           HG       SER   2 -22.378   6.941 -12.750
    9    H    SER   3           H        SER   3 -20.368   6.053 -12.965
   10    HA   SER   3           HA       SER   3 -19.278   4.473 -15.187
   11    HB2  SER   3           1HB      SER   3 -17.420   5.660 -13.994
   12    HB3  SER   3           2HB      SER   3 -17.875   4.796 -12.525
   13    HG   SER   3           HG       SER   3 -16.694   3.228 -13.243
   14    H    GLY   4           H        GLY   4 -18.720   2.176 -14.336
   15    HA2  GLY   4           1HA      GLY   4 -21.143   1.084 -13.288
   16    HA3  GLY   4           2HA      GLY   4 -19.683   0.188 -13.679
   17    H    SER   5           H        SER   5 -18.844  -0.839 -12.005
   18    HA   SER   5           HA       SER   5 -19.487   0.036  -9.304
   19    HB2  SER   5           1HB      SER   5 -19.676  -2.372 -10.001
   20    HB3  SER   5           2HB      SER   5 -17.920  -2.408 -10.157
   21    HG   SER   5           HG       SER   5 -19.451  -2.589  -7.932
   22    H    SER   6           H        SER   6 -17.875   0.301  -7.669
   23    HA   SER   6           HA       SER   6 -15.243   1.092  -8.734
   24    HB2  SER   6           1HB      SER   6 -16.842   2.385  -6.513
   25    HB3  SER   6           2HB      SER   6 -15.183   2.814  -6.931
   26    HG   SER   6           HG       SER   6 -17.509   3.095  -8.523
   27    H    GLY   7           H        GLY   7 -15.680  -1.499  -7.887
   28    HA2  GLY   7           1HA      GLY   7 -13.755  -1.675  -5.738
   29    HA3  GLY   7           2HA      GLY   7 -15.355  -2.265  -5.314
   30    H    THR   8           H        THR   8 -16.068  -4.209  -6.113
   31    HA   THR   8           HA       THR   8 -15.686  -6.418  -6.639
   32    HB   THR   8           HB       THR   8 -15.276  -6.766  -9.049
   33    HG1  THR   8           HG1      THR   8 -13.850  -5.230  -9.664
   34   HG21  THR   8          3HG2      THR   8 -17.289  -4.895  -7.982
   35   HG22  THR   8          1HG2      THR   8 -17.501  -6.385  -8.899
   36   HG23  THR   8          2HG2      THR   8 -17.093  -4.886  -9.734
   37    H    GLY   9           H        GLY   9 -13.479  -5.352  -5.233
   38    HA2  GLY   9           1HA      GLY   9 -11.370  -7.077  -6.317
   39    HA3  GLY   9           2HA      GLY   9 -10.971  -5.401  -5.969
   40    H    GLU  10           H        GLU  10 -10.708  -8.413  -4.783
   41    HA   GLU  10           HA       GLU  10 -10.699  -7.453  -1.998
   42    HB2  GLU  10           1HB      GLU  10 -12.510  -9.165  -2.635
   43    HB3  GLU  10           2HB      GLU  10 -11.193 -10.324  -2.753
   44    HG2  GLU  10           1HG      GLU  10 -11.806 -10.692  -0.606
   45    HG3  GLU  10           2HG      GLU  10 -10.638  -9.398  -0.343
   46    H    LYS  11           H        LYS  11  -8.555  -7.014  -1.798
   47    HA   LYS  11           HA       LYS  11  -6.669  -9.195  -2.398
   48    HB2  LYS  11           1HB      LYS  11  -5.914  -6.310  -1.977
   49    HB3  LYS  11           2HB      LYS  11  -4.963  -7.585  -2.727
   50    HG2  LYS  11           1HG      LYS  11  -7.552  -6.801  -3.970
   51    HG3  LYS  11           2HG      LYS  11  -6.146  -5.753  -4.174
   52    HD2  LYS  11           1HD      LYS  11  -5.863  -7.111  -5.986
   53    HD3  LYS  11           2HD      LYS  11  -4.981  -8.055  -4.782
   54    HE2  LYS  11           1HE      LYS  11  -7.214  -9.235  -4.354
   55    HE3  LYS  11           2HE      LYS  11  -7.746  -8.504  -5.867
   56    HZ1  LYS  11           3HZ      LYS  11  -6.116 -10.786  -5.467
   57    HZ2  LYS  11           1HZ      LYS  11  -5.284  -9.638  -6.389
   58    HZ3  LYS  11           2HZ      LYS  11  -6.795 -10.199  -6.901
   59    HA   PRO  12           HA       PRO  12  -5.790  -9.678   1.879
   60    HB2  PRO  12           1HB      PRO  12  -3.204 -10.496   1.760
   61    HB3  PRO  12           2HB      PRO  12  -4.560 -11.524   1.283
   62    HG2  PRO  12           1HG      PRO  12  -2.716  -9.905  -0.431
   63    HG3  PRO  12           2HG      PRO  12  -3.317 -11.554  -0.682
   64    HD2  PRO  12           1HD      PRO  12  -4.371  -9.409  -1.956
   65    HD3  PRO  12           2HD      PRO  12  -5.343 -10.825  -1.505
   66    H    TYR  13           H        TYR  13  -4.564  -7.196   0.070
   67    HA   TYR  13           HA       TYR  13  -3.378  -5.947   2.444
   68    HB2  TYR  13           1HB      TYR  13  -2.165  -5.681  -0.310
   69    HB3  TYR  13           2HB      TYR  13  -1.517  -5.070   1.208
   70    HD1  TYR  13           HD1      TYR  13  -0.762  -6.753   2.956
   71    HD2  TYR  13           HD2      TYR  13  -1.618  -7.836  -1.069
   72    HE1  TYR  13           HE1      TYR  13   0.529  -8.826   3.245
   73    HE2  TYR  13           HE2      TYR  13  -0.330  -9.913  -0.790
   74    HH   TYR  13           HH       TYR  13   1.409 -10.607   2.216
   75    H    LYS  14           H        LYS  14  -3.865  -3.824   2.715
   76    HA   LYS  14           HA       LYS  14  -5.086  -2.333   0.526
   77    HB2  LYS  14           1HB      LYS  14  -6.943  -3.480   1.718
   78    HB3  LYS  14           2HB      LYS  14  -6.458  -2.666   3.200
   79    HG2  LYS  14           1HG      LYS  14  -7.028  -0.995   0.814
   80    HG3  LYS  14           2HG      LYS  14  -8.387  -1.733   1.665
   81    HD2  LYS  14           1HD      LYS  14  -6.307  -0.314   3.258
   82    HD3  LYS  14           2HD      LYS  14  -7.470   0.648   2.342
   83    HE2  LYS  14           1HE      LYS  14  -9.245  -0.040   3.614
   84    HE3  LYS  14           2HE      LYS  14  -8.496  -1.584   4.020
   85    HZ1  LYS  14           3HZ      LYS  14  -7.022   0.613   5.078
   86    HZ2  LYS  14           1HZ      LYS  14  -7.663  -0.734   5.876
   87    HZ3  LYS  14           2HZ      LYS  14  -8.624   0.634   5.620
   88    H    CYS  15           H        CYS  15  -4.144  -0.411   0.451
   89    HA   CYS  15           HA       CYS  15  -2.321   0.576   2.274
   90    HB2  CYS  15           1HB      CYS  15  -2.339   1.497   0.082
   91    HB3  CYS  15           2HB      CYS  15  -4.024   1.987   0.223
   92    H    SER  16           H        SER  16  -2.430   1.616   4.163
   93    HA   SER  16           HA       SER  16  -5.079   2.218   5.244
   94    HB2  SER  16           1HB      SER  16  -3.376   0.801   6.501
   95    HB3  SER  16           2HB      SER  16  -2.454   2.286   6.738
   96    HG   SER  16           HG       SER  16  -4.677   3.053   7.542
   97    H    ASP  17           H        ASP  17  -4.146   3.983   3.279
   98    HA   ASP  17           HA       ASP  17  -3.864   6.433   4.876
   99    HB2  ASP  17           1HB      ASP  17  -1.696   5.669   3.721
  100    HB3  ASP  17           2HB      ASP  17  -2.491   6.116   2.214
  101    H    CYS  18           H        CYS  18  -4.531   5.205   1.597
  102    HA   CYS  18           HA       CYS  18  -6.513   7.353   1.273
  103    HB2  CYS  18           1HB      CYS  18  -6.358   6.809  -1.167
  104    HB3  CYS  18           2HB      CYS  18  -4.854   7.399  -0.466
  105    H    GLY  19           H        GLY  19  -6.020   3.876   0.725
  106    HA2  GLY  19           1HA      GLY  19  -7.878   2.454   1.587
  107    HA3  GLY  19           2HA      GLY  19  -8.960   3.567   0.761
  108    H    LYS  20           H        LYS  20  -5.910   2.420  -0.548
  109    HA   LYS  20           HA       LYS  20  -7.387   1.225  -2.776
  110    HB2  LYS  20           1HB      LYS  20  -5.378   2.937  -2.927
  111    HB3  LYS  20           2HB      LYS  20  -4.411   1.478  -2.760
  112    HG2  LYS  20           1HG      LYS  20  -5.842   0.568  -4.697
  113    HG3  LYS  20           2HG      LYS  20  -6.277   2.258  -4.964
  114    HD2  LYS  20           1HD      LYS  20  -3.654   2.578  -4.814
  115    HD3  LYS  20           2HD      LYS  20  -3.660   0.884  -5.310
  116    HE2  LYS  20           1HE      LYS  20  -5.267   1.628  -7.159
  117    HE3  LYS  20           2HE      LYS  20  -4.768   3.271  -6.759
  118    HZ1  LYS  20           3HZ      LYS  20  -3.498   1.577  -8.479
  119    HZ2  LYS  20           1HZ      LYS  20  -2.540   1.511  -7.087
  120    HZ3  LYS  20           2HZ      LYS  20  -2.854   2.999  -7.827
  121    H    SER  21           H        SER  21  -6.964  -0.874  -3.520
  122    HA   SER  21           HA       SER  21  -5.843  -2.653  -1.465
  123    HB2  SER  21           1HB      SER  21  -7.980  -3.003  -3.543
  124    HB3  SER  21           2HB      SER  21  -7.133  -4.414  -2.910
  125    HG   SER  21           HG       SER  21  -9.169  -3.256  -1.825
  126    H    PHE  22           H        PHE  22  -4.138  -3.929  -1.888
  127    HA   PHE  22           HA       PHE  22  -3.147  -4.024  -4.660
  128    HB2  PHE  22           1HB      PHE  22  -1.415  -3.912  -2.185
  129    HB3  PHE  22           2HB      PHE  22  -0.875  -3.859  -3.860
  130    HD1  PHE  22           HD1      PHE  22  -3.052  -2.010  -1.469
  131    HD2  PHE  22           HD2      PHE  22  -0.461  -1.817  -4.840
  132    HE1  PHE  22           HE1      PHE  22  -3.188   0.446  -1.428
  133    HE2  PHE  22           HE2      PHE  22  -0.592   0.640  -4.804
  134    HZ   PHE  22           HZ       PHE  22  -1.956   1.775  -3.096
  135    H    THR  23           H        THR  23  -2.198  -5.937  -5.349
  136    HA   THR  23           HA       THR  23  -3.088  -8.302  -3.969
  137    HB   THR  23           HB       THR  23  -1.388  -8.122  -6.462
  138    HG1  THR  23           HG1      THR  23  -3.166  -7.551  -7.441
  139   HG21  THR  23          3HG2      THR  23  -1.232 -10.335  -5.976
  140   HG22  THR  23          1HG2      THR  23  -2.824 -10.373  -6.733
  141   HG23  THR  23          2HG2      THR  23  -2.685 -10.328  -4.976
  142    H    TRP  24           H        TRP  24   0.056  -6.908  -4.861
  143    HA   TRP  24           HA       TRP  24   1.409  -8.914  -3.219
  144    HB2  TRP  24           1HB      TRP  24   2.321  -6.959  -5.306
  145    HB3  TRP  24           2HB      TRP  24   3.482  -7.654  -4.178
  146    HD1  TRP  24           HD1      TRP  24   1.727  -8.371  -7.382
  147    HE1  TRP  24           HE1      TRP  24   2.262 -10.763  -8.169
  148    HE3  TRP  24           HE3      TRP  24   3.909 -10.160  -3.118
  149    HZ2  TRP  24           HZ2      TRP  24   3.452 -13.098  -7.121
  150    HZ3  TRP  24           HZ3      TRP  24   4.718 -12.483  -3.093
  151    HH2  TRP  24           HH2      TRP  24   4.493 -13.921  -5.054
  152    H    LYS  25           H        LYS  25   2.491  -8.453  -1.365
  153    HA   LYS  25           HA       LYS  25   1.762  -6.136   0.088
  154    HB2  LYS  25           1HB      LYS  25   2.235  -8.214   1.238
  155    HB3  LYS  25           2HB      LYS  25   3.882  -8.225   0.619
  156    HG2  LYS  25           1HG      LYS  25   4.524  -6.431   1.993
  157    HG3  LYS  25           2HG      LYS  25   2.850  -6.018   2.372
  158    HD2  LYS  25           1HD      LYS  25   2.620  -8.155   3.575
  159    HD3  LYS  25           2HD      LYS  25   4.313  -8.516   3.229
  160    HE2  LYS  25           1HE      LYS  25   5.035  -6.627   4.526
  161    HE3  LYS  25           2HE      LYS  25   3.372  -6.085   4.745
  162    HZ1  LYS  25           3HZ      LYS  25   2.919  -8.067   6.031
  163    HZ2  LYS  25           1HZ      LYS  25   4.225  -7.229   6.705
  164    HZ3  LYS  25           2HZ      LYS  25   4.497  -8.627   5.793
  165    H    SER  26           H        SER  26   4.852  -7.157  -1.351
  166    HA   SER  26           HA       SER  26   6.495  -5.114  -0.601
  167    HB2  SER  26           1HB      SER  26   7.205  -7.041  -1.984
  168    HB3  SER  26           2HB      SER  26   6.381  -6.331  -3.373
  169    HG   SER  26           HG       SER  26   7.892  -4.809  -3.519
  170    H    ARG  27           H        ARG  27   4.328  -5.100  -3.425
  171    HA   ARG  27           HA       ARG  27   4.908  -2.600  -4.434
  172    HB2  ARG  27           1HB      ARG  27   2.163  -3.860  -4.299
  173    HB3  ARG  27           2HB      ARG  27   2.687  -2.620  -5.430
  174    HG2  ARG  27           1HG      ARG  27   3.957  -5.339  -5.283
  175    HG3  ARG  27           2HG      ARG  27   2.585  -4.966  -6.329
  176    HD2  ARG  27           1HD      ARG  27   5.063  -3.288  -6.406
  177    HD3  ARG  27           2HD      ARG  27   4.988  -4.815  -7.285
  178    HE   ARG  27           HE       ARG  27   2.792  -3.005  -7.786
  179   HH11  ARG  27          1HH1      ARG  27   5.960  -4.072  -8.756
  180   HH12  ARG  27          2HH1      ARG  27   5.806  -3.480 -10.377
  181   HH21  ARG  27          1HH2      ARG  27   2.577  -2.221  -9.917
  182   HH22  ARG  27          2HH2      ARG  27   3.882  -2.426 -11.036
  183    H    LEU  28           H        LEU  28   2.500  -3.426  -1.949
  184    HA   LEU  28           HA       LEU  28   1.429  -0.924  -1.499
  185    HB2  LEU  28           1HB      LEU  28   0.425  -2.756  -0.427
  186    HB3  LEU  28           2HB      LEU  28   1.937  -3.243   0.336
  187    HG   LEU  28           HG       LEU  28   1.695  -0.949   1.581
  188   HD11  LEU  28          1HD1      LEU  28  -0.474  -0.650   0.052
  189   HD12  LEU  28          2HD1      LEU  28  -0.339   0.036   1.671
  190   HD13  LEU  28          3HD1      LEU  28  -1.209  -1.478   1.425
  191   HD21  LEU  28          3HD2      LEU  28   0.762  -2.085   3.413
  192   HD22  LEU  28          1HD2      LEU  28   1.590  -3.330   2.476
  193   HD23  LEU  28          2HD2      LEU  28  -0.164  -3.172   2.376
  194    H    ARG  29           H        ARG  29   4.219  -2.392   0.164
  195    HA   ARG  29           HA       ARG  29   4.910  -0.421   1.905
  196    HB2  ARG  29           1HB      ARG  29   6.486  -2.386   0.322
  197    HB3  ARG  29           2HB      ARG  29   7.375  -1.104   1.135
  198    HG2  ARG  29           1HG      ARG  29   5.998  -1.827   3.215
  199    HG3  ARG  29           2HG      ARG  29   5.757  -3.320   2.305
  200    HD2  ARG  29           1HD      ARG  29   8.421  -2.085   2.996
  201    HD3  ARG  29           2HD      ARG  29   7.687  -3.468   3.808
  202    HE   ARG  29           HE       ARG  29   7.775  -4.283   1.248
  203   HH11  ARG  29          1HH1      ARG  29  10.169  -2.871   3.345
  204   HH12  ARG  29          2HH1      ARG  29  11.500  -3.677   2.584
  205   HH21  ARG  29          1HH2      ARG  29   9.520  -5.351   0.238
  206   HH22  ARG  29          2HH2      ARG  29  11.130  -5.087   0.817
  207    H    ILE  30           H        ILE  30   5.699  -0.527  -1.551
  208    HA   ILE  30           HA       ILE  30   7.182   1.896  -1.559
  209    HB   ILE  30           HB       ILE  30   5.797   0.495  -3.849
  210   HG12  ILE  30          1HG1      ILE  30   8.739   0.441  -3.212
  211   HG13  ILE  30          2HG1      ILE  30   7.628  -0.724  -2.499
  212   HG21  ILE  30          1HG2      ILE  30   6.362   2.935  -4.171
  213   HG22  ILE  30          2HG2      ILE  30   8.056   2.474  -4.014
  214   HG23  ILE  30          3HG2      ILE  30   7.082   1.818  -5.330
  215   HD11  ILE  30          3HD1      ILE  30   8.953  -1.122  -4.796
  216   HD12  ILE  30          1HD1      ILE  30   7.404  -1.873  -4.414
  217   HD13  ILE  30          2HD1      ILE  30   7.458  -0.423  -5.418
  218    H    HIS  31           H        HIS  31   3.812   1.097  -2.285
  219    HA   HIS  31           HA       HIS  31   2.950   3.529  -3.290
  220    HB2  HIS  31           1HB      HIS  31   1.534   1.543  -3.282
  221    HB3  HIS  31           2HB      HIS  31   1.444   1.588  -1.523
  222    HD1  HIS  31           HD1      HIS  31   0.532   3.864  -4.438
  223    HD2  HIS  31           HD2      HIS  31  -0.762   2.859  -0.620
  224    HE1  HIS  31           HE1      HIS  31  -1.604   5.146  -4.093
  225    H    GLN  32           H        GLN  32   2.816   2.453   0.109
  226    HA   GLN  32           HA       GLN  32   1.762   4.577   1.373
  227    HB2  GLN  32           1HB      GLN  32   4.032   2.780   2.113
  228    HB3  GLN  32           2HB      GLN  32   3.654   4.142   3.158
  229    HG2  GLN  32           1HG      GLN  32   1.267   3.266   3.170
  230    HG3  GLN  32           2HG      GLN  32   1.927   1.793   2.462
  231   HE21  GLN  32          1HE2      GLN  32   0.864   1.079   4.572
  232   HE22  GLN  32          2HE2      GLN  32   1.902   0.992   5.949
  233    H    LYS  33           H        LYS  33   5.135   4.378   0.282
  234    HA   LYS  33           HA       LYS  33   6.092   6.775   1.259
  235    HB2  LYS  33           1HB      LYS  33   6.734   5.382  -1.344
  236    HB3  LYS  33           2HB      LYS  33   7.660   6.732  -0.702
  237    HG2  LYS  33           1HG      LYS  33   8.438   5.477   1.119
  238    HG3  LYS  33           2HG      LYS  33   7.229   4.215   0.872
  239    HD2  LYS  33           1HD      LYS  33   9.260   3.322   0.068
  240    HD3  LYS  33           2HD      LYS  33   8.343   3.786  -1.367
  241    HE2  LYS  33           1HE      LYS  33  10.283   5.700  -0.134
  242    HE3  LYS  33           2HE      LYS  33  10.861   4.409  -1.186
  243    HZ1  LYS  33           3HZ      LYS  33   8.672   5.675  -2.408
  244    HZ2  LYS  33           1HZ      LYS  33  10.277   5.601  -2.938
  245    HZ3  LYS  33           2HZ      LYS  33   9.777   6.863  -1.929
  246    H    CYS  34           H        CYS  34   4.438   6.189  -1.832
  247    HA   CYS  34           HA       CYS  34   4.546   8.559  -3.089
  248    HB2  CYS  34           1HB      CYS  34   2.046   6.910  -2.666
  249    HB3  CYS  34           2HB      CYS  34   2.218   8.169  -3.883
  250    HG   CYS  34           HG       CYS  34   4.422   6.776  -5.119
  251    H    HIS  35           H        HIS  35   2.430   7.853  -0.334
  252    HA   HIS  35           HA       HIS  35   1.239  10.437  -0.267
  253    HB2  HIS  35           1HB      HIS  35   1.441   8.347   1.912
  254    HB3  HIS  35           2HB      HIS  35   0.376   9.749   1.935
  255    HD1  HIS  35           HD1      HIS  35  -1.506   9.766  -0.003
  256    HD2  HIS  35           HD2      HIS  35   0.390   6.139   0.710
  257    HE1  HIS  35           HE1      HIS  35  -2.981   8.019  -1.050
  258    H    THR  36           H        THR  36   3.117  11.798  -0.404
  259    HA   THR  36           HA       THR  36   4.816  11.890   1.978
  260    HB   THR  36           HB       THR  36   6.175  13.520   0.709
  261    HG1  THR  36           HG1      THR  36   4.962  14.499  -0.769
  262   HG21  THR  36          3HG2      THR  36   6.321  10.916   0.511
  263   HG22  THR  36          1HG2      THR  36   7.259  11.936  -0.579
  264   HG23  THR  36          2HG2      THR  36   5.753  11.204  -1.134
  265    H    GLY  37           H        GLY  37   5.339  14.067   2.871
  266    HA2  GLY  37           1HA      GLY  37   3.140  15.996   2.604
  267    HA3  GLY  37           2HA      GLY  37   3.517  15.363   4.199
  268    H    GLU  38           H        GLU  38   3.833  17.676   4.682
  269    HA   GLU  38           HA       GLU  38   6.615  18.435   4.130
  270    HB2  GLU  38           1HB      GLU  38   5.224  19.777   2.644
  271    HB3  GLU  38           2HB      GLU  38   4.227  20.285   4.000
  272    HG2  GLU  38           1HG      GLU  38   5.927  21.949   3.185
  273    HG3  GLU  38           2HG      GLU  38   5.951  21.598   4.912
  274    H    ARG  39           H        ARG  39   7.659  19.558   5.779
  275    HA   ARG  39           HA       ARG  39   6.942  18.924   8.397
  276    HB2  ARG  39           1HB      ARG  39   8.766  21.134   7.431
  277    HB3  ARG  39           2HB      ARG  39   8.703  20.516   9.076
  278    HG2  ARG  39           1HG      ARG  39   9.264  18.665   6.801
  279    HG3  ARG  39           2HG      ARG  39  10.545  19.683   7.463
  280    HD2  ARG  39           1HD      ARG  39  10.796  17.795   8.742
  281    HD3  ARG  39           2HD      ARG  39   9.693  18.730   9.751
  282    HE   ARG  39           HE       ARG  39   8.008  17.265   8.251
  283   HH11  ARG  39          1HH1      ARG  39  10.812  16.428  10.136
  284   HH12  ARG  39          2HH1      ARG  39  10.241  14.838  10.520
  285   HH21  ARG  39          1HH2      ARG  39   7.245  15.174   8.749
  286   HH22  ARG  39          2HH2      ARG  39   8.212  14.125   9.730
  287    H    HIS  40           H        HIS  40   4.829  19.543   8.838
  288    HA   HIS  40           HA       HIS  40   4.007  22.294   8.570
  289    HB2  HIS  40           1HB      HIS  40   2.424  20.408   8.253
  290    HB3  HIS  40           2HB      HIS  40   2.604  20.000   9.957
  291    HD2  HIS  40           HD2      HIS  40   0.890  21.312  11.616
  292    HE1  HIS  40           HE1      HIS  40  -0.483  24.203   8.831
  293    HE2  HIS  40           HE2      HIS  40  -0.698  23.306  11.174
  294    H    SER  41           H        SER  41   6.271  22.138  10.153
  295    HA   SER  41           HA       SER  41   5.512  22.198  12.937
  296    HB2  SER  41           1HB      SER  41   7.734  21.374  12.257
  297    HB3  SER  41           2HB      SER  41   8.125  22.968  11.612
  298    HG   SER  41           HG       SER  41   8.941  23.056  13.607
  299    H    GLY  42           H        GLY  42   6.605  24.569  10.521
  300    HA2  GLY  42           1HA      GLY  42   5.507  26.730  10.423
  301    HA3  GLY  42           2HA      GLY  42   5.344  26.664  12.172
  302    HA   PRO  43           HA       PRO  43   9.966  27.699  11.046
  303    HB2  PRO  43           1HB      PRO  43  10.286  28.825   8.597
  304    HB3  PRO  43           2HB      PRO  43  10.425  27.086   8.880
  305    HG2  PRO  43           1HG      PRO  43   8.110  28.650   7.807
  306    HG3  PRO  43           2HG      PRO  43   8.765  27.099   7.252
  307    HD2  PRO  43           1HD      PRO  43   6.558  27.274   8.810
  308    HD3  PRO  43           2HD      PRO  43   7.689  25.909   8.906
  309    H    SER  44           H        SER  44   7.566  29.739   9.371
  310    HA   SER  44           HA       SER  44   8.738  32.209   9.920
  311    HB2  SER  44           1HB      SER  44   6.524  33.174   9.467
  312    HB3  SER  44           2HB      SER  44   6.911  31.912   8.297
  313    HG   SER  44           HG       SER  44   4.809  32.064   9.907
  314    H    SER  45           H        SER  45   7.423  33.913  11.286
  315    HA   SER  45           HA       SER  45   7.522  32.932  14.025
  316    HB2  SER  45           1HB      SER  45   7.485  35.672  12.781
  317    HB3  SER  45           2HB      SER  45   7.194  35.455  14.506
  318    HG   SER  45           HG       SER  45   9.435  34.262  13.300
  319    H    GLY  46           H        GLY  46   5.336  31.964  12.586
  320    HA2  GLY  46           1HA      GLY  46   3.071  31.674  12.811
  321    HA3  GLY  46           2HA      GLY  46   3.211  32.556  14.325
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1 -16.526 -20.016  18.907
    2    HA2  GLY   1           1HA      GLY   1 -14.735 -19.845  16.565
    3    HA3  GLY   1           2HA      GLY   1 -16.320 -20.596  16.455
    4    H    SER   2           H        SER   2 -15.591 -18.508  14.795
    5    HA   SER   2           HA       SER   2 -17.221 -16.284  15.838
    6    HB2  SER   2           1HB      SER   2 -15.936 -14.762  14.449
    7    HB3  SER   2           2HB      SER   2 -14.830 -15.693  15.460
    8    HG   SER   2           HG       SER   2 -15.435 -16.732  12.951
    9    H    SER   3           H        SER   3 -18.552 -15.160  14.299
   10    HA   SER   3           HA       SER   3 -19.234 -16.771  11.928
   11    HB2  SER   3           1HB      SER   3 -21.617 -16.081  12.313
   12    HB3  SER   3           2HB      SER   3 -20.969 -17.147  13.560
   13    HG   SER   3           HG       SER   3 -21.979 -15.499  14.618
   14    H    GLY   4           H        GLY   4 -19.180 -15.693  10.068
   15    HA2  GLY   4           1HA      GLY   4 -20.201 -13.223   9.473
   16    HA3  GLY   4           2HA      GLY   4 -18.570 -12.889  10.037
   17    H    SER   5           H        SER   5 -16.911 -13.110   8.654
   18    HA   SER   5           HA       SER   5 -17.428 -14.485   6.102
   19    HB2  SER   5           1HB      SER   5 -16.248 -12.745   4.901
   20    HB3  SER   5           2HB      SER   5 -17.532 -12.001   5.852
   21    HG   SER   5           HG       SER   5 -16.077 -10.929   6.913
   22    H    SER   6           H        SER   6 -15.535 -15.288   5.010
   23    HA   SER   6           HA       SER   6 -13.799 -16.715   6.637
   24    HB2  SER   6           1HB      SER   6 -13.683 -15.940   3.732
   25    HB3  SER   6           2HB      SER   6 -12.383 -16.873   4.474
   26    HG   SER   6           HG       SER   6 -13.637 -18.502   4.019
   27    H    GLY   7           H        GLY   7 -13.101 -13.760   4.764
   28    HA2  GLY   7           1HA      GLY   7 -11.824 -12.138   6.349
   29    HA3  GLY   7           2HA      GLY   7 -10.629 -13.426   6.315
   30    H    THR   8           H        THR   8 -10.795 -14.180   3.638
   31    HA   THR   8           HA       THR   8  -9.349 -11.982   2.422
   32    HB   THR   8           HB       THR   8  -9.900 -14.750   1.335
   33    HG1  THR   8           HG1      THR   8  -7.780 -15.181   2.065
   34   HG21  THR   8          3HG2      THR   8  -9.359 -13.339  -0.490
   35   HG22  THR   8          1HG2      THR   8  -7.870 -14.188  -0.078
   36   HG23  THR   8          2HG2      THR   8  -8.099 -12.514   0.426
   37    H    GLY   9           H        GLY   9 -10.024 -10.733   0.762
   38    HA2  GLY   9           1HA      GLY   9 -12.571 -11.431  -0.545
   39    HA3  GLY   9           2HA      GLY   9 -12.342  -9.828   0.138
   40    H    GLU  10           H        GLU  10 -11.463  -8.290  -1.105
   41    HA   GLU  10           HA       GLU  10 -11.003  -8.788  -3.856
   42    HB2  GLU  10           1HB      GLU  10 -10.515  -6.382  -2.107
   43    HB3  GLU  10           2HB      GLU  10 -10.153  -6.385  -3.827
   44    HG2  GLU  10           1HG      GLU  10 -12.874  -7.137  -2.847
   45    HG3  GLU  10           2HG      GLU  10 -12.410  -5.445  -3.011
   46    H    LYS  11           H        LYS  11  -8.758  -7.637  -1.332
   47    HA   LYS  11           HA       LYS  11  -6.626  -9.217  -2.549
   48    HB2  LYS  11           1HB      LYS  11  -6.401  -6.243  -2.049
   49    HB3  LYS  11           2HB      LYS  11  -5.071  -7.294  -2.515
   50    HG2  LYS  11           1HG      LYS  11  -7.541  -6.833  -4.173
   51    HG3  LYS  11           2HG      LYS  11  -6.008  -5.984  -4.390
   52    HD2  LYS  11           1HD      LYS  11  -4.886  -8.091  -4.861
   53    HD3  LYS  11           2HD      LYS  11  -6.389  -8.973  -4.580
   54    HE2  LYS  11           1HE      LYS  11  -7.413  -7.679  -6.449
   55    HE3  LYS  11           2HE      LYS  11  -5.826  -6.981  -6.773
   56    HZ1  LYS  11           3HZ      LYS  11  -5.580  -9.775  -6.630
   57    HZ2  LYS  11           1HZ      LYS  11  -5.311  -8.761  -7.957
   58    HZ3  LYS  11           2HZ      LYS  11  -6.850  -9.408  -7.685
   59    HA   PRO  12           HA       PRO  12  -5.622  -9.988   1.666
   60    HB2  PRO  12           1HB      PRO  12  -3.042 -10.780   1.364
   61    HB3  PRO  12           2HB      PRO  12  -4.418 -11.787   0.895
   62    HG2  PRO  12           1HG      PRO  12  -2.670 -10.054  -0.809
   63    HG3  PRO  12           2HG      PRO  12  -3.278 -11.689  -1.129
   64    HD2  PRO  12           1HD      PRO  12  -4.404  -9.478  -2.214
   65    HD3  PRO  12           2HD      PRO  12  -5.346 -10.925  -1.801
   66    H    TYR  13           H        TYR  13  -4.442  -7.416  -0.078
   67    HA   TYR  13           HA       TYR  13  -3.232  -6.257   2.323
   68    HB2  TYR  13           1HB      TYR  13  -1.968  -5.946  -0.401
   69    HB3  TYR  13           2HB      TYR  13  -1.327  -5.408   1.148
   70    HD1  TYR  13           HD1      TYR  13  -0.948  -7.340   2.911
   71    HD2  TYR  13           HD2      TYR  13  -1.171  -7.922  -1.298
   72    HE1  TYR  13           HE1      TYR  13   0.277  -9.460   3.145
   73    HE2  TYR  13           HE2      TYR  13   0.052 -10.043  -1.075
   74    HH   TYR  13           HH       TYR  13   1.360 -11.274   0.346
   75    H    LYS  14           H        LYS  14  -3.740  -4.160   2.657
   76    HA   LYS  14           HA       LYS  14  -4.912  -2.609   0.468
   77    HB2  LYS  14           1HB      LYS  14  -6.858  -3.524   1.507
   78    HB3  LYS  14           2HB      LYS  14  -6.239  -3.182   3.117
   79    HG2  LYS  14           1HG      LYS  14  -6.501  -0.814   2.766
   80    HG3  LYS  14           2HG      LYS  14  -6.984  -1.084   1.090
   81    HD2  LYS  14           1HD      LYS  14  -8.525  -2.454   3.234
   82    HD3  LYS  14           2HD      LYS  14  -8.767  -0.719   3.014
   83    HE2  LYS  14           1HE      LYS  14 -10.384  -1.681   1.640
   84    HE3  LYS  14           2HE      LYS  14  -9.075  -1.285   0.528
   85    HZ1  LYS  14           3HZ      LYS  14  -9.332  -3.965   1.755
   86    HZ2  LYS  14           1HZ      LYS  14  -8.421  -3.514   0.403
   87    HZ3  LYS  14           2HZ      LYS  14 -10.109  -3.565   0.307
   88    H    CYS  15           H        CYS  15  -4.647  -0.397   0.642
   89    HA   CYS  15           HA       CYS  15  -2.545   0.457   2.421
   90    HB2  CYS  15           1HB      CYS  15  -2.402   1.310   0.211
   91    HB3  CYS  15           2HB      CYS  15  -4.088   1.819   0.218
   92    H    SER  16           H        SER  16  -2.676   2.200   3.899
   93    HA   SER  16           HA       SER  16  -5.348   2.497   5.079
   94    HB2  SER  16           1HB      SER  16  -4.248   3.024   7.154
   95    HB3  SER  16           2HB      SER  16  -3.479   1.582   6.491
   96    HG   SER  16           HG       SER  16  -2.512   4.244   6.470
   97    H    ASP  17           H        ASP  17  -2.673   4.273   3.718
   98    HA   ASP  17           HA       ASP  17  -3.221   6.851   4.570
   99    HB2  ASP  17           1HB      ASP  17  -2.305   6.134   1.781
  100    HB3  ASP  17           2HB      ASP  17  -1.979   7.621   2.667
  101    H    CYS  18           H        CYS  18  -4.309   5.386   1.501
  102    HA   CYS  18           HA       CYS  18  -6.505   7.342   1.446
  103    HB2  CYS  18           1HB      CYS  18  -6.651   6.792  -0.980
  104    HB3  CYS  18           2HB      CYS  18  -5.099   7.480  -0.513
  105    H    GLY  19           H        GLY  19  -5.780   3.914   0.836
  106    HA2  GLY  19           1HA      GLY  19  -7.309   2.308   1.935
  107    HA3  GLY  19           2HA      GLY  19  -8.626   3.336   1.389
  108    H    LYS  20           H        LYS  20  -5.792   2.436  -0.501
  109    HA   LYS  20           HA       LYS  20  -7.553   1.334  -2.543
  110    HB2  LYS  20           1HB      LYS  20  -5.477   2.953  -2.838
  111    HB3  LYS  20           2HB      LYS  20  -4.587   1.437  -2.863
  112    HG2  LYS  20           1HG      LYS  20  -5.656   0.705  -4.807
  113    HG3  LYS  20           2HG      LYS  20  -6.954   1.891  -4.645
  114    HD2  LYS  20           1HD      LYS  20  -5.244   3.683  -5.006
  115    HD3  LYS  20           2HD      LYS  20  -4.073   2.413  -5.368
  116    HE2  LYS  20           1HE      LYS  20  -6.677   2.477  -6.827
  117    HE3  LYS  20           2HE      LYS  20  -5.396   3.594  -7.294
  118    HZ1  LYS  20           3HZ      LYS  20  -4.442   0.918  -6.972
  119    HZ2  LYS  20           1HZ      LYS  20  -4.275   1.970  -8.286
  120    HZ3  LYS  20           2HZ      LYS  20  -5.664   1.017  -8.138
  121    H    SER  21           H        SER  21  -6.755  -0.662  -3.711
  122    HA   SER  21           HA       SER  21  -5.952  -2.665  -1.710
  123    HB2  SER  21           1HB      SER  21  -7.593  -2.949  -4.236
  124    HB3  SER  21           2HB      SER  21  -7.058  -4.311  -3.251
  125    HG   SER  21           HG       SER  21  -8.271  -3.500  -1.540
  126    H    PHE  22           H        PHE  22  -4.432  -4.249  -2.241
  127    HA   PHE  22           HA       PHE  22  -3.021  -4.002  -4.784
  128    HB2  PHE  22           1HB      PHE  22  -1.503  -3.954  -2.175
  129    HB3  PHE  22           2HB      PHE  22  -0.864  -3.713  -3.798
  130    HD1  PHE  22           HD1      PHE  22  -3.333  -2.230  -1.433
  131    HD2  PHE  22           HD2      PHE  22  -0.499  -1.567  -4.539
  132    HE1  PHE  22           HE1      PHE  22  -3.636   0.199  -1.185
  133    HE2  PHE  22           HE2      PHE  22  -0.796   0.863  -4.295
  134    HZ   PHE  22           HZ       PHE  22  -2.365   1.749  -2.616
  135    H    THR  23           H        THR  23  -2.135  -5.886  -5.501
  136    HA   THR  23           HA       THR  23  -2.910  -8.294  -4.103
  137    HB   THR  23           HB       THR  23  -1.415  -8.015  -6.717
  138    HG1  THR  23           HG1      THR  23  -3.448  -8.226  -7.666
  139   HG21  THR  23          3HG2      THR  23  -1.094 -10.216  -5.903
  140   HG22  THR  23          1HG2      THR  23  -2.405 -10.325  -7.078
  141   HG23  THR  23          2HG2      THR  23  -2.765 -10.335  -5.351
  142    H    TRP  24           H        TRP  24   0.071  -6.620  -4.961
  143    HA   TRP  24           HA       TRP  24   1.621  -8.669  -3.539
  144    HB2  TRP  24           1HB      TRP  24   2.475  -6.493  -5.455
  145    HB3  TRP  24           2HB      TRP  24   3.601  -7.533  -4.588
  146    HD1  TRP  24           HD1      TRP  24   1.381  -7.440  -7.624
  147    HE1  TRP  24           HE1      TRP  24   1.613  -9.647  -8.928
  148    HE3  TRP  24           HE3      TRP  24   4.012 -10.148  -4.176
  149    HZ2  TRP  24           HZ2      TRP  24   2.758 -12.198  -8.546
  150    HZ3  TRP  24           HZ3      TRP  24   4.636 -12.464  -4.723
  151    HH2  TRP  24           HH2      TRP  24   4.021 -13.467  -6.863
  152    H    LYS  25           H        LYS  25   1.837  -8.244  -1.442
  153    HA   LYS  25           HA       LYS  25   1.414  -5.913  -0.089
  154    HB2  LYS  25           1HB      LYS  25   3.032  -6.837   1.641
  155    HB3  LYS  25           2HB      LYS  25   1.696  -7.885   1.182
  156    HG2  LYS  25           1HG      LYS  25   3.216  -9.083  -0.355
  157    HG3  LYS  25           2HG      LYS  25   4.546  -8.080   0.228
  158    HD2  LYS  25           1HD      LYS  25   2.844  -9.866   1.967
  159    HD3  LYS  25           2HD      LYS  25   4.433 -10.298   1.330
  160    HE2  LYS  25           1HE      LYS  25   5.444  -8.449   2.534
  161    HE3  LYS  25           2HE      LYS  25   3.861  -7.933   3.115
  162    HZ1  LYS  25           3HZ      LYS  25   4.793  -9.138   4.866
  163    HZ2  LYS  25           1HZ      LYS  25   5.380 -10.360   3.853
  164    HZ3  LYS  25           2HZ      LYS  25   3.720 -10.230   4.146
  165    H    SER  26           H        SER  26   4.499  -7.022  -1.454
  166    HA   SER  26           HA       SER  26   6.220  -5.099  -0.567
  167    HB2  SER  26           1HB      SER  26   6.032  -6.577  -3.170
  168    HB3  SER  26           2HB      SER  26   7.265  -5.333  -2.961
  169    HG   SER  26           HG       SER  26   7.777  -7.619  -2.352
  170    H    ARG  27           H        ARG  27   4.142  -4.854  -3.448
  171    HA   ARG  27           HA       ARG  27   4.875  -2.325  -4.295
  172    HB2  ARG  27           1HB      ARG  27   2.091  -3.501  -4.382
  173    HB3  ARG  27           2HB      ARG  27   2.709  -2.213  -5.407
  174    HG2  ARG  27           1HG      ARG  27   3.818  -5.010  -5.356
  175    HG3  ARG  27           2HG      ARG  27   2.608  -4.437  -6.505
  176    HD2  ARG  27           1HD      ARG  27   4.409  -2.528  -6.875
  177    HD3  ARG  27           2HD      ARG  27   5.500  -3.787  -6.297
  178    HE   ARG  27           HE       ARG  27   5.243  -4.864  -8.295
  179   HH11  ARG  27          1HH1      ARG  27   2.648  -2.575  -7.908
  180   HH12  ARG  27          2HH1      ARG  27   2.027  -2.811  -9.508
  181   HH21  ARG  27          1HH2      ARG  27   4.434  -5.184 -10.403
  182   HH22  ARG  27          2HH2      ARG  27   3.043  -4.296 -10.926
  183    H    LEU  28           H        LEU  28   2.337  -3.213  -1.970
  184    HA   LEU  28           HA       LEU  28   1.289  -0.718  -1.442
  185    HB2  LEU  28           1HB      LEU  28   0.308  -2.715  -0.535
  186    HB3  LEU  28           2HB      LEU  28   1.748  -3.033   0.430
  187    HG   LEU  28           HG       LEU  28   1.225  -0.877   1.663
  188   HD11  LEU  28          1HD1      LEU  28  -0.836  -0.799  -0.317
  189   HD12  LEU  28          2HD1      LEU  28  -0.415   0.403   0.903
  190   HD13  LEU  28          3HD1      LEU  28  -1.562  -0.880   1.288
  191   HD21  LEU  28          3HD2      LEU  28  -0.209  -3.453   1.802
  192   HD22  LEU  28          1HD2      LEU  28  -0.906  -2.121   2.724
  193   HD23  LEU  28          2HD2      LEU  28   0.759  -2.621   3.021
  194    H    ARG  29           H        ARG  29   4.010  -2.300   0.227
  195    HA   ARG  29           HA       ARG  29   4.680  -0.490   2.116
  196    HB2  ARG  29           1HB      ARG  29   6.576  -1.914   0.242
  197    HB3  ARG  29           2HB      ARG  29   7.067  -1.108   1.725
  198    HG2  ARG  29           1HG      ARG  29   5.977  -2.671   3.076
  199    HG3  ARG  29           2HG      ARG  29   5.002  -3.278   1.736
  200    HD2  ARG  29           1HD      ARG  29   6.560  -4.944   1.870
  201    HD3  ARG  29           2HD      ARG  29   7.369  -3.866   0.734
  202    HE   ARG  29           HE       ARG  29   8.039  -3.343   3.474
  203   HH11  ARG  29          1HH1      ARG  29   8.776  -5.281   0.677
  204   HH12  ARG  29          2HH1      ARG  29  10.403  -5.610   1.172
  205   HH21  ARG  29          1HH2      ARG  29  10.180  -3.770   4.137
  206   HH22  ARG  29          2HH2      ARG  29  11.200  -4.751   3.141
  207    H    ILE  30           H        ILE  30   5.423  -0.219  -1.336
  208    HA   ILE  30           HA       ILE  30   6.796   2.285  -1.033
  209    HB   ILE  30           HB       ILE  30   5.752   0.934  -3.525
  210   HG12  ILE  30          1HG1      ILE  30   8.609   1.092  -2.572
  211   HG13  ILE  30          2HG1      ILE  30   7.547  -0.237  -2.121
  212   HG21  ILE  30          1HG2      ILE  30   7.842   3.088  -3.389
  213   HG22  ILE  30          2HG2      ILE  30   6.986   2.474  -4.803
  214   HG23  ILE  30          3HG2      ILE  30   6.129   3.448  -3.609
  215   HD11  ILE  30          3HD1      ILE  30   9.008  -0.750  -4.036
  216   HD12  ILE  30          1HD1      ILE  30   7.292  -0.874  -4.422
  217   HD13  ILE  30          2HD1      ILE  30   8.215   0.532  -4.950
  218    H    HIS  31           H        HIS  31   3.619   1.278  -2.257
  219    HA   HIS  31           HA       HIS  31   2.635   3.695  -3.132
  220    HB2  HIS  31           1HB      HIS  31   1.377   1.662  -3.455
  221    HB3  HIS  31           2HB      HIS  31   1.185   1.451  -1.717
  222    HD1  HIS  31           HD1      HIS  31  -0.297   3.131  -4.646
  223    HD2  HIS  31           HD2      HIS  31  -0.666   3.275  -0.510
  224    HE1  HIS  31           HE1      HIS  31  -2.434   4.381  -4.205
  225    H    GLN  32           H        GLN  32   3.320   2.705   0.093
  226    HA   GLN  32           HA       GLN  32   1.638   4.657   1.371
  227    HB2  GLN  32           1HB      GLN  32   3.863   2.898   2.406
  228    HB3  GLN  32           2HB      GLN  32   2.940   3.996   3.424
  229    HG2  GLN  32           1HG      GLN  32   0.972   2.769   3.168
  230    HG3  GLN  32           2HG      GLN  32   1.590   1.903   1.762
  231   HE21  GLN  32          1HE2      GLN  32   0.684   0.135   3.193
  232   HE22  GLN  32          2HE2      GLN  32   1.793  -0.614   4.286
  233    H    LYS  33           H        LYS  33   5.131   4.311   0.808
  234    HA   LYS  33           HA       LYS  33   5.766   6.859   1.932
  235    HB2  LYS  33           1HB      LYS  33   7.996   6.411   1.328
  236    HB3  LYS  33           2HB      LYS  33   7.311   4.836   1.705
  237    HG2  LYS  33           1HG      LYS  33   7.219   4.207  -0.543
  238    HG3  LYS  33           2HG      LYS  33   7.405   5.869  -1.106
  239    HD2  LYS  33           1HD      LYS  33   9.503   4.911  -1.476
  240    HD3  LYS  33           2HD      LYS  33   9.701   5.791   0.042
  241    HE2  LYS  33           1HE      LYS  33   9.007   3.503   1.107
  242    HE3  LYS  33           2HE      LYS  33   9.528   2.849  -0.445
  243    HZ1  LYS  33           3HZ      LYS  33  11.102   3.865   1.730
  244    HZ2  LYS  33           1HZ      LYS  33  11.549   4.520   0.235
  245    HZ3  LYS  33           2HZ      LYS  33  11.549   2.844   0.458
  246    H    CYS  34           H        CYS  34   4.499   5.860  -1.051
  247    HA   CYS  34           HA       CYS  34   5.583   8.012  -2.628
  248    HB2  CYS  34           1HB      CYS  34   4.477   7.070  -4.435
  249    HB3  CYS  34           2HB      CYS  34   4.739   5.664  -3.409
  250    HG   CYS  34           HG       CYS  34   1.811   7.353  -3.118
  251    H    HIS  35           H        HIS  35   3.189   7.789  -0.307
  252    HA   HIS  35           HA       HIS  35   1.301   9.631  -1.437
  253    HB2  HIS  35           1HB      HIS  35   1.660   8.288   1.206
  254    HB3  HIS  35           2HB      HIS  35   0.626   9.711   1.124
  255    HD1  HIS  35           HD1      HIS  35  -1.146   9.430  -1.111
  256    HD2  HIS  35           HD2      HIS  35   0.194   6.053   0.904
  257    HE1  HIS  35           HE1      HIS  35  -2.808   7.622  -1.651
  258    H    THR  36           H        THR  36   3.609  10.877  -1.810
  259    HA   THR  36           HA       THR  36   4.138  12.692   0.402
  260    HB   THR  36           HB       THR  36   5.861  13.660  -1.158
  261    HG1  THR  36           HG1      THR  36   6.309  12.432  -3.043
  262   HG21  THR  36          3HG2      THR  36   7.054  12.255   0.118
  263   HG22  THR  36          1HG2      THR  36   7.003  11.157  -1.261
  264   HG23  THR  36          2HG2      THR  36   5.820  10.998   0.038
  265    H    GLY  37           H        GLY  37   2.095  13.775   0.429
  266    HA2  GLY  37           1HA      GLY  37   1.587  16.154  -0.161
  267    HA3  GLY  37           2HA      GLY  37   1.727  15.638  -1.836
  268    H    GLU  38           H        GLU  38   0.157  13.900   0.811
  269    HA   GLU  38           HA       GLU  38  -2.487  14.673   0.072
  270    HB2  GLU  38           1HB      GLU  38  -1.648  13.018  -1.756
  271    HB3  GLU  38           2HB      GLU  38  -1.895  11.792  -0.521
  272    HG2  GLU  38           1HG      GLU  38  -4.207  12.213  -0.418
  273    HG3  GLU  38           2HG      GLU  38  -4.051  13.716  -1.325
  274    H    ARG  39           H        ARG  39  -3.517  14.659   1.947
  275    HA   ARG  39           HA       ARG  39  -3.094  12.402   3.782
  276    HB2  ARG  39           1HB      ARG  39  -3.122  15.336   4.501
  277    HB3  ARG  39           2HB      ARG  39  -3.260  14.041   5.682
  278    HG2  ARG  39           1HG      ARG  39  -0.937  14.249   3.792
  279    HG3  ARG  39           2HG      ARG  39  -0.967  15.061   5.359
  280    HD2  ARG  39           1HD      ARG  39  -1.001  13.044   6.535
  281    HD3  ARG  39           2HD      ARG  39  -1.524  12.126   5.124
  282    HE   ARG  39           HE       ARG  39   1.063  13.327   4.808
  283   HH11  ARG  39          1HH1      ARG  39  -0.672  10.574   6.044
  284   HH12  ARG  39          2HH1      ARG  39   0.691   9.508   5.949
  285   HH21  ARG  39          1HH2      ARG  39   2.864  11.934   4.678
  286   HH22  ARG  39          2HH2      ARG  39   2.702  10.283   5.173
  287    H    HIS  40           H        HIS  40  -4.915  11.540   4.576
  288    HA   HIS  40           HA       HIS  40  -7.436  12.973   4.063
  289    HB2  HIS  40           1HB      HIS  40  -6.799  10.026   4.127
  290    HB3  HIS  40           2HB      HIS  40  -8.451  10.634   4.192
  291    HD2  HIS  40           HD2      HIS  40  -9.332   9.995   1.694
  292    HE1  HIS  40           HE1      HIS  40  -6.163  11.783  -0.488
  293    HE2  HIS  40           HE2      HIS  40  -8.435  10.704  -0.626
  294    H    SER  41           H        SER  41  -5.750  10.887   6.376
  295    HA   SER  41           HA       SER  41  -7.629  10.691   8.371
  296    HB2  SER  41           1HB      SER  41  -4.638  10.796   8.384
  297    HB3  SER  41           2HB      SER  41  -5.499  10.824   9.923
  298    HG   SER  41           HG       SER  41  -5.469   8.730   9.649
  299    H    GLY  42           H        GLY  42  -8.652  12.088   9.644
  300    HA2  GLY  42           1HA      GLY  42  -8.001  14.031  11.237
  301    HA3  GLY  42           2HA      GLY  42  -7.680  14.861   9.721
  302    HA   PRO  43           HA       PRO  43 -12.158  15.417  11.067
  303    HB2  PRO  43           1HB      PRO  43 -12.059  18.114  11.363
  304    HB3  PRO  43           2HB      PRO  43 -11.695  16.990  12.677
  305    HG2  PRO  43           1HG      PRO  43  -9.817  18.471  10.876
  306    HG3  PRO  43           2HG      PRO  43  -9.716  18.210  12.627
  307    HD2  PRO  43           1HD      PRO  43  -8.288  16.747  10.852
  308    HD3  PRO  43           2HD      PRO  43  -8.874  16.077  12.388
  309    H    SER  44           H        SER  44 -13.790  16.776   9.944
  310    HA   SER  44           HA       SER  44 -13.111  18.186   7.566
  311    HB2  SER  44           1HB      SER  44 -14.049  16.629   5.927
  312    HB3  SER  44           2HB      SER  44 -12.692  15.884   6.771
  313    HG   SER  44           HG       SER  44 -14.050  14.348   7.202
  314    H    SER  45           H        SER  45 -15.008  18.962   6.412
  315    HA   SER  45           HA       SER  45 -17.075  19.739   8.175
  316    HB2  SER  45           1HB      SER  45 -16.781  19.951   5.176
  317    HB3  SER  45           2HB      SER  45 -18.161  20.616   6.050
  318    HG   SER  45           HG       SER  45 -16.952  22.265   6.480
  319    H    GLY  46           H        GLY  46 -18.386  18.211   8.998
  320    HA2  GLY  46           1HA      GLY  46 -20.612  17.235   8.077
  321    HA3  GLY  46           2HA      GLY  46 -19.514  16.192   7.186
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1 -22.745   7.794  -0.519
    2    HA2  GLY   1           1HA      GLY   1 -22.936   7.295  -2.946
    3    HA3  GLY   1           2HA      GLY   1 -22.351   8.929  -3.220
    4    H    SER   2           H        SER   2 -21.252   6.352  -1.025
    5    HA   SER   2           HA       SER   2 -18.579   6.616  -2.235
    6    HB2  SER   2           1HB      SER   2 -18.856   7.281   0.200
    7    HB3  SER   2           2HB      SER   2 -19.176   5.580   0.540
    8    HG   SER   2           HG       SER   2 -17.114   5.093  -0.283
    9    H    SER   3           H        SER   3 -18.896   5.057  -3.835
   10    HA   SER   3           HA       SER   3 -19.771   2.398  -3.149
   11    HB2  SER   3           1HB      SER   3 -19.645   1.914  -5.453
   12    HB3  SER   3           2HB      SER   3 -20.124   3.610  -5.394
   13    HG   SER   3           HG       SER   3 -18.163   2.710  -6.741
   14    H    GLY   4           H        GLY   4 -18.547   0.693  -2.621
   15    HA2  GLY   4           1HA      GLY   4 -15.834   0.382  -3.440
   16    HA3  GLY   4           2HA      GLY   4 -15.930   0.907  -1.766
   17    H    SER   5           H        SER   5 -17.927  -0.427  -0.667
   18    HA   SER   5           HA       SER   5 -16.918  -3.107  -0.537
   19    HB2  SER   5           1HB      SER   5 -18.941  -1.501   0.942
   20    HB3  SER   5           2HB      SER   5 -19.099  -3.256   1.006
   21    HG   SER   5           HG       SER   5 -17.142  -1.602   2.074
   22    H    SER   6           H        SER   6 -17.685  -2.855  -3.081
   23    HA   SER   6           HA       SER   6 -20.317  -4.153  -3.281
   24    HB2  SER   6           1HB      SER   6 -19.938  -2.049  -4.597
   25    HB3  SER   6           2HB      SER   6 -18.696  -2.904  -5.511
   26    HG   SER   6           HG       SER   6 -21.477  -3.275  -5.501
   27    H    GLY   7           H        GLY   7 -17.007  -4.341  -4.582
   28    HA2  GLY   7           1HA      GLY   7 -16.484  -6.968  -4.236
   29    HA3  GLY   7           2HA      GLY   7 -17.486  -6.974  -5.680
   30    H    THR   8           H        THR   8 -14.573  -5.463  -4.317
   31    HA   THR   8           HA       THR   8 -13.466  -5.364  -7.047
   32    HB   THR   8           HB       THR   8 -11.997  -3.542  -6.269
   33    HG1  THR   8           HG1      THR   8 -11.921  -3.023  -4.214
   34   HG21  THR   8          3HG2      THR   8 -14.781  -3.408  -6.750
   35   HG22  THR   8          1HG2      THR   8 -13.569  -2.156  -7.021
   36   HG23  THR   8          2HG2      THR   8 -14.416  -2.244  -5.477
   37    H    GLY   9           H        GLY   9 -13.327  -7.721  -5.542
   38    HA2  GLY   9           1HA      GLY   9 -11.825  -9.311  -4.847
   39    HA3  GLY   9           2HA      GLY   9 -10.627  -8.381  -5.737
   40    H    GLU  10           H        GLU  10 -11.671  -9.396  -2.688
   41    HA   GLU  10           HA       GLU  10 -10.542  -7.290  -1.122
   42    HB2  GLU  10           1HB      GLU  10 -12.330  -9.008  -0.429
   43    HB3  GLU  10           2HB      GLU  10 -10.984 -10.106  -0.160
   44    HG2  GLU  10           1HG      GLU  10 -11.803  -8.907   1.870
   45    HG3  GLU  10           2HG      GLU  10 -10.081  -8.731   1.540
   46    H    LYS  11           H        LYS  11  -8.447  -7.038  -2.014
   47    HA   LYS  11           HA       LYS  11  -6.538  -9.108  -2.175
   48    HB2  LYS  11           1HB      LYS  11  -6.029  -6.151  -1.805
   49    HB3  LYS  11           2HB      LYS  11  -4.892  -7.337  -2.434
   50    HG2  LYS  11           1HG      LYS  11  -7.515  -6.732  -3.767
   51    HG3  LYS  11           2HG      LYS  11  -6.024  -5.862  -4.134
   52    HD2  LYS  11           1HD      LYS  11  -5.014  -8.204  -4.520
   53    HD3  LYS  11           2HD      LYS  11  -6.691  -8.749  -4.605
   54    HE2  LYS  11           1HE      LYS  11  -5.499  -6.559  -6.302
   55    HE3  LYS  11           2HE      LYS  11  -5.709  -8.231  -6.821
   56    HZ1  LYS  11           3HZ      LYS  11  -7.604  -7.281  -7.630
   57    HZ2  LYS  11           1HZ      LYS  11  -7.732  -6.156  -6.373
   58    HZ3  LYS  11           2HZ      LYS  11  -8.163  -7.770  -6.110
   59    HA   PRO  12           HA       PRO  12  -5.210  -9.678   1.972
   60    HB2  PRO  12           1HB      PRO  12  -2.590 -10.278   1.591
   61    HB3  PRO  12           2HB      PRO  12  -3.899 -11.393   1.184
   62    HG2  PRO  12           1HG      PRO  12  -2.347  -9.561  -0.603
   63    HG3  PRO  12           2HG      PRO  12  -2.839 -11.242  -0.880
   64    HD2  PRO  12           1HD      PRO  12  -4.165  -9.140  -1.954
   65    HD3  PRO  12           2HD      PRO  12  -4.981 -10.647  -1.489
   66    H    TYR  13           H        TYR  13  -4.366  -7.027   0.195
   67    HA   TYR  13           HA       TYR  13  -3.125  -5.759   2.521
   68    HB2  TYR  13           1HB      TYR  13  -2.020  -5.446  -0.276
   69    HB3  TYR  13           2HB      TYR  13  -1.391  -4.711   1.195
   70    HD1  TYR  13           HD1      TYR  13  -0.326  -6.161   2.931
   71    HD2  TYR  13           HD2      TYR  13  -1.418  -7.654  -0.901
   72    HE1  TYR  13           HE1      TYR  13   1.153  -8.096   3.270
   73    HE2  TYR  13           HE2      TYR  13   0.058  -9.594  -0.572
   74    HH   TYR  13           HH       TYR  13   2.287  -9.780   2.072
   75    H    LYS  14           H        LYS  14  -3.796  -3.712   2.874
   76    HA   LYS  14           HA       LYS  14  -5.185  -2.273   0.738
   77    HB2  LYS  14           1HB      LYS  14  -6.885  -3.542   2.058
   78    HB3  LYS  14           2HB      LYS  14  -6.376  -2.657   3.490
   79    HG2  LYS  14           1HG      LYS  14  -7.240  -0.642   2.701
   80    HG3  LYS  14           2HG      LYS  14  -7.318  -1.222   1.036
   81    HD2  LYS  14           1HD      LYS  14  -9.045  -2.883   1.814
   82    HD3  LYS  14           2HD      LYS  14  -9.068  -2.021   3.355
   83    HE2  LYS  14           1HE      LYS  14  -9.654  -0.795   0.661
   84    HE3  LYS  14           2HE      LYS  14 -10.870  -1.302   1.832
   85    HZ1  LYS  14           3HZ      LYS  14 -10.240   0.368   3.314
   86    HZ2  LYS  14           1HZ      LYS  14 -10.223   1.136   1.806
   87    HZ3  LYS  14           2HZ      LYS  14  -8.770   0.659   2.528
   88    H    CYS  15           H        CYS  15  -4.554  -0.221   0.656
   89    HA   CYS  15           HA       CYS  15  -2.663   0.847   2.448
   90    HB2  CYS  15           1HB      CYS  15  -2.771   1.601   0.143
   91    HB3  CYS  15           2HB      CYS  15  -4.400   2.220   0.389
   92    H    SER  16           H        SER  16  -2.856   1.974   4.281
   93    HA   SER  16           HA       SER  16  -5.560   2.549   5.249
   94    HB2  SER  16           1HB      SER  16  -3.751   1.196   6.560
   95    HB3  SER  16           2HB      SER  16  -3.088   2.786   6.937
   96    HG   SER  16           HG       SER  16  -5.164   3.333   7.785
   97    H    ASP  17           H        ASP  17  -4.521   4.269   3.283
   98    HA   ASP  17           HA       ASP  17  -4.346   6.760   4.830
   99    HB2  ASP  17           1HB      ASP  17  -2.664   6.023   2.428
  100    HB3  ASP  17           2HB      ASP  17  -2.776   7.651   3.091
  101    H    CYS  18           H        CYS  18  -4.893   5.362   1.605
  102    HA   CYS  18           HA       CYS  18  -6.863   7.496   1.107
  103    HB2  CYS  18           1HB      CYS  18  -6.516   6.976  -1.315
  104    HB3  CYS  18           2HB      CYS  18  -5.082   7.603  -0.509
  105    H    GLY  19           H        GLY  19  -6.202   4.051   0.490
  106    HA2  GLY  19           1HA      GLY  19  -8.030   2.523   1.225
  107    HA3  GLY  19           2HA      GLY  19  -9.126   3.625   0.406
  108    H    LYS  20           H        LYS  20  -5.981   2.450  -0.711
  109    HA   LYS  20           HA       LYS  20  -7.270   1.502  -3.155
  110    HB2  LYS  20           1HB      LYS  20  -5.090   2.993  -2.930
  111    HB3  LYS  20           2HB      LYS  20  -4.312   1.424  -2.766
  112    HG2  LYS  20           1HG      LYS  20  -4.736   0.829  -4.924
  113    HG3  LYS  20           2HG      LYS  20  -6.197   1.815  -5.026
  114    HD2  LYS  20           1HD      LYS  20  -4.805   3.076  -6.324
  115    HD3  LYS  20           2HD      LYS  20  -4.442   3.782  -4.747
  116    HE2  LYS  20           1HE      LYS  20  -2.379   2.803  -4.633
  117    HE3  LYS  20           2HE      LYS  20  -2.856   1.427  -5.626
  118    HZ1  LYS  20           3HZ      LYS  20  -1.528   3.770  -6.414
  119    HZ2  LYS  20           1HZ      LYS  20  -3.019   3.714  -7.211
  120    HZ3  LYS  20           2HZ      LYS  20  -1.935   2.425  -7.355
  121    H    SER  21           H        SER  21  -6.177  -0.521  -4.131
  122    HA   SER  21           HA       SER  21  -5.785  -2.541  -2.024
  123    HB2  SER  21           1HB      SER  21  -7.630  -2.596  -4.388
  124    HB3  SER  21           2HB      SER  21  -6.958  -4.104  -3.770
  125    HG   SER  21           HG       SER  21  -8.385  -2.198  -2.223
  126    H    PHE  22           H        PHE  22  -4.130  -3.923  -2.315
  127    HA   PHE  22           HA       PHE  22  -2.807  -3.971  -4.941
  128    HB2  PHE  22           1HB      PHE  22  -1.315  -3.935  -2.316
  129    HB3  PHE  22           2HB      PHE  22  -0.638  -3.810  -3.936
  130    HD1  PHE  22           HD1      PHE  22  -2.910  -2.058  -1.574
  131    HD2  PHE  22           HD2      PHE  22  -0.232  -1.728  -4.865
  132    HE1  PHE  22           HE1      PHE  22  -3.045   0.395  -1.433
  133    HE2  PHE  22           HE2      PHE  22  -0.361   0.725  -4.729
  134    HZ   PHE  22           HZ       PHE  22  -1.768   1.790  -3.011
  135    H    THR  23           H        THR  23  -2.017  -5.922  -5.601
  136    HA   THR  23           HA       THR  23  -2.976  -8.246  -4.186
  137    HB   THR  23           HB       THR  23  -1.386  -8.056  -6.753
  138    HG1  THR  23           HG1      THR  23  -3.263  -7.741  -7.681
  139   HG21  THR  23          3HG2      THR  23  -2.966 -10.413  -6.569
  140   HG22  THR  23          1HG2      THR  23  -1.989 -10.294  -5.107
  141   HG23  THR  23          2HG2      THR  23  -1.212 -10.274  -6.690
  142    H    TRP  24           H        TRP  24   0.178  -6.909  -5.102
  143    HA   TRP  24           HA       TRP  24   1.532  -8.988  -3.561
  144    HB2  TRP  24           1HB      TRP  24   2.485  -6.866  -5.474
  145    HB3  TRP  24           2HB      TRP  24   3.610  -7.758  -4.454
  146    HD1  TRP  24           HD1      TRP  24   0.889  -8.527  -7.114
  147    HE1  TRP  24           HE1      TRP  24   1.629 -10.621  -8.416
  148    HE3  TRP  24           HE3      TRP  24   5.150  -9.637  -4.515
  149    HZ2  TRP  24           HZ2      TRP  24   3.739 -12.495  -8.349
  150    HZ3  TRP  24           HZ3      TRP  24   6.471 -11.597  -5.197
  151    HH2  TRP  24           HH2      TRP  24   5.778 -12.995  -7.075
  152    H    LYS  25           H        LYS  25   3.134  -8.441  -1.961
  153    HA   LYS  25           HA       LYS  25   2.218  -6.397  -0.175
  154    HB2  LYS  25           1HB      LYS  25   3.019  -8.414   0.810
  155    HB3  LYS  25           2HB      LYS  25   4.531  -8.331  -0.085
  156    HG2  LYS  25           1HG      LYS  25   4.980  -7.725   2.169
  157    HG3  LYS  25           2HG      LYS  25   5.088  -6.261   1.189
  158    HD2  LYS  25           1HD      LYS  25   2.581  -5.971   1.846
  159    HD3  LYS  25           2HD      LYS  25   2.990  -7.078   3.158
  160    HE2  LYS  25           1HE      LYS  25   4.565  -5.592   4.065
  161    HE3  LYS  25           2HE      LYS  25   4.624  -4.623   2.594
  162    HZ1  LYS  25           3HZ      LYS  25   2.293  -3.980   3.042
  163    HZ2  LYS  25           1HZ      LYS  25   3.371  -3.455   4.235
  164    HZ3  LYS  25           2HZ      LYS  25   2.376  -4.791   4.524
  165    H    SER  26           H        SER  26   5.317  -6.955  -1.851
  166    HA   SER  26           HA       SER  26   6.701  -4.724  -1.126
  167    HB2  SER  26           1HB      SER  26   7.891  -4.882  -3.272
  168    HB3  SER  26           2HB      SER  26   7.625  -6.481  -2.578
  169    HG   SER  26           HG       SER  26   6.057  -5.263  -4.608
  170    H    ARG  27           H        ARG  27   4.308  -4.947  -3.736
  171    HA   ARG  27           HA       ARG  27   4.510  -2.408  -4.794
  172    HB2  ARG  27           1HB      ARG  27   1.997  -4.037  -4.377
  173    HB3  ARG  27           2HB      ARG  27   2.142  -2.659  -5.459
  174    HG2  ARG  27           1HG      ARG  27   3.990  -4.977  -5.777
  175    HG3  ARG  27           2HG      ARG  27   2.336  -5.082  -6.383
  176    HD2  ARG  27           1HD      ARG  27   4.156  -2.788  -7.061
  177    HD3  ARG  27           2HD      ARG  27   4.123  -4.274  -8.009
  178    HE   ARG  27           HE       ARG  27   2.092  -2.214  -7.918
  179   HH11  ARG  27          1HH1      ARG  27   2.891  -5.486  -8.798
  180   HH12  ARG  27          2HH1      ARG  27   1.604  -5.629  -9.949
  181   HH21  ARG  27          1HH2      ARG  27   0.394  -2.390  -9.431
  182   HH22  ARG  27          2HH2      ARG  27   0.185  -3.867 -10.309
  183    H    LEU  28           H        LEU  28   2.215  -3.417  -2.253
  184    HA   LEU  28           HA       LEU  28   1.078  -1.015  -1.641
  185    HB2  LEU  28           1HB      LEU  28   0.385  -3.076  -0.594
  186    HB3  LEU  28           2HB      LEU  28   1.922  -3.196   0.260
  187    HG   LEU  28           HG       LEU  28   1.250  -1.013   1.411
  188   HD11  LEU  28          1HD1      LEU  28  -1.320  -0.893   1.569
  189   HD12  LEU  28          2HD1      LEU  28  -1.301  -1.758   0.032
  190   HD13  LEU  28          3HD1      LEU  28  -0.523  -0.181   0.166
  191   HD21  LEU  28          3HD2      LEU  28   0.963  -2.458   3.069
  192   HD22  LEU  28          1HD2      LEU  28   0.586  -3.746   1.924
  193   HD23  LEU  28          2HD2      LEU  28  -0.701  -2.706   2.537
  194    H    ARG  29           H        ARG  29   4.034  -2.315  -0.126
  195    HA   ARG  29           HA       ARG  29   4.687  -0.287   1.569
  196    HB2  ARG  29           1HB      ARG  29   6.574  -1.838  -0.213
  197    HB3  ARG  29           2HB      ARG  29   7.068  -0.885   1.180
  198    HG2  ARG  29           1HG      ARG  29   5.302  -2.425   2.405
  199    HG3  ARG  29           2HG      ARG  29   5.687  -3.505   1.064
  200    HD2  ARG  29           1HD      ARG  29   7.895  -3.728   1.705
  201    HD3  ARG  29           2HD      ARG  29   7.894  -2.209   2.601
  202    HE   ARG  29           HE       ARG  29   6.193  -4.286   3.681
  203   HH11  ARG  29          1HH1      ARG  29   9.327  -2.769   3.719
  204   HH12  ARG  29          2HH1      ARG  29   9.728  -3.340   5.305
  205   HH21  ARG  29          1HH2      ARG  29   6.710  -5.044   5.769
  206   HH22  ARG  29          2HH2      ARG  29   8.240  -4.635   6.470
  207    H    ILE  30           H        ILE  30   5.784  -0.470  -1.823
  208    HA   ILE  30           HA       ILE  30   7.057   1.961  -2.001
  209    HB   ILE  30           HB       ILE  30   5.393   0.637  -4.146
  210   HG12  ILE  30          1HG1      ILE  30   8.382   0.501  -3.758
  211   HG13  ILE  30          2HG1      ILE  30   7.284  -0.691  -3.070
  212   HG21  ILE  30          1HG2      ILE  30   6.460   1.980  -5.738
  213   HG22  ILE  30          2HG2      ILE  30   6.028   3.095  -4.442
  214   HG23  ILE  30          3HG2      ILE  30   7.688   2.518  -4.591
  215   HD11  ILE  30          3HD1      ILE  30   7.139  -0.101  -5.983
  216   HD12  ILE  30          1HD1      ILE  30   8.447  -1.110  -5.365
  217   HD13  ILE  30          2HD1      ILE  30   6.768  -1.589  -5.111
  218    H    HIS  31           H        HIS  31   3.610   1.277  -2.186
  219    HA   HIS  31           HA       HIS  31   2.850   3.911  -2.980
  220    HB2  HIS  31           1HB      HIS  31   1.415   1.964  -3.411
  221    HB3  HIS  31           2HB      HIS  31   1.210   1.726  -1.678
  222    HD1  HIS  31           HD1      HIS  31   0.082   3.864  -4.517
  223    HD2  HIS  31           HD2      HIS  31  -0.552   3.521  -0.426
  224    HE1  HIS  31           HE1      HIS  31  -1.923   5.300  -4.025
  225    H    GLN  32           H        GLN  32   2.444   2.169   0.110
  226    HA   GLN  32           HA       GLN  32   1.427   4.054   1.726
  227    HB2  GLN  32           1HB      GLN  32   3.699   2.161   2.321
  228    HB3  GLN  32           2HB      GLN  32   2.917   3.132   3.562
  229    HG2  GLN  32           1HG      GLN  32   0.739   2.036   2.600
  230    HG3  GLN  32           2HG      GLN  32   1.870   0.812   2.024
  231   HE21  GLN  32          1HE2      GLN  32  -0.266   0.763   4.093
  232   HE22  GLN  32          2HE2      GLN  32   0.509   0.179   5.522
  233    H    LYS  33           H        LYS  33   4.945   3.740   1.214
  234    HA   LYS  33           HA       LYS  33   5.613   6.136   2.534
  235    HB2  LYS  33           1HB      LYS  33   7.813   5.848   1.632
  236    HB3  LYS  33           2HB      LYS  33   7.187   4.254   2.030
  237    HG2  LYS  33           1HG      LYS  33   8.052   3.806  -0.017
  238    HG3  LYS  33           2HG      LYS  33   6.434   4.317  -0.506
  239    HD2  LYS  33           1HD      LYS  33   7.180   6.412  -1.215
  240    HD3  LYS  33           2HD      LYS  33   8.680   6.293  -0.291
  241    HE2  LYS  33           1HE      LYS  33   9.149   4.259  -1.854
  242    HE3  LYS  33           2HE      LYS  33   7.944   5.020  -2.893
  243    HZ1  LYS  33           3HZ      LYS  33  10.220   6.572  -1.838
  244    HZ2  LYS  33           1HZ      LYS  33   9.266   6.879  -3.201
  245    HZ3  LYS  33           2HZ      LYS  33  10.395   5.621  -3.225
  246    H    CYS  34           H        CYS  34   4.835   5.414  -0.820
  247    HA   CYS  34           HA       CYS  34   5.661   7.619  -2.171
  248    HB2  CYS  34           1HB      CYS  34   4.280   5.641  -3.025
  249    HB3  CYS  34           2HB      CYS  34   2.863   6.551  -2.516
  250    HG   CYS  34           HG       CYS  34   3.841   6.612  -5.398
  251    H    HIS  35           H        HIS  35   2.542   7.392  -0.455
  252    HA   HIS  35           HA       HIS  35   1.412   9.777  -0.816
  253    HB2  HIS  35           1HB      HIS  35   1.754   8.216   1.726
  254    HB3  HIS  35           2HB      HIS  35   0.876   9.742   1.731
  255    HD1  HIS  35           HD1      HIS  35  -1.283   9.819   0.136
  256    HD2  HIS  35           HD2      HIS  35   0.307   6.055   0.889
  257    HE1  HIS  35           HE1      HIS  35  -3.086   8.188  -0.503
  258    H    THR  36           H        THR  36   3.697   9.379   1.895
  259    HA   THR  36           HA       THR  36   4.106  12.219   2.073
  260    HB   THR  36           HB       THR  36   4.138  10.744   4.076
  261    HG1  THR  36           HG1      THR  36   6.362  11.663   4.752
  262   HG21  THR  36          3HG2      THR  36   6.921   9.918   3.382
  263   HG22  THR  36          1HG2      THR  36   5.567   8.992   2.736
  264   HG23  THR  36          2HG2      THR  36   5.765   9.165   4.480
  265    H    GLY  37           H        GLY  37   5.733  13.413   1.259
  266    HA2  GLY  37           1HA      GLY  37   8.313  12.549   0.654
  267    HA3  GLY  37           2HA      GLY  37   7.358  12.372  -0.811
  268    H    GLU  38           H        GLU  38   7.015  14.113  -2.065
  269    HA   GLU  38           HA       GLU  38   7.614  16.765  -0.948
  270    HB2  GLU  38           1HB      GLU  38   8.721  17.325  -3.140
  271    HB3  GLU  38           2HB      GLU  38   9.604  16.194  -2.124
  272    HG2  GLU  38           1HG      GLU  38   9.230  14.422  -3.528
  273    HG3  GLU  38           2HG      GLU  38   7.764  15.128  -4.205
  274    H    ARG  39           H        ARG  39   5.260  16.863  -0.848
  275    HA   ARG  39           HA       ARG  39   3.878  17.030  -3.412
  276    HB2  ARG  39           1HB      ARG  39   2.790  15.826  -1.567
  277    HB3  ARG  39           2HB      ARG  39   2.822  17.287  -0.590
  278    HG2  ARG  39           1HG      ARG  39   1.385  18.388  -2.290
  279    HG3  ARG  39           2HG      ARG  39   1.268  16.838  -3.127
  280    HD2  ARG  39           1HD      ARG  39   0.348  15.853  -1.034
  281    HD3  ARG  39           2HD      ARG  39   0.340  17.469  -0.329
  282    HE   ARG  39           HE       ARG  39  -1.094  17.205  -2.827
  283   HH11  ARG  39          1HH1      ARG  39  -1.255  17.121   0.650
  284   HH12  ARG  39          2HH1      ARG  39  -2.960  17.427   0.708
  285   HH21  ARG  39          1HH2      ARG  39  -3.338  17.609  -2.763
  286   HH22  ARG  39          2HH2      ARG  39  -4.143  17.703  -1.234
  287    H    HIS  40           H        HIS  40   4.476  18.911  -4.384
  288    HA   HIS  40           HA       HIS  40   4.890  21.161  -4.656
  289    HB2  HIS  40           1HB      HIS  40   2.475  20.940  -5.037
  290    HB3  HIS  40           2HB      HIS  40   2.175  21.203  -3.321
  291    HD2  HIS  40           HD2      HIS  40   0.689  23.518  -4.090
  292    HE1  HIS  40           HE1      HIS  40   4.135  25.757  -5.143
  293    HE2  HIS  40           HE2      HIS  40   1.679  25.854  -4.594
  294    H    SER  41           H        SER  41   6.252  20.314  -2.417
  295    HA   SER  41           HA       SER  41   5.690  21.770  -0.070
  296    HB2  SER  41           1HB      SER  41   7.321  19.763  -0.487
  297    HB3  SER  41           2HB      SER  41   8.496  21.032  -0.831
  298    HG   SER  41           HG       SER  41   6.936  21.071   1.520
  299    H    GLY  42           H        GLY  42   6.238  23.778   0.605
  300    HA2  GLY  42           1HA      GLY  42   7.538  25.513  -1.393
  301    HA3  GLY  42           2HA      GLY  42   6.402  26.061  -0.169
  302    HA   PRO  43           HA       PRO  43  10.614  27.112   1.367
  303    HB2  PRO  43           1HB      PRO  43   9.876  29.515   2.391
  304    HB3  PRO  43           2HB      PRO  43  10.339  29.293   0.699
  305    HG2  PRO  43           1HG      PRO  43   7.605  29.456   1.910
  306    HG3  PRO  43           2HG      PRO  43   8.217  30.204   0.423
  307    HD2  PRO  43           1HD      PRO  43   6.718  27.949   0.409
  308    HD3  PRO  43           2HD      PRO  43   7.979  28.265  -0.800
  309    H    SER  44           H        SER  44  10.255  25.365   2.891
  310    HA   SER  44           HA       SER  44   9.680  24.434   4.917
  311    HB2  SER  44           1HB      SER  44  10.920  27.099   5.593
  312    HB3  SER  44           2HB      SER  44  10.509  25.918   6.835
  313    HG   SER  44           HG       SER  44  12.509  25.326   6.351
  314    H    SER  45           H        SER  45   7.389  25.406   3.772
  315    HA   SER  45           HA       SER  45   5.987  26.747   5.986
  316    HB2  SER  45           1HB      SER  45   6.046  27.677   3.519
  317    HB3  SER  45           2HB      SER  45   4.780  26.477   3.259
  318    HG   SER  45           HG       SER  45   4.127  28.679   3.951
  319    H    GLY  46           H        GLY  46   5.483  24.258   3.481
  320    HA2  GLY  46           1HA      GLY  46   3.300  23.106   5.021
  321    HA3  GLY  46           2HA      GLY  46   3.842  22.590   3.431
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1 -13.329   5.459  -9.587
    2    HA2  GLY   1           1HA      GLY   1 -12.646   6.170 -12.324
    3    HA3  GLY   1           2HA      GLY   1 -11.787   4.787 -11.662
    4    H    SER   2           H        SER   2 -14.789   5.976 -12.894
    5    HA   SER   2           HA       SER   2 -16.493   3.877 -12.145
    6    HB2  SER   2           1HB      SER   2 -17.903   4.610 -14.048
    7    HB3  SER   2           2HB      SER   2 -17.357   5.967 -13.062
    8    HG   SER   2           HG       SER   2 -15.517   5.837 -14.786
    9    H    SER   3           H        SER   3 -15.481   1.894 -12.384
   10    HA   SER   3           HA       SER   3 -15.486   0.847 -15.100
   11    HB2  SER   3           1HB      SER   3 -13.061   0.713 -13.294
   12    HB3  SER   3           2HB      SER   3 -13.255  -0.230 -14.771
   13    HG   SER   3           HG       SER   3 -13.522   1.849 -15.851
   14    H    GLY   4           H        GLY   4 -14.975  -1.609 -15.004
   15    HA2  GLY   4           1HA      GLY   4 -16.855  -2.760 -13.171
   16    HA3  GLY   4           2HA      GLY   4 -15.902  -3.625 -14.368
   17    H    SER   5           H        SER   5 -16.518  -3.697 -11.266
   18    HA   SER   5           HA       SER   5 -13.777  -3.891 -10.285
   19    HB2  SER   5           1HB      SER   5 -16.446  -4.104  -8.875
   20    HB3  SER   5           2HB      SER   5 -14.888  -4.290  -8.070
   21    HG   SER   5           HG       SER   5 -15.507  -2.169  -7.848
   22    H    SER   6           H        SER   6 -16.672  -5.918 -10.620
   23    HA   SER   6           HA       SER   6 -15.859  -8.271  -9.524
   24    HB2  SER   6           1HB      SER   6 -17.403  -9.397 -10.959
   25    HB3  SER   6           2HB      SER   6 -18.065  -7.786 -10.679
   26    HG   SER   6           HG       SER   6 -18.152  -8.350 -12.885
   27    H    GLY   7           H        GLY   7 -14.101  -9.474  -9.752
   28    HA2  GLY   7           1HA      GLY   7 -13.161 -10.689 -12.002
   29    HA3  GLY   7           2HA      GLY   7 -12.342  -9.134 -12.005
   30    H    THR   8           H        THR   8 -10.432 -10.587 -11.884
   31    HA   THR   8           HA       THR   8  -9.918 -12.043  -9.484
   32    HB   THR   8           HB       THR   8  -7.959 -11.070 -11.573
   33    HG1  THR   8           HG1      THR   8  -8.837 -13.728 -11.385
   34   HG21  THR   8          3HG2      THR   8  -6.511 -11.701  -9.942
   35   HG22  THR   8          1HG2      THR   8  -6.862 -13.309 -10.575
   36   HG23  THR   8          2HG2      THR   8  -7.697 -12.726  -9.135
   37    H    GLY   9           H        GLY   9 -10.049 -10.794  -7.666
   38    HA2  GLY   9           1HA      GLY   9  -8.489  -8.313  -7.560
   39    HA3  GLY   9           2HA      GLY   9  -9.706  -8.816  -6.396
   40    H    GLU  10           H        GLU  10  -9.098 -10.940  -5.229
   41    HA   GLU  10           HA       GLU  10  -7.767 -11.687  -3.508
   42    HB2  GLU  10           1HB      GLU  10  -6.032 -11.964  -5.959
   43    HB3  GLU  10           2HB      GLU  10  -5.583 -12.637  -4.398
   44    HG2  GLU  10           1HG      GLU  10  -7.947 -13.365  -6.102
   45    HG3  GLU  10           2HG      GLU  10  -6.568 -14.375  -5.673
   46    H    LYS  11           H        LYS  11  -7.798  -9.041  -3.237
   47    HA   LYS  11           HA       LYS  11  -4.983  -8.314  -2.752
   48    HB2  LYS  11           1HB      LYS  11  -5.773  -5.929  -2.909
   49    HB3  LYS  11           2HB      LYS  11  -5.827  -6.831  -4.419
   50    HG2  LYS  11           1HG      LYS  11  -8.285  -7.284  -3.819
   51    HG3  LYS  11           2HG      LYS  11  -8.091  -5.961  -2.667
   52    HD2  LYS  11           1HD      LYS  11  -8.817  -4.785  -4.488
   53    HD3  LYS  11           2HD      LYS  11  -7.077  -4.740  -4.781
   54    HE2  LYS  11           1HE      LYS  11  -7.242  -6.582  -6.324
   55    HE3  LYS  11           2HE      LYS  11  -8.951  -6.794  -5.946
   56    HZ1  LYS  11           3HZ      LYS  11  -9.379  -5.414  -7.608
   57    HZ2  LYS  11           1HZ      LYS  11  -7.741  -5.048  -7.823
   58    HZ3  LYS  11           2HZ      LYS  11  -8.669  -4.163  -6.719
   59    HA   PRO  12           HA       PRO  12  -7.168  -8.624   1.331
   60    HB2  PRO  12           1HB      PRO  12  -5.144  -9.939   2.574
   61    HB3  PRO  12           2HB      PRO  12  -6.405 -10.767   1.654
   62    HG2  PRO  12           1HG      PRO  12  -3.621 -10.041   0.825
   63    HG3  PRO  12           2HG      PRO  12  -4.515 -11.547   0.546
   64    HD2  PRO  12           1HD      PRO  12  -4.245  -9.640  -1.357
   65    HD3  PRO  12           2HD      PRO  12  -5.686 -10.671  -1.236
   66    H    TYR  13           H        TYR  13  -4.671  -6.947  -0.002
   67    HA   TYR  13           HA       TYR  13  -3.819  -5.755   2.547
   68    HB2  TYR  13           1HB      TYR  13  -2.567  -5.607  -0.203
   69    HB3  TYR  13           2HB      TYR  13  -1.959  -4.768   1.221
   70    HD1  TYR  13           HD2      TYR  13  -2.663  -8.155  -0.137
   71    HD2  TYR  13           HD1      TYR  13  -0.495  -5.844   2.702
   72    HE1  TYR  13           HE2      TYR  13  -1.337 -10.140   0.458
   73    HE2  TYR  13           HE1      TYR  13   0.838  -7.821   3.303
   74    HH   TYR  13           HH       TYR  13   1.080 -10.027   3.046
   75    H    LYS  14           H        LYS  14  -4.467  -3.777   3.086
   76    HA   LYS  14           HA       LYS  14  -5.584  -2.041   0.984
   77    HB2  LYS  14           1HB      LYS  14  -7.243  -3.185   2.627
   78    HB3  LYS  14           2HB      LYS  14  -6.638  -2.020   3.797
   79    HG2  LYS  14           1HG      LYS  14  -7.368  -0.186   2.423
   80    HG3  LYS  14           2HG      LYS  14  -7.847  -1.295   1.136
   81    HD2  LYS  14           1HD      LYS  14  -9.663  -2.111   2.352
   82    HD3  LYS  14           2HD      LYS  14  -9.016  -1.530   3.888
   83    HE2  LYS  14           1HE      LYS  14  -9.608   0.682   3.435
   84    HE3  LYS  14           2HE      LYS  14  -9.771   0.381   1.706
   85    HZ1  LYS  14           3HZ      LYS  14 -11.904  -0.092   1.979
   86    HZ2  LYS  14           1HZ      LYS  14 -11.779   0.367   3.603
   87    HZ3  LYS  14           2HZ      LYS  14 -11.565  -1.252   3.163
   88    H    CYS  15           H        CYS  15  -4.850  -0.001   0.944
   89    HA   CYS  15           HA       CYS  15  -2.729   0.739   2.747
   90    HB2  CYS  15           1HB      CYS  15  -2.406   1.357   0.475
   91    HB3  CYS  15           2HB      CYS  15  -4.001   2.094   0.372
   92    H    SER  16           H        SER  16  -3.230   1.434   4.721
   93    HA   SER  16           HA       SER  16  -5.709   2.634   5.404
   94    HB2  SER  16           1HB      SER  16  -4.064   1.340   6.920
   95    HB3  SER  16           2HB      SER  16  -3.212   2.877   7.069
   96    HG   SER  16           HG       SER  16  -4.745   3.599   8.322
   97    H    ASP  17           H        ASP  17  -2.749   3.870   4.176
   98    HA   ASP  17           HA       ASP  17  -2.748   6.477   5.159
   99    HB2  ASP  17           1HB      ASP  17  -1.067   5.167   3.593
  100    HB3  ASP  17           2HB      ASP  17  -1.969   5.980   2.317
  101    H    CYS  18           H        CYS  18  -4.076   5.343   2.046
  102    HA   CYS  18           HA       CYS  18  -5.852   7.694   2.059
  103    HB2  CYS  18           1HB      CYS  18  -5.937   7.485  -0.383
  104    HB3  CYS  18           2HB      CYS  18  -4.278   7.672   0.177
  105    H    GLY  19           H        GLY  19  -5.685   4.257   1.155
  106    HA2  GLY  19           1HA      GLY  19  -7.557   2.898   2.105
  107    HA3  GLY  19           2HA      GLY  19  -8.622   4.145   1.474
  108    H    LYS  20           H        LYS  20  -5.873   2.315   0.129
  109    HA   LYS  20           HA       LYS  20  -7.574   1.680  -2.190
  110    HB2  LYS  20           1HB      LYS  20  -4.631   2.198  -1.922
  111    HB3  LYS  20           2HB      LYS  20  -5.238   1.236  -3.263
  112    HG2  LYS  20           1HG      LYS  20  -6.708   3.121  -3.897
  113    HG3  LYS  20           2HG      LYS  20  -5.972   4.082  -2.612
  114    HD2  LYS  20           1HD      LYS  20  -4.693   4.735  -4.400
  115    HD3  LYS  20           2HD      LYS  20  -3.739   3.372  -3.811
  116    HE2  LYS  20           1HE      LYS  20  -3.841   2.871  -6.044
  117    HE3  LYS  20           2HE      LYS  20  -5.265   2.011  -5.462
  118    HZ1  LYS  20           3HZ      LYS  20  -5.219   4.677  -6.766
  119    HZ2  LYS  20           1HZ      LYS  20  -6.600   3.965  -6.098
  120    HZ3  LYS  20           2HZ      LYS  20  -5.831   3.242  -7.419
  121    H    SER  21           H        SER  21  -6.565  -0.368  -3.368
  122    HA   SER  21           HA       SER  21  -6.079  -2.443  -1.338
  123    HB2  SER  21           1HB      SER  21  -7.487  -3.965  -2.830
  124    HB3  SER  21           2HB      SER  21  -8.364  -2.746  -1.905
  125    HG   SER  21           HG       SER  21  -7.928  -2.935  -4.647
  126    H    PHE  22           H        PHE  22  -4.349  -3.652  -1.732
  127    HA   PHE  22           HA       PHE  22  -3.294  -3.726  -4.483
  128    HB2  PHE  22           1HB      PHE  22  -1.718  -3.783  -1.900
  129    HB3  PHE  22           2HB      PHE  22  -1.039  -3.867  -3.523
  130    HD1  PHE  22           HD1      PHE  22  -3.065  -1.690  -1.298
  131    HD2  PHE  22           HD2      PHE  22  -0.446  -1.925  -4.645
  132    HE1  PHE  22           HE1      PHE  22  -2.932   0.766  -1.362
  133    HE2  PHE  22           HE2      PHE  22  -0.308   0.530  -4.714
  134    HZ   PHE  22           HZ       PHE  22  -1.551   1.879  -3.070
  135    H    THR  23           H        THR  23  -2.285  -5.659  -5.169
  136    HA   THR  23           HA       THR  23  -3.480  -8.030  -4.040
  137    HB   THR  23           HB       THR  23  -1.542  -7.806  -6.350
  138    HG1  THR  23           HG1      THR  23  -4.385  -7.743  -6.238
  139   HG21  THR  23          3HG2      THR  23  -1.524 -10.040  -6.164
  140   HG22  THR  23          1HG2      THR  23  -3.177  -9.978  -6.774
  141   HG23  THR  23          2HG2      THR  23  -2.880 -10.043  -5.037
  142    H    TRP  24           H        TRP  24  -0.152  -6.920  -4.659
  143    HA   TRP  24           HA       TRP  24   0.843  -9.012  -2.866
  144    HB2  TRP  24           1HB      TRP  24   2.160  -7.261  -4.930
  145    HB3  TRP  24           2HB      TRP  24   3.109  -8.146  -3.739
  146    HD1  TRP  24           HD1      TRP  24   1.030  -8.650  -6.885
  147    HE1  TRP  24           HE1      TRP  24   1.357 -11.060  -7.726
  148    HE3  TRP  24           HE3      TRP  24   3.624 -10.550  -2.911
  149    HZ2  TRP  24           HZ2      TRP  24   2.555 -13.452  -6.823
  150    HZ3  TRP  24           HZ3      TRP  24   4.323 -12.908  -2.978
  151    HH2  TRP  24           HH2      TRP  24   3.798 -14.327  -4.894
  152    H    LYS  25           H        LYS  25   2.144  -8.557  -1.084
  153    HA   LYS  25           HA       LYS  25   1.478  -6.246   0.384
  154    HB2  LYS  25           1HB      LYS  25   2.123  -8.388   1.423
  155    HB3  LYS  25           2HB      LYS  25   3.764  -8.176   0.828
  156    HG2  LYS  25           1HG      LYS  25   3.845  -6.038   2.160
  157    HG3  LYS  25           2HG      LYS  25   2.327  -6.547   2.903
  158    HD2  LYS  25           1HD      LYS  25   3.600  -8.752   3.400
  159    HD3  LYS  25           2HD      LYS  25   5.048  -7.783   3.114
  160    HE2  LYS  25           1HE      LYS  25   4.728  -7.613   5.412
  161    HE3  LYS  25           2HE      LYS  25   4.010  -6.128   4.791
  162    HZ1  LYS  25           3HZ      LYS  25   1.998  -8.026   4.795
  163    HZ2  LYS  25           1HZ      LYS  25   2.157  -6.698   5.831
  164    HZ3  LYS  25           2HZ      LYS  25   2.792  -8.201   6.278
  165    H    SER  26           H        SER  26   4.717  -7.223  -0.755
  166    HA   SER  26           HA       SER  26   6.184  -5.037  -0.253
  167    HB2  SER  26           1HB      SER  26   6.864  -7.130  -1.560
  168    HB3  SER  26           2HB      SER  26   6.292  -6.286  -2.998
  169    HG   SER  26           HG       SER  26   7.806  -4.654  -2.575
  170    H    ARG  27           H        ARG  27   4.149  -5.370  -3.158
  171    HA   ARG  27           HA       ARG  27   4.603  -2.972  -4.383
  172    HB2  ARG  27           1HB      ARG  27   1.887  -4.262  -4.074
  173    HB3  ARG  27           2HB      ARG  27   2.371  -3.140  -5.338
  174    HG2  ARG  27           1HG      ARG  27   3.588  -5.859  -4.906
  175    HG3  ARG  27           2HG      ARG  27   2.318  -5.493  -6.076
  176    HD2  ARG  27           1HD      ARG  27   3.807  -3.897  -7.185
  177    HD3  ARG  27           2HD      ARG  27   5.074  -4.267  -6.015
  178    HE   ARG  27           HE       ARG  27   4.149  -6.606  -7.354
  179   HH11  ARG  27          1HH1      ARG  27   6.204  -3.817  -7.696
  180   HH12  ARG  27          2HH1      ARG  27   7.260  -4.572  -8.843
  181   HH21  ARG  27          1HH2      ARG  27   5.532  -7.612  -8.863
  182   HH22  ARG  27          2HH2      ARG  27   6.876  -6.731  -9.507
  183    H    LEU  28           H        LEU  28   2.128  -3.567  -1.886
  184    HA   LEU  28           HA       LEU  28   1.052  -1.062  -1.653
  185    HB2  LEU  28           1HB      LEU  28   0.129  -2.837  -0.391
  186    HB3  LEU  28           2HB      LEU  28   1.651  -3.123   0.451
  187    HG   LEU  28           HG       LEU  28   1.337  -0.856   1.526
  188   HD11  LEU  28          1HD1      LEU  28  -0.628  -0.525  -0.324
  189   HD12  LEU  28          2HD1      LEU  28  -0.479   0.404   1.167
  190   HD13  LEU  28          3HD1      LEU  28  -1.558  -0.990   1.101
  191   HD21  LEU  28          3HD2      LEU  28   0.586  -3.303   2.330
  192   HD22  LEU  28          1HD2      LEU  28  -0.980  -2.492   2.349
  193   HD23  LEU  28          2HD2      LEU  28   0.357  -1.850   3.304
  194    H    ARG  29           H        ARG  29   3.907  -2.278   0.096
  195    HA   ARG  29           HA       ARG  29   4.533  -0.040   1.570
  196    HB2  ARG  29           1HB      ARG  29   6.290  -2.118   0.281
  197    HB3  ARG  29           2HB      ARG  29   6.959  -0.830   1.274
  198    HG2  ARG  29           1HG      ARG  29   5.682  -1.585   3.181
  199    HG3  ARG  29           2HG      ARG  29   4.894  -2.818   2.195
  200    HD2  ARG  29           1HD      ARG  29   6.542  -4.069   3.175
  201    HD3  ARG  29           2HD      ARG  29   7.372  -3.547   1.710
  202    HE   ARG  29           HE       ARG  29   7.939  -2.727   4.426
  203   HH11  ARG  29          1HH1      ARG  29   8.377  -2.084   1.033
  204   HH12  ARG  29          2HH1      ARG  29   9.811  -1.140   1.264
  205   HH21  ARG  29          1HH2      ARG  29   9.826  -1.486   4.743
  206   HH22  ARG  29          2HH2      ARG  29  10.635  -0.801   3.375
  207    H    ILE  30           H        ILE  30   5.001  -0.611  -1.843
  208    HA   ILE  30           HA       ILE  30   6.791   1.544  -2.317
  209    HB   ILE  30           HB       ILE  30   4.891   0.424  -4.363
  210   HG12  ILE  30          1HG1      ILE  30   5.876  -1.498  -3.278
  211   HG13  ILE  30          2HG1      ILE  30   6.653  -1.277  -4.841
  212   HG21  ILE  30          1HG2      ILE  30   6.718   0.925  -5.906
  213   HG22  ILE  30          2HG2      ILE  30   6.212   2.363  -5.022
  214   HG23  ILE  30          3HG2      ILE  30   7.692   1.522  -4.562
  215   HD11  ILE  30          3HD1      ILE  30   8.126  -1.847  -2.846
  216   HD12  ILE  30          1HD1      ILE  30   8.630  -0.506  -3.875
  217   HD13  ILE  30          2HD1      ILE  30   7.852  -0.184  -2.325
  218    H    HIS  31           H        HIS  31   3.284   1.224  -2.354
  219    HA   HIS  31           HA       HIS  31   2.790   3.818  -3.438
  220    HB2  HIS  31           1HB      HIS  31   1.086   2.161  -3.706
  221    HB3  HIS  31           2HB      HIS  31   1.031   1.848  -1.974
  222    HD1  HIS  31           HD1      HIS  31   0.438   4.848  -4.252
  223    HD2  HIS  31           HD2      HIS  31  -1.060   3.081  -0.803
  224    HE1  HIS  31           HE1      HIS  31  -1.535   6.254  -3.578
  225    H    GLN  32           H        GLN  32   2.545   2.462  -0.154
  226    HA   GLN  32           HA       GLN  32   1.653   4.497   1.335
  227    HB2  GLN  32           1HB      GLN  32   4.050   2.755   1.913
  228    HB3  GLN  32           2HB      GLN  32   3.326   3.823   3.108
  229    HG2  GLN  32           1HG      GLN  32   1.194   2.615   2.854
  230    HG3  GLN  32           2HG      GLN  32   1.983   1.511   1.728
  231   HE21  GLN  32          1HE2      GLN  32   0.881   0.281   3.719
  232   HE22  GLN  32          2HE2      GLN  32   2.017  -0.204   4.926
  233    H    LYS  33           H        LYS  33   5.135   4.195   0.605
  234    HA   LYS  33           HA       LYS  33   5.885   6.702   1.559
  235    HB2  LYS  33           1HB      LYS  33   7.910   6.432   0.186
  236    HB3  LYS  33           2HB      LYS  33   7.511   4.959   1.062
  237    HG2  LYS  33           1HG      LYS  33   6.490   4.050  -0.989
  238    HG3  LYS  33           2HG      LYS  33   6.986   5.507  -1.853
  239    HD2  LYS  33           1HD      LYS  33   8.720   4.079  -2.355
  240    HD3  LYS  33           2HD      LYS  33   9.354   4.890  -0.921
  241    HE2  LYS  33           1HE      LYS  33   7.805   2.333  -0.699
  242    HE3  LYS  33           2HE      LYS  33   9.528   2.321  -1.073
  243    HZ1  LYS  33           3HZ      LYS  33   8.175   2.973   1.414
  244    HZ2  LYS  33           1HZ      LYS  33   9.499   3.951   1.021
  245    HZ3  LYS  33           2HZ      LYS  33   9.696   2.277   1.157
  246    H    CYS  34           H        CYS  34   4.730   5.724  -1.627
  247    HA   CYS  34           HA       CYS  34   5.264   7.840  -3.216
  248    HB2  CYS  34           1HB      CYS  34   3.785   5.765  -3.662
  249    HB3  CYS  34           2HB      CYS  34   2.454   6.775  -3.110
  250    HG   CYS  34           HG       CYS  34   1.992   7.657  -5.469
  251    H    HIS  35           H        HIS  35   2.746   7.728  -0.733
  252    HA   HIS  35           HA       HIS  35   1.469  10.129  -1.218
  253    HB2  HIS  35           1HB      HIS  35   2.045   8.695   1.372
  254    HB3  HIS  35           2HB      HIS  35   1.050  10.147   1.296
  255    HD1  HIS  35           HD1      HIS  35  -0.942   9.799  -0.728
  256    HD2  HIS  35           HD2      HIS  35   0.499   6.494   1.336
  257    HE1  HIS  35           HE1      HIS  35  -2.698   8.020  -0.998
  258    H    THR  36           H        THR  36   2.898  11.725  -1.892
  259    HA   THR  36           HA       THR  36   4.492  12.930   0.268
  260    HB   THR  36           HB       THR  36   6.161  13.652  -1.438
  261    HG1  THR  36           HG1      THR  36   5.781  13.245  -3.475
  262   HG21  THR  36          3HG2      THR  36   5.815  11.075  -0.282
  263   HG22  THR  36          1HG2      THR  36   7.317  11.900  -0.694
  264   HG23  THR  36          2HG2      THR  36   6.522  10.870  -1.884
  265    H    GLY  37           H        GLY  37   1.887  13.682  -0.292
  266    HA2  GLY  37           1HA      GLY  37   2.170  16.171  -1.843
  267    HA3  GLY  37           2HA      GLY  37   0.648  15.367  -1.489
  268    H    GLU  38           H        GLU  38   1.253  18.128  -1.037
  269    HA   GLU  38           HA       GLU  38   1.102  18.212   1.906
  270    HB2  GLU  38           1HB      GLU  38   3.131  19.296   0.781
  271    HB3  GLU  38           2HB      GLU  38   2.008  20.507   0.177
  272    HG2  GLU  38           1HG      GLU  38   2.781  21.520   2.075
  273    HG3  GLU  38           2HG      GLU  38   1.329  20.726   2.680
  274    H    ARG  39           H        ARG  39  -1.210  17.692   0.694
  275    HA   ARG  39           HA       ARG  39  -2.720  20.142   1.128
  276    HB2  ARG  39           1HB      ARG  39  -2.146  19.813  -1.381
  277    HB3  ARG  39           2HB      ARG  39  -3.337  18.520  -1.323
  278    HG2  ARG  39           1HG      ARG  39  -5.021  20.138  -0.544
  279    HG3  ARG  39           2HG      ARG  39  -3.820  21.423  -0.688
  280    HD2  ARG  39           1HD      ARG  39  -5.048  21.542  -2.677
  281    HD3  ARG  39           2HD      ARG  39  -3.574  20.681  -3.118
  282    HE   ARG  39           HE       ARG  39  -4.819  18.775  -3.487
  283   HH11  ARG  39          1HH1      ARG  39  -6.784  21.218  -1.974
  284   HH12  ARG  39          2HH1      ARG  39  -8.273  20.375  -2.247
  285   HH21  ARG  39          1HH2      ARG  39  -6.772  17.655  -3.852
  286   HH22  ARG  39          2HH2      ARG  39  -8.265  18.348  -3.315
  287    H    HIS  40           H        HIS  40  -4.190  19.618   2.594
  288    HA   HIS  40           HA       HIS  40  -5.515  18.307   3.942
  289    HB2  HIS  40           1HB      HIS  40  -7.020  19.011   2.120
  290    HB3  HIS  40           2HB      HIS  40  -6.592  17.563   1.213
  291    HD2  HIS  40           HD2      HIS  40  -8.673  15.863   1.413
  292    HE1  HIS  40           HE1      HIS  40  -9.658  16.573   5.478
  293    HE2  HIS  40           HE2      HIS  40 -10.144  15.189   3.430
  294    H    SER  41           H        SER  41  -3.074  17.040   3.523
  295    HA   SER  41           HA       SER  41  -3.563  14.290   2.776
  296    HB2  SER  41           1HB      SER  41  -1.369  15.656   2.467
  297    HB3  SER  41           2HB      SER  41  -1.072  15.251   4.157
  298    HG   SER  41           HG       SER  41  -0.305  13.772   2.352
  299    H    GLY  42           H        GLY  42  -5.252  15.034   4.835
  300    HA2  GLY  42           1HA      GLY  42  -6.047  14.051   6.768
  301    HA3  GLY  42           2HA      GLY  42  -4.614  13.034   6.789
  302    HA   PRO  43           HA       PRO  43  -3.625  17.222   9.068
  303    HB2  PRO  43           1HB      PRO  43  -5.813  18.495  10.048
  304    HB3  PRO  43           2HB      PRO  43  -5.129  18.847   8.456
  305    HG2  PRO  43           1HG      PRO  43  -7.475  17.131   9.172
  306    HG3  PRO  43           2HG      PRO  43  -7.306  18.300   7.850
  307    HD2  PRO  43           1HD      PRO  43  -7.050  15.630   7.476
  308    HD3  PRO  43           2HD      PRO  43  -6.141  16.820   6.522
  309    H    SER  44           H        SER  44  -3.503  17.605  11.362
  310    HA   SER  44           HA       SER  44  -4.779  15.482  12.960
  311    HB2  SER  44           1HB      SER  44  -2.172  15.513  12.520
  312    HB3  SER  44           2HB      SER  44  -2.189  16.712  13.813
  313    HG   SER  44           HG       SER  44  -3.368  15.113  15.061
  314    H    SER  45           H        SER  45  -5.316  15.984  15.138
  315    HA   SER  45           HA       SER  45  -5.963  18.814  15.503
  316    HB2  SER  45           1HB      SER  45  -7.493  18.001  17.280
  317    HB3  SER  45           2HB      SER  45  -7.827  17.258  15.716
  318    HG   SER  45           HG       SER  45  -6.820  16.132  18.049
  319    H    GLY  46           H        GLY  46  -3.277  18.196  15.850
  320    HA2  GLY  46           1HA      GLY  46  -2.571  19.444  18.167
  321    HA3  GLY  46           2HA      GLY  46  -2.701  17.755  18.635
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1 -17.450  13.036  -9.510
    2    HA2  GLY   1           1HA      GLY   1 -18.983  12.898  -7.035
    3    HA3  GLY   1           2HA      GLY   1 -19.854  12.505  -8.510
    4    H    SER   2           H        SER   2 -16.532  11.758  -7.485
    5    HA   SER   2           HA       SER   2 -17.228   8.903  -7.546
    6    HB2  SER   2           1HB      SER   2 -14.832  10.189  -8.876
    7    HB3  SER   2           2HB      SER   2 -15.046   8.450  -8.675
    8    HG   SER   2           HG       SER   2 -17.183   8.956  -9.794
    9    H    SER   3           H        SER   3 -17.090   8.516  -5.398
   10    HA   SER   3           HA       SER   3 -14.474   8.996  -4.137
   11    HB2  SER   3           1HB      SER   3 -16.167  10.599  -3.273
   12    HB3  SER   3           2HB      SER   3 -17.154   9.235  -2.748
   13    HG   SER   3           HG       SER   3 -14.944   8.678  -1.671
   14    H    GLY   4           H        GLY   4 -17.541   7.261  -3.546
   15    HA2  GLY   4           1HA      GLY   4 -16.718   4.684  -3.835
   16    HA3  GLY   4           2HA      GLY   4 -16.166   5.105  -2.221
   17    H    SER   5           H        SER   5 -18.259   3.207  -3.255
   18    HA   SER   5           HA       SER   5 -20.537   4.268  -1.714
   19    HB2  SER   5           1HB      SER   5 -21.979   2.786  -3.075
   20    HB3  SER   5           2HB      SER   5 -21.119   3.962  -4.068
   21    HG   SER   5           HG       SER   5 -20.637   1.197  -3.777
   22    H    SER   6           H        SER   6 -18.909   1.239  -2.642
   23    HA   SER   6           HA       SER   6 -18.882   0.290   0.050
   24    HB2  SER   6           1HB      SER   6 -20.967  -0.724  -1.849
   25    HB3  SER   6           2HB      SER   6 -20.256  -1.830  -0.674
   26    HG   SER   6           HG       SER   6 -22.218  -0.207  -0.239
   27    H    GLY   7           H        GLY   7 -16.896  -0.528   0.079
   28    HA2  GLY   7           1HA      GLY   7 -16.215  -2.663  -1.773
   29    HA3  GLY   7           2HA      GLY   7 -15.208  -1.226  -1.875
   30    H    THR   8           H        THR   8 -15.820  -4.137  -0.211
   31    HA   THR   8           HA       THR   8 -14.513  -3.557   2.238
   32    HB   THR   8           HB       THR   8 -14.332  -6.040   2.475
   33    HG1  THR   8           HG1      THR   8 -15.655  -6.055  -0.053
   34   HG21  THR   8          3HG2      THR   8 -17.102  -5.860   1.645
   35   HG22  THR   8          1HG2      THR   8 -16.596  -4.423   2.531
   36   HG23  THR   8          2HG2      THR   8 -16.422  -6.018   3.264
   37    H    GLY   9           H        GLY   9 -13.405  -5.382  -0.628
   38    HA2  GLY   9           1HA      GLY   9 -11.198  -4.857  -1.541
   39    HA3  GLY   9           2HA      GLY   9 -10.647  -4.625   0.111
   40    H    GLU  10           H        GLU  10 -11.237  -6.890  -2.415
   41    HA   GLU  10           HA       GLU  10 -11.144  -9.290  -0.955
   42    HB2  GLU  10           1HB      GLU  10 -10.343  -8.666  -3.799
   43    HB3  GLU  10           2HB      GLU  10 -10.391 -10.295  -3.139
   44    HG2  GLU  10           1HG      GLU  10 -12.684  -8.404  -3.560
   45    HG3  GLU  10           2HG      GLU  10 -12.408  -9.971  -4.320
   46    H    LYS  11           H        LYS  11  -8.528  -7.924  -2.960
   47    HA   LYS  11           HA       LYS  11  -6.431  -9.451  -2.331
   48    HB2  LYS  11           1HB      LYS  11  -4.965  -7.525  -2.584
   49    HB3  LYS  11           2HB      LYS  11  -6.286  -7.435  -3.741
   50    HG2  LYS  11           1HG      LYS  11  -6.490  -6.019  -1.118
   51    HG3  LYS  11           2HG      LYS  11  -5.569  -5.313  -2.448
   52    HD2  LYS  11           1HD      LYS  11  -8.484  -6.089  -2.472
   53    HD3  LYS  11           2HD      LYS  11  -7.822  -4.453  -2.496
   54    HE2  LYS  11           1HE      LYS  11  -6.596  -5.331  -4.647
   55    HE3  LYS  11           2HE      LYS  11  -7.911  -6.506  -4.657
   56    HZ1  LYS  11           3HZ      LYS  11  -9.436  -4.931  -5.154
   57    HZ2  LYS  11           1HZ      LYS  11  -8.095  -4.158  -5.835
   58    HZ3  LYS  11           2HZ      LYS  11  -8.642  -3.706  -4.300
   59    HA   PRO  12           HA       PRO  12  -5.808  -9.459   2.027
   60    HB2  PRO  12           1HB      PRO  12  -3.194 -10.190   2.085
   61    HB3  PRO  12           2HB      PRO  12  -4.497 -11.315   1.684
   62    HG2  PRO  12           1HG      PRO  12  -2.646  -9.832  -0.143
   63    HG3  PRO  12           2HG      PRO  12  -3.184 -11.520  -0.224
   64    HD2  PRO  12           1HD      PRO  12  -4.260  -9.573  -1.766
   65    HD3  PRO  12           2HD      PRO  12  -5.201 -10.963  -1.189
   66    H    TYR  13           H        TYR  13  -4.636  -7.138   0.001
   67    HA   TYR  13           HA       TYR  13  -3.464  -5.641   2.244
   68    HB2  TYR  13           1HB      TYR  13  -2.431  -5.466  -0.588
   69    HB3  TYR  13           2HB      TYR  13  -1.731  -4.745   0.857
   70    HD1  TYR  13           HD1      TYR  13  -0.756  -6.281   2.619
   71    HD2  TYR  13           HD2      TYR  13  -1.832  -7.638  -1.267
   72    HE1  TYR  13           HE1      TYR  13   0.666  -8.265   2.924
   73    HE2  TYR  13           HE2      TYR  13  -0.415  -9.626  -0.972
   74    HH   TYR  13           HH       TYR  13   1.871 -10.011   0.780
   75    H    LYS  14           H        LYS  14  -4.267  -3.653   2.516
   76    HA   LYS  14           HA       LYS  14  -5.419  -2.174   0.312
   77    HB2  LYS  14           1HB      LYS  14  -7.332  -3.506   0.925
   78    HB3  LYS  14           2HB      LYS  14  -7.104  -3.134   2.629
   79    HG2  LYS  14           1HG      LYS  14  -7.817  -0.914   2.351
   80    HG3  LYS  14           2HG      LYS  14  -7.665  -1.000   0.595
   81    HD2  LYS  14           1HD      LYS  14  -9.470  -2.782   0.669
   82    HD3  LYS  14           2HD      LYS  14  -9.725  -2.316   2.353
   83    HE2  LYS  14           1HE      LYS  14 -10.136   0.006   1.599
   84    HE3  LYS  14           2HE      LYS  14  -9.982  -0.537  -0.071
   85    HZ1  LYS  14           3HZ      LYS  14 -12.176  -0.843   0.060
   86    HZ2  LYS  14           1HZ      LYS  14 -12.195  -0.810   1.752
   87    HZ3  LYS  14           2HZ      LYS  14 -11.812  -2.242   0.938
   88    H    CYS  15           H        CYS  15  -4.459  -0.271   0.565
   89    HA   CYS  15           HA       CYS  15  -3.339   0.711   2.921
   90    HB2  CYS  15           1HB      CYS  15  -2.634   1.585   0.793
   91    HB3  CYS  15           2HB      CYS  15  -4.259   2.161   0.434
   92    H    SER  16           H        SER  16  -4.166   1.635   4.675
   93    HA   SER  16           HA       SER  16  -7.016   2.191   4.768
   94    HB2  SER  16           1HB      SER  16  -6.098   0.930   6.617
   95    HB3  SER  16           2HB      SER  16  -4.888   2.177   6.921
   96    HG   SER  16           HG       SER  16  -7.685   2.308   7.316
   97    H    ASP  17           H        ASP  17  -4.059   3.895   4.456
   98    HA   ASP  17           HA       ASP  17  -4.725   6.366   5.601
   99    HB2  ASP  17           1HB      ASP  17  -3.001   5.998   3.150
  100    HB3  ASP  17           2HB      ASP  17  -2.905   7.282   4.352
  101    H    CYS  18           H        CYS  18  -5.065   5.238   2.242
  102    HA   CYS  18           HA       CYS  18  -6.996   7.422   1.805
  103    HB2  CYS  18           1HB      CYS  18  -6.379   7.302  -0.593
  104    HB3  CYS  18           2HB      CYS  18  -5.020   7.748   0.433
  105    H    GLY  19           H        GLY  19  -6.164   4.086   0.898
  106    HA2  GLY  19           1HA      GLY  19  -8.130   2.532   1.270
  107    HA3  GLY  19           2HA      GLY  19  -9.011   3.654   0.243
  108    H    LYS  20           H        LYS  20  -5.695   3.030  -0.484
  109    HA   LYS  20           HA       LYS  20  -6.332   2.060  -3.080
  110    HB2  LYS  20           1HB      LYS  20  -3.777   2.359  -1.526
  111    HB3  LYS  20           2HB      LYS  20  -3.791   1.559  -3.092
  112    HG2  LYS  20           1HG      LYS  20  -5.036   4.251  -2.840
  113    HG3  LYS  20           2HG      LYS  20  -3.277   4.115  -2.890
  114    HD2  LYS  20           1HD      LYS  20  -3.279   3.242  -5.041
  115    HD3  LYS  20           2HD      LYS  20  -4.957   2.707  -4.928
  116    HE2  LYS  20           1HE      LYS  20  -5.193   4.544  -6.279
  117    HE3  LYS  20           2HE      LYS  20  -5.426   5.279  -4.694
  118    HZ1  LYS  20           3HZ      LYS  20  -2.674   5.216  -5.433
  119    HZ2  LYS  20           1HZ      LYS  20  -3.632   6.532  -4.970
  120    HZ3  LYS  20           2HZ      LYS  20  -3.600   6.037  -6.587
  121    H    SER  21           H        SER  21  -4.975   0.015  -3.832
  122    HA   SER  21           HA       SER  21  -5.224  -2.166  -1.905
  123    HB2  SER  21           1HB      SER  21  -6.437  -3.550  -3.621
  124    HB3  SER  21           2HB      SER  21  -7.383  -2.216  -2.963
  125    HG   SER  21           HG       SER  21  -6.307  -1.118  -4.967
  126    H    PHE  22           H        PHE  22  -3.999  -4.016  -2.423
  127    HA   PHE  22           HA       PHE  22  -2.364  -3.990  -4.820
  128    HB2  PHE  22           1HB      PHE  22  -0.954  -4.154  -2.165
  129    HB3  PHE  22           2HB      PHE  22  -0.259  -3.893  -3.762
  130    HD1  PHE  22           HD1      PHE  22  -2.428  -2.315  -1.199
  131    HD2  PHE  22           HD2      PHE  22   0.151  -1.738  -4.534
  132    HE1  PHE  22           HE1      PHE  22  -2.487   0.116  -0.820
  133    HE2  PHE  22           HE2      PHE  22   0.098   0.693  -4.161
  134    HZ   PHE  22           HZ       PHE  22  -1.222   1.623  -2.301
  135    H    THR  23           H        THR  23  -1.541  -5.999  -5.364
  136    HA   THR  23           HA       THR  23  -2.767  -8.237  -3.963
  137    HB   THR  23           HB       THR  23  -1.193  -8.220  -6.546
  138    HG1  THR  23           HG1      THR  23  -2.998  -7.379  -7.269
  139   HG21  THR  23          3HG2      THR  23  -3.056 -10.377  -6.279
  140   HG22  THR  23          1HG2      THR  23  -1.982 -10.359  -4.881
  141   HG23  THR  23          2HG2      THR  23  -1.309 -10.444  -6.509
  142    H    TRP  24           H        TRP  24   0.441  -7.037  -4.823
  143    HA   TRP  24           HA       TRP  24   1.657  -9.210  -3.268
  144    HB2  TRP  24           1HB      TRP  24   2.689  -7.365  -5.400
  145    HB3  TRP  24           2HB      TRP  24   3.810  -8.164  -4.300
  146    HD1  TRP  24           HD1      TRP  24   1.606  -8.811  -7.307
  147    HE1  TRP  24           HE1      TRP  24   1.996 -11.214  -8.143
  148    HE3  TRP  24           HE3      TRP  24   4.427 -10.574  -3.424
  149    HZ2  TRP  24           HZ2      TRP  24   3.322 -13.548  -7.272
  150    HZ3  TRP  24           HZ3      TRP  24   5.216 -12.904  -3.503
  151    HH2  TRP  24           HH2      TRP  24   4.674 -14.358  -5.387
  152    H    LYS  25           H        LYS  25   2.985  -8.817  -1.526
  153    HA   LYS  25           HA       LYS  25   2.418  -6.671   0.136
  154    HB2  LYS  25           1HB      LYS  25   3.535  -8.909   0.701
  155    HB3  LYS  25           2HB      LYS  25   5.043  -8.148   0.210
  156    HG2  LYS  25           1HG      LYS  25   5.093  -6.752   2.019
  157    HG3  LYS  25           2HG      LYS  25   3.338  -6.760   2.212
  158    HD2  LYS  25           1HD      LYS  25   3.389  -8.973   3.137
  159    HD3  LYS  25           2HD      LYS  25   5.108  -9.137   2.771
  160    HE2  LYS  25           1HE      LYS  25   5.730  -7.646   4.449
  161    HE3  LYS  25           2HE      LYS  25   4.121  -6.932   4.543
  162    HZ1  LYS  25           3HZ      LYS  25   3.448  -9.292   5.311
  163    HZ2  LYS  25           1HZ      LYS  25   4.192  -8.245   6.413
  164    HZ3  LYS  25           2HZ      LYS  25   5.091  -9.471   5.671
  165    H    SER  26           H        SER  26   5.557  -7.193  -1.482
  166    HA   SER  26           HA       SER  26   6.836  -4.888  -1.005
  167    HB2  SER  26           1HB      SER  26   7.656  -6.740  -2.485
  168    HB3  SER  26           2HB      SER  26   6.676  -6.066  -3.788
  169    HG   SER  26           HG       SER  26   8.419  -4.344  -2.456
  170    H    ARG  27           H        ARG  27   4.557  -5.264  -3.723
  171    HA   ARG  27           HA       ARG  27   4.557  -2.778  -4.796
  172    HB2  ARG  27           1HB      ARG  27   2.060  -4.376  -4.202
  173    HB3  ARG  27           2HB      ARG  27   2.222  -3.122  -5.424
  174    HG2  ARG  27           1HG      ARG  27   3.787  -5.693  -5.408
  175    HG3  ARG  27           2HG      ARG  27   2.306  -5.423  -6.329
  176    HD2  ARG  27           1HD      ARG  27   3.407  -3.558  -7.502
  177    HD3  ARG  27           2HD      ARG  27   4.890  -3.894  -6.611
  178    HE   ARG  27           HE       ARG  27   4.176  -6.255  -7.857
  179   HH11  ARG  27          1HH1      ARG  27   5.033  -3.017  -8.806
  180   HH12  ARG  27          2HH1      ARG  27   5.724  -3.503 -10.319
  181   HH21  ARG  27          1HH2      ARG  27   5.083  -6.908  -9.846
  182   HH22  ARG  27          2HH2      ARG  27   5.751  -5.717 -10.909
  183    H    LEU  28           H        LEU  28   2.390  -3.729  -2.123
  184    HA   LEU  28           HA       LEU  28   1.223  -1.321  -1.576
  185    HB2  LEU  28           1HB      LEU  28   0.542  -3.282  -0.408
  186    HB3  LEU  28           2HB      LEU  28   2.137  -3.473   0.318
  187    HG   LEU  28           HG       LEU  28   1.753  -1.456   1.665
  188   HD11  LEU  28          1HD1      LEU  28  -0.582  -0.564   1.765
  189   HD12  LEU  28          2HD1      LEU  28  -0.927  -1.472   0.293
  190   HD13  LEU  28          3HD1      LEU  28   0.288  -0.194   0.276
  191   HD21  LEU  28          3HD2      LEU  28   0.114  -2.411   3.179
  192   HD22  LEU  28          1HD2      LEU  28   1.169  -3.673   2.543
  193   HD23  LEU  28          2HD2      LEU  28  -0.465  -3.487   1.906
  194    H    ARG  29           H        ARG  29   4.278  -2.506  -0.176
  195    HA   ARG  29           HA       ARG  29   4.917  -0.346   1.409
  196    HB2  ARG  29           1HB      ARG  29   6.638  -2.258  -0.149
  197    HB3  ARG  29           2HB      ARG  29   7.349  -0.990   0.840
  198    HG2  ARG  29           1HG      ARG  29   6.446  -1.900   2.825
  199    HG3  ARG  29           2HG      ARG  29   5.396  -2.997   1.925
  200    HD2  ARG  29           1HD      ARG  29   7.229  -4.318   1.219
  201    HD3  ARG  29           2HD      ARG  29   8.396  -3.107   1.748
  202    HE   ARG  29           HE       ARG  29   7.097  -3.792   4.032
  203   HH11  ARG  29          1HH1      ARG  29   8.756  -5.590   1.554
  204   HH12  ARG  29          2HH1      ARG  29   9.262  -6.853   2.627
  205   HH21  ARG  29          1HH2      ARG  29   7.758  -5.448   5.454
  206   HH22  ARG  29          2HH2      ARG  29   8.693  -6.772   4.845
  207    H    ILE  30           H        ILE  30   5.143  -0.661  -2.063
  208    HA   ILE  30           HA       ILE  30   6.806   1.571  -2.554
  209    HB   ILE  30           HB       ILE  30   4.680   0.548  -4.428
  210   HG12  ILE  30          1HG1      ILE  30   5.938  -1.375  -3.634
  211   HG13  ILE  30          2HG1      ILE  30   6.410  -1.007  -5.289
  212   HG21  ILE  30          1HG2      ILE  30   5.641   2.513  -5.283
  213   HG22  ILE  30          2HG2      ILE  30   7.260   2.044  -4.769
  214   HG23  ILE  30          3HG2      ILE  30   6.481   1.199  -6.106
  215   HD11  ILE  30          3HD1      ILE  30   8.252  -1.601  -3.652
  216   HD12  ILE  30          1HD1      ILE  30   8.479  -0.146  -4.621
  217   HD13  ILE  30          2HD1      ILE  30   7.975  -0.014  -2.935
  218    H    HIS  31           H        HIS  31   3.305   1.204  -2.280
  219    HA   HIS  31           HA       HIS  31   2.564   3.770  -3.129
  220    HB2  HIS  31           1HB      HIS  31   0.943   1.958  -2.862
  221    HB3  HIS  31           2HB      HIS  31   1.206   1.960  -1.120
  222    HD1  HIS  31           HD1      HIS  31   0.109   4.491  -3.751
  223    HD2  HIS  31           HD2      HIS  31  -0.672   3.393   0.179
  224    HE1  HIS  31           HE1      HIS  31  -1.756   5.997  -2.990
  225    H    GLN  32           H        GLN  32   3.014   2.550   0.192
  226    HA   GLN  32           HA       GLN  32   2.515   4.706   1.711
  227    HB2  GLN  32           1HB      GLN  32   5.003   3.015   2.006
  228    HB3  GLN  32           2HB      GLN  32   4.236   3.964   3.272
  229    HG2  GLN  32           1HG      GLN  32   2.172   2.525   2.860
  230    HG3  GLN  32           2HG      GLN  32   3.247   1.463   1.953
  231   HE21  GLN  32          1HE2      GLN  32   2.282   0.092   3.791
  232   HE22  GLN  32          2HE2      GLN  32   3.252  -0.027   5.215
  233    H    LYS  33           H        LYS  33   5.656   4.162   0.116
  234    HA   LYS  33           HA       LYS  33   7.010   6.409   0.856
  235    HB2  LYS  33           1HB      LYS  33   6.960   5.056  -1.844
  236    HB3  LYS  33           2HB      LYS  33   8.130   6.291  -1.398
  237    HG2  LYS  33           1HG      LYS  33   8.555   4.678   0.638
  238    HG3  LYS  33           2HG      LYS  33   7.892   3.478  -0.474
  239    HD2  LYS  33           1HD      LYS  33  10.145   5.344  -1.195
  240    HD3  LYS  33           2HD      LYS  33  10.396   3.730  -0.525
  241    HE2  LYS  33           1HE      LYS  33   8.755   4.223  -2.996
  242    HE3  LYS  33           2HE      LYS  33  10.496   3.952  -3.055
  243    HZ1  LYS  33           3HZ      LYS  33  10.220   1.779  -2.757
  244    HZ2  LYS  33           1HZ      LYS  33   8.578   2.023  -3.083
  245    HZ3  LYS  33           2HZ      LYS  33   9.126   1.989  -1.484
  246    H    CYS  34           H        CYS  34   4.615   6.148  -1.742
  247    HA   CYS  34           HA       CYS  34   4.847   8.709  -2.800
  248    HB2  CYS  34           1HB      CYS  34   3.492   6.818  -3.750
  249    HB3  CYS  34           2HB      CYS  34   2.273   7.148  -2.525
  250    HG   CYS  34           HG       CYS  34   2.821   9.991  -3.939
  251    H    HIS  35           H        HIS  35   2.585   7.569  -0.292
  252    HA   HIS  35           HA       HIS  35   1.242   9.865   0.288
  253    HB2  HIS  35           1HB      HIS  35   2.126   7.550   1.938
  254    HB3  HIS  35           2HB      HIS  35   1.491   8.957   2.786
  255    HD1  HIS  35           HD1      HIS  35  -0.985   9.734   1.885
  256    HD2  HIS  35           HD2      HIS  35   0.211   5.837   1.079
  257    HE1  HIS  35           HE1      HIS  35  -3.097   8.480   1.345
  258    H    THR  36           H        THR  36   4.321   8.891   1.800
  259    HA   THR  36           HA       THR  36   4.647  11.435   3.089
  260    HB   THR  36           HB       THR  36   6.895  10.577   3.718
  261    HG1  THR  36           HG1      THR  36   6.109   8.163   2.437
  262   HG21  THR  36          3HG2      THR  36   5.229   8.255   4.363
  263   HG22  THR  36          1HG2      THR  36   4.448   9.806   4.671
  264   HG23  THR  36          2HG2      THR  36   5.996   9.431   5.430
  265    H    GLY  37           H        GLY  37   4.843  13.106   1.670
  266    HA2  GLY  37           1HA      GLY  37   7.117  14.026   0.659
  267    HA3  GLY  37           2HA      GLY  37   6.673  12.873  -0.590
  268    H    GLU  38           H        GLU  38   4.725  13.223  -1.786
  269    HA   GLU  38           HA       GLU  38   4.104  16.068  -2.028
  270    HB2  GLU  38           1HB      GLU  38   4.791  14.592  -4.005
  271    HB3  GLU  38           2HB      GLU  38   3.190  13.877  -3.882
  272    HG2  GLU  38           1HG      GLU  38   2.126  15.886  -4.452
  273    HG3  GLU  38           2HG      GLU  38   3.585  16.835  -4.169
  274    H    ARG  39           H        ARG  39   3.012  14.952   0.226
  275    HA   ARG  39           HA       ARG  39   0.590  13.751   0.236
  276    HB2  ARG  39           1HB      ARG  39   1.420  16.161   1.861
  277    HB3  ARG  39           2HB      ARG  39   0.010  15.170   2.212
  278    HG2  ARG  39           1HG      ARG  39   1.511  13.215   2.474
  279    HG3  ARG  39           2HG      ARG  39   2.889  14.296   2.259
  280    HD2  ARG  39           1HD      ARG  39   2.769  14.302   4.534
  281    HD3  ARG  39           2HD      ARG  39   1.669  15.636   4.188
  282    HE   ARG  39           HE       ARG  39   0.429  13.030   4.388
  283   HH11  ARG  39          1HH1      ARG  39   1.345  15.957   6.035
  284   HH12  ARG  39          2HH1      ARG  39   0.194  15.753   7.313
  285   HH21  ARG  39          1HH2      ARG  39  -1.091  12.749   6.066
  286   HH22  ARG  39          2HH2      ARG  39  -1.191  13.927   7.330
  287    H    HIS  40           H        HIS  40  -0.930  14.063  -1.283
  288    HA   HIS  40           HA       HIS  40  -1.703  16.788  -2.011
  289    HB2  HIS  40           1HB      HIS  40  -1.995  14.106  -3.266
  290    HB3  HIS  40           2HB      HIS  40  -3.246  15.298  -3.608
  291    HD2  HIS  40           HD2      HIS  40   0.385  16.625  -3.327
  292    HE1  HIS  40           HE1      HIS  40  -0.672  16.536  -7.435
  293    HE2  HIS  40           HE2      HIS  40   1.075  17.209  -5.751
  294    H    SER  41           H        SER  41  -3.254  13.745  -0.996
  295    HA   SER  41           HA       SER  41  -5.845  14.629  -0.705
  296    HB2  SER  41           1HB      SER  41  -4.856  12.264  -0.364
  297    HB3  SER  41           2HB      SER  41  -4.610  12.762   1.309
  298    HG   SER  41           HG       SER  41  -7.123  13.177   0.157
  299    H    GLY  42           H        GLY  42  -6.961  14.746   1.568
  300    HA2  GLY  42           1HA      GLY  42  -5.768  17.055   2.891
  301    HA3  GLY  42           2HA      GLY  42  -7.410  16.465   3.103
  302    HA   PRO  43           HA       PRO  43  -5.095  15.346   6.923
  303    HB2  PRO  43           1HB      PRO  43  -7.157  15.911   8.597
  304    HB3  PRO  43           2HB      PRO  43  -6.014  17.136   8.033
  305    HG2  PRO  43           1HG      PRO  43  -8.766  16.510   7.035
  306    HG3  PRO  43           2HG      PRO  43  -8.013  18.089   7.324
  307    HD2  PRO  43           1HD      PRO  43  -8.219  17.004   4.851
  308    HD3  PRO  43           2HD      PRO  43  -6.863  18.047   5.326
  309    H    SER  44           H        SER  44  -7.540  14.070   5.111
  310    HA   SER  44           HA       SER  44  -8.804  12.254   6.841
  311    HB2  SER  44           1HB      SER  44  -8.263  12.089   3.869
  312    HB3  SER  44           2HB      SER  44  -9.303  10.966   4.745
  313    HG   SER  44           HG       SER  44 -10.565  12.599   3.872
  314    H    SER  45           H        SER  45  -7.689  10.920   8.119
  315    HA   SER  45           HA       SER  45  -5.811   9.061   6.856
  316    HB2  SER  45           1HB      SER  45  -5.230  10.592   9.403
  317    HB3  SER  45           2HB      SER  45  -4.231   9.298   8.741
  318    HG   SER  45           HG       SER  45  -4.609  11.914   7.821
  319    H    GLY  46           H        GLY  46  -5.542   7.068   7.984
  320    HA2  GLY  46           1HA      GLY  46  -7.920   6.347   9.508
  321    HA3  GLY  46           2HA      GLY  46  -6.739   5.236   8.830
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1 -18.993  -0.964   9.488
    2    HA2  GLY   1           1HA      GLY   1 -20.527   0.834   9.019
    3    HA3  GLY   1           2HA      GLY   1 -19.397   0.772   7.675
    4    H    SER   2           H        SER   2 -20.417   1.047   5.815
    5    HA   SER   2           HA       SER   2 -23.199   0.244   5.540
    6    HB2  SER   2           1HB      SER   2 -22.990   1.391   3.298
    7    HB3  SER   2           2HB      SER   2 -22.691   2.428   4.693
    8    HG   SER   2           HG       SER   2 -20.946   2.866   3.565
    9    H    SER   3           H        SER   3 -23.090  -1.998   5.448
   10    HA   SER   3           HA       SER   3 -21.336  -3.503   3.879
   11    HB2  SER   3           1HB      SER   3 -22.855  -5.354   4.211
   12    HB3  SER   3           2HB      SER   3 -22.805  -4.404   5.696
   13    HG   SER   3           HG       SER   3 -24.849  -4.603   3.775
   14    H    GLY   4           H        GLY   4 -21.064  -3.288   1.755
   15    HA2  GLY   4           1HA      GLY   4 -22.558  -4.110  -0.258
   16    HA3  GLY   4           2HA      GLY   4 -23.338  -2.568   0.065
   17    H    SER   5           H        SER   5 -19.904  -3.486   0.108
   18    HA   SER   5           HA       SER   5 -19.447  -1.485  -2.008
   19    HB2  SER   5           1HB      SER   5 -17.657  -2.104   0.355
   20    HB3  SER   5           2HB      SER   5 -17.285  -0.966  -0.940
   21    HG   SER   5           HG       SER   5 -19.209   0.181  -0.296
   22    H    SER   6           H        SER   6 -18.244  -4.444  -0.475
   23    HA   SER   6           HA       SER   6 -16.148  -5.221  -1.923
   24    HB2  SER   6           1HB      SER   6 -17.192  -6.690  -0.278
   25    HB3  SER   6           2HB      SER   6 -18.561  -6.961  -1.356
   26    HG   SER   6           HG       SER   6 -16.652  -7.638  -2.843
   27    H    GLY   7           H        GLY   7 -15.715  -4.916  -4.008
   28    HA2  GLY   7           1HA      GLY   7 -17.275  -6.237  -6.021
   29    HA3  GLY   7           2HA      GLY   7 -17.446  -4.489  -6.087
   30    H    THR   8           H        THR   8 -14.826  -3.769  -5.355
   31    HA   THR   8           HA       THR   8 -13.498  -4.226  -7.880
   32    HB   THR   8           HB       THR   8 -13.506  -1.980  -6.857
   33    HG1  THR   8           HG1      THR   8 -11.240  -1.625  -7.168
   34   HG21  THR   8          3HG2      THR   8 -12.752  -1.515  -4.782
   35   HG22  THR   8          1HG2      THR   8 -11.411  -2.654  -4.903
   36   HG23  THR   8          2HG2      THR   8 -13.026  -3.234  -4.498
   37    H    GLY   9           H        GLY   9 -13.718  -6.586  -6.370
   38    HA2  GLY   9           1HA      GLY   9 -12.386  -8.407  -5.906
   39    HA3  GLY   9           2HA      GLY   9 -10.998  -7.445  -6.389
   40    H    GLU  10           H        GLU  10 -11.391  -9.312  -4.118
   41    HA   GLU  10           HA       GLU  10 -10.995  -7.455  -1.872
   42    HB2  GLU  10           1HB      GLU  10 -11.956 -10.290  -2.037
   43    HB3  GLU  10           2HB      GLU  10 -11.244  -9.692  -0.545
   44    HG2  GLU  10           1HG      GLU  10 -12.953  -8.168  -0.187
   45    HG3  GLU  10           2HG      GLU  10 -13.465  -8.197  -1.873
   46    H    LYS  11           H        LYS  11  -8.819  -6.995  -2.475
   47    HA   LYS  11           HA       LYS  11  -6.857  -9.049  -2.718
   48    HB2  LYS  11           1HB      LYS  11  -6.459  -6.114  -2.110
   49    HB3  LYS  11           2HB      LYS  11  -5.232  -7.233  -2.690
   50    HG2  LYS  11           1HG      LYS  11  -7.720  -6.718  -4.273
   51    HG3  LYS  11           2HG      LYS  11  -6.330  -5.633  -4.367
   52    HD2  LYS  11           1HD      LYS  11  -4.928  -7.353  -5.195
   53    HD3  LYS  11           2HD      LYS  11  -6.108  -8.604  -4.797
   54    HE2  LYS  11           1HE      LYS  11  -7.582  -7.866  -6.518
   55    HE3  LYS  11           2HE      LYS  11  -6.625  -6.411  -6.796
   56    HZ1  LYS  11           3HZ      LYS  11  -5.065  -8.780  -7.091
   57    HZ2  LYS  11           1HZ      LYS  11  -5.295  -7.503  -8.177
   58    HZ3  LYS  11           2HZ      LYS  11  -6.396  -8.785  -8.135
   59    HA   PRO  12           HA       PRO  12  -5.968  -9.906   1.501
   60    HB2  PRO  12           1HB      PRO  12  -3.360 -10.630   1.296
   61    HB3  PRO  12           2HB      PRO  12  -4.688 -11.652   0.733
   62    HG2  PRO  12           1HG      PRO  12  -2.906  -9.828  -0.834
   63    HG3  PRO  12           2HG      PRO  12  -3.459 -11.465  -1.232
   64    HD2  PRO  12           1HD      PRO  12  -4.585  -9.246  -2.300
   65    HD3  PRO  12           2HD      PRO  12  -5.512 -10.726  -1.976
   66    H    TYR  13           H        TYR  13  -4.866  -7.221  -0.062
   67    HA   TYR  13           HA       TYR  13  -3.700  -6.157   2.407
   68    HB2  TYR  13           1HB      TYR  13  -2.484  -5.737  -0.331
   69    HB3  TYR  13           2HB      TYR  13  -1.904  -5.049   1.181
   70    HD1  TYR  13           HD1      TYR  13  -0.785  -6.466   2.843
   71    HD2  TYR  13           HD2      TYR  13  -2.031  -8.030  -0.912
   72    HE1  TYR  13           HE1      TYR  13   0.654  -8.430   3.191
   73    HE2  TYR  13           HE2      TYR  13  -0.597  -9.999  -0.575
   74    HH   TYR  13           HH       TYR  13   0.374 -11.199   1.715
   75    H    LYS  14           H        LYS  14  -3.908  -3.899   2.664
   76    HA   LYS  14           HA       LYS  14  -5.387  -2.400   0.662
   77    HB2  LYS  14           1HB      LYS  14  -7.091  -3.576   2.090
   78    HB3  LYS  14           2HB      LYS  14  -6.475  -2.673   3.467
   79    HG2  LYS  14           1HG      LYS  14  -7.179  -0.605   2.531
   80    HG3  LYS  14           2HG      LYS  14  -7.558  -1.367   0.985
   81    HD2  LYS  14           1HD      LYS  14  -9.390  -2.565   1.946
   82    HD3  LYS  14           2HD      LYS  14  -8.931  -2.067   3.576
   83    HE2  LYS  14           1HE      LYS  14  -9.623  -0.055   1.460
   84    HE3  LYS  14           2HE      LYS  14 -10.874  -0.837   2.426
   85    HZ1  LYS  14           3HZ      LYS  14  -9.065  -0.016   4.275
   86    HZ2  LYS  14           1HZ      LYS  14 -10.501   0.787   3.881
   87    HZ3  LYS  14           2HZ      LYS  14  -9.046   1.250   3.153
   88    H    CYS  15           H        CYS  15  -4.561  -0.424   0.539
   89    HA   CYS  15           HA       CYS  15  -2.550   0.497   2.283
   90    HB2  CYS  15           1HB      CYS  15  -2.745   1.193  -0.083
   91    HB3  CYS  15           2HB      CYS  15  -4.206   2.091   0.315
   92    H    SER  16           H        SER  16  -2.782   1.229   4.279
   93    HA   SER  16           HA       SER  16  -5.354   2.207   5.201
   94    HB2  SER  16           1HB      SER  16  -4.003   0.645   6.587
   95    HB3  SER  16           2HB      SER  16  -2.762   1.889   6.734
   96    HG   SER  16           HG       SER  16  -3.942   2.894   8.162
   97    H    ASP  17           H        ASP  17  -4.235   3.882   3.291
   98    HA   ASP  17           HA       ASP  17  -3.711   6.281   4.907
   99    HB2  ASP  17           1HB      ASP  17  -1.573   5.651   3.977
  100    HB3  ASP  17           2HB      ASP  17  -2.277   5.466   2.373
  101    H    CYS  18           H        CYS  18  -4.475   5.189   1.598
  102    HA   CYS  18           HA       CYS  18  -6.287   7.493   1.344
  103    HB2  CYS  18           1HB      CYS  18  -6.108   7.143  -1.095
  104    HB3  CYS  18           2HB      CYS  18  -4.539   7.438  -0.353
  105    H    GLY  19           H        GLY  19  -6.023   4.008   0.746
  106    HA2  GLY  19           1HA      GLY  19  -7.992   2.693   1.488
  107    HA3  GLY  19           2HA      GLY  19  -8.977   3.905   0.681
  108    H    LYS  20           H        LYS  20  -6.094   2.030  -0.259
  109    HA   LYS  20           HA       LYS  20  -7.565   1.196  -2.674
  110    HB2  LYS  20           1HB      LYS  20  -4.727   2.045  -2.263
  111    HB3  LYS  20           2HB      LYS  20  -5.091   0.880  -3.529
  112    HG2  LYS  20           1HG      LYS  20  -6.831   2.567  -4.335
  113    HG3  LYS  20           2HG      LYS  20  -6.014   3.720  -3.277
  114    HD2  LYS  20           1HD      LYS  20  -4.938   4.066  -5.295
  115    HD3  LYS  20           2HD      LYS  20  -3.864   2.913  -4.500
  116    HE2  LYS  20           1HE      LYS  20  -4.134   2.144  -6.719
  117    HE3  LYS  20           2HE      LYS  20  -5.127   1.093  -5.711
  118    HZ1  LYS  20           3HZ      LYS  20  -5.976   2.357  -7.936
  119    HZ2  LYS  20           1HZ      LYS  20  -6.520   3.402  -6.721
  120    HZ3  LYS  20           2HZ      LYS  20  -6.987   1.777  -6.710
  121    H    SER  21           H        SER  21  -6.611  -0.863  -3.649
  122    HA   SER  21           HA       SER  21  -5.910  -2.755  -1.501
  123    HB2  SER  21           1HB      SER  21  -7.995  -2.966  -3.646
  124    HB3  SER  21           2HB      SER  21  -7.222  -4.429  -3.036
  125    HG   SER  21           HG       SER  21  -8.646  -4.281  -1.501
  126    H    PHE  22           H        PHE  22  -4.126  -3.900  -1.849
  127    HA   PHE  22           HA       PHE  22  -3.128  -4.131  -4.612
  128    HB2  PHE  22           1HB      PHE  22  -1.472  -3.794  -2.102
  129    HB3  PHE  22           2HB      PHE  22  -0.842  -3.979  -3.735
  130    HD1  PHE  22           HD1      PHE  22  -3.218  -1.806  -1.849
  131    HD2  PHE  22           HD2      PHE  22  -0.220  -2.081  -4.858
  132    HE1  PHE  22           HE1      PHE  22  -3.305   0.634  -2.153
  133    HE2  PHE  22           HE2      PHE  22  -0.301   0.359  -5.166
  134    HZ   PHE  22           HZ       PHE  22  -1.844   1.720  -3.812
  135    H    THR  23           H        THR  23  -1.860  -6.016  -5.081
  136    HA   THR  23           HA       THR  23  -2.817  -8.348  -3.633
  137    HB   THR  23           HB       THR  23  -1.146  -8.210  -6.151
  138    HG1  THR  23           HG1      THR  23  -2.987  -7.757  -7.074
  139   HG21  THR  23          3HG2      THR  23  -0.823 -10.384  -5.657
  140   HG22  THR  23          1HG2      THR  23  -2.486 -10.580  -6.208
  141   HG23  THR  23          2HG2      THR  23  -2.141 -10.417  -4.486
  142    H    TRP  24           H        TRP  24   0.299  -6.951  -4.624
  143    HA   TRP  24           HA       TRP  24   1.675  -8.790  -2.804
  144    HB2  TRP  24           1HB      TRP  24   2.659  -6.997  -5.023
  145    HB3  TRP  24           2HB      TRP  24   3.751  -7.817  -3.910
  146    HD1  TRP  24           HD1      TRP  24   1.250  -8.559  -6.731
  147    HE1  TRP  24           HE1      TRP  24   1.739 -10.912  -7.653
  148    HE3  TRP  24           HE3      TRP  24   4.771 -10.046  -3.335
  149    HZ2  TRP  24           HZ2      TRP  24   3.398 -13.108  -7.024
  150    HZ3  TRP  24           HZ3      TRP  24   5.759 -12.287  -3.566
  151    HH2  TRP  24           HH2      TRP  24   5.085 -13.785  -5.372
  152    H    LYS  25           H        LYS  25   2.437  -8.144  -0.898
  153    HA   LYS  25           HA       LYS  25   1.862  -5.620   0.179
  154    HB2  LYS  25           1HB      LYS  25   3.381  -6.315   2.038
  155    HB3  LYS  25           2HB      LYS  25   2.146  -7.502   1.640
  156    HG2  LYS  25           1HG      LYS  25   4.091  -8.437   0.094
  157    HG3  LYS  25           2HG      LYS  25   5.085  -7.633   1.311
  158    HD2  LYS  25           1HD      LYS  25   2.851  -9.379   2.223
  159    HD3  LYS  25           2HD      LYS  25   4.318 -10.140   1.603
  160    HE2  LYS  25           1HE      LYS  25   4.533  -7.965   3.636
  161    HE3  LYS  25           2HE      LYS  25   4.081  -9.589   4.150
  162    HZ1  LYS  25           3HZ      LYS  25   6.105 -10.457   3.428
  163    HZ2  LYS  25           1HZ      LYS  25   6.536  -8.996   4.163
  164    HZ3  LYS  25           2HZ      LYS  25   6.469  -9.106   2.477
  165    H    SER  26           H        SER  26   4.808  -6.923  -1.266
  166    HA   SER  26           HA       SER  26   6.618  -4.943  -0.604
  167    HB2  SER  26           1HB      SER  26   7.457  -6.860  -1.715
  168    HB3  SER  26           2HB      SER  26   6.356  -6.651  -3.077
  169    HG   SER  26           HG       SER  26   8.582  -5.969  -3.438
  170    H    ARG  27           H        ARG  27   4.347  -5.027  -3.330
  171    HA   ARG  27           HA       ARG  27   5.141  -2.625  -4.537
  172    HB2  ARG  27           1HB      ARG  27   2.372  -3.840  -4.508
  173    HB3  ARG  27           2HB      ARG  27   2.987  -2.675  -5.673
  174    HG2  ARG  27           1HG      ARG  27   4.247  -5.372  -5.291
  175    HG3  ARG  27           2HG      ARG  27   2.900  -5.101  -6.399
  176    HD2  ARG  27           1HD      ARG  27   4.768  -4.877  -7.765
  177    HD3  ARG  27           2HD      ARG  27   4.359  -3.210  -7.362
  178    HE   ARG  27           HE       ARG  27   6.174  -4.007  -5.457
  179   HH11  ARG  27          1HH1      ARG  27   6.115  -3.743  -8.928
  180   HH12  ARG  27          2HH1      ARG  27   7.814  -3.428  -9.063
  181   HH21  ARG  27          1HH2      ARG  27   8.411  -3.594  -5.622
  182   HH22  ARG  27          2HH2      ARG  27   9.119  -3.344  -7.182
  183    H    LEU  28           H        LEU  28   2.751  -3.284  -2.014
  184    HA   LEU  28           HA       LEU  28   1.595  -0.762  -1.824
  185    HB2  LEU  28           1HB      LEU  28   0.663  -2.642  -0.664
  186    HB3  LEU  28           2HB      LEU  28   2.127  -2.830   0.300
  187    HG   LEU  28           HG       LEU  28   1.559  -0.481   1.211
  188   HD11  LEU  28          1HD1      LEU  28  -0.725   0.180   1.143
  189   HD12  LEU  28          2HD1      LEU  28  -1.190  -1.294   0.294
  190   HD13  LEU  28          3HD1      LEU  28  -0.202  -0.082  -0.521
  191   HD21  LEU  28          3HD2      LEU  28   0.424  -1.439   3.016
  192   HD22  LEU  28          1HD2      LEU  28   1.363  -2.771   2.342
  193   HD23  LEU  28          2HD2      LEU  28  -0.363  -2.647   2.000
  194    H    ARG  29           H        ARG  29   4.428  -2.058  -0.109
  195    HA   ARG  29           HA       ARG  29   5.064  -0.022   1.571
  196    HB2  ARG  29           1HB      ARG  29   7.038  -1.505  -0.175
  197    HB3  ARG  29           2HB      ARG  29   7.416  -0.654   1.317
  198    HG2  ARG  29           1HG      ARG  29   5.662  -2.264   2.363
  199    HG3  ARG  29           2HG      ARG  29   5.976  -3.234   0.923
  200    HD2  ARG  29           1HD      ARG  29   8.130  -2.231   2.774
  201    HD3  ARG  29           2HD      ARG  29   7.374  -3.817   2.919
  202    HE   ARG  29           HE       ARG  29   8.222  -3.789   0.359
  203   HH11  ARG  29          1HH1      ARG  29   9.793  -3.091   3.386
  204   HH12  ARG  29          2HH1      ARG  29  11.356  -3.605   2.843
  205   HH21  ARG  29          1HH2      ARG  29  10.274  -4.469  -0.368
  206   HH22  ARG  29          2HH2      ARG  29  11.629  -4.389   0.707
  207    H    ILE  30           H        ILE  30   5.866  -0.172  -1.886
  208    HA   ILE  30           HA       ILE  30   7.175   2.348  -1.951
  209    HB   ILE  30           HB       ILE  30   5.940   0.751  -4.197
  210   HG12  ILE  30          1HG1      ILE  30   8.872   1.038  -3.594
  211   HG13  ILE  30          2HG1      ILE  30   7.903  -0.187  -2.783
  212   HG21  ILE  30          1HG2      ILE  30   7.982   2.943  -4.454
  213   HG22  ILE  30          2HG2      ILE  30   7.069   2.144  -5.733
  214   HG23  ILE  30          3HG2      ILE  30   6.248   3.228  -4.610
  215   HD11  ILE  30          3HD1      ILE  30   8.898  -0.079  -5.534
  216   HD12  ILE  30          1HD1      ILE  30   8.524  -1.464  -4.509
  217   HD13  ILE  30          2HD1      ILE  30   7.230  -0.625  -5.365
  218    H    HIS  31           H        HIS  31   3.858   1.309  -2.413
  219    HA   HIS  31           HA       HIS  31   2.937   3.808  -3.460
  220    HB2  HIS  31           1HB      HIS  31   1.630   1.933  -4.052
  221    HB3  HIS  31           2HB      HIS  31   1.553   1.357  -2.389
  222    HD1  HIS  31           HD1      HIS  31   0.112   4.011  -4.645
  223    HD2  HIS  31           HD2      HIS  31  -0.545   2.342  -0.897
  224    HE1  HIS  31           HE1      HIS  31  -2.099   4.931  -3.878
  225    H    GLN  32           H        GLN  32   3.468   2.505  -0.303
  226    HA   GLN  32           HA       GLN  32   1.757   4.349   1.078
  227    HB2  GLN  32           1HB      GLN  32   3.936   2.486   2.021
  228    HB3  GLN  32           2HB      GLN  32   3.007   3.508   3.109
  229    HG2  GLN  32           1HG      GLN  32   1.003   2.361   2.635
  230    HG3  GLN  32           2HG      GLN  32   1.717   1.537   1.250
  231   HE21  GLN  32          1HE2      GLN  32   0.608   0.953   4.174
  232   HE22  GLN  32          2HE2      GLN  32   1.658  -0.319   4.688
  233    H    LYS  33           H        LYS  33   5.182   4.170   0.278
  234    HA   LYS  33           HA       LYS  33   5.942   6.440   1.830
  235    HB2  LYS  33           1HB      LYS  33   8.083   6.210   0.851
  236    HB3  LYS  33           2HB      LYS  33   7.464   4.573   1.025
  237    HG2  LYS  33           1HG      LYS  33   7.077   4.348  -1.266
  238    HG3  LYS  33           2HG      LYS  33   7.162   6.090  -1.541
  239    HD2  LYS  33           1HD      LYS  33   9.545   4.622  -0.484
  240    HD3  LYS  33           2HD      LYS  33   9.172   4.574  -2.209
  241    HE2  LYS  33           1HE      LYS  33  10.547   6.404  -2.136
  242    HE3  LYS  33           2HE      LYS  33   8.980   7.178  -1.906
  243    HZ1  LYS  33           3HZ      LYS  33   9.539   7.832   0.133
  244    HZ2  LYS  33           1HZ      LYS  33  11.135   7.446  -0.277
  245    HZ3  LYS  33           2HZ      LYS  33  10.180   6.324   0.555
  246    H    CYS  34           H        CYS  34   4.489   6.014  -1.252
  247    HA   CYS  34           HA       CYS  34   5.259   8.633  -2.231
  248    HB2  CYS  34           1HB      CYS  34   4.221   8.043  -4.258
  249    HB3  CYS  34           2HB      CYS  34   4.922   6.538  -3.676
  250    HG   CYS  34           HG       CYS  34   2.400   6.067  -4.860
  251    H    HIS  35           H        HIS  35   3.635   8.292   0.245
  252    HA   HIS  35           HA       HIS  35   1.244   9.800  -0.589
  253    HB2  HIS  35           1HB      HIS  35   1.680   7.732   1.506
  254    HB3  HIS  35           2HB      HIS  35   0.558   9.037   1.881
  255    HD1  HIS  35           HD1      HIS  35  -1.316   9.383  -0.172
  256    HD2  HIS  35           HD2      HIS  35   0.470   5.659   0.278
  257    HE1  HIS  35           HE1      HIS  35  -2.834   7.762  -1.352
  258    H    THR  36           H        THR  36   3.676  11.115  -0.311
  259    HA   THR  36           HA       THR  36   3.411  12.525   2.260
  260    HB   THR  36           HB       THR  36   5.697  13.343   1.905
  261    HG1  THR  36           HG1      THR  36   6.897  12.468   0.136
  262   HG21  THR  36          3HG2      THR  36   5.064  10.983   2.877
  263   HG22  THR  36          1HG2      THR  36   6.750  11.420   2.605
  264   HG23  THR  36          2HG2      THR  36   5.903  10.403   1.440
  265    H    GLY  37           H        GLY  37   1.635  13.795   1.469
  266    HA2  GLY  37           1HA      GLY  37   2.556  16.026  -0.224
  267    HA3  GLY  37           2HA      GLY  37   1.004  15.260  -0.533
  268    H    GLU  38           H        GLU  38   0.247  14.883   2.190
  269    HA   GLU  38           HA       GLU  38  -1.259  17.041   2.762
  270    HB2  GLU  38           1HB      GLU  38  -1.473  15.040   4.070
  271    HB3  GLU  38           2HB      GLU  38   0.151  15.225   4.719
  272    HG2  GLU  38           1HG      GLU  38  -1.038  16.003   6.482
  273    HG3  GLU  38           2HG      GLU  38  -0.841  17.511   5.590
  274    H    ARG  39           H        ARG  39  -0.925  19.111   3.208
  275    HA   ARG  39           HA       ARG  39   1.412  19.920   4.751
  276    HB2  ARG  39           1HB      ARG  39   2.060  20.017   2.339
  277    HB3  ARG  39           2HB      ARG  39   0.769  21.183   2.083
  278    HG2  ARG  39           1HG      ARG  39   2.016  22.443   4.048
  279    HG3  ARG  39           2HG      ARG  39   3.384  21.508   3.440
  280    HD2  ARG  39           1HD      ARG  39   2.805  22.381   1.145
  281    HD3  ARG  39           2HD      ARG  39   1.675  23.479   1.937
  282    HE   ARG  39           HE       ARG  39   4.393  23.576   2.923
  283   HH11  ARG  39          1HH1      ARG  39   2.045  24.883   0.710
  284   HH12  ARG  39          2HH1      ARG  39   2.879  26.388   0.510
  285   HH21  ARG  39          1HH2      ARG  39   5.500  25.554   2.669
  286   HH22  ARG  39          2HH2      ARG  39   4.844  26.769   1.624
  287    H    HIS  40           H        HIS  40   1.099  21.752   5.956
  288    HA   HIS  40           HA       HIS  40  -1.269  22.480   6.950
  289    HB2  HIS  40           1HB      HIS  40  -0.313  24.791   7.335
  290    HB3  HIS  40           2HB      HIS  40   0.699  23.455   7.876
  291    HD2  HIS  40           HD2      HIS  40   0.933  26.538   5.667
  292    HE1  HIS  40           HE1      HIS  40   4.317  24.144   4.764
  293    HE2  HIS  40           HE2      HIS  40   3.266  26.424   4.557
  294    H    SER  41           H        SER  41  -3.127  23.230   6.193
  295    HA   SER  41           HA       SER  41  -3.089  24.972   3.820
  296    HB2  SER  41           1HB      SER  41  -5.080  23.865   2.964
  297    HB3  SER  41           2HB      SER  41  -3.810  22.668   3.219
  298    HG   SER  41           HG       SER  41  -5.554  23.137   5.336
  299    H    GLY  42           H        GLY  42  -4.859  26.454   3.642
  300    HA2  GLY  42           1HA      GLY  42  -7.034  26.925   5.083
  301    HA3  GLY  42           2HA      GLY  42  -5.796  27.330   6.263
  302    HA   PRO  43           HA       PRO  43  -6.869  31.037   3.566
  303    HB2  PRO  43           1HB      PRO  43  -7.813  32.611   5.567
  304    HB3  PRO  43           2HB      PRO  43  -8.842  31.509   4.644
  305    HG2  PRO  43           1HG      PRO  43  -7.608  31.133   7.346
  306    HG3  PRO  43           2HG      PRO  43  -9.247  30.734   6.799
  307    HD2  PRO  43           1HD      PRO  43  -7.293  28.873   7.021
  308    HD3  PRO  43           2HD      PRO  43  -8.570  28.774   5.793
  309    H    SER  44           H        SER  44  -5.362  32.565   3.238
  310    HA   SER  44           HA       SER  44  -3.828  33.688   5.406
  311    HB2  SER  44           1HB      SER  44  -1.643  32.979   4.613
  312    HB3  SER  44           2HB      SER  44  -2.631  31.555   4.938
  313    HG   SER  44           HG       SER  44  -2.707  32.597   2.357
  314    H    SER  45           H        SER  45  -2.642  35.542   4.799
  315    HA   SER  45           HA       SER  45  -3.696  36.840   2.434
  316    HB2  SER  45           1HB      SER  45  -3.648  38.179   4.423
  317    HB3  SER  45           2HB      SER  45  -1.945  37.812   4.699
  318    HG   SER  45           HG       SER  45  -3.110  39.653   3.006
  319    H    GLY  46           H        GLY  46  -2.696  36.932   0.537
  320    HA2  GLY  46           1HA      GLY  46   0.219  36.442   0.481
  321    HA3  GLY  46           2HA      GLY  46  -0.880  35.824  -0.743
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1 -12.600  11.735  -8.747
    2    HA2  GLY   1           1HA      GLY   1 -14.413  10.507  -7.964
    3    HA3  GLY   1           2HA      GLY   1 -14.330   9.881  -9.604
    4    H    SER   2           H        SER   2 -14.699   8.900  -6.577
    5    HA   SER   2           HA       SER   2 -12.857   6.657  -6.596
    6    HB2  SER   2           1HB      SER   2 -13.608   6.197  -4.391
    7    HB3  SER   2           2HB      SER   2 -13.543   7.956  -4.505
    8    HG   SER   2           HG       SER   2 -15.696   6.296  -4.146
    9    H    SER   3           H        SER   3 -13.458   4.486  -6.701
   10    HA   SER   3           HA       SER   3 -16.129   4.001  -7.850
   11    HB2  SER   3           1HB      SER   3 -14.120   3.699  -9.386
   12    HB3  SER   3           2HB      SER   3 -13.675   2.322  -8.378
   13    HG   SER   3           HG       SER   3 -14.998   1.851 -10.283
   14    H    GLY   4           H        GLY   4 -17.380   2.438  -6.980
   15    HA2  GLY   4           1HA      GLY   4 -16.868   1.496  -4.388
   16    HA3  GLY   4           2HA      GLY   4 -18.121   0.887  -5.460
   17    H    SER   5           H        SER   5 -17.660  -1.191  -4.467
   18    HA   SER   5           HA       SER   5 -15.580  -2.598  -5.951
   19    HB2  SER   5           1HB      SER   5 -14.542  -1.975  -3.787
   20    HB3  SER   5           2HB      SER   5 -15.838  -2.821  -2.941
   21    HG   SER   5           HG       SER   5 -14.964  -4.576  -4.600
   22    H    SER   6           H        SER   6 -16.172  -4.609  -6.560
   23    HA   SER   6           HA       SER   6 -18.241  -6.070  -5.184
   24    HB2  SER   6           1HB      SER   6 -19.680  -6.246  -7.247
   25    HB3  SER   6           2HB      SER   6 -19.686  -4.658  -6.482
   26    HG   SER   6           HG       SER   6 -17.994  -5.342  -8.651
   27    H    GLY   7           H        GLY   7 -18.839  -8.080  -6.666
   28    HA2  GLY   7           1HA      GLY   7 -18.120  -9.953  -7.801
   29    HA3  GLY   7           2HA      GLY   7 -16.802  -8.990  -8.450
   30    H    THR   8           H        THR   8 -16.959 -11.756  -7.271
   31    HA   THR   8           HA       THR   8 -15.556 -11.712  -4.796
   32    HB   THR   8           HB       THR   8 -15.712 -13.964  -6.810
   33    HG1  THR   8           HG1      THR   8 -17.376 -14.578  -5.054
   34   HG21  THR   8          3HG2      THR   8 -13.954 -14.243  -5.112
   35   HG22  THR   8          1HG2      THR   8 -15.258 -15.411  -4.900
   36   HG23  THR   8          2HG2      THR   8 -15.152 -14.004  -3.841
   37    H    GLY   9           H        GLY   9 -13.789 -10.297  -5.149
   38    HA2  GLY   9           1HA      GLY   9 -11.414 -11.629  -6.026
   39    HA3  GLY   9           2HA      GLY   9 -11.905 -10.370  -7.150
   40    H    GLU  10           H        GLU  10 -12.002 -10.524  -3.596
   41    HA   GLU  10           HA       GLU  10 -11.045  -7.841  -3.367
   42    HB2  GLU  10           1HB      GLU  10 -11.234  -8.143  -1.002
   43    HB3  GLU  10           2HB      GLU  10 -12.609  -8.943  -1.749
   44    HG2  GLU  10           1HG      GLU  10 -11.586 -11.096  -1.451
   45    HG3  GLU  10           2HG      GLU  10 -10.106 -10.350  -0.851
   46    H    LYS  11           H        LYS  11  -9.135  -7.242  -2.074
   47    HA   LYS  11           HA       LYS  11  -6.867  -8.982  -2.754
   48    HB2  LYS  11           1HB      LYS  11  -6.948  -6.027  -2.115
   49    HB3  LYS  11           2HB      LYS  11  -5.488  -6.937  -2.482
   50    HG2  LYS  11           1HG      LYS  11  -7.789  -6.813  -4.400
   51    HG3  LYS  11           2HG      LYS  11  -6.539  -5.568  -4.357
   52    HD2  LYS  11           1HD      LYS  11  -4.829  -7.233  -4.798
   53    HD3  LYS  11           2HD      LYS  11  -6.037  -8.519  -4.750
   54    HE2  LYS  11           1HE      LYS  11  -7.176  -7.059  -6.621
   55    HE3  LYS  11           2HE      LYS  11  -5.536  -6.449  -6.836
   56    HZ1  LYS  11           3HZ      LYS  11  -4.916  -8.323  -7.830
   57    HZ2  LYS  11           1HZ      LYS  11  -6.557  -8.720  -7.938
   58    HZ3  LYS  11           2HZ      LYS  11  -5.629  -9.303  -6.649
   59    HA   PRO  12           HA       PRO  12  -6.155  -9.898   1.493
   60    HB2  PRO  12           1HB      PRO  12  -3.515 -10.517   1.361
   61    HB3  PRO  12           2HB      PRO  12  -4.783 -11.582   0.744
   62    HG2  PRO  12           1HG      PRO  12  -3.027  -9.668  -0.743
   63    HG3  PRO  12           2HG      PRO  12  -3.502 -11.320  -1.179
   64    HD2  PRO  12           1HD      PRO  12  -4.682  -9.133  -2.255
   65    HD3  PRO  12           2HD      PRO  12  -5.558 -10.652  -1.978
   66    H    TYR  13           H        TYR  13  -4.981  -7.190  -0.056
   67    HA   TYR  13           HA       TYR  13  -3.996  -6.092   2.481
   68    HB2  TYR  13           1HB      TYR  13  -2.668  -5.645  -0.200
   69    HB3  TYR  13           2HB      TYR  13  -2.181  -4.926   1.331
   70    HD1  TYR  13           HD1      TYR  13  -1.472  -6.549   3.208
   71    HD2  TYR  13           HD2      TYR  13  -1.744  -7.672  -0.887
   72    HE1  TYR  13           HE1      TYR  13   0.008  -8.465   3.641
   73    HE2  TYR  13           HE2      TYR  13  -0.266  -9.592  -0.465
   74    HH   TYR  13           HH       TYR  13   0.358 -11.024   1.561
   75    H    LYS  14           H        LYS  14  -3.923  -3.677   2.441
   76    HA   LYS  14           HA       LYS  14  -5.382  -2.232   0.476
   77    HB2  LYS  14           1HB      LYS  14  -7.253  -3.433   1.572
   78    HB3  LYS  14           2HB      LYS  14  -6.793  -2.710   3.108
   79    HG2  LYS  14           1HG      LYS  14  -7.337  -0.521   2.316
   80    HG3  LYS  14           2HG      LYS  14  -7.600  -1.127   0.679
   81    HD2  LYS  14           1HD      LYS  14  -9.499  -2.436   1.448
   82    HD3  LYS  14           2HD      LYS  14  -9.214  -1.909   3.108
   83    HE2  LYS  14           1HE      LYS  14  -9.591   0.429   2.379
   84    HE3  LYS  14           2HE      LYS  14  -9.984  -0.168   0.767
   85    HZ1  LYS  14           3HZ      LYS  14 -11.886   0.295   2.396
   86    HZ2  LYS  14           1HZ      LYS  14 -11.437  -1.159   3.135
   87    HZ3  LYS  14           2HZ      LYS  14 -11.927  -1.150   1.517
   88    H    CYS  15           H        CYS  15  -4.252  -0.410   0.478
   89    HA   CYS  15           HA       CYS  15  -2.573   0.536   2.435
   90    HB2  CYS  15           1HB      CYS  15  -2.414   1.476   0.257
   91    HB3  CYS  15           2HB      CYS  15  -4.093   2.005   0.284
   92    H    SER  16           H        SER  16  -2.710   2.195   3.997
   93    HA   SER  16           HA       SER  16  -5.384   2.443   5.175
   94    HB2  SER  16           1HB      SER  16  -3.312   1.554   6.462
   95    HB3  SER  16           2HB      SER  16  -2.832   3.248   6.548
   96    HG   SER  16           HG       SER  16  -5.183   2.048   7.576
   97    H    ASP  17           H        ASP  17  -2.698   4.312   3.935
   98    HA   ASP  17           HA       ASP  17  -3.340   6.848   4.851
   99    HB2  ASP  17           1HB      ASP  17  -2.038   5.886   2.314
  100    HB3  ASP  17           2HB      ASP  17  -2.286   7.604   2.617
  101    H    CYS  18           H        CYS  18  -4.293   5.420   1.722
  102    HA   CYS  18           HA       CYS  18  -6.522   7.341   1.626
  103    HB2  CYS  18           1HB      CYS  18  -6.551   6.882  -0.820
  104    HB3  CYS  18           2HB      CYS  18  -5.033   7.579  -0.264
  105    H    GLY  19           H        GLY  19  -5.679   3.956   0.930
  106    HA2  GLY  19           1HA      GLY  19  -7.293   2.341   1.987
  107    HA3  GLY  19           2HA      GLY  19  -8.546   3.295   1.207
  108    H    LYS  20           H        LYS  20  -5.666   2.936  -0.590
  109    HA   LYS  20           HA       LYS  20  -6.960   1.634  -2.727
  110    HB2  LYS  20           1HB      LYS  20  -4.062   2.153  -2.094
  111    HB3  LYS  20           2HB      LYS  20  -4.550   1.291  -3.547
  112    HG2  LYS  20           1HG      LYS  20  -5.817   3.917  -2.985
  113    HG3  LYS  20           2HG      LYS  20  -4.143   3.894  -3.546
  114    HD2  LYS  20           1HD      LYS  20  -4.714   2.881  -5.574
  115    HD3  LYS  20           2HD      LYS  20  -6.279   2.336  -4.965
  116    HE2  LYS  20           1HE      LYS  20  -6.728   4.145  -6.419
  117    HE3  LYS  20           2HE      LYS  20  -6.918   4.771  -4.782
  118    HZ1  LYS  20           3HZ      LYS  20  -5.417   6.312  -5.239
  119    HZ2  LYS  20           1HZ      LYS  20  -5.230   5.706  -6.808
  120    HZ3  LYS  20           2HZ      LYS  20  -4.253   5.126  -5.555
  121    H    SER  21           H        SER  21  -6.042  -0.430  -3.724
  122    HA   SER  21           HA       SER  21  -5.724  -2.454  -1.604
  123    HB2  SER  21           1HB      SER  21  -7.099  -2.746  -4.286
  124    HB3  SER  21           2HB      SER  21  -6.892  -4.033  -3.099
  125    HG   SER  21           HG       SER  21  -8.015  -2.379  -1.657
  126    H    PHE  22           H        PHE  22  -4.327  -4.194  -1.985
  127    HA   PHE  22           HA       PHE  22  -2.683  -4.128  -4.396
  128    HB2  PHE  22           1HB      PHE  22  -1.419  -4.149  -1.653
  129    HB3  PHE  22           2HB      PHE  22  -0.599  -4.056  -3.208
  130    HD1  PHE  22           HD1      PHE  22  -3.179  -2.203  -1.250
  131    HD2  PHE  22           HD2      PHE  22   0.144  -2.002  -3.903
  132    HE1  PHE  22           HE1      PHE  22  -3.231   0.254  -1.124
  133    HE2  PHE  22           HE2      PHE  22   0.097   0.455  -3.780
  134    HZ   PHE  22           HZ       PHE  22  -1.591   1.586  -2.389
  135    H    THR  23           H        THR  23  -1.540  -6.076  -4.800
  136    HA   THR  23           HA       THR  23  -2.792  -8.394  -3.538
  137    HB   THR  23           HB       THR  23  -1.636  -9.663  -5.406
  138    HG1  THR  23           HG1      THR  23  -1.362  -7.209  -6.742
  139   HG21  THR  23          3HG2      THR  23  -4.018  -8.951  -5.467
  140   HG22  THR  23          1HG2      THR  23  -3.275  -9.038  -7.063
  141   HG23  THR  23          2HG2      THR  23  -3.518  -7.472  -6.288
  142    H    TRP  24           H        TRP  24   0.359  -6.917  -4.017
  143    HA   TRP  24           HA       TRP  24   1.507  -8.934  -2.199
  144    HB2  TRP  24           1HB      TRP  24   3.066  -7.404  -4.283
  145    HB3  TRP  24           2HB      TRP  24   3.597  -8.795  -3.341
  146    HD1  TRP  24           HD1      TRP  24   1.371  -7.881  -6.330
  147    HE1  TRP  24           HE1      TRP  24   0.934 -10.013  -7.704
  148    HE3  TRP  24           HE3      TRP  24   3.492 -11.317  -3.194
  149    HZ2  TRP  24           HZ2      TRP  24   1.423 -12.784  -7.487
  150    HZ3  TRP  24           HZ3      TRP  24   3.465 -13.688  -3.852
  151    HH2  TRP  24           HH2      TRP  24   2.451 -14.404  -5.954
  152    H    LYS  25           H        LYS  25   3.051  -8.210  -0.678
  153    HA   LYS  25           HA       LYS  25   2.474  -5.749   0.535
  154    HB2  LYS  25           1HB      LYS  25   4.511  -7.879   0.910
  155    HB3  LYS  25           2HB      LYS  25   4.853  -6.313   1.633
  156    HG2  LYS  25           1HG      LYS  25   2.169  -7.480   2.102
  157    HG3  LYS  25           2HG      LYS  25   3.545  -8.217   2.926
  158    HD2  LYS  25           1HD      LYS  25   2.824  -6.603   4.438
  159    HD3  LYS  25           2HD      LYS  25   4.151  -5.798   3.597
  160    HE2  LYS  25           1HE      LYS  25   2.181  -4.344   3.870
  161    HE3  LYS  25           2HE      LYS  25   2.585  -4.624   2.177
  162    HZ1  LYS  25           3HZ      LYS  25   0.704  -5.802   1.826
  163    HZ2  LYS  25           1HZ      LYS  25   0.133  -4.856   3.107
  164    HZ3  LYS  25           2HZ      LYS  25   0.655  -6.440   3.392
  165    H    SER  26           H        SER  26   5.597  -6.704  -0.906
  166    HA   SER  26           HA       SER  26   6.945  -4.388  -0.927
  167    HB2  SER  26           1HB      SER  26   7.874  -6.400  -1.921
  168    HB3  SER  26           2HB      SER  26   6.727  -6.309  -3.257
  169    HG   SER  26           HG       SER  26   8.874  -4.560  -2.670
  170    H    ARG  27           H        ARG  27   4.370  -5.220  -3.209
  171    HA   ARG  27           HA       ARG  27   4.559  -2.950  -4.843
  172    HB2  ARG  27           1HB      ARG  27   2.025  -4.453  -4.177
  173    HB3  ARG  27           2HB      ARG  27   2.350  -3.504  -5.621
  174    HG2  ARG  27           1HG      ARG  27   4.090  -5.838  -4.981
  175    HG3  ARG  27           2HG      ARG  27   2.494  -6.103  -5.686
  176    HD2  ARG  27           1HD      ARG  27   4.668  -4.362  -6.845
  177    HD3  ARG  27           2HD      ARG  27   4.244  -5.981  -7.400
  178    HE   ARG  27           HE       ARG  27   2.857  -3.534  -7.975
  179   HH11  ARG  27          1HH1      ARG  27   2.552  -6.990  -7.696
  180   HH12  ARG  27          2HH1      ARG  27   1.183  -7.086  -8.754
  181   HH21  ARG  27          1HH2      ARG  27   1.055  -3.646  -9.369
  182   HH22  ARG  27          2HH2      ARG  27   0.333  -5.183  -9.706
  183    H    LEU  28           H        LEU  28   2.637  -3.550  -1.923
  184    HA   LEU  28           HA       LEU  28   1.257  -1.104  -1.904
  185    HB2  LEU  28           1HB      LEU  28   0.433  -2.825  -0.530
  186    HB3  LEU  28           2HB      LEU  28   1.996  -3.058   0.250
  187    HG   LEU  28           HG       LEU  28   1.708  -0.829   1.335
  188   HD11  LEU  28          1HD1      LEU  28  -0.598  -0.784  -0.415
  189   HD12  LEU  28          2HD1      LEU  28   0.171   0.529   0.477
  190   HD13  LEU  28          3HD1      LEU  28  -1.038  -0.484   1.267
  191   HD21  LEU  28          3HD2      LEU  28  -0.322  -1.693   2.765
  192   HD22  LEU  28          1HD2      LEU  28   1.236  -2.519   2.806
  193   HD23  LEU  28          2HD2      LEU  28  -0.077  -3.163   1.820
  194    H    ARG  29           H        ARG  29   4.126  -2.080  -0.020
  195    HA   ARG  29           HA       ARG  29   4.711   0.198   1.317
  196    HB2  ARG  29           1HB      ARG  29   6.580  -1.701  -0.094
  197    HB3  ARG  29           2HB      ARG  29   7.164  -0.393   0.926
  198    HG2  ARG  29           1HG      ARG  29   5.696  -1.380   2.756
  199    HG3  ARG  29           2HG      ARG  29   5.558  -2.799   1.715
  200    HD2  ARG  29           1HD      ARG  29   8.242  -1.658   2.391
  201    HD3  ARG  29           2HD      ARG  29   7.412  -2.724   3.525
  202    HE   ARG  29           HE       ARG  29   7.790  -4.502   2.103
  203   HH11  ARG  29          1HH1      ARG  29   8.650  -1.511   0.542
  204   HH12  ARG  29          2HH1      ARG  29   9.455  -2.283  -0.784
  205   HH21  ARG  29          1HH2      ARG  29   8.846  -5.530   0.363
  206   HH22  ARG  29          2HH2      ARG  29   9.565  -4.569  -0.885
  207    H    ILE  30           H        ILE  30   5.553  -0.453  -2.072
  208    HA   ILE  30           HA       ILE  30   6.951   1.893  -2.609
  209    HB   ILE  30           HB       ILE  30   5.177   0.335  -4.493
  210   HG12  ILE  30          1HG1      ILE  30   8.174   0.155  -4.223
  211   HG13  ILE  30          2HG1      ILE  30   7.092  -0.872  -3.289
  212   HG21  ILE  30          1HG2      ILE  30   6.013   2.765  -5.042
  213   HG22  ILE  30          2HG2      ILE  30   7.526   1.929  -5.386
  214   HG23  ILE  30          3HG2      ILE  30   6.060   1.492  -6.262
  215   HD11  ILE  30          3HD1      ILE  30   8.046  -1.243  -5.921
  216   HD12  ILE  30          1HD1      ILE  30   6.965  -2.276  -4.986
  217   HD13  ILE  30          2HD1      ILE  30   6.301  -1.001  -6.008
  218    H    HIS  31           H        HIS  31   3.488   1.267  -2.568
  219    HA   HIS  31           HA       HIS  31   2.815   3.871  -3.605
  220    HB2  HIS  31           1HB      HIS  31   1.238   2.226  -4.162
  221    HB3  HIS  31           2HB      HIS  31   1.227   1.554  -2.534
  222    HD1  HIS  31           HD1      HIS  31  -0.484   3.969  -4.694
  223    HD2  HIS  31           HD2      HIS  31  -0.215   3.181  -0.624
  224    HE1  HIS  31           HE1      HIS  31  -2.407   5.202  -3.642
  225    H    GLN  32           H        GLN  32   3.011   2.315  -0.461
  226    HA   GLN  32           HA       GLN  32   1.666   4.159   1.109
  227    HB2  GLN  32           1HB      GLN  32   4.169   2.626   1.831
  228    HB3  GLN  32           2HB      GLN  32   3.053   3.365   2.971
  229    HG2  GLN  32           1HG      GLN  32   1.292   1.850   1.780
  230    HG3  GLN  32           2HG      GLN  32   2.714   0.927   1.297
  231   HE21  GLN  32          1HE2      GLN  32   0.671   1.886   3.914
  232   HE22  GLN  32          2HE2      GLN  32   1.335   0.820   5.101
  233    H    LYS  33           H        LYS  33   5.190   4.062   0.546
  234    HA   LYS  33           HA       LYS  33   5.928   6.378   1.796
  235    HB2  LYS  33           1HB      LYS  33   7.849   6.457   0.321
  236    HB3  LYS  33           2HB      LYS  33   7.494   4.785   0.733
  237    HG2  LYS  33           1HG      LYS  33   7.837   4.547  -1.495
  238    HG3  LYS  33           2HG      LYS  33   6.109   4.906  -1.518
  239    HD2  LYS  33           1HD      LYS  33   6.950   6.333  -3.144
  240    HD3  LYS  33           2HD      LYS  33   6.870   7.373  -1.721
  241    HE2  LYS  33           1HE      LYS  33   9.225   7.087  -1.319
  242    HE3  LYS  33           2HE      LYS  33   9.341   5.892  -2.610
  243    HZ1  LYS  33           3HZ      LYS  33  10.143   7.932  -3.462
  244    HZ2  LYS  33           1HZ      LYS  33   8.807   8.795  -2.884
  245    HZ3  LYS  33           2HZ      LYS  33   8.618   7.696  -4.156
  246    H    CYS  34           H        CYS  34   4.547   6.041  -1.439
  247    HA   CYS  34           HA       CYS  34   4.860   8.465  -2.570
  248    HB2  CYS  34           1HB      CYS  34   3.419   6.483  -3.352
  249    HB3  CYS  34           2HB      CYS  34   2.112   7.239  -2.449
  250    HG   CYS  34           HG       CYS  34   1.470   8.133  -4.857
  251    H    HIS  35           H        HIS  35   2.445   7.719  -0.072
  252    HA   HIS  35           HA       HIS  35   1.261  10.248   0.065
  253    HB2  HIS  35           1HB      HIS  35   1.605   8.151   2.218
  254    HB3  HIS  35           2HB      HIS  35   0.558   9.560   2.362
  255    HD1  HIS  35           HD1      HIS  35  -1.455   9.657   0.567
  256    HD2  HIS  35           HD2      HIS  35   0.456   5.995   1.010
  257    HE1  HIS  35           HE1      HIS  35  -3.015   7.959  -0.437
  258    H    THR  36           H        THR  36   3.685   8.883   2.303
  259    HA   THR  36           HA       THR  36   4.245  11.442   3.459
  260    HB   THR  36           HB       THR  36   4.466   9.303   4.720
  261    HG1  THR  36           HG1      THR  36   6.993  10.573   4.648
  262   HG21  THR  36          3HG2      THR  36   7.057   8.502   4.103
  263   HG22  THR  36          1HG2      THR  36   6.276   8.710   2.536
  264   HG23  THR  36          2HG2      THR  36   5.570   7.628   3.737
  265    H    GLY  37           H        GLY  37   6.605  12.172   3.629
  266    HA2  GLY  37           1HA      GLY  37   8.782  12.104   2.438
  267    HA3  GLY  37           2HA      GLY  37   7.849  11.989   0.953
  268    H    GLU  38           H        GLU  38   6.686  14.065   3.454
  269    HA   GLU  38           HA       GLU  38   7.839  16.412   2.119
  270    HB2  GLU  38           1HB      GLU  38   4.944  15.792   2.563
  271    HB3  GLU  38           2HB      GLU  38   5.484  17.464   2.588
  272    HG2  GLU  38           1HG      GLU  38   6.184  17.388   0.350
  273    HG3  GLU  38           2HG      GLU  38   6.109  15.627   0.303
  274    H    ARG  39           H        ARG  39   7.460  18.437   3.435
  275    HA   ARG  39           HA       ARG  39   7.526  17.819   6.314
  276    HB2  ARG  39           1HB      ARG  39   9.279  19.713   4.749
  277    HB3  ARG  39           2HB      ARG  39   9.159  19.739   6.503
  278    HG2  ARG  39           1HG      ARG  39   9.830  17.275   6.405
  279    HG3  ARG  39           2HG      ARG  39  10.299  17.606   4.736
  280    HD2  ARG  39           1HD      ARG  39  12.265  17.905   5.975
  281    HD3  ARG  39           2HD      ARG  39  11.667  19.538   5.684
  282    HE   ARG  39           HE       ARG  39  10.823  18.364   8.184
  283   HH11  ARG  39          1HH1      ARG  39  13.222  20.280   6.542
  284   HH12  ARG  39          2HH1      ARG  39  13.780  21.056   7.987
  285   HH21  ARG  39          1HH2      ARG  39  11.549  19.379  10.093
  286   HH22  ARG  39          2HH2      ARG  39  12.828  20.542  10.006
  287    H    HIS  40           H        HIS  40   5.222  18.595   4.861
  288    HA   HIS  40           HA       HIS  40   4.743  21.258   6.026
  289    HB2  HIS  40           1HB      HIS  40   3.610  21.999   4.161
  290    HB3  HIS  40           2HB      HIS  40   4.825  20.973   3.404
  291    HD2  HIS  40           HD2      HIS  40   3.842  18.729   2.098
  292    HE1  HIS  40           HE1      HIS  40  -0.256  19.507   2.875
  293    HE2  HIS  40           HE2      HIS  40   1.389  18.031   1.666
  294    H    SER  41           H        SER  41   3.308  18.172   5.050
  295    HA   SER  41           HA       SER  41   0.775  18.580   6.201
  296    HB2  SER  41           1HB      SER  41   1.288  16.785   4.565
  297    HB3  SER  41           2HB      SER  41   2.229  15.953   5.803
  298    HG   SER  41           HG       SER  41   0.279  15.867   7.055
  299    H    GLY  42           H        GLY  42   3.530  16.682   7.455
  300    HA2  GLY  42           1HA      GLY  42   3.908  17.482   9.923
  301    HA3  GLY  42           2HA      GLY  42   2.315  16.767  10.120
  302    HA   PRO  43           HA       PRO  43   5.925  13.603  10.279
  303    HB2  PRO  43           1HB      PRO  43   6.395  13.534  12.952
  304    HB3  PRO  43           2HB      PRO  43   7.277  14.597  11.850
  305    HG2  PRO  43           1HG      PRO  43   4.959  15.224  13.638
  306    HG3  PRO  43           2HG      PRO  43   6.429  16.170  13.338
  307    HD2  PRO  43           1HD      PRO  43   4.064  16.739  12.150
  308    HD3  PRO  43           2HD      PRO  43   5.625  17.027  11.356
  309    H    SER  44           H        SER  44   3.129  14.261  12.295
  310    HA   SER  44           HA       SER  44   2.000  11.711  11.856
  311    HB2  SER  44           1HB      SER  44   3.914  11.398  13.665
  312    HB3  SER  44           2HB      SER  44   2.670  12.014  14.753
  313    HG   SER  44           HG       SER  44   2.057   9.944  12.954
  314    H    SER  45           H        SER  45   0.015  11.381  13.256
  315    HA   SER  45           HA       SER  45  -1.437  13.869  13.335
  316    HB2  SER  45           1HB      SER  45  -2.327  11.586  12.543
  317    HB3  SER  45           2HB      SER  45  -2.497  11.202  14.256
  318    HG   SER  45           HG       SER  45  -4.368  12.187  13.105
  319    H    GLY  46           H        GLY  46   0.545  14.073  15.174
  320    HA2  GLY  46           1HA      GLY  46  -0.992  14.307  17.639
  321    HA3  GLY  46           2HA      GLY  46   0.436  13.286  17.712
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1 -24.370  -1.869  -3.488
    2    HA2  GLY   1           1HA      GLY   1 -23.139  -4.184  -3.234
    3    HA3  GLY   1           2HA      GLY   1 -21.977  -3.157  -2.407
    4    H    SER   2           H        SER   2 -22.213  -4.005  -0.379
    5    HA   SER   2           HA       SER   2 -24.640  -3.237   1.027
    6    HB2  SER   2           1HB      SER   2 -23.605  -6.077   1.179
    7    HB3  SER   2           2HB      SER   2 -25.014  -5.420   2.011
    8    HG   SER   2           HG       SER   2 -26.140  -5.493   0.202
    9    H    SER   3           H        SER   3 -24.367  -3.751   3.449
   10    HA   SER   3           HA       SER   3 -21.797  -2.681   4.242
   11    HB2  SER   3           1HB      SER   3 -22.787  -2.341   6.404
   12    HB3  SER   3           2HB      SER   3 -23.988  -1.879   5.198
   13    HG   SER   3           HG       SER   3 -23.874  -4.405   6.489
   14    H    GLY   4           H        GLY   4 -20.223  -3.714   5.370
   15    HA2  GLY   4           1HA      GLY   4 -19.867  -5.620   7.018
   16    HA3  GLY   4           2HA      GLY   4 -20.611  -6.611   5.772
   17    H    SER   5           H        SER   5 -19.410  -7.312   4.064
   18    HA   SER   5           HA       SER   5 -16.531  -6.809   4.254
   19    HB2  SER   5           1HB      SER   5 -17.362  -9.164   4.294
   20    HB3  SER   5           2HB      SER   5 -17.977  -8.936   2.658
   21    HG   SER   5           HG       SER   5 -15.533  -9.624   3.392
   22    H    SER   6           H        SER   6 -16.289  -4.869   3.188
   23    HA   SER   6           HA       SER   6 -17.434  -3.790   1.036
   24    HB2  SER   6           1HB      SER   6 -14.539  -3.897   1.812
   25    HB3  SER   6           2HB      SER   6 -15.014  -3.080   0.323
   26    HG   SER   6           HG       SER   6 -16.667  -2.112   1.971
   27    H    GLY   7           H        GLY   7 -14.737  -6.111   0.731
   28    HA2  GLY   7           1HA      GLY   7 -14.086  -7.438  -1.029
   29    HA3  GLY   7           2HA      GLY   7 -15.810  -7.688  -1.259
   30    H    THR   8           H        THR   8 -13.905  -4.724  -1.651
   31    HA   THR   8           HA       THR   8 -14.905  -4.555  -4.409
   32    HB   THR   8           HB       THR   8 -15.454  -2.652  -2.937
   33    HG1  THR   8           HG1      THR   8 -14.143  -1.075  -4.410
   34   HG21  THR   8          3HG2      THR   8 -13.918  -1.405  -1.795
   35   HG22  THR   8          1HG2      THR   8 -12.631  -1.725  -2.956
   36   HG23  THR   8          2HG2      THR   8 -13.080  -2.956  -1.776
   37    H    GLY   9           H        GLY   9 -12.018  -4.791  -2.496
   38    HA2  GLY   9           1HA      GLY   9 -10.313  -4.188  -4.798
   39    HA3  GLY   9           2HA      GLY   9  -9.772  -4.426  -3.143
   40    H    GLU  10           H        GLU  10 -10.892  -6.851  -2.513
   41    HA   GLU  10           HA       GLU  10 -10.718  -9.112  -2.802
   42    HB2  GLU  10           1HB      GLU  10 -11.439  -8.467  -5.216
   43    HB3  GLU  10           2HB      GLU  10  -9.747  -8.725  -5.616
   44    HG2  GLU  10           1HG      GLU  10 -10.730 -10.762  -6.096
   45    HG3  GLU  10           2HG      GLU  10 -10.041 -11.013  -4.493
   46    H    LYS  11           H        LYS  11  -8.612  -7.529  -1.780
   47    HA   LYS  11           HA       LYS  11  -6.346  -9.281  -2.408
   48    HB2  LYS  11           1HB      LYS  11  -6.398  -6.288  -2.491
   49    HB3  LYS  11           2HB      LYS  11  -4.923  -7.110  -1.998
   50    HG2  LYS  11           1HG      LYS  11  -4.520  -6.939  -4.222
   51    HG3  LYS  11           2HG      LYS  11  -5.379  -8.481  -4.215
   52    HD2  LYS  11           1HD      LYS  11  -7.495  -7.152  -4.626
   53    HD3  LYS  11           2HD      LYS  11  -6.453  -5.759  -4.928
   54    HE2  LYS  11           1HE      LYS  11  -5.376  -6.906  -6.755
   55    HE3  LYS  11           2HE      LYS  11  -6.270  -8.384  -6.401
   56    HZ1  LYS  11           3HZ      LYS  11  -8.209  -6.498  -6.720
   57    HZ2  LYS  11           1HZ      LYS  11  -7.743  -7.645  -7.873
   58    HZ3  LYS  11           2HZ      LYS  11  -7.076  -6.091  -7.908
   59    HA   PRO  12           HA       PRO  12  -6.034  -9.647   1.965
   60    HB2  PRO  12           1HB      PRO  12  -3.426 -10.370   2.174
   61    HB3  PRO  12           2HB      PRO  12  -4.679 -11.460   1.571
   62    HG2  PRO  12           1HG      PRO  12  -2.702  -9.816   0.039
   63    HG3  PRO  12           2HG      PRO  12  -3.212 -11.492  -0.232
   64    HD2  PRO  12           1HD      PRO  12  -4.180  -9.422  -1.684
   65    HD3  PRO  12           2HD      PRO  12  -5.150 -10.862  -1.309
   66    H    TYR  13           H        TYR  13  -4.360  -7.301   0.175
   67    HA   TYR  13           HA       TYR  13  -3.476  -5.967   2.650
   68    HB2  TYR  13           1HB      TYR  13  -2.315  -5.563  -0.111
   69    HB3  TYR  13           2HB      TYR  13  -1.704  -4.907   1.404
   70    HD1  TYR  13           HD1      TYR  13  -1.202  -6.811   3.236
   71    HD2  TYR  13           HD2      TYR  13  -1.212  -7.387  -0.980
   72    HE1  TYR  13           HE1      TYR  13   0.248  -8.779   3.507
   73    HE2  TYR  13           HE2      TYR  13   0.237  -9.358  -0.720
   74    HH   TYR  13           HH       TYR  13   1.711 -10.372   0.790
   75    H    LYS  14           H        LYS  14  -3.511  -3.590   2.567
   76    HA   LYS  14           HA       LYS  14  -4.982  -2.192   0.591
   77    HB2  LYS  14           1HB      LYS  14  -6.817  -3.500   1.703
   78    HB3  LYS  14           2HB      LYS  14  -6.459  -2.630   3.189
   79    HG2  LYS  14           1HG      LYS  14  -6.828  -0.514   1.721
   80    HG3  LYS  14           2HG      LYS  14  -7.689  -1.634   0.662
   81    HD2  LYS  14           1HD      LYS  14  -9.407  -0.933   2.010
   82    HD3  LYS  14           2HD      LYS  14  -8.854  -2.348   2.910
   83    HE2  LYS  14           1HE      LYS  14  -7.345  -0.712   4.178
   84    HE3  LYS  14           2HE      LYS  14  -8.348   0.557   3.478
   85    HZ1  LYS  14           3HZ      LYS  14  -9.484  -1.706   5.014
   86    HZ2  LYS  14           1HZ      LYS  14 -10.241  -0.256   4.582
   87    HZ3  LYS  14           2HZ      LYS  14  -9.014  -0.255   5.746
   88    H    CYS  15           H        CYS  15  -3.998  -0.291   0.631
   89    HA   CYS  15           HA       CYS  15  -2.408   0.676   2.699
   90    HB2  CYS  15           1HB      CYS  15  -2.456   1.406   0.250
   91    HB3  CYS  15           2HB      CYS  15  -3.801   2.450   0.697
   92    H    SER  16           H        SER  16  -3.036   1.195   4.682
   93    HA   SER  16           HA       SER  16  -5.726   2.098   5.222
   94    HB2  SER  16           1HB      SER  16  -4.967   2.103   7.598
   95    HB3  SER  16           2HB      SER  16  -4.700   0.558   6.791
   96    HG   SER  16           HG       SER  16  -2.614   2.368   6.641
   97    H    ASP  17           H        ASP  17  -4.308   3.874   3.570
   98    HA   ASP  17           HA       ASP  17  -4.175   6.228   5.329
   99    HB2  ASP  17           1HB      ASP  17  -2.319   5.562   3.036
  100    HB3  ASP  17           2HB      ASP  17  -2.394   7.139   3.817
  101    H    CYS  18           H        CYS  18  -4.673   5.006   2.045
  102    HA   CYS  18           HA       CYS  18  -6.311   7.390   1.479
  103    HB2  CYS  18           1HB      CYS  18  -5.922   6.785  -0.944
  104    HB3  CYS  18           2HB      CYS  18  -4.494   7.323  -0.065
  105    H    GLY  19           H        GLY  19  -6.073   3.901   0.783
  106    HA2  GLY  19           1HA      GLY  19  -8.121   2.615   1.419
  107    HA3  GLY  19           2HA      GLY  19  -9.021   3.863   0.570
  108    H    LYS  20           H        LYS  20  -6.036   2.166  -0.337
  109    HA   LYS  20           HA       LYS  20  -7.421   1.252  -2.773
  110    HB2  LYS  20           1HB      LYS  20  -4.697   2.353  -2.303
  111    HB3  LYS  20           2HB      LYS  20  -4.857   1.088  -3.515
  112    HG2  LYS  20           1HG      LYS  20  -4.995   3.278  -4.537
  113    HG3  LYS  20           2HG      LYS  20  -6.533   2.425  -4.690
  114    HD2  LYS  20           1HD      LYS  20  -7.326   3.673  -2.668
  115    HD3  LYS  20           2HD      LYS  20  -5.842   4.626  -2.748
  116    HE2  LYS  20           1HE      LYS  20  -7.929   4.416  -4.917
  117    HE3  LYS  20           2HE      LYS  20  -7.720   5.779  -3.818
  118    HZ1  LYS  20           3HZ      LYS  20  -6.184   6.611  -5.156
  119    HZ2  LYS  20           1HZ      LYS  20  -6.463   5.358  -6.258
  120    HZ3  LYS  20           2HZ      LYS  20  -5.266   5.192  -5.074
  121    H    SER  21           H        SER  21  -6.597  -0.780  -3.705
  122    HA   SER  21           HA       SER  21  -5.831  -2.661  -1.572
  123    HB2  SER  21           1HB      SER  21  -6.919  -4.403  -3.003
  124    HB3  SER  21           2HB      SER  21  -8.034  -3.161  -2.434
  125    HG   SER  21           HG       SER  21  -7.905  -2.182  -4.465
  126    H    PHE  22           H        PHE  22  -4.264  -4.221  -1.968
  127    HA   PHE  22           HA       PHE  22  -2.833  -4.109  -4.515
  128    HB2  PHE  22           1HB      PHE  22  -1.405  -3.891  -1.860
  129    HB3  PHE  22           2HB      PHE  22  -0.678  -3.837  -3.463
  130    HD1  PHE  22           HD1      PHE  22  -3.380  -2.072  -1.583
  131    HD2  PHE  22           HD2      PHE  22  -0.047  -1.771  -4.213
  132    HE1  PHE  22           HE1      PHE  22  -3.620   0.377  -1.602
  133    HE2  PHE  22           HE2      PHE  22  -0.281   0.678  -4.235
  134    HZ   PHE  22           HZ       PHE  22  -2.069   1.755  -2.928
  135    H    THR  23           H        THR  23  -2.148  -6.051  -5.197
  136    HA   THR  23           HA       THR  23  -2.921  -8.390  -3.759
  137    HB   THR  23           HB       THR  23  -1.153  -8.247  -6.207
  138    HG1  THR  23           HG1      THR  23  -3.155  -8.509  -7.342
  139   HG21  THR  23          3HG2      THR  23  -1.574 -10.411  -4.718
  140   HG22  THR  23          1HG2      THR  23  -1.486 -10.491  -6.477
  141   HG23  THR  23          2HG2      THR  23  -3.055 -10.466  -5.673
  142    H    TRP  24           H        TRP  24   0.203  -6.912  -4.563
  143    HA   TRP  24           HA       TRP  24   1.553  -8.862  -2.842
  144    HB2  TRP  24           1HB      TRP  24   2.511  -6.957  -4.962
  145    HB3  TRP  24           2HB      TRP  24   3.636  -7.662  -3.806
  146    HD1  TRP  24           HD1      TRP  24   1.406  -8.605  -6.768
  147    HE1  TRP  24           HE1      TRP  24   2.115 -10.926  -7.625
  148    HE3  TRP  24           HE3      TRP  24   4.722  -9.852  -3.083
  149    HZ2  TRP  24           HZ2      TRP  24   3.850 -13.010  -6.841
  150    HZ3  TRP  24           HZ3      TRP  24   5.864 -12.028  -3.210
  151    HH2  TRP  24           HH2      TRP  24   5.435 -13.573  -5.051
  152    H    LYS  25           H        LYS  25   2.608  -8.306  -0.994
  153    HA   LYS  25           HA       LYS  25   1.804  -5.975   0.376
  154    HB2  LYS  25           1HB      LYS  25   2.527  -8.192   1.385
  155    HB3  LYS  25           2HB      LYS  25   4.185  -7.690   1.078
  156    HG2  LYS  25           1HG      LYS  25   4.132  -6.050   2.685
  157    HG3  LYS  25           2HG      LYS  25   2.376  -5.885   2.612
  158    HD2  LYS  25           1HD      LYS  25   2.982  -6.947   4.688
  159    HD3  LYS  25           2HD      LYS  25   2.169  -8.125   3.655
  160    HE2  LYS  25           1HE      LYS  25   4.100  -9.315   3.265
  161    HE3  LYS  25           2HE      LYS  25   5.143  -7.926   3.566
  162    HZ1  LYS  25           3HZ      LYS  25   4.763  -9.917   5.305
  163    HZ2  LYS  25           1HZ      LYS  25   3.593  -8.819   5.843
  164    HZ3  LYS  25           2HZ      LYS  25   5.215  -8.350   5.754
  165    H    SER  26           H        SER  26   4.893  -6.884  -1.124
  166    HA   SER  26           HA       SER  26   6.390  -4.660  -0.421
  167    HB2  SER  26           1HB      SER  26   7.327  -6.663  -1.524
  168    HB3  SER  26           2HB      SER  26   6.528  -6.199  -3.026
  169    HG   SER  26           HG       SER  26   7.797  -4.093  -2.496
  170    H    ARG  27           H        ARG  27   4.378  -5.136  -3.315
  171    HA   ARG  27           HA       ARG  27   4.833  -2.767  -4.626
  172    HB2  ARG  27           1HB      ARG  27   2.163  -4.160  -4.354
  173    HB3  ARG  27           2HB      ARG  27   2.611  -3.022  -5.617
  174    HG2  ARG  27           1HG      ARG  27   4.019  -5.639  -5.155
  175    HG3  ARG  27           2HG      ARG  27   2.680  -5.425  -6.285
  176    HD2  ARG  27           1HD      ARG  27   3.948  -3.833  -7.566
  177    HD3  ARG  27           2HD      ARG  27   5.248  -3.850  -6.376
  178    HE   ARG  27           HE       ARG  27   4.742  -5.812  -8.432
  179   HH11  ARG  27          1HH1      ARG  27   6.326  -5.124  -5.409
  180   HH12  ARG  27          2HH1      ARG  27   7.516  -6.369  -5.599
  181   HH21  ARG  27          1HH2      ARG  27   6.303  -7.454  -8.694
  182   HH22  ARG  27          2HH2      ARG  27   7.502  -7.693  -7.469
  183    H    LEU  28           H        LEU  28   2.388  -3.367  -2.109
  184    HA   LEU  28           HA       LEU  28   1.213  -0.875  -2.011
  185    HB2  LEU  28           1HB      LEU  28   0.229  -2.557  -0.723
  186    HB3  LEU  28           2HB      LEU  28   1.743  -2.941   0.094
  187    HG   LEU  28           HG       LEU  28   1.548  -0.670   1.213
  188   HD11  LEU  28          1HD1      LEU  28  -0.414   0.537   1.147
  189   HD12  LEU  28          2HD1      LEU  28  -1.364  -0.834   0.576
  190   HD13  LEU  28          3HD1      LEU  28  -0.267  -0.003  -0.526
  191   HD21  LEU  28          3HD2      LEU  28  -0.101  -3.078   1.707
  192   HD22  LEU  28          1HD2      LEU  28  -0.498  -1.629   2.630
  193   HD23  LEU  28          2HD2      LEU  28   1.126  -2.313   2.718
  194    H    ARG  29           H        ARG  29   4.020  -1.995  -0.123
  195    HA   ARG  29           HA       ARG  29   4.560   0.272   1.325
  196    HB2  ARG  29           1HB      ARG  29   6.335  -1.836   0.143
  197    HB3  ARG  29           2HB      ARG  29   7.041  -0.468   0.992
  198    HG2  ARG  29           1HG      ARG  29   5.297  -1.167   2.845
  199    HG3  ARG  29           2HG      ARG  29   5.436  -2.731   2.039
  200    HD2  ARG  29           1HD      ARG  29   8.021  -2.168   2.227
  201    HD3  ARG  29           2HD      ARG  29   7.455  -1.194   3.583
  202    HE   ARG  29           HE       ARG  29   7.532  -4.074   3.418
  203   HH11  ARG  29          1HH1      ARG  29   6.166  -1.300   5.017
  204   HH12  ARG  29          2HH1      ARG  29   5.758  -2.170   6.459
  205   HH21  ARG  29          1HH2      ARG  29   7.000  -5.230   5.311
  206   HH22  ARG  29          2HH2      ARG  29   6.234  -4.404   6.626
  207    H    ILE  30           H        ILE  30   5.626  -0.463  -1.981
  208    HA   ILE  30           HA       ILE  30   7.119   1.893  -2.371
  209    HB   ILE  30           HB       ILE  30   5.700   0.250  -4.471
  210   HG12  ILE  30          1HG1      ILE  30   8.605  -0.010  -3.778
  211   HG13  ILE  30          2HG1      ILE  30   7.402  -0.862  -2.815
  212   HG21  ILE  30          1HG2      ILE  30   6.367   2.335  -5.402
  213   HG22  ILE  30          2HG2      ILE  30   7.947   2.246  -4.624
  214   HG23  ILE  30          3HG2      ILE  30   7.542   1.131  -5.929
  215   HD11  ILE  30          3HD1      ILE  30   8.251  -1.300  -5.620
  216   HD12  ILE  30          1HD1      ILE  30   7.899  -2.466  -4.345
  217   HD13  ILE  30          2HD1      ILE  30   6.578  -1.655  -5.188
  218    H    HIS  31           H        HIS  31   3.747   1.335  -2.267
  219    HA   HIS  31           HA       HIS  31   3.101   3.740  -3.781
  220    HB2  HIS  31           1HB      HIS  31   1.477   2.212  -4.301
  221    HB3  HIS  31           2HB      HIS  31   1.574   1.414  -2.734
  222    HD1  HIS  31           HD1      HIS  31  -0.352   3.900  -4.622
  223    HD2  HIS  31           HD2      HIS  31   0.116   2.783  -0.647
  224    HE1  HIS  31           HE1      HIS  31  -2.297   4.926  -3.401
  225    H    GLN  32           H        GLN  32   2.285   2.454  -0.551
  226    HA   GLN  32           HA       GLN  32   1.242   4.779   0.526
  227    HB2  GLN  32           1HB      GLN  32   1.398   3.755   2.618
  228    HB3  GLN  32           2HB      GLN  32   1.329   2.395   1.505
  229    HG2  GLN  32           1HG      GLN  32   3.669   2.016   1.700
  230    HG3  GLN  32           2HG      GLN  32   3.895   3.518   2.593
  231   HE21  GLN  32          1HE2      GLN  32   2.953   0.213   2.747
  232   HE22  GLN  32          2HE2      GLN  32   2.763   0.120   4.461
  233    H    LYS  33           H        LYS  33   4.581   3.805   0.131
  234    HA   LYS  33           HA       LYS  33   5.753   5.738   1.821
  235    HB2  LYS  33           1HB      LYS  33   7.827   5.180   0.777
  236    HB3  LYS  33           2HB      LYS  33   6.890   3.697   0.897
  237    HG2  LYS  33           1HG      LYS  33   6.413   3.683  -1.401
  238    HG3  LYS  33           2HG      LYS  33   6.922   5.362  -1.599
  239    HD2  LYS  33           1HD      LYS  33   8.756   3.093  -0.830
  240    HD3  LYS  33           2HD      LYS  33   8.565   3.716  -2.470
  241    HE2  LYS  33           1HE      LYS  33   9.206   5.980  -1.537
  242    HE3  LYS  33           2HE      LYS  33   9.666   5.139  -0.058
  243    HZ1  LYS  33           3HZ      LYS  33  11.398   5.595  -1.945
  244    HZ2  LYS  33           1HZ      LYS  33  10.754   4.175  -2.601
  245    HZ3  LYS  33           2HZ      LYS  33  11.444   4.155  -1.058
  246    H    CYS  34           H        CYS  34   4.300   5.962  -1.273
  247    HA   CYS  34           HA       CYS  34   5.697   8.281  -2.185
  248    HB2  CYS  34           1HB      CYS  34   4.497   6.669  -3.680
  249    HB3  CYS  34           2HB      CYS  34   2.976   7.287  -3.049
  250    HG   CYS  34           HG       CYS  34   2.759   9.068  -4.872
  251    H    HIS  35           H        HIS  35   2.729   7.696  -0.390
  252    HA   HIS  35           HA       HIS  35   1.386  10.030  -0.459
  253    HB2  HIS  35           1HB      HIS  35   2.033   8.308   1.929
  254    HB3  HIS  35           2HB      HIS  35   0.937   9.682   2.034
  255    HD1  HIS  35           HD1      HIS  35  -0.780   9.379  -0.401
  256    HD2  HIS  35           HD2      HIS  35   0.431   6.134   1.894
  257    HE1  HIS  35           HE1      HIS  35  -2.455   7.563  -0.868
  258    H    THR  36           H        THR  36   4.315   9.444   1.454
  259    HA   THR  36           HA       THR  36   4.628  11.635   2.954
  260    HB   THR  36           HB       THR  36   7.049  11.584   2.544
  261    HG1  THR  36           HG1      THR  36   7.637  11.079   0.579
  262   HG21  THR  36          3HG2      THR  36   6.999   8.810   2.549
  263   HG22  THR  36          1HG2      THR  36   5.421   9.268   3.190
  264   HG23  THR  36          2HG2      THR  36   6.893   9.861   3.961
  265    H    GLY  37           H        GLY  37   4.231  13.717   2.607
  266    HA2  GLY  37           1HA      GLY  37   5.229  15.707   1.473
  267    HA3  GLY  37           2HA      GLY  37   4.941  14.846  -0.031
  268    H    GLU  38           H        GLU  38   2.567  14.149  -0.313
  269    HA   GLU  38           HA       GLU  38   0.959  16.545   0.050
  270    HB2  GLU  38           1HB      GLU  38   0.799  14.122  -1.685
  271    HB3  GLU  38           2HB      GLU  38  -0.679  15.014  -1.355
  272    HG2  GLU  38           1HG      GLU  38   0.377  17.054  -2.220
  273    HG3  GLU  38           2HG      GLU  38   1.828  16.126  -2.594
  274    H    ARG  39           H        ARG  39  -1.405  16.226   0.569
  275    HA   ARG  39           HA       ARG  39  -1.820  14.091   2.543
  276    HB2  ARG  39           1HB      ARG  39  -1.201  16.491   3.451
  277    HB3  ARG  39           2HB      ARG  39  -2.894  16.822   3.108
  278    HG2  ARG  39           1HG      ARG  39  -2.238  14.385   4.672
  279    HG3  ARG  39           2HG      ARG  39  -2.094  15.955   5.465
  280    HD2  ARG  39           1HD      ARG  39  -4.422  16.460   4.756
  281    HD3  ARG  39           2HD      ARG  39  -4.542  14.819   4.122
  282    HE   ARG  39           HE       ARG  39  -4.815  14.052   6.261
  283   HH11  ARG  39          1HH1      ARG  39  -3.580  17.305   6.365
  284   HH12  ARG  39          2HH1      ARG  39  -3.771  17.462   8.080
  285   HH21  ARG  39          1HH2      ARG  39  -5.071  14.246   8.519
  286   HH22  ARG  39          2HH2      ARG  39  -4.618  15.721   9.304
  287    H    HIS  40           H        HIS  40  -3.738  13.103   2.381
  288    HA   HIS  40           HA       HIS  40  -6.062  14.447   1.333
  289    HB2  HIS  40           1HB      HIS  40  -5.272  13.903  -0.798
  290    HB3  HIS  40           2HB      HIS  40  -4.588  12.372  -0.259
  291    HD2  HIS  40           HD2      HIS  40  -6.049  10.341  -1.251
  292    HE1  HIS  40           HE1      HIS  40  -9.849  12.227  -1.202
  293    HE2  HIS  40           HE2      HIS  40  -8.589  10.098  -1.676
  294    H    SER  41           H        SER  41  -7.583  13.840   2.713
  295    HA   SER  41           HA       SER  41  -8.377  11.156   3.051
  296    HB2  SER  41           1HB      SER  41  -6.410  10.944   4.458
  297    HB3  SER  41           2HB      SER  41  -6.868  12.380   5.373
  298    HG   SER  41           HG       SER  41  -8.807  11.187   5.955
  299    H    GLY  42           H        GLY  42 -10.384  10.998   4.010
  300    HA2  GLY  42           1HA      GLY  42 -11.470  13.263   5.472
  301    HA3  GLY  42           2HA      GLY  42 -12.202  12.956   3.904
  302    HA   PRO  43           HA       PRO  43 -14.991  10.212   5.902
  303    HB2  PRO  43           1HB      PRO  43 -15.758   8.732   3.760
  304    HB3  PRO  43           2HB      PRO  43 -16.292  10.397   4.017
  305    HG2  PRO  43           1HG      PRO  43 -14.109   9.359   2.251
  306    HG3  PRO  43           2HG      PRO  43 -15.328  10.601   1.911
  307    HD2  PRO  43           1HD      PRO  43 -12.781  11.209   2.598
  308    HD3  PRO  43           2HD      PRO  43 -14.160  12.235   3.041
  309    H    SER  44           H        SER  44 -14.479   8.551   7.168
  310    HA   SER  44           HA       SER  44 -12.318   6.781   6.557
  311    HB2  SER  44           1HB      SER  44 -14.345   6.792   8.803
  312    HB3  SER  44           2HB      SER  44 -13.000   5.656   8.701
  313    HG   SER  44           HG       SER  44 -12.406   7.415   9.972
  314    H    SER  45           H        SER  45 -12.610   4.364   6.799
  315    HA   SER  45           HA       SER  45 -15.056   3.495   5.401
  316    HB2  SER  45           1HB      SER  45 -12.181   2.773   4.908
  317    HB3  SER  45           2HB      SER  45 -13.471   1.658   4.460
  318    HG   SER  45           HG       SER  45 -14.368   3.357   3.195
  319    H    GLY  46           H        GLY  46 -12.304   2.235   7.296
  320    HA2  GLY  46           1HA      GLY  46 -12.289   0.824   9.120
  321    HA3  GLY  46           2HA      GLY  46 -14.036   0.997   9.206
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1 -22.161   5.633   6.888
    2    HA2  GLY   1           1HA      GLY   1 -22.952   3.091   7.803
    3    HA3  GLY   1           2HA      GLY   1 -23.475   3.844   6.304
    4    H    SER   2           H        SER   2 -21.049   1.791   7.792
    5    HA   SER   2           HA       SER   2 -19.499   1.260   5.516
    6    HB2  SER   2           1HB      SER   2 -18.791  -0.792   6.733
    7    HB3  SER   2           2HB      SER   2 -18.720   0.655   7.737
    8    HG   SER   2           HG       SER   2 -20.818  -1.258   7.719
    9    H    SER   3           H        SER   3 -19.508  -0.464   4.048
   10    HA   SER   3           HA       SER   3 -21.636  -2.384   3.998
   11    HB2  SER   3           1HB      SER   3 -22.843  -1.637   2.109
   12    HB3  SER   3           2HB      SER   3 -22.654  -0.199   3.111
   13    HG   SER   3           HG       SER   3 -21.577  -0.792   0.636
   14    H    GLY   4           H        GLY   4 -21.275  -4.050   2.522
   15    HA2  GLY   4           1HA      GLY   4 -18.750  -4.841   1.950
   16    HA3  GLY   4           2HA      GLY   4 -20.124  -5.307   0.959
   17    H    SER   5           H        SER   5 -17.303  -4.748   0.246
   18    HA   SER   5           HA       SER   5 -17.460  -2.316  -1.334
   19    HB2  SER   5           1HB      SER   5 -15.237  -4.362  -1.120
   20    HB3  SER   5           2HB      SER   5 -15.124  -2.796  -1.922
   21    HG   SER   5           HG       SER   5 -14.579  -2.061  -0.040
   22    H    SER   6           H        SER   6 -18.804  -2.565  -3.037
   23    HA   SER   6           HA       SER   6 -18.809  -4.990  -4.608
   24    HB2  SER   6           1HB      SER   6 -20.352  -2.412  -4.700
   25    HB3  SER   6           2HB      SER   6 -20.420  -3.544  -6.050
   26    HG   SER   6           HG       SER   6 -22.009  -3.711  -4.186
   27    H    GLY   7           H        GLY   7 -17.217  -5.353  -6.006
   28    HA2  GLY   7           1HA      GLY   7 -16.636  -4.378  -8.337
   29    HA3  GLY   7           2HA      GLY   7 -15.975  -3.065  -7.373
   30    H    THR   8           H        THR   8 -13.964  -3.609  -8.482
   31    HA   THR   8           HA       THR   8 -12.688  -6.120  -7.946
   32    HB   THR   8           HB       THR   8 -10.650  -4.991  -8.897
   33    HG1  THR   8           HG1      THR   8 -10.934  -2.854  -8.524
   34   HG21  THR   8          3HG2      THR   8 -12.359  -4.366 -11.060
   35   HG22  THR   8          1HG2      THR   8 -13.097  -5.709 -10.189
   36   HG23  THR   8          2HG2      THR   8 -11.445  -5.849 -10.792
   37    H    GLY   9           H        GLY   9 -12.446  -6.459  -5.770
   38    HA2  GLY   9           1HA      GLY   9 -10.259  -5.138  -4.490
   39    HA3  GLY   9           2HA      GLY   9 -11.799  -4.657  -3.793
   40    H    GLU  10           H        GLU  10 -10.112  -7.641  -4.782
   41    HA   GLU  10           HA       GLU  10 -11.071  -8.871  -2.282
   42    HB2  GLU  10           1HB      GLU  10 -10.841 -10.015  -5.051
   43    HB3  GLU  10           2HB      GLU  10 -10.807 -11.062  -3.639
   44    HG2  GLU  10           1HG      GLU  10 -12.995 -10.195  -2.955
   45    HG3  GLU  10           2HG      GLU  10 -13.031  -9.181  -4.397
   46    H    LYS  11           H        LYS  11  -8.711  -7.458  -2.312
   47    HA   LYS  11           HA       LYS  11  -6.621  -9.526  -2.419
   48    HB2  LYS  11           1HB      LYS  11  -6.617  -6.576  -2.803
   49    HB3  LYS  11           2HB      LYS  11  -5.191  -7.295  -2.066
   50    HG2  LYS  11           1HG      LYS  11  -4.669  -7.266  -4.319
   51    HG3  LYS  11           2HG      LYS  11  -5.241  -8.916  -4.064
   52    HD2  LYS  11           1HD      LYS  11  -6.378  -8.327  -5.981
   53    HD3  LYS  11           2HD      LYS  11  -7.556  -7.910  -4.735
   54    HE2  LYS  11           1HE      LYS  11  -7.443  -6.110  -6.318
   55    HE3  LYS  11           2HE      LYS  11  -6.719  -5.574  -4.803
   56    HZ1  LYS  11           3HZ      LYS  11  -4.710  -6.701  -6.394
   57    HZ2  LYS  11           1HZ      LYS  11  -4.874  -5.092  -5.896
   58    HZ3  LYS  11           2HZ      LYS  11  -5.570  -5.602  -7.350
   59    HA   PRO  12           HA       PRO  12  -6.418  -9.621   1.977
   60    HB2  PRO  12           1HB      PRO  12  -3.867 -10.501   2.276
   61    HB3  PRO  12           2HB      PRO  12  -5.185 -11.544   1.729
   62    HG2  PRO  12           1HG      PRO  12  -3.084 -10.145   0.120
   63    HG3  PRO  12           2HG      PRO  12  -3.703 -11.799  -0.045
   64    HD2  PRO  12           1HD      PRO  12  -4.513  -9.773  -1.649
   65    HD3  PRO  12           2HD      PRO  12  -5.582 -11.115  -1.192
   66    H    TYR  13           H        TYR  13  -4.642  -7.482   0.064
   67    HA   TYR  13           HA       TYR  13  -3.620  -6.083   2.448
   68    HB2  TYR  13           1HB      TYR  13  -2.542  -5.904  -0.372
   69    HB3  TYR  13           2HB      TYR  13  -1.867  -5.134   1.060
   70    HD1  TYR  13           HD1      TYR  13  -0.704  -6.473   2.760
   71    HD2  TYR  13           HD2      TYR  13  -2.160  -8.234  -0.829
   72    HE1  TYR  13           HE1      TYR  13   0.708  -8.447   3.163
   73    HE2  TYR  13           HE2      TYR  13  -0.753 -10.213  -0.436
   74    HH   TYR  13           HH       TYR  13   0.793 -10.809   2.533
   75    H    LYS  14           H        LYS  14  -3.831  -3.824   2.534
   76    HA   LYS  14           HA       LYS  14  -5.137  -2.340   0.471
   77    HB2  LYS  14           1HB      LYS  14  -7.046  -3.613   1.455
   78    HB3  LYS  14           2HB      LYS  14  -6.716  -2.840   3.000
   79    HG2  LYS  14           1HG      LYS  14  -7.045  -0.630   1.807
   80    HG3  LYS  14           2HG      LYS  14  -7.687  -1.571   0.458
   81    HD2  LYS  14           1HD      LYS  14  -9.573  -0.943   1.708
   82    HD3  LYS  14           2HD      LYS  14  -9.268  -2.621   2.164
   83    HE2  LYS  14           1HE      LYS  14  -8.134  -1.874   4.188
   84    HE3  LYS  14           2HE      LYS  14  -8.387  -0.192   3.724
   85    HZ1  LYS  14           3HZ      LYS  14 -10.003  -1.161   5.379
   86    HZ2  LYS  14           1HZ      LYS  14 -10.635  -2.079   4.105
   87    HZ3  LYS  14           2HZ      LYS  14 -10.689  -0.390   4.038
   88    H    CYS  15           H        CYS  15  -4.443  -0.310   0.615
   89    HA   CYS  15           HA       CYS  15  -2.811   0.559   2.755
   90    HB2  CYS  15           1HB      CYS  15  -2.334   1.504   0.650
   91    HB3  CYS  15           2HB      CYS  15  -4.016   1.946   0.371
   92    H    SER  16           H        SER  16  -3.162   2.153   4.319
   93    HA   SER  16           HA       SER  16  -5.978   2.467   5.076
   94    HB2  SER  16           1HB      SER  16  -5.107   3.017   7.322
   95    HB3  SER  16           2HB      SER  16  -4.531   1.446   6.767
   96    HG   SER  16           HG       SER  16  -3.133   3.854   7.079
   97    H    ASP  17           H        ASP  17  -3.126   4.244   4.182
   98    HA   ASP  17           HA       ASP  17  -3.711   6.789   5.094
   99    HB2  ASP  17           1HB      ASP  17  -2.415   5.994   2.479
  100    HB3  ASP  17           2HB      ASP  17  -2.363   7.609   3.180
  101    H    CYS  18           H        CYS  18  -4.566   5.422   1.912
  102    HA   CYS  18           HA       CYS  18  -6.680   7.462   1.708
  103    HB2  CYS  18           1HB      CYS  18  -6.560   7.120  -0.734
  104    HB3  CYS  18           2HB      CYS  18  -5.019   7.649  -0.066
  105    H    GLY  19           H        GLY  19  -5.932   4.063   0.976
  106    HA2  GLY  19           1HA      GLY  19  -7.618   2.445   1.831
  107    HA3  GLY  19           2HA      GLY  19  -8.831   3.510   1.136
  108    H    LYS  20           H        LYS  20  -5.751   2.420  -0.241
  109    HA   LYS  20           HA       LYS  20  -7.197   1.520  -2.613
  110    HB2  LYS  20           1HB      LYS  20  -4.408   2.355  -2.021
  111    HB3  LYS  20           2HB      LYS  20  -4.627   1.159  -3.292
  112    HG2  LYS  20           1HG      LYS  20  -6.356   3.558  -3.389
  113    HG3  LYS  20           2HG      LYS  20  -4.643   3.776  -3.756
  114    HD2  LYS  20           1HD      LYS  20  -5.390   3.263  -5.845
  115    HD3  LYS  20           2HD      LYS  20  -5.089   1.627  -5.255
  116    HE2  LYS  20           1HE      LYS  20  -7.249   1.701  -6.317
  117    HE3  LYS  20           2HE      LYS  20  -7.465   1.478  -4.582
  118    HZ1  LYS  20           3HZ      LYS  20  -7.948   3.835  -4.373
  119    HZ2  LYS  20           1HZ      LYS  20  -9.013   3.107  -5.468
  120    HZ3  LYS  20           2HZ      LYS  20  -7.732   4.054  -6.037
  121    H    SER  21           H        SER  21  -6.254  -0.491  -3.697
  122    HA   SER  21           HA       SER  21  -5.798  -2.566  -1.653
  123    HB2  SER  21           1HB      SER  21  -7.507  -2.616  -4.134
  124    HB3  SER  21           2HB      SER  21  -6.942  -4.103  -3.373
  125    HG   SER  21           HG       SER  21  -7.881  -2.937  -1.380
  126    H    PHE  22           H        PHE  22  -4.312  -4.171  -2.090
  127    HA   PHE  22           HA       PHE  22  -2.871  -4.068  -4.633
  128    HB2  PHE  22           1HB      PHE  22  -1.415  -4.056  -1.987
  129    HB3  PHE  22           2HB      PHE  22  -0.712  -3.927  -3.596
  130    HD1  PHE  22           HD1      PHE  22  -3.111  -2.176  -1.347
  131    HD2  PHE  22           HD2      PHE  22  -0.189  -1.843  -4.425
  132    HE1  PHE  22           HE1      PHE  22  -3.240   0.277  -1.200
  133    HE2  PHE  22           HE2      PHE  22  -0.312   0.610  -4.281
  134    HZ   PHE  22           HZ       PHE  22  -1.838   1.673  -2.666
  135    H    THR  23           H        THR  23  -1.803  -5.985  -5.191
  136    HA   THR  23           HA       THR  23  -2.887  -8.347  -3.901
  137    HB   THR  23           HB       THR  23  -1.067  -8.217  -6.311
  138    HG1  THR  23           HG1      THR  23  -3.162  -8.495  -7.426
  139   HG21  THR  23          3HG2      THR  23  -1.226 -10.441  -6.378
  140   HG22  THR  23          1HG2      THR  23  -2.982 -10.372  -6.240
  141   HG23  THR  23          2HG2      THR  23  -1.982 -10.381  -4.787
  142    H    TRP  24           H        TRP  24   0.341  -7.111  -4.762
  143    HA   TRP  24           HA       TRP  24   1.560  -9.092  -2.994
  144    HB2  TRP  24           1HB      TRP  24   2.662  -7.215  -5.076
  145    HB3  TRP  24           2HB      TRP  24   3.714  -8.060  -3.944
  146    HD1  TRP  24           HD1      TRP  24   0.836  -9.135  -6.338
  147    HE1  TRP  24           HE1      TRP  24   1.568 -11.304  -7.515
  148    HE3  TRP  24           HE3      TRP  24   5.412  -9.745  -4.142
  149    HZ2  TRP  24           HZ2      TRP  24   3.791 -13.043  -7.513
  150    HZ3  TRP  24           HZ3      TRP  24   6.779 -11.688  -4.785
  151    HH2  TRP  24           HH2      TRP  24   5.983 -13.302  -6.435
  152    H    LYS  25           H        LYS  25   2.847  -8.559  -1.236
  153    HA   LYS  25           HA       LYS  25   2.085  -6.250   0.217
  154    HB2  LYS  25           1HB      LYS  25   2.678  -8.221   1.434
  155    HB3  LYS  25           2HB      LYS  25   4.253  -8.303   0.656
  156    HG2  LYS  25           1HG      LYS  25   4.875  -7.419   2.649
  157    HG3  LYS  25           2HG      LYS  25   4.527  -5.923   1.778
  158    HD2  LYS  25           1HD      LYS  25   2.300  -7.240   3.244
  159    HD3  LYS  25           2HD      LYS  25   3.534  -6.403   4.188
  160    HE2  LYS  25           1HE      LYS  25   2.014  -5.170   1.896
  161    HE3  LYS  25           2HE      LYS  25   1.572  -4.988   3.593
  162    HZ1  LYS  25           3HZ      LYS  25   4.282  -4.348   3.315
  163    HZ2  LYS  25           1HZ      LYS  25   3.004  -3.328   3.749
  164    HZ3  LYS  25           2HZ      LYS  25   3.430  -3.504   2.122
  165    H    SER  26           H        SER  26   5.244  -7.196  -1.148
  166    HA   SER  26           HA       SER  26   6.751  -5.015  -0.572
  167    HB2  SER  26           1HB      SER  26   7.751  -6.835  -1.755
  168    HB3  SER  26           2HB      SER  26   6.668  -6.621  -3.131
  169    HG   SER  26           HG       SER  26   7.685  -4.592  -3.493
  170    H    ARG  27           H        ARG  27   4.431  -5.288  -3.236
  171    HA   ARG  27           HA       ARG  27   4.916  -2.840  -4.472
  172    HB2  ARG  27           1HB      ARG  27   2.447  -4.546  -4.253
  173    HB3  ARG  27           2HB      ARG  27   2.440  -3.032  -5.147
  174    HG2  ARG  27           1HG      ARG  27   4.528  -4.077  -6.333
  175    HG3  ARG  27           2HG      ARG  27   3.825  -5.592  -5.761
  176    HD2  ARG  27           1HD      ARG  27   1.631  -4.659  -6.790
  177    HD3  ARG  27           2HD      ARG  27   2.711  -3.592  -7.687
  178    HE   ARG  27           HE       ARG  27   3.523  -6.314  -7.882
  179   HH11  ARG  27          1HH1      ARG  27   1.235  -3.992  -9.105
  180   HH12  ARG  27          2HH1      ARG  27   1.022  -4.805 -10.619
  181   HH21  ARG  27          1HH2      ARG  27   3.250  -7.394  -9.872
  182   HH22  ARG  27          2HH2      ARG  27   2.168  -6.741 -11.054
  183    H    LEU  28           H        LEU  28   2.600  -3.633  -1.892
  184    HA   LEU  28           HA       LEU  28   1.318  -1.251  -1.558
  185    HB2  LEU  28           1HB      LEU  28   0.780  -3.201  -0.244
  186    HB3  LEU  28           2HB      LEU  28   2.336  -3.114   0.580
  187    HG   LEU  28           HG       LEU  28   1.644  -1.021   1.654
  188   HD11  LEU  28          1HD1      LEU  28   0.149   0.075   0.315
  189   HD12  LEU  28          2HD1      LEU  28  -0.953  -0.654   1.483
  190   HD13  LEU  28          3HD1      LEU  28  -0.730  -1.396  -0.101
  191   HD21  LEU  28          3HD2      LEU  28  -0.292  -2.042   2.991
  192   HD22  LEU  28          1HD2      LEU  28   1.250  -2.898   2.984
  193   HD23  LEU  28          2HD2      LEU  28  -0.076  -3.460   1.964
  194    H    ARG  29           H        ARG  29   4.431  -2.148  -0.081
  195    HA   ARG  29           HA       ARG  29   4.989   0.068   1.399
  196    HB2  ARG  29           1HB      ARG  29   6.716  -1.762  -0.216
  197    HB3  ARG  29           2HB      ARG  29   7.441  -0.340   0.522
  198    HG2  ARG  29           1HG      ARG  29   6.405  -1.153   2.705
  199    HG3  ARG  29           2HG      ARG  29   6.134  -2.680   1.863
  200    HD2  ARG  29           1HD      ARG  29   8.846  -1.470   1.737
  201    HD3  ARG  29           2HD      ARG  29   8.341  -2.216   3.253
  202    HE   ARG  29           HE       ARG  29   7.755  -4.139   1.501
  203   HH11  ARG  29          1HH1      ARG  29  10.605  -2.176   1.875
  204   HH12  ARG  29          2HH1      ARG  29  11.681  -3.391   1.269
  205   HH21  ARG  29          1HH2      ARG  29   9.161  -5.747   0.701
  206   HH22  ARG  29          2HH2      ARG  29  10.858  -5.422   0.600
  207    H    ILE  30           H        ILE  30   5.774  -0.313  -2.059
  208    HA   ILE  30           HA       ILE  30   6.881   2.155  -2.553
  209    HB   ILE  30           HB       ILE  30   5.036   0.649  -4.411
  210   HG12  ILE  30          1HG1      ILE  30   8.023   0.519  -4.530
  211   HG13  ILE  30          2HG1      ILE  30   7.173  -0.471  -3.348
  212   HG21  ILE  30          1HG2      ILE  30   5.924   1.884  -6.182
  213   HG22  ILE  30          2HG2      ILE  30   5.649   3.084  -4.921
  214   HG23  ILE  30          3HG2      ILE  30   7.276   2.473  -5.215
  215   HD11  ILE  30          3HD1      ILE  30   5.785  -0.939  -5.674
  216   HD12  ILE  30          1HD1      ILE  30   7.460  -0.819  -6.212
  217   HD13  ILE  30          2HD1      ILE  30   7.016  -1.984  -4.964
  218    H    HIS  31           H        HIS  31   3.494   1.312  -2.201
  219    HA   HIS  31           HA       HIS  31   2.399   3.723  -3.184
  220    HB2  HIS  31           1HB      HIS  31   1.116   1.612  -2.837
  221    HB3  HIS  31           2HB      HIS  31   1.218   1.876  -1.099
  222    HD1  HIS  31           HD1      HIS  31  -0.310   3.397  -4.200
  223    HD2  HIS  31           HD2      HIS  31  -0.671   3.578  -0.065
  224    HE1  HIS  31           HE1      HIS  31  -2.370   4.772  -3.764
  225    H    GLN  32           H        GLN  32   3.032   2.642   0.153
  226    HA   GLN  32           HA       GLN  32   2.204   4.914   1.494
  227    HB2  GLN  32           1HB      GLN  32   4.535   3.127   2.210
  228    HB3  GLN  32           2HB      GLN  32   3.700   4.216   3.309
  229    HG2  GLN  32           1HG      GLN  32   1.792   2.902   3.370
  230    HG3  GLN  32           2HG      GLN  32   2.202   2.067   1.872
  231   HE21  GLN  32          1HE2      GLN  32   1.665   0.187   3.241
  232   HE22  GLN  32          2HE2      GLN  32   2.924  -0.509   4.197
  233    H    LYS  33           H        LYS  33   5.288   4.254  -0.081
  234    HA   LYS  33           HA       LYS  33   6.815   6.359   0.839
  235    HB2  LYS  33           1HB      LYS  33   6.735   4.828  -1.721
  236    HB3  LYS  33           2HB      LYS  33   7.737   6.271  -1.644
  237    HG2  LYS  33           1HG      LYS  33   9.145   4.460  -1.117
  238    HG3  LYS  33           2HG      LYS  33   8.806   5.275   0.412
  239    HD2  LYS  33           1HD      LYS  33   6.902   3.570   0.667
  240    HD3  LYS  33           2HD      LYS  33   7.718   2.672  -0.616
  241    HE2  LYS  33           1HE      LYS  33   8.638   1.732   1.280
  242    HE3  LYS  33           2HE      LYS  33   9.823   2.975   0.882
  243    HZ1  LYS  33           3HZ      LYS  33   8.521   2.659   3.276
  244    HZ2  LYS  33           1HZ      LYS  33   7.772   3.999   2.566
  245    HZ3  LYS  33           2HZ      LYS  33   9.446   3.993   2.801
  246    H    CYS  34           H        CYS  34   4.674   6.351  -2.010
  247    HA   CYS  34           HA       CYS  34   5.051   9.011  -2.754
  248    HB2  CYS  34           1HB      CYS  34   3.258   8.728  -4.204
  249    HB3  CYS  34           2HB      CYS  34   3.786   7.069  -3.948
  250    HG   CYS  34           HG       CYS  34   1.361   6.338  -3.514
  251    H    HIS  35           H        HIS  35   2.665   7.581  -0.555
  252    HA   HIS  35           HA       HIS  35   1.140   9.828  -0.011
  253    HB2  HIS  35           1HB      HIS  35   1.783   7.328   1.470
  254    HB3  HIS  35           2HB      HIS  35   1.035   8.638   2.379
  255    HD1  HIS  35           HD1      HIS  35  -1.123   9.676   0.705
  256    HD2  HIS  35           HD2      HIS  35  -0.157   5.635   0.689
  257    HE1  HIS  35           HE1      HIS  35  -3.180   8.496  -0.134
  258    H    THR  36           H        THR  36   4.217   8.817   1.390
  259    HA   THR  36           HA       THR  36   4.270  11.068   3.215
  260    HB   THR  36           HB       THR  36   6.557  10.211   3.794
  261    HG1  THR  36           HG1      THR  36   6.712   7.878   2.916
  262   HG21  THR  36          3HG2      THR  36   4.401   8.102   3.916
  263   HG22  THR  36          1HG2      THR  36   4.482   9.503   4.984
  264   HG23  THR  36          2HG2      THR  36   5.766   8.294   5.016
  265    H    GLY  37           H        GLY  37   4.180  12.776   1.643
  266    HA2  GLY  37           1HA      GLY  37   6.824  13.302   0.445
  267    HA3  GLY  37           2HA      GLY  37   5.353  13.572  -0.477
  268    H    GLU  38           H        GLU  38   3.688  14.836   1.176
  269    HA   GLU  38           HA       GLU  38   4.406  17.468   1.114
  270    HB2  GLU  38           1HB      GLU  38   2.631  17.890   2.753
  271    HB3  GLU  38           2HB      GLU  38   2.120  16.726   1.539
  272    HG2  GLU  38           1HG      GLU  38   3.286  15.689   4.062
  273    HG3  GLU  38           2HG      GLU  38   1.657  16.360   4.107
  274    H    ARG  39           H        ARG  39   5.313  15.084   3.467
  275    HA   ARG  39           HA       ARG  39   6.012  16.626   5.649
  276    HB2  ARG  39           1HB      ARG  39   6.117  14.237   5.791
  277    HB3  ARG  39           2HB      ARG  39   7.325  14.157   4.515
  278    HG2  ARG  39           1HG      ARG  39   8.506  13.801   6.501
  279    HG3  ARG  39           2HG      ARG  39   8.833  15.481   6.071
  280    HD2  ARG  39           1HD      ARG  39   7.410  16.305   7.735
  281    HD3  ARG  39           2HD      ARG  39   6.591  14.755   7.924
  282    HE   ARG  39           HE       ARG  39   9.049  15.588   9.174
  283   HH11  ARG  39          1HH1      ARG  39   7.076  12.885   8.213
  284   HH12  ARG  39          2HH1      ARG  39   7.768  11.800   9.373
  285   HH21  ARG  39          1HH2      ARG  39   9.968  14.169  10.705
  286   HH22  ARG  39          2HH2      ARG  39   9.413  12.531  10.790
  287    H    HIS  40           H        HIS  40   7.862  17.717   6.300
  288    HA   HIS  40           HA       HIS  40   9.406  18.877   4.141
  289    HB2  HIS  40           1HB      HIS  40   9.417  19.425   7.116
  290    HB3  HIS  40           2HB      HIS  40  10.334  20.339   5.922
  291    HD2  HIS  40           HD2      HIS  40   8.946  22.355   4.694
  292    HE1  HIS  40           HE1      HIS  40   5.127  21.413   6.283
  293    HE2  HIS  40           HE2      HIS  40   6.454  23.024   4.873
  294    H    SER  41           H        SER  41  11.056  17.702   3.396
  295    HA   SER  41           HA       SER  41  12.497  15.834   5.005
  296    HB2  SER  41           1HB      SER  41  13.926  15.564   2.999
  297    HB3  SER  41           2HB      SER  41  12.210  15.448   2.611
  298    HG   SER  41           HG       SER  41  12.337  17.683   1.978
  299    H    GLY  42           H        GLY  42  13.439  16.915   6.721
  300    HA2  GLY  42           1HA      GLY  42  15.453  18.957   6.027
  301    HA3  GLY  42           2HA      GLY  42  14.663  18.824   7.591
  302    HA   PRO  43           HA       PRO  43  17.989  15.291   7.184
  303    HB2  PRO  43           1HB      PRO  43  19.973  15.834   5.412
  304    HB3  PRO  43           2HB      PRO  43  18.517  14.931   4.977
  305    HG2  PRO  43           1HG      PRO  43  19.162  17.819   4.524
  306    HG3  PRO  43           2HG      PRO  43  18.406  16.655   3.420
  307    HD2  PRO  43           1HD      PRO  43  16.973  18.480   4.817
  308    HD3  PRO  43           2HD      PRO  43  16.334  16.876   4.405
  309    H    SER  44           H        SER  44  19.507  15.335   8.735
  310    HA   SER  44           HA       SER  44  20.581  17.912   9.545
  311    HB2  SER  44           1HB      SER  44  21.111  16.895  11.616
  312    HB3  SER  44           2HB      SER  44  19.569  16.182  11.143
  313    HG   SER  44           HG       SER  44  22.088  15.028  11.318
  314    H    SER  45           H        SER  45  22.791  18.342   9.837
  315    HA   SER  45           HA       SER  45  24.485  17.363   7.810
  316    HB2  SER  45           1HB      SER  45  24.557  19.605   9.163
  317    HB3  SER  45           2HB      SER  45  25.578  18.687  10.271
  318    HG   SER  45           HG       SER  45  26.210  19.776   7.897
  319    H    GLY  46           H        GLY  46  25.574  15.520   7.711
  320    HA2  GLY  46           1HA      GLY  46  26.689  14.383  10.174
  321    HA3  GLY  46           2HA      GLY  46  25.628  13.374   9.201
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1 -15.070  12.077   4.472
    2    HA2  GLY   1           1HA      GLY   1 -13.651   9.627   3.641
    3    HA3  GLY   1           2HA      GLY   1 -15.388   9.617   3.907
    4    H    SER   2           H        SER   2 -13.039  11.654   2.155
    5    HA   SER   2           HA       SER   2 -14.970  12.074   0.032
    6    HB2  SER   2           1HB      SER   2 -13.610  13.968   0.755
    7    HB3  SER   2           2HB      SER   2 -12.134  13.082   0.371
    8    HG   SER   2           HG       SER   2 -13.378  14.655  -1.227
    9    H    SER   3           H        SER   3 -11.684  10.733   0.319
   10    HA   SER   3           HA       SER   3 -11.436   9.859  -2.327
   11    HB2  SER   3           1HB      SER   3 -10.198   8.544   0.100
   12    HB3  SER   3           2HB      SER   3  -9.595   8.503  -1.556
   13    HG   SER   3           HG       SER   3  -9.444  10.865  -1.338
   14    H    GLY   4           H        GLY   4 -12.760   8.516  -3.354
   15    HA2  GLY   4           1HA      GLY   4 -13.968   6.295  -1.839
   16    HA3  GLY   4           2HA      GLY   4 -14.632   6.993  -3.309
   17    H    SER   5           H        SER   5 -14.734   5.139  -4.509
   18    HA   SER   5           HA       SER   5 -14.036   3.340  -5.727
   19    HB2  SER   5           1HB      SER   5 -11.801   5.327  -6.053
   20    HB3  SER   5           2HB      SER   5 -11.734   3.756  -6.851
   21    HG   SER   5           HG       SER   5 -13.389   4.301  -8.112
   22    H    SER   6           H        SER   6 -13.761   2.822  -3.079
   23    HA   SER   6           HA       SER   6 -11.269   2.136  -2.090
   24    HB2  SER   6           1HB      SER   6 -13.940   0.785  -1.645
   25    HB3  SER   6           2HB      SER   6 -12.495   0.458  -0.689
   26    HG   SER   6           HG       SER   6 -13.845   2.943  -0.940
   27    H    GLY   7           H        GLY   7 -13.459   0.222  -4.119
   28    HA2  GLY   7           1HA      GLY   7 -12.313  -1.125  -5.863
   29    HA3  GLY   7           2HA      GLY   7 -11.217  -1.646  -4.592
   30    H    THR   8           H        THR   8 -12.623  -3.436  -6.206
   31    HA   THR   8           HA       THR   8 -14.576  -4.562  -4.306
   32    HB   THR   8           HB       THR   8 -14.472  -5.070  -7.284
   33    HG1  THR   8           HG1      THR   8 -16.116  -3.339  -5.729
   34   HG21  THR   8          3HG2      THR   8 -16.137  -6.082  -5.040
   35   HG22  THR   8          1HG2      THR   8 -15.590  -6.903  -6.501
   36   HG23  THR   8          2HG2      THR   8 -16.940  -5.770  -6.579
   37    H    GLY   9           H        GLY   9 -12.065  -5.381  -6.684
   38    HA2  GLY   9           1HA      GLY   9 -11.932  -8.126  -6.217
   39    HA3  GLY   9           2HA      GLY   9 -10.592  -7.138  -6.780
   40    H    GLU  10           H        GLU  10 -11.772  -9.036  -4.265
   41    HA   GLU  10           HA       GLU  10 -10.847  -8.038  -1.923
   42    HB2  GLU  10           1HB      GLU  10 -10.535 -10.286  -1.144
   43    HB3  GLU  10           2HB      GLU  10 -11.901 -10.279  -2.251
   44    HG2  GLU  10           1HG      GLU  10  -9.103 -11.121  -2.971
   45    HG3  GLU  10           2HG      GLU  10 -10.420 -12.217  -2.555
   46    H    LYS  11           H        LYS  11  -8.889  -8.109  -0.750
   47    HA   LYS  11           HA       LYS  11  -6.437  -8.825  -2.105
   48    HB2  LYS  11           1HB      LYS  11  -5.473  -6.721  -2.289
   49    HB3  LYS  11           2HB      LYS  11  -7.136  -6.410  -2.769
   50    HG2  LYS  11           1HG      LYS  11  -6.036  -5.932  -0.008
   51    HG3  LYS  11           2HG      LYS  11  -6.208  -4.695  -1.256
   52    HD2  LYS  11           1HD      LYS  11  -8.484  -6.351  -0.171
   53    HD3  LYS  11           2HD      LYS  11  -8.071  -4.732   0.397
   54    HE2  LYS  11           1HE      LYS  11  -8.424  -3.864  -1.874
   55    HE3  LYS  11           2HE      LYS  11  -8.869  -5.482  -2.415
   56    HZ1  LYS  11           3HZ      LYS  11 -10.488  -5.048  -0.275
   57    HZ2  LYS  11           1HZ      LYS  11 -10.936  -4.889  -1.899
   58    HZ3  LYS  11           2HZ      LYS  11 -10.438  -3.531  -1.022
   59    HA   PRO  12           HA       PRO  12  -5.405  -9.767   2.082
   60    HB2  PRO  12           1HB      PRO  12  -2.743 -10.174   1.734
   61    HB3  PRO  12           2HB      PRO  12  -3.969 -11.333   1.207
   62    HG2  PRO  12           1HG      PRO  12  -2.493  -9.279  -0.393
   63    HG3  PRO  12           2HG      PRO  12  -2.870 -10.961  -0.808
   64    HD2  PRO  12           1HD      PRO  12  -4.300  -8.868  -1.762
   65    HD3  PRO  12           2HD      PRO  12  -5.030 -10.453  -1.434
   66    H    TYR  13           H        TYR  13  -4.216  -7.069   0.343
   67    HA   TYR  13           HA       TYR  13  -3.422  -5.795   2.865
   68    HB2  TYR  13           1HB      TYR  13  -1.888  -5.355   0.307
   69    HB3  TYR  13           2HB      TYR  13  -1.449  -4.850   1.935
   70    HD1  TYR  13           HD1      TYR  13  -1.018  -6.748   3.652
   71    HD2  TYR  13           HD2      TYR  13  -1.022  -7.331  -0.563
   72    HE1  TYR  13           HE1      TYR  13   0.296  -8.807   3.942
   73    HE2  TYR  13           HE2      TYR  13   0.291  -9.392  -0.285
   74    HH   TYR  13           HH       TYR  13   1.780 -10.423   1.321
   75    H    LYS  14           H        LYS  14  -4.350  -3.877   3.163
   76    HA   LYS  14           HA       LYS  14  -5.312  -2.384   0.821
   77    HB2  LYS  14           1HB      LYS  14  -7.230  -3.549   1.769
   78    HB3  LYS  14           2HB      LYS  14  -6.858  -2.911   3.365
   79    HG2  LYS  14           1HG      LYS  14  -7.638  -0.820   2.867
   80    HG3  LYS  14           2HG      LYS  14  -7.323  -0.994   1.139
   81    HD2  LYS  14           1HD      LYS  14  -9.174  -2.771   1.182
   82    HD3  LYS  14           2HD      LYS  14  -9.599  -2.098   2.757
   83    HE2  LYS  14           1HE      LYS  14  -9.999   0.062   1.788
   84    HE3  LYS  14           2HE      LYS  14  -9.386  -0.476   0.225
   85    HZ1  LYS  14           3HZ      LYS  14 -11.979  -0.466   0.932
   86    HZ2  LYS  14           1HZ      LYS  14 -11.555  -2.070   1.264
   87    HZ3  LYS  14           2HZ      LYS  14 -11.323  -1.437  -0.288
   88    H    CYS  15           H        CYS  15  -4.891  -0.254   0.858
   89    HA   CYS  15           HA       CYS  15  -3.275   0.792   2.994
   90    HB2  CYS  15           1HB      CYS  15  -2.716   1.410   0.729
   91    HB3  CYS  15           2HB      CYS  15  -4.335   2.045   0.456
   92    H    SER  16           H        SER  16  -4.190   1.435   4.829
   93    HA   SER  16           HA       SER  16  -6.914   2.351   4.941
   94    HB2  SER  16           1HB      SER  16  -6.630   2.415   7.312
   95    HB3  SER  16           2HB      SER  16  -5.756   0.993   6.742
   96    HG   SER  16           HG       SER  16  -4.753   3.444   7.684
   97    H    ASP  17           H        ASP  17  -4.284   3.841   3.840
   98    HA   ASP  17           HA       ASP  17  -4.559   6.382   5.201
   99    HB2  ASP  17           1HB      ASP  17  -2.398   5.320   4.181
  100    HB3  ASP  17           2HB      ASP  17  -2.993   6.005   2.671
  101    H    CYS  18           H        CYS  18  -4.920   5.282   1.825
  102    HA   CYS  18           HA       CYS  18  -6.781   7.523   1.392
  103    HB2  CYS  18           1HB      CYS  18  -6.255   7.234  -1.028
  104    HB3  CYS  18           2HB      CYS  18  -4.857   7.683  -0.057
  105    H    GLY  19           H        GLY  19  -6.220   4.100   0.625
  106    HA2  GLY  19           1HA      GLY  19  -8.243   2.680   1.085
  107    HA3  GLY  19           2HA      GLY  19  -9.118   3.847   0.105
  108    H    LYS  20           H        LYS  20  -5.889   2.599  -0.555
  109    HA   LYS  20           HA       LYS  20  -6.859   1.623  -3.134
  110    HB2  LYS  20           1HB      LYS  20  -4.740   3.139  -2.671
  111    HB3  LYS  20           2HB      LYS  20  -3.970   1.586  -2.374
  112    HG2  LYS  20           1HG      LYS  20  -4.503   0.835  -4.592
  113    HG3  LYS  20           2HG      LYS  20  -5.445   2.295  -4.900
  114    HD2  LYS  20           1HD      LYS  20  -3.372   3.631  -4.575
  115    HD3  LYS  20           2HD      LYS  20  -2.470   2.121  -4.433
  116    HE2  LYS  20           1HE      LYS  20  -4.033   3.077  -6.827
  117    HE3  LYS  20           2HE      LYS  20  -2.279   2.971  -6.685
  118    HZ1  LYS  20           3HZ      LYS  20  -4.098   0.981  -7.488
  119    HZ2  LYS  20           1HZ      LYS  20  -3.311   0.460  -6.083
  120    HZ3  LYS  20           2HZ      LYS  20  -2.408   0.910  -7.441
  121    H    SER  21           H        SER  21  -5.781  -0.419  -3.957
  122    HA   SER  21           HA       SER  21  -5.583  -2.407  -1.791
  123    HB2  SER  21           1HB      SER  21  -6.826  -3.985  -3.072
  124    HB3  SER  21           2HB      SER  21  -7.740  -2.479  -3.138
  125    HG   SER  21           HG       SER  21  -6.905  -3.896  -5.164
  126    H    PHE  22           H        PHE  22  -4.012  -3.949  -1.959
  127    HA   PHE  22           HA       PHE  22  -2.392  -4.044  -4.393
  128    HB2  PHE  22           1HB      PHE  22  -1.085  -3.816  -1.686
  129    HB3  PHE  22           2HB      PHE  22  -0.331  -3.690  -3.271
  130    HD1  PHE  22           HD1      PHE  22  -2.793  -2.007  -1.057
  131    HD2  PHE  22           HD2      PHE  22   0.000  -1.613  -4.244
  132    HE1  PHE  22           HE1      PHE  22  -3.059   0.438  -0.983
  133    HE2  PHE  22           HE2      PHE  22  -0.260   0.833  -4.174
  134    HZ   PHE  22           HZ       PHE  22  -1.791   1.862  -2.542
  135    H    THR  23           H        THR  23  -2.317  -6.097  -4.988
  136    HA   THR  23           HA       THR  23  -2.939  -8.244  -3.217
  137    HB   THR  23           HB       THR  23  -3.269  -8.077  -5.807
  138    HG1  THR  23           HG1      THR  23  -2.832 -10.537  -5.761
  139   HG21  THR  23          3HG2      THR  23  -1.566  -8.987  -7.161
  140   HG22  THR  23          1HG2      THR  23  -0.632  -9.527  -5.766
  141   HG23  THR  23          2HG2      THR  23  -0.753  -7.806  -6.134
  142    H    TRP  24           H        TRP  24   0.039  -6.976  -4.622
  143    HA   TRP  24           HA       TRP  24   1.592  -9.008  -3.192
  144    HB2  TRP  24           1HB      TRP  24   2.121  -7.222  -5.522
  145    HB3  TRP  24           2HB      TRP  24   3.490  -7.705  -4.524
  146    HD1  TRP  24           HD1      TRP  24   0.953  -9.098  -7.005
  147    HE1  TRP  24           HE1      TRP  24   1.700 -11.454  -7.722
  148    HE3  TRP  24           HE3      TRP  24   4.798  -9.770  -3.704
  149    HZ2  TRP  24           HZ2      TRP  24   3.659 -13.348  -6.985
  150    HZ3  TRP  24           HZ3      TRP  24   6.058 -11.882  -3.775
  151    HH2  TRP  24           HH2      TRP  24   5.498 -13.633  -5.382
  152    H    LYS  25           H        LYS  25   3.171  -8.483  -1.690
  153    HA   LYS  25           HA       LYS  25   2.665  -6.298  -0.011
  154    HB2  LYS  25           1HB      LYS  25   4.953  -8.230  -0.253
  155    HB3  LYS  25           2HB      LYS  25   5.019  -6.903   0.899
  156    HG2  LYS  25           1HG      LYS  25   3.387  -7.791   2.229
  157    HG3  LYS  25           2HG      LYS  25   2.619  -8.659   0.897
  158    HD2  LYS  25           1HD      LYS  25   4.043 -10.441   1.059
  159    HD3  LYS  25           2HD      LYS  25   5.372  -9.461   1.682
  160    HE2  LYS  25           1HE      LYS  25   2.897  -9.964   3.302
  161    HE3  LYS  25           2HE      LYS  25   4.231 -11.117   3.280
  162    HZ1  LYS  25           3HZ      LYS  25   4.465  -9.620   5.132
  163    HZ2  LYS  25           1HZ      LYS  25   4.385  -8.271   4.113
  164    HZ3  LYS  25           2HZ      LYS  25   5.706  -9.323   4.021
  165    H    SER  26           H        SER  26   5.528  -6.854  -2.071
  166    HA   SER  26           HA       SER  26   6.884  -4.541  -1.771
  167    HB2  SER  26           1HB      SER  26   7.459  -4.739  -4.264
  168    HB3  SER  26           2HB      SER  26   7.802  -6.141  -3.251
  169    HG   SER  26           HG       SER  26   5.447  -6.645  -3.998
  170    H    ARG  27           H        ARG  27   3.959  -4.972  -3.696
  171    HA   ARG  27           HA       ARG  27   3.899  -2.481  -4.955
  172    HB2  ARG  27           1HB      ARG  27   1.617  -4.241  -4.043
  173    HB3  ARG  27           2HB      ARG  27   1.434  -2.854  -5.108
  174    HG2  ARG  27           1HG      ARG  27   3.381  -4.958  -5.880
  175    HG3  ARG  27           2HG      ARG  27   1.658  -5.308  -6.042
  176    HD2  ARG  27           1HD      ARG  27   2.430  -4.419  -8.122
  177    HD3  ARG  27           2HD      ARG  27   1.426  -3.196  -7.346
  178    HE   ARG  27           HE       ARG  27   3.285  -1.852  -7.099
  179   HH11  ARG  27          1HH1      ARG  27   4.232  -5.026  -8.170
  180   HH12  ARG  27          2HH1      ARG  27   5.860  -4.559  -8.537
  181   HH21  ARG  27          1HH2      ARG  27   5.425  -1.225  -7.577
  182   HH22  ARG  27          2HH2      ARG  27   6.538  -2.397  -8.198
  183    H    LEU  28           H        LEU  28   2.264  -3.480  -1.946
  184    HA   LEU  28           HA       LEU  28   1.159  -1.033  -1.264
  185    HB2  LEU  28           1HB      LEU  28   0.629  -3.120  -0.122
  186    HB3  LEU  28           2HB      LEU  28   2.250  -3.166   0.567
  187    HG   LEU  28           HG       LEU  28   1.712  -1.073   1.808
  188   HD11  LEU  28          1HD1      LEU  28  -0.853  -1.449   0.360
  189   HD12  LEU  28          2HD1      LEU  28   0.005   0.033   0.784
  190   HD13  LEU  28          3HD1      LEU  28  -0.911  -0.838   2.014
  191   HD21  LEU  28          3HD2      LEU  28  -0.214  -3.322   2.370
  192   HD22  LEU  28          1HD2      LEU  28   0.451  -2.162   3.521
  193   HD23  LEU  28          2HD2      LEU  28   1.503  -3.366   2.776
  194    H    ARG  29           H        ARG  29   4.288  -2.369  -0.195
  195    HA   ARG  29           HA       ARG  29   5.179  -0.277   1.348
  196    HB2  ARG  29           1HB      ARG  29   6.741  -2.092  -0.492
  197    HB3  ARG  29           2HB      ARG  29   7.494  -0.997   0.661
  198    HG2  ARG  29           1HG      ARG  29   6.756  -2.207   2.491
  199    HG3  ARG  29           2HG      ARG  29   5.467  -2.993   1.577
  200    HD2  ARG  29           1HD      ARG  29   7.200  -4.599   2.005
  201    HD3  ARG  29           2HD      ARG  29   7.199  -4.211   0.285
  202    HE   ARG  29           HE       ARG  29   9.032  -2.570   1.698
  203   HH11  ARG  29          1HH1      ARG  29   8.598  -5.791   0.451
  204   HH12  ARG  29          2HH1      ARG  29  10.295  -6.086   0.260
  205   HH21  ARG  29          1HH2      ARG  29  11.268  -2.946   1.452
  206   HH22  ARG  29          2HH2      ARG  29  11.813  -4.468   0.830
  207    H    ILE  30           H        ILE  30   5.509  -0.658  -2.167
  208    HA   ILE  30           HA       ILE  30   6.969   1.700  -2.628
  209    HB   ILE  30           HB       ILE  30   5.074   0.250  -4.481
  210   HG12  ILE  30          1HG1      ILE  30   8.066   0.126  -4.611
  211   HG13  ILE  30          2HG1      ILE  30   7.207  -0.884  -3.454
  212   HG21  ILE  30          1HG2      ILE  30   5.521   2.595  -5.141
  213   HG22  ILE  30          2HG2      ILE  30   7.244   2.224  -5.171
  214   HG23  ILE  30          3HG2      ILE  30   6.148   1.416  -6.292
  215   HD11  ILE  30          3HD1      ILE  30   7.278  -2.331  -5.183
  216   HD12  ILE  30          1HD1      ILE  30   5.801  -1.478  -5.631
  217   HD13  ILE  30          2HD1      ILE  30   7.332  -1.054  -6.398
  218    H    HIS  31           H        HIS  31   3.582   1.126  -2.104
  219    HA   HIS  31           HA       HIS  31   2.764   3.721  -3.079
  220    HB2  HIS  31           1HB      HIS  31   1.226   1.851  -3.307
  221    HB3  HIS  31           2HB      HIS  31   1.250   1.582  -1.567
  222    HD1  HIS  31           HD1      HIS  31  -0.123   3.901  -4.174
  223    HD2  HIS  31           HD2      HIS  31  -0.394   3.263  -0.078
  224    HE1  HIS  31           HE1      HIS  31  -2.045   5.324  -3.398
  225    H    GLN  32           H        GLN  32   3.578   2.232  -0.028
  226    HA   GLN  32           HA       GLN  32   2.447   4.043   1.754
  227    HB2  GLN  32           1HB      GLN  32   4.760   2.176   1.837
  228    HB3  GLN  32           2HB      GLN  32   4.666   3.401   3.096
  229    HG2  GLN  32           1HG      GLN  32   2.462   2.612   3.732
  230    HG3  GLN  32           2HG      GLN  32   2.501   1.416   2.437
  231   HE21  GLN  32          1HE2      GLN  32   3.102  -0.543   2.997
  232   HE22  GLN  32          2HE2      GLN  32   4.061  -0.963   4.372
  233    H    LYS  33           H        LYS  33   5.754   4.074   0.420
  234    HA   LYS  33           HA       LYS  33   6.578   6.480   1.553
  235    HB2  LYS  33           1HB      LYS  33   8.292   6.535  -0.192
  236    HB3  LYS  33           2HB      LYS  33   8.116   4.914   0.466
  237    HG2  LYS  33           1HG      LYS  33   6.679   4.352  -1.490
  238    HG3  LYS  33           2HG      LYS  33   7.076   5.933  -2.167
  239    HD2  LYS  33           1HD      LYS  33   9.475   5.321  -2.074
  240    HD3  LYS  33           2HD      LYS  33   9.013   3.713  -1.510
  241    HE2  LYS  33           1HE      LYS  33   7.905   3.226  -3.556
  242    HE3  LYS  33           2HE      LYS  33   8.021   4.901  -4.093
  243    HZ1  LYS  33           3HZ      LYS  33  10.594   4.290  -3.708
  244    HZ2  LYS  33           1HZ      LYS  33   9.801   4.137  -5.195
  245    HZ3  LYS  33           2HZ      LYS  33   9.995   2.786  -4.196
  246    H    CYS  34           H        CYS  34   5.133   5.901  -1.648
  247    HA   CYS  34           HA       CYS  34   5.151   8.298  -2.831
  248    HB2  CYS  34           1HB      CYS  34   2.736   6.500  -2.551
  249    HB3  CYS  34           2HB      CYS  34   2.861   7.817  -3.712
  250    HG   CYS  34           HG       CYS  34   3.989   6.440  -5.552
  251    H    HIS  35           H        HIS  35   3.066   7.439  -0.111
  252    HA   HIS  35           HA       HIS  35   1.580   9.833  -0.040
  253    HB2  HIS  35           1HB      HIS  35   2.152   7.653   1.932
  254    HB3  HIS  35           2HB      HIS  35   1.355   9.125   2.479
  255    HD1  HIS  35           HD1      HIS  35  -0.601   9.666   0.248
  256    HD2  HIS  35           HD2      HIS  35   0.142   5.855   1.727
  257    HE1  HIS  35           HE1      HIS  35  -2.638   8.311  -0.333
  258    H    THR  36           H        THR  36   4.340   8.806   1.974
  259    HA   THR  36           HA       THR  36   4.661  11.284   3.275
  260    HB   THR  36           HB       THR  36   6.883  10.464   3.942
  261    HG1  THR  36           HG1      THR  36   6.363   8.624   1.878
  262   HG21  THR  36          3HG2      THR  36   5.461   9.557   5.454
  263   HG22  THR  36          1HG2      THR  36   5.928   8.049   4.667
  264   HG23  THR  36          2HG2      THR  36   4.424   8.851   4.215
  265    H    GLY  37           H        GLY  37   6.161  12.953   2.963
  266    HA2  GLY  37           1HA      GLY  37   7.867  14.097   1.792
  267    HA3  GLY  37           2HA      GLY  37   7.684  12.962   0.463
  268    H    GLU  38           H        GLU  38   7.240  16.084   1.305
  269    HA   GLU  38           HA       GLU  38   4.749  16.502  -0.139
  270    HB2  GLU  38           1HB      GLU  38   5.009  18.851   0.493
  271    HB3  GLU  38           2HB      GLU  38   5.160  17.801   1.896
  272    HG2  GLU  38           1HG      GLU  38   7.699  17.959   1.444
  273    HG3  GLU  38           2HG      GLU  38   7.269  19.369   0.478
  274    H    ARG  39           H        ARG  39   6.634  15.383  -1.778
  275    HA   ARG  39           HA       ARG  39   6.757  17.274  -3.896
  276    HB2  ARG  39           1HB      ARG  39   9.201  17.360  -4.154
  277    HB3  ARG  39           2HB      ARG  39   8.679  18.102  -2.648
  278    HG2  ARG  39           1HG      ARG  39   9.347  16.136  -1.408
  279    HG3  ARG  39           2HG      ARG  39   9.785  15.314  -2.906
  280    HD2  ARG  39           1HD      ARG  39  11.027  17.933  -2.131
  281    HD3  ARG  39           2HD      ARG  39  11.656  16.402  -1.523
  282    HE   ARG  39           HE       ARG  39  11.560  15.993  -4.187
  283   HH11  ARG  39          1HH1      ARG  39  12.898  18.539  -2.226
  284   HH12  ARG  39          2HH1      ARG  39  14.170  18.909  -3.342
  285   HH21  ARG  39          1HH2      ARG  39  13.230  16.470  -5.666
  286   HH22  ARG  39          2HH2      ARG  39  14.357  17.732  -5.299
  287    H    HIS  40           H        HIS  40   6.567  16.172  -5.734
  288    HA   HIS  40           HA       HIS  40   7.545  13.393  -5.809
  289    HB2  HIS  40           1HB      HIS  40   5.056  14.421  -7.183
  290    HB3  HIS  40           2HB      HIS  40   5.618  12.753  -7.121
  291    HD2  HIS  40           HD2      HIS  40   6.092  12.592  -3.851
  292    HE1  HIS  40           HE1      HIS  40   1.976  13.607  -3.679
  293    HE2  HIS  40           HE2      HIS  40   3.959  12.732  -2.395
  294    H    SER  41           H        SER  41   6.351  15.951  -7.996
  295    HA   SER  41           HA       SER  41   8.797  15.900  -9.514
  296    HB2  SER  41           1HB      SER  41   7.661  13.955 -10.478
  297    HB3  SER  41           2HB      SER  41   6.229  14.933 -10.797
  298    HG   SER  41           HG       SER  41   8.648  15.851 -11.822
  299    H    GLY  42           H        GLY  42   9.114  18.034  -9.586
  300    HA2  GLY  42           1HA      GLY  42   8.801  20.159 -10.495
  301    HA3  GLY  42           2HA      GLY  42   7.188  19.679 -11.001
  302    HA   PRO  43           HA       PRO  43   6.802  22.606  -7.419
  303    HB2  PRO  43           1HB      PRO  43   4.909  24.163  -8.587
  304    HB3  PRO  43           2HB      PRO  43   6.642  24.425  -8.814
  305    HG2  PRO  43           1HG      PRO  43   4.685  23.043 -10.608
  306    HG3  PRO  43           2HG      PRO  43   5.975  24.184 -11.028
  307    HD2  PRO  43           1HD      PRO  43   6.244  21.506 -11.328
  308    HD3  PRO  43           2HD      PRO  43   7.612  22.564 -10.928
  309    H    SER  44           H        SER  44   4.223  21.369  -9.544
  310    HA   SER  44           HA       SER  44   2.778  20.471  -7.154
  311    HB2  SER  44           1HB      SER  44   1.776  22.310  -9.289
  312    HB3  SER  44           2HB      SER  44   0.651  21.161  -8.566
  313    HG   SER  44           HG       SER  44   1.013  22.076  -6.576
  314    H    SER  45           H        SER  45   0.859  19.034  -7.868
  315    HA   SER  45           HA       SER  45   1.907  16.822  -9.251
  316    HB2  SER  45           1HB      SER  45   0.213  16.400  -7.637
  317    HB3  SER  45           2HB      SER  45  -0.899  17.538  -8.398
  318    HG   SER  45           HG       SER  45  -1.393  16.090  -9.889
  319    H    GLY  46           H        GLY  46   1.581  16.023 -11.299
  320    HA2  GLY  46           1HA      GLY  46   0.228  16.099 -13.365
  321    HA3  GLY  46           2HA      GLY  46   0.223  17.847 -13.188
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1 -10.438   5.179 -13.314
    2    HA2  GLY   1           1HA      GLY   1 -11.935   3.378 -13.506
    3    HA3  GLY   1           2HA      GLY   1 -10.531   2.775 -14.375
    4    H    SER   2           H        SER   2  -9.948   0.799 -13.810
    5    HA   SER   2           HA       SER   2  -9.659  -1.116 -12.615
    6    HB2  SER   2           1HB      SER   2  -9.261   0.981 -10.491
    7    HB3  SER   2           2HB      SER   2  -9.150  -0.737 -10.110
    8    HG   SER   2           HG       SER   2  -7.257  -0.774 -11.005
    9    H    SER   3           H        SER   3 -12.284  -0.531 -13.180
   10    HA   SER   3           HA       SER   3 -13.630  -1.804 -10.921
   11    HB2  SER   3           1HB      SER   3 -13.915   0.817 -11.030
   12    HB3  SER   3           2HB      SER   3 -15.078   0.425 -12.297
   13    HG   SER   3           HG       SER   3 -15.887  -1.142 -10.594
   14    H    GLY   4           H        GLY   4 -14.328  -3.648 -11.781
   15    HA2  GLY   4           1HA      GLY   4 -16.104  -4.677 -13.078
   16    HA3  GLY   4           2HA      GLY   4 -15.782  -3.503 -14.345
   17    H    SER   5           H        SER   5 -14.391  -6.272 -12.634
   18    HA   SER   5           HA       SER   5 -13.205  -7.162 -15.147
   19    HB2  SER   5           1HB      SER   5 -11.407  -5.898 -14.069
   20    HB3  SER   5           2HB      SER   5 -11.610  -6.841 -12.592
   21    HG   SER   5           HG       SER   5  -9.889  -7.514 -14.104
   22    H    SER   6           H        SER   6 -13.760  -9.205 -15.450
   23    HA   SER   6           HA       SER   6 -15.235 -10.818 -13.887
   24    HB2  SER   6           1HB      SER   6 -12.960 -11.776 -15.642
   25    HB3  SER   6           2HB      SER   6 -14.327 -12.751 -15.105
   26    HG   SER   6           HG       SER   6 -15.411 -11.970 -16.712
   27    H    GLY   7           H        GLY   7 -15.043 -11.952 -12.054
   28    HA2  GLY   7           1HA      GLY   7 -13.465 -13.497 -10.820
   29    HA3  GLY   7           2HA      GLY   7 -12.349 -12.141 -10.859
   30    H    THR   8           H        THR   8 -12.545 -12.786  -8.459
   31    HA   THR   8           HA       THR   8 -14.855 -11.489  -7.199
   32    HB   THR   8           HB       THR   8 -12.718 -13.248  -5.979
   33    HG1  THR   8           HG1      THR   8 -15.438 -13.932  -6.120
   34   HG21  THR   8          3HG2      THR   8 -13.358 -12.108  -4.120
   35   HG22  THR   8          1HG2      THR   8 -14.700 -13.250  -4.173
   36   HG23  THR   8          2HG2      THR   8 -14.902 -11.621  -4.818
   37    H    GLY   9           H        GLY   9 -11.304 -11.477  -7.160
   38    HA2  GLY   9           1HA      GLY   9  -9.947  -9.581  -6.923
   39    HA3  GLY   9           2HA      GLY   9 -11.355  -8.666  -6.404
   40    H    GLU  10           H        GLU  10  -9.054 -11.149  -5.365
   41    HA   GLU  10           HA       GLU  10  -9.728 -10.637  -2.572
   42    HB2  GLU  10           1HB      GLU  10  -9.291 -12.968  -3.657
   43    HB3  GLU  10           2HB      GLU  10  -7.595 -12.541  -3.478
   44    HG2  GLU  10           1HG      GLU  10  -8.328 -12.019  -1.008
   45    HG3  GLU  10           2HG      GLU  10  -9.632 -13.138  -1.401
   46    H    LYS  11           H        LYS  11  -8.837  -8.775  -1.885
   47    HA   LYS  11           HA       LYS  11  -5.936  -8.435  -2.283
   48    HB2  LYS  11           1HB      LYS  11  -8.184  -6.490  -2.452
   49    HB3  LYS  11           2HB      LYS  11  -6.665  -5.920  -1.773
   50    HG2  LYS  11           1HG      LYS  11  -6.293  -5.416  -3.949
   51    HG3  LYS  11           2HG      LYS  11  -5.689  -7.075  -3.949
   52    HD2  LYS  11           1HD      LYS  11  -8.001  -7.794  -4.652
   53    HD3  LYS  11           2HD      LYS  11  -8.377  -6.086  -4.886
   54    HE2  LYS  11           1HE      LYS  11  -6.001  -7.366  -6.197
   55    HE3  LYS  11           2HE      LYS  11  -7.606  -7.450  -6.921
   56    HZ1  LYS  11           3HZ      LYS  11  -6.292  -5.583  -7.767
   57    HZ2  LYS  11           1HZ      LYS  11  -6.194  -4.936  -6.206
   58    HZ3  LYS  11           2HZ      LYS  11  -7.693  -5.055  -6.980
   59    HA   PRO  12           HA       PRO  12  -6.538  -8.974   2.228
   60    HB2  PRO  12           1HB      PRO  12  -4.115 -10.135   2.619
   61    HB3  PRO  12           2HB      PRO  12  -5.539 -11.039   2.094
   62    HG2  PRO  12           1HG      PRO  12  -3.263  -9.978   0.465
   63    HG3  PRO  12           2HG      PRO  12  -4.073 -11.552   0.364
   64    HD2  PRO  12           1HD      PRO  12  -4.611  -9.524  -1.347
   65    HD3  PRO  12           2HD      PRO  12  -5.839 -10.706  -0.851
   66    H    TYR  13           H        TYR  13  -4.763  -6.978   0.300
   67    HA   TYR  13           HA       TYR  13  -3.578  -5.623   2.627
   68    HB2  TYR  13           1HB      TYR  13  -2.304  -5.724  -0.111
   69    HB3  TYR  13           2HB      TYR  13  -1.622  -5.031   1.356
   70    HD1  TYR  13           HD1      TYR  13  -1.751  -6.916   3.395
   71    HD2  TYR  13           HD2      TYR  13  -1.265  -7.667  -0.765
   72    HE1  TYR  13           HE1      TYR  13  -0.673  -9.065   3.915
   73    HE2  TYR  13           HE2      TYR  13  -0.186  -9.818  -0.257
   74    HH   TYR  13           HH       TYR  13  -0.411 -11.380   2.510
   75    H    LYS  14           H        LYS  14  -4.516  -3.722   2.901
   76    HA   LYS  14           HA       LYS  14  -5.203  -2.125   0.530
   77    HB2  LYS  14           1HB      LYS  14  -7.176  -3.308   1.756
   78    HB3  LYS  14           2HB      LYS  14  -6.937  -2.065   2.978
   79    HG2  LYS  14           1HG      LYS  14  -7.455  -0.335   1.452
   80    HG3  LYS  14           2HG      LYS  14  -7.374  -1.433   0.072
   81    HD2  LYS  14           1HD      LYS  14  -9.378  -2.513   0.686
   82    HD3  LYS  14           2HD      LYS  14  -9.357  -1.804   2.302
   83    HE2  LYS  14           1HE      LYS  14 -10.986  -0.590   1.127
   84    HE3  LYS  14           2HE      LYS  14  -9.564   0.451   1.141
   85    HZ1  LYS  14           3HZ      LYS  14 -10.961  -0.139  -1.055
   86    HZ2  LYS  14           1HZ      LYS  14  -9.767  -1.335  -1.130
   87    HZ3  LYS  14           2HZ      LYS  14  -9.326   0.296  -1.071
   88    H    CYS  15           H        CYS  15  -4.459  -0.101   0.590
   89    HA   CYS  15           HA       CYS  15  -2.798   0.789   2.694
   90    HB2  CYS  15           1HB      CYS  15  -2.347   1.589   0.492
   91    HB3  CYS  15           2HB      CYS  15  -3.986   2.204   0.308
   92    H    SER  16           H        SER  16  -3.119   2.241   4.328
   93    HA   SER  16           HA       SER  16  -5.904   2.763   5.031
   94    HB2  SER  16           1HB      SER  16  -4.508   1.746   6.754
   95    HB3  SER  16           2HB      SER  16  -3.357   3.077   6.639
   96    HG   SER  16           HG       SER  16  -5.505   4.321   7.098
   97    H    ASP  17           H        ASP  17  -3.060   4.396   3.947
   98    HA   ASP  17           HA       ASP  17  -3.523   6.994   4.829
   99    HB2  ASP  17           1HB      ASP  17  -2.368   6.218   2.145
  100    HB3  ASP  17           2HB      ASP  17  -2.091   7.720   3.022
  101    H    CYS  18           H        CYS  18  -4.448   5.581   1.685
  102    HA   CYS  18           HA       CYS  18  -6.522   7.662   1.468
  103    HB2  CYS  18           1HB      CYS  18  -6.427   7.289  -0.968
  104    HB3  CYS  18           2HB      CYS  18  -4.866   7.784  -0.321
  105    H    GLY  19           H        GLY  19  -5.850   4.239   0.764
  106    HA2  GLY  19           1HA      GLY  19  -7.577   2.681   1.676
  107    HA3  GLY  19           2HA      GLY  19  -8.760   3.749   0.935
  108    H    LYS  20           H        LYS  20  -5.696   2.721  -0.477
  109    HA   LYS  20           HA       LYS  20  -7.131   1.732  -2.802
  110    HB2  LYS  20           1HB      LYS  20  -5.075   3.196  -2.951
  111    HB3  LYS  20           2HB      LYS  20  -4.144   1.822  -2.371
  112    HG2  LYS  20           1HG      LYS  20  -4.606   0.562  -4.310
  113    HG3  LYS  20           2HG      LYS  20  -5.866   1.685  -4.827
  114    HD2  LYS  20           1HD      LYS  20  -4.153   3.430  -5.129
  115    HD3  LYS  20           2HD      LYS  20  -2.908   2.266  -4.668
  116    HE2  LYS  20           1HE      LYS  20  -2.936   2.356  -7.043
  117    HE3  LYS  20           2HE      LYS  20  -3.686   0.831  -6.575
  118    HZ1  LYS  20           3HZ      LYS  20  -5.512   1.407  -7.658
  119    HZ2  LYS  20           1HZ      LYS  20  -4.755   2.826  -8.185
  120    HZ3  LYS  20           2HZ      LYS  20  -5.661   2.830  -6.756
  121    H    SER  21           H        SER  21  -6.898  -0.363  -3.655
  122    HA   SER  21           HA       SER  21  -6.251  -2.383  -1.625
  123    HB2  SER  21           1HB      SER  21  -7.639  -3.913  -2.955
  124    HB3  SER  21           2HB      SER  21  -8.537  -2.454  -2.536
  125    HG   SER  21           HG       SER  21  -8.911  -2.481  -4.623
  126    H    PHE  22           H        PHE  22  -4.682  -3.863  -1.924
  127    HA   PHE  22           HA       PHE  22  -3.379  -3.997  -4.556
  128    HB2  PHE  22           1HB      PHE  22  -1.875  -3.986  -1.935
  129    HB3  PHE  22           2HB      PHE  22  -1.192  -3.953  -3.558
  130    HD1  PHE  22           HD1      PHE  22  -3.184  -1.999  -1.129
  131    HD2  PHE  22           HD2      PHE  22  -0.837  -1.925  -4.679
  132    HE1  PHE  22           HE1      PHE  22  -3.173   0.461  -1.067
  133    HE2  PHE  22           HE2      PHE  22  -0.821   0.534  -4.622
  134    HZ   PHE  22           HZ       PHE  22  -1.989   1.731  -2.814
  135    H    THR  23           H        THR  23  -2.029  -5.949  -4.828
  136    HA   THR  23           HA       THR  23  -3.263  -8.232  -3.443
  137    HB   THR  23           HB       THR  23  -1.816  -8.215  -6.099
  138    HG1  THR  23           HG1      THR  23  -4.165  -8.724  -6.707
  139   HG21  THR  23          3HG2      THR  23  -3.650 -10.406  -5.480
  140   HG22  THR  23          1HG2      THR  23  -2.249 -10.337  -4.412
  141   HG23  THR  23          2HG2      THR  23  -2.023 -10.450  -6.157
  142    H    TRP  24           H        TRP  24  -0.164  -6.940  -4.563
  143    HA   TRP  24           HA       TRP  24   1.239  -8.983  -2.994
  144    HB2  TRP  24           1HB      TRP  24   2.083  -7.151  -5.224
  145    HB3  TRP  24           2HB      TRP  24   3.279  -7.924  -4.187
  146    HD1  TRP  24           HD1      TRP  24   0.339  -8.977  -6.491
  147    HE1  TRP  24           HE1      TRP  24   0.938 -11.247  -7.548
  148    HE3  TRP  24           HE3      TRP  24   4.779  -9.835  -4.107
  149    HZ2  TRP  24           HZ2      TRP  24   3.018 -13.149  -7.391
  150    HZ3  TRP  24           HZ3      TRP  24   6.011 -11.903  -4.616
  151    HH2  TRP  24           HH2      TRP  24   5.147 -13.525  -6.224
  152    H    LYS  25           H        LYS  25   2.805  -8.426  -1.453
  153    HA   LYS  25           HA       LYS  25   2.210  -6.070   0.050
  154    HB2  LYS  25           1HB      LYS  25   4.357  -8.173   0.362
  155    HB3  LYS  25           2HB      LYS  25   4.100  -6.862   1.505
  156    HG2  LYS  25           1HG      LYS  25   1.913  -7.682   2.046
  157    HG3  LYS  25           2HG      LYS  25   2.014  -8.908   0.779
  158    HD2  LYS  25           1HD      LYS  25   3.914  -8.757   3.115
  159    HD3  LYS  25           2HD      LYS  25   2.449  -9.743   3.108
  160    HE2  LYS  25           1HE      LYS  25   3.987 -11.288   2.406
  161    HE3  LYS  25           2HE      LYS  25   3.461 -10.642   0.853
  162    HZ1  LYS  25           3HZ      LYS  25   5.581 -10.189   0.458
  163    HZ2  LYS  25           1HZ      LYS  25   6.040 -10.576   2.039
  164    HZ3  LYS  25           2HZ      LYS  25   5.519  -9.010   1.670
  165    H    SER  26           H        SER  26   5.060  -7.171  -1.772
  166    HA   SER  26           HA       SER  26   6.816  -5.138  -1.334
  167    HB2  SER  26           1HB      SER  26   6.233  -6.562  -3.938
  168    HB3  SER  26           2HB      SER  26   7.637  -5.526  -3.680
  169    HG   SER  26           HG       SER  26   8.554  -7.198  -2.824
  170    H    ARG  27           H        ARG  27   4.140  -5.124  -3.662
  171    HA   ARG  27           HA       ARG  27   4.658  -2.583  -4.753
  172    HB2  ARG  27           1HB      ARG  27   2.012  -4.024  -4.492
  173    HB3  ARG  27           2HB      ARG  27   2.338  -2.665  -5.559
  174    HG2  ARG  27           1HG      ARG  27   4.246  -4.284  -6.428
  175    HG3  ARG  27           2HG      ARG  27   3.138  -5.507  -5.802
  176    HD2  ARG  27           1HD      ARG  27   1.335  -4.561  -7.165
  177    HD3  ARG  27           2HD      ARG  27   2.450  -3.349  -7.795
  178    HE   ARG  27           HE       ARG  27   3.254  -6.098  -8.201
  179   HH11  ARG  27          1HH1      ARG  27   1.591  -3.327  -9.493
  180   HH12  ARG  27          2HH1      ARG  27   1.724  -3.851 -11.139
  181   HH21  ARG  27          1HH2      ARG  27   3.436  -6.800 -10.364
  182   HH22  ARG  27          2HH2      ARG  27   2.772  -5.827 -11.633
  183    H    LEU  28           H        LEU  28   2.394  -3.580  -2.191
  184    HA   LEU  28           HA       LEU  28   1.238  -1.179  -1.572
  185    HB2  LEU  28           1HB      LEU  28   0.505  -3.141  -0.467
  186    HB3  LEU  28           2HB      LEU  28   2.102  -3.433   0.220
  187    HG   LEU  28           HG       LEU  28   1.802  -1.413   1.636
  188   HD11  LEU  28          1HD1      LEU  28   0.272  -0.052   0.558
  189   HD12  LEU  28          2HD1      LEU  28  -0.685  -0.742   1.868
  190   HD13  LEU  28          3HD1      LEU  28  -0.839  -1.382   0.232
  191   HD21  LEU  28          3HD2      LEU  28   1.267  -3.734   2.393
  192   HD22  LEU  28          1HD2      LEU  28  -0.419  -3.420   1.982
  193   HD23  LEU  28          2HD2      LEU  28   0.375  -2.466   3.235
  194    H    ARG  29           H        ARG  29   4.300  -2.434  -0.259
  195    HA   ARG  29           HA       ARG  29   4.990  -0.449   1.480
  196    HB2  ARG  29           1HB      ARG  29   6.862  -1.797  -0.475
  197    HB3  ARG  29           2HB      ARG  29   7.334  -0.987   1.013
  198    HG2  ARG  29           1HG      ARG  29   5.789  -2.675   2.179
  199    HG3  ARG  29           2HG      ARG  29   5.873  -3.574   0.663
  200    HD2  ARG  29           1HD      ARG  29   7.639  -4.519   1.751
  201    HD3  ARG  29           2HD      ARG  29   8.466  -3.163   0.988
  202    HE   ARG  29           HE       ARG  29   7.441  -2.642   3.641
  203   HH11  ARG  29          1HH1      ARG  29  10.147  -3.696   1.721
  204   HH12  ARG  29          2HH1      ARG  29  11.322  -3.330   2.941
  205   HH21  ARG  29          1HH2      ARG  29   8.978  -2.156   5.254
  206   HH22  ARG  29          2HH2      ARG  29  10.656  -2.455   4.950
  207    H    ILE  30           H        ILE  30   5.675  -0.459  -2.016
  208    HA   ILE  30           HA       ILE  30   6.924   2.025  -2.166
  209    HB   ILE  30           HB       ILE  30   5.184   0.725  -4.265
  210   HG12  ILE  30          1HG1      ILE  30   8.174   0.634  -4.252
  211   HG13  ILE  30          2HG1      ILE  30   7.284  -0.479  -3.219
  212   HG21  ILE  30          1HG2      ILE  30   6.070   2.170  -5.839
  213   HG22  ILE  30          2HG2      ILE  30   5.843   3.225  -4.445
  214   HG23  ILE  30          3HG2      ILE  30   7.447   2.597  -4.824
  215   HD11  ILE  30          3HD1      ILE  30   7.692  -1.653  -5.198
  216   HD12  ILE  30          1HD1      ILE  30   6.007  -1.145  -5.308
  217   HD13  ILE  30          2HD1      ILE  30   7.251  -0.276  -6.207
  218    H    HIS  31           H        HIS  31   3.490   1.234  -2.692
  219    HA   HIS  31           HA       HIS  31   2.487   3.706  -3.292
  220    HB2  HIS  31           1HB      HIS  31   1.159   1.611  -3.216
  221    HB3  HIS  31           2HB      HIS  31   1.171   1.692  -1.457
  222    HD1  HIS  31           HD1      HIS  31  -0.084   3.688  -4.428
  223    HD2  HIS  31           HD2      HIS  31  -0.857   3.156  -0.381
  224    HE1  HIS  31           HE1      HIS  31  -2.179   4.999  -3.966
  225    H    GLN  32           H        GLN  32   3.164   2.407  -0.065
  226    HA   GLN  32           HA       GLN  32   2.144   4.497   1.460
  227    HB2  GLN  32           1HB      GLN  32   4.511   2.700   1.999
  228    HB3  GLN  32           2HB      GLN  32   3.787   3.764   3.197
  229    HG2  GLN  32           1HG      GLN  32   1.875   2.496   3.368
  230    HG3  GLN  32           2HG      GLN  32   2.083   1.777   1.772
  231   HE21  GLN  32          1HE2      GLN  32   1.528  -0.117   3.237
  232   HE22  GLN  32          2HE2      GLN  32   2.866  -0.976   3.912
  233    H    LYS  33           H        LYS  33   5.461   4.053   0.246
  234    HA   LYS  33           HA       LYS  33   6.693   6.267   1.262
  235    HB2  LYS  33           1HB      LYS  33   6.988   5.088  -1.505
  236    HB3  LYS  33           2HB      LYS  33   8.099   6.261  -0.810
  237    HG2  LYS  33           1HG      LYS  33   8.670   4.699   0.962
  238    HG3  LYS  33           2HG      LYS  33   7.521   3.526   0.314
  239    HD2  LYS  33           1HD      LYS  33   8.812   3.164  -1.614
  240    HD3  LYS  33           2HD      LYS  33   9.767   4.625  -1.352
  241    HE2  LYS  33           1HE      LYS  33  11.097   2.695  -0.796
  242    HE3  LYS  33           2HE      LYS  33  10.723   3.585   0.679
  243    HZ1  LYS  33           3HZ      LYS  33   8.839   1.497  -0.010
  244    HZ2  LYS  33           1HZ      LYS  33   9.513   1.899   1.489
  245    HZ3  LYS  33           2HZ      LYS  33  10.388   0.951   0.396
  246    H    CYS  34           H        CYS  34   4.574   6.121  -1.564
  247    HA   CYS  34           HA       CYS  34   4.918   8.739  -2.474
  248    HB2  CYS  34           1HB      CYS  34   3.586   6.690  -3.464
  249    HB3  CYS  34           2HB      CYS  34   2.230   7.436  -2.629
  250    HG   CYS  34           HG       CYS  34   2.460   8.043  -5.478
  251    H    HIS  35           H        HIS  35   2.973   7.447   0.130
  252    HA   HIS  35           HA       HIS  35   1.488   9.876   0.541
  253    HB2  HIS  35           1HB      HIS  35   1.765   7.321   2.117
  254    HB3  HIS  35           2HB      HIS  35   0.829   8.690   2.709
  255    HD1  HIS  35           HD1      HIS  35  -1.011   9.535   0.726
  256    HD2  HIS  35           HD2      HIS  35   0.203   5.562   0.806
  257    HE1  HIS  35           HE1      HIS  35  -2.779   8.265  -0.534
  258    H    THR  36           H        THR  36   4.034  10.676   0.472
  259    HA   THR  36           HA       THR  36   4.614  11.330   3.282
  260    HB   THR  36           HB       THR  36   7.034  11.346   2.742
  261    HG1  THR  36           HG1      THR  36   6.033  10.491   0.246
  262   HG21  THR  36          3HG2      THR  36   5.470   8.798   2.437
  263   HG22  THR  36          1HG2      THR  36   6.329   9.401   3.854
  264   HG23  THR  36          2HG2      THR  36   7.233   8.804   2.462
  265    H    GLY  37           H        GLY  37   5.062  12.260  -0.115
  266    HA2  GLY  37           1HA      GLY  37   5.737  14.985   0.643
  267    HA3  GLY  37           2HA      GLY  37   5.669  14.341  -0.991
  268    H    GLU  38           H        GLU  38   4.123  15.194  -2.195
  269    HA   GLU  38           HA       GLU  38   2.121  16.887  -1.217
  270    HB2  GLU  38           1HB      GLU  38   1.217  16.874  -3.461
  271    HB3  GLU  38           2HB      GLU  38   2.972  16.919  -3.541
  272    HG2  GLU  38           1HG      GLU  38   2.299  15.402  -5.194
  273    HG3  GLU  38           2HG      GLU  38   2.894  14.416  -3.860
  274    H    ARG  39           H        ARG  39  -0.238  16.590  -1.467
  275    HA   ARG  39           HA       ARG  39  -1.408  14.020  -1.603
  276    HB2  ARG  39           1HB      ARG  39  -0.189  14.091   0.696
  277    HB3  ARG  39           2HB      ARG  39  -1.519  15.136   1.180
  278    HG2  ARG  39           1HG      ARG  39  -3.113  13.374   0.602
  279    HG3  ARG  39           2HG      ARG  39  -1.775  12.327   0.126
  280    HD2  ARG  39           1HD      ARG  39  -2.456  11.728   2.345
  281    HD3  ARG  39           2HD      ARG  39  -0.882  12.517   2.437
  282    HE   ARG  39           HE       ARG  39  -3.154  14.258   2.841
  283   HH11  ARG  39          1HH1      ARG  39  -0.767  12.198   4.318
  284   HH12  ARG  39          2HH1      ARG  39  -0.893  12.948   5.874
  285   HH21  ARG  39          1HH2      ARG  39  -3.329  15.254   4.886
  286   HH22  ARG  39          2HH2      ARG  39  -2.351  14.686   6.197
  287    H    HIS  40           H        HIS  40  -3.669  14.094  -1.564
  288    HA   HIS  40           HA       HIS  40  -4.768  16.744  -1.978
  289    HB2  HIS  40           1HB      HIS  40  -5.233  14.549  -3.343
  290    HB3  HIS  40           2HB      HIS  40  -6.415  14.243  -2.074
  291    HD2  HIS  40           HD2      HIS  40  -7.635  14.762  -4.984
  292    HE1  HIS  40           HE1      HIS  40  -8.448  18.698  -3.624
  293    HE2  HIS  40           HE2      HIS  40  -9.037  16.913  -5.300
  294    H    SER  41           H        SER  41  -5.574  13.924   0.050
  295    HA   SER  41           HA       SER  41  -6.232  15.612   2.277
  296    HB2  SER  41           1HB      SER  41  -8.297  15.733   0.852
  297    HB3  SER  41           2HB      SER  41  -8.478  13.991   1.057
  298    HG   SER  41           HG       SER  41  -9.257  15.933   2.696
  299    H    GLY  42           H        GLY  42  -5.334  14.541   3.902
  300    HA2  GLY  42           1HA      GLY  42  -5.656  11.603   3.977
  301    HA3  GLY  42           2HA      GLY  42  -4.175  12.408   4.475
  302    HA   PRO  43           HA       PRO  43  -7.621  13.294   7.794
  303    HB2  PRO  43           1HB      PRO  43  -9.662  11.504   7.802
  304    HB3  PRO  43           2HB      PRO  43  -9.713  13.014   6.885
  305    HG2  PRO  43           1HG      PRO  43  -9.075  10.245   5.941
  306    HG3  PRO  43           2HG      PRO  43 -10.081  11.486   5.171
  307    HD2  PRO  43           1HD      PRO  43  -7.531  10.994   4.403
  308    HD3  PRO  43           2HD      PRO  43  -8.259  12.611   4.316
  309    H    SER  44           H        SER  44  -6.677  12.654   9.618
  310    HA   SER  44           HA       SER  44  -6.254   9.768  10.048
  311    HB2  SER  44           1HB      SER  44  -4.103  10.769   9.852
  312    HB3  SER  44           2HB      SER  44  -4.566  12.134  10.868
  313    HG   SER  44           HG       SER  44  -4.092  11.000  12.569
  314    H    SER  45           H        SER  45  -6.528   8.959  12.170
  315    HA   SER  45           HA       SER  45  -8.739  10.024  13.555
  316    HB2  SER  45           1HB      SER  45  -8.278   7.647  13.631
  317    HB3  SER  45           2HB      SER  45  -6.713   7.936  14.391
  318    HG   SER  45           HG       SER  45  -7.982   8.942  16.132
  319    H    GLY  46           H        GLY  46  -8.755  11.796  14.762
  320    HA2  GLY  46           1HA      GLY  46  -8.087  12.759  16.902
  321    HA3  GLY  46           2HA      GLY  46  -6.434  12.301  16.517
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1  -7.441  15.483   4.650
    2    HA2  GLY   1           1HA      GLY   1  -9.162  13.175   5.142
    3    HA3  GLY   1           2HA      GLY   1  -9.610  14.644   4.287
    4    H    SER   2           H        SER   2 -10.269  12.135   3.316
    5    HA   SER   2           HA       SER   2  -8.712  12.107   0.833
    6    HB2  SER   2           1HB      SER   2  -7.764  10.260   1.999
    7    HB3  SER   2           2HB      SER   2  -9.343   9.711   2.559
    8    HG   SER   2           HG       SER   2  -8.337   9.665  -0.091
    9    H    SER   3           H        SER   3  -9.881  11.690  -1.000
   10    HA   SER   3           HA       SER   3 -12.596  12.280  -1.036
   11    HB2  SER   3           1HB      SER   3 -10.938  12.344  -2.978
   12    HB3  SER   3           2HB      SER   3 -11.229  10.613  -3.150
   13    HG   SER   3           HG       SER   3 -13.332  12.505  -3.120
   14    H    GLY   4           H        GLY   4 -14.465  11.050  -1.268
   15    HA2  GLY   4           1HA      GLY   4 -14.934   8.905   0.273
   16    HA3  GLY   4           2HA      GLY   4 -15.796   9.148  -1.239
   17    H    SER   5           H        SER   5 -13.631   7.179   0.474
   18    HA   SER   5           HA       SER   5 -12.535   5.864  -1.863
   19    HB2  SER   5           1HB      SER   5 -11.056   6.009   0.008
   20    HB3  SER   5           2HB      SER   5 -12.272   5.351   1.103
   21    HG   SER   5           HG       SER   5 -11.359   3.512   0.667
   22    H    SER   6           H        SER   6 -13.407   4.181  -2.872
   23    HA   SER   6           HA       SER   6 -15.401   2.552  -1.447
   24    HB2  SER   6           1HB      SER   6 -16.884   2.561  -3.296
   25    HB3  SER   6           2HB      SER   6 -16.398   4.243  -3.090
   26    HG   SER   6           HG       SER   6 -16.237   3.710  -5.256
   27    H    GLY   7           H        GLY   7 -15.834   0.450  -2.627
   28    HA2  GLY   7           1HA      GLY   7 -14.919  -1.125  -4.296
   29    HA3  GLY   7           2HA      GLY   7 -13.326  -0.537  -3.842
   30    H    THR   8           H        THR   8 -15.379  -3.056  -3.503
   31    HA   THR   8           HA       THR   8 -15.088  -3.699  -0.748
   32    HB   THR   8           HB       THR   8 -15.624  -5.620  -3.019
   33    HG1  THR   8           HG1      THR   8 -17.237  -3.723  -1.736
   34   HG21  THR   8          3HG2      THR   8 -15.424  -7.063  -1.291
   35   HG22  THR   8          1HG2      THR   8 -17.048  -6.504  -0.893
   36   HG23  THR   8          2HG2      THR   8 -15.649  -5.804  -0.078
   37    H    GLY   9           H        GLY   9 -13.177  -4.078   0.172
   38    HA2  GLY   9           1HA      GLY   9 -10.781  -4.657  -1.052
   39    HA3  GLY   9           2HA      GLY   9 -11.159  -5.089   0.609
   40    H    GLU  10           H        GLU  10  -9.997  -6.335  -2.125
   41    HA   GLU  10           HA       GLU  10 -11.202  -8.982  -1.647
   42    HB2  GLU  10           1HB      GLU  10 -11.794  -8.311  -3.852
   43    HB3  GLU  10           2HB      GLU  10 -10.167  -7.737  -4.189
   44    HG2  GLU  10           1HG      GLU  10 -10.281  -9.734  -5.347
   45    HG3  GLU  10           2HG      GLU  10  -9.455 -10.180  -3.855
   46    H    LYS  11           H        LYS  11  -8.218  -7.330  -2.646
   47    HA   LYS  11           HA       LYS  11  -6.563  -9.623  -2.346
   48    HB2  LYS  11           1HB      LYS  11  -5.664  -6.745  -2.232
   49    HB3  LYS  11           2HB      LYS  11  -4.719  -8.147  -2.715
   50    HG2  LYS  11           1HG      LYS  11  -6.858  -6.704  -4.221
   51    HG3  LYS  11           2HG      LYS  11  -5.222  -7.130  -4.729
   52    HD2  LYS  11           1HD      LYS  11  -7.474  -9.085  -4.264
   53    HD3  LYS  11           2HD      LYS  11  -6.932  -8.507  -5.841
   54    HE2  LYS  11           1HE      LYS  11  -4.723  -9.473  -5.435
   55    HE3  LYS  11           2HE      LYS  11  -5.257 -10.040  -3.854
   56    HZ1  LYS  11           3HZ      LYS  11  -5.821 -11.110  -6.494
   57    HZ2  LYS  11           1HZ      LYS  11  -7.123 -11.110  -5.413
   58    HZ3  LYS  11           2HZ      LYS  11  -5.688 -11.907  -5.007
   59    HA   PRO  12           HA       PRO  12  -5.824  -9.712   1.982
   60    HB2  PRO  12           1HB      PRO  12  -3.275 -10.644   2.041
   61    HB3  PRO  12           2HB      PRO  12  -4.658 -11.658   1.615
   62    HG2  PRO  12           1HG      PRO  12  -2.686 -10.292  -0.177
   63    HG3  PRO  12           2HG      PRO  12  -3.352 -11.932  -0.289
   64    HD2  PRO  12           1HD      PRO  12  -4.265  -9.882  -1.804
   65    HD3  PRO  12           2HD      PRO  12  -5.314 -11.204  -1.256
   66    H    TYR  13           H        TYR  13  -4.457  -7.458  -0.000
   67    HA   TYR  13           HA       TYR  13  -3.198  -6.088   2.276
   68    HB2  TYR  13           1HB      TYR  13  -2.099  -5.803  -0.506
   69    HB3  TYR  13           2HB      TYR  13  -1.326  -5.426   1.030
   70    HD1  TYR  13           HD1      TYR  13  -1.321  -7.689   2.633
   71    HD2  TYR  13           HD2      TYR  13  -1.126  -7.564  -1.615
   72    HE1  TYR  13           HE1      TYR  13  -0.221  -9.889   2.625
   73    HE2  TYR  13           HE2      TYR  13  -0.026  -9.765  -1.635
   74    HH   TYR  13           HH       TYR  13   0.680 -11.493   1.389
   75    H    LYS  14           H        LYS  14  -3.681  -3.966   2.488
   76    HA   LYS  14           HA       LYS  14  -4.803  -2.452   0.297
   77    HB2  LYS  14           1HB      LYS  14  -6.814  -3.530   1.039
   78    HB3  LYS  14           2HB      LYS  14  -6.446  -3.181   2.723
   79    HG2  LYS  14           1HG      LYS  14  -6.531  -0.697   1.924
   80    HG3  LYS  14           2HG      LYS  14  -7.472  -1.370   0.592
   81    HD2  LYS  14           1HD      LYS  14  -9.089  -2.280   2.115
   82    HD3  LYS  14           2HD      LYS  14  -8.097  -1.835   3.506
   83    HE2  LYS  14           1HE      LYS  14  -8.923   0.310   1.619
   84    HE3  LYS  14           2HE      LYS  14 -10.138  -0.349   2.713
   85    HZ1  LYS  14           3HZ      LYS  14  -8.592   1.657   3.392
   86    HZ2  LYS  14           1HZ      LYS  14  -7.558   0.401   3.858
   87    HZ3  LYS  14           2HZ      LYS  14  -9.108   0.511   4.524
   88    H    CYS  15           H        CYS  15  -4.587  -0.262   0.564
   89    HA   CYS  15           HA       CYS  15  -2.883   0.584   2.744
   90    HB2  CYS  15           1HB      CYS  15  -2.447   1.336   0.433
   91    HB3  CYS  15           2HB      CYS  15  -4.001   2.164   0.418
   92    H    SER  16           H        SER  16  -3.380   2.055   4.330
   93    HA   SER  16           HA       SER  16  -6.238   2.456   4.809
   94    HB2  SER  16           1HB      SER  16  -3.833   2.733   6.625
   95    HB3  SER  16           2HB      SER  16  -5.486   3.101   7.117
   96    HG   SER  16           HG       SER  16  -4.264   0.652   6.673
   97    H    ASP  17           H        ASP  17  -3.383   4.172   3.948
   98    HA   ASP  17           HA       ASP  17  -4.059   6.753   4.841
   99    HB2  ASP  17           1HB      ASP  17  -1.830   5.831   3.843
  100    HB3  ASP  17           2HB      ASP  17  -2.533   6.298   2.297
  101    H    CYS  18           H        CYS  18  -4.320   5.422   1.538
  102    HA   CYS  18           HA       CYS  18  -6.267   7.500   0.888
  103    HB2  CYS  18           1HB      CYS  18  -6.017   6.638  -1.444
  104    HB3  CYS  18           2HB      CYS  18  -4.510   7.207  -0.734
  105    H    GLY  19           H        GLY  19  -5.967   3.957   0.823
  106    HA2  GLY  19           1HA      GLY  19  -7.857   2.660   1.677
  107    HA3  GLY  19           2HA      GLY  19  -8.917   3.823   0.895
  108    H    LYS  20           H        LYS  20  -6.015   2.414  -0.518
  109    HA   LYS  20           HA       LYS  20  -7.705   1.241  -2.615
  110    HB2  LYS  20           1HB      LYS  20  -4.942   2.361  -2.561
  111    HB3  LYS  20           2HB      LYS  20  -5.288   1.075  -3.711
  112    HG2  LYS  20           1HG      LYS  20  -6.916   2.364  -4.820
  113    HG3  LYS  20           2HG      LYS  20  -6.971   3.554  -3.517
  114    HD2  LYS  20           1HD      LYS  20  -5.677   4.657  -5.068
  115    HD3  LYS  20           2HD      LYS  20  -4.435   3.859  -4.101
  116    HE2  LYS  20           1HE      LYS  20  -3.797   3.424  -6.302
  117    HE3  LYS  20           2HE      LYS  20  -4.620   1.947  -5.801
  118    HZ1  LYS  20           3HZ      LYS  20  -6.672   3.161  -6.824
  119    HZ2  LYS  20           1HZ      LYS  20  -5.587   2.328  -7.819
  120    HZ3  LYS  20           2HZ      LYS  20  -5.496   4.012  -7.691
  121    H    SER  21           H        SER  21  -6.798  -0.789  -3.623
  122    HA   SER  21           HA       SER  21  -5.906  -2.597  -1.479
  123    HB2  SER  21           1HB      SER  21  -8.184  -2.865  -2.796
  124    HB3  SER  21           2HB      SER  21  -7.143  -3.621  -4.002
  125    HG   SER  21           HG       SER  21  -7.460  -5.315  -2.777
  126    H    PHE  22           H        PHE  22  -4.397  -4.258  -1.984
  127    HA   PHE  22           HA       PHE  22  -2.889  -3.916  -4.474
  128    HB2  PHE  22           1HB      PHE  22  -1.571  -4.093  -1.759
  129    HB3  PHE  22           2HB      PHE  22  -0.766  -3.895  -3.312
  130    HD1  PHE  22           HD1      PHE  22  -3.450  -2.216  -1.331
  131    HD2  PHE  22           HD2      PHE  22  -0.020  -1.792  -3.815
  132    HE1  PHE  22           HE1      PHE  22  -3.572   0.228  -1.075
  133    HE2  PHE  22           HE2      PHE  22  -0.135   0.653  -3.562
  134    HZ   PHE  22           HZ       PHE  22  -1.912   1.666  -2.191
  135    H    THR  23           H        THR  23  -2.165  -5.777  -5.352
  136    HA   THR  23           HA       THR  23  -3.024  -8.254  -4.125
  137    HB   THR  23           HB       THR  23  -1.664  -7.752  -6.779
  138    HG1  THR  23           HG1      THR  23  -3.690  -7.792  -7.612
  139   HG21  THR  23          3HG2      THR  23  -3.084 -10.172  -6.816
  140   HG22  THR  23          1HG2      THR  23  -2.148 -10.186  -5.322
  141   HG23  THR  23          2HG2      THR  23  -1.335  -9.956  -6.869
  142    H    TRP  24           H        TRP  24  -0.098  -6.465  -4.524
  143    HA   TRP  24           HA       TRP  24   1.435  -8.746  -3.459
  144    HB2  TRP  24           1HB      TRP  24   2.256  -6.528  -5.327
  145    HB3  TRP  24           2HB      TRP  24   3.442  -7.473  -4.431
  146    HD1  TRP  24           HD1      TRP  24   0.373  -8.388  -6.650
  147    HE1  TRP  24           HE1      TRP  24   1.088 -10.297  -8.221
  148    HE3  TRP  24           HE3      TRP  24   5.213  -8.947  -5.100
  149    HZ2  TRP  24           HZ2      TRP  24   3.397 -11.838  -8.735
  150    HZ3  TRP  24           HZ3      TRP  24   6.607 -10.662  -6.183
  151    HH2  TRP  24           HH2      TRP  24   5.716 -12.076  -7.962
  152    H    LYS  25           H        LYS  25   2.971  -8.337  -1.830
  153    HA   LYS  25           HA       LYS  25   2.201  -6.344   0.045
  154    HB2  LYS  25           1HB      LYS  25   4.381  -8.395  -0.090
  155    HB3  LYS  25           2HB      LYS  25   4.438  -7.149   1.150
  156    HG2  LYS  25           1HG      LYS  25   2.040  -7.881   1.707
  157    HG3  LYS  25           2HG      LYS  25   2.417  -9.323   0.761
  158    HD2  LYS  25           1HD      LYS  25   4.516  -9.481   2.251
  159    HD3  LYS  25           2HD      LYS  25   3.662  -8.361   3.315
  160    HE2  LYS  25           1HE      LYS  25   3.076 -10.439   4.168
  161    HE3  LYS  25           2HE      LYS  25   1.708 -10.039   3.130
  162    HZ1  LYS  25           3HZ      LYS  25   3.906 -11.946   2.604
  163    HZ2  LYS  25           1HZ      LYS  25   2.924 -11.354   1.360
  164    HZ3  LYS  25           2HZ      LYS  25   2.241 -12.242   2.627
  165    H    SER  26           H        SER  26   5.379  -6.853  -1.499
  166    HA   SER  26           HA       SER  26   6.631  -4.545  -0.816
  167    HB2  SER  26           1HB      SER  26   7.586  -4.734  -3.307
  168    HB3  SER  26           2HB      SER  26   8.028  -5.884  -2.045
  169    HG   SER  26           HG       SER  26   6.927  -6.440  -4.335
  170    H    ARG  27           H        ARG  27   4.598  -4.943  -3.717
  171    HA   ARG  27           HA       ARG  27   4.731  -2.411  -4.754
  172    HB2  ARG  27           1HB      ARG  27   2.482  -4.404  -4.661
  173    HB3  ARG  27           2HB      ARG  27   2.280  -2.849  -5.458
  174    HG2  ARG  27           1HG      ARG  27   2.873  -4.569  -7.058
  175    HG3  ARG  27           2HG      ARG  27   4.155  -3.363  -6.938
  176    HD2  ARG  27           1HD      ARG  27   4.228  -5.883  -5.315
  177    HD3  ARG  27           2HD      ARG  27   4.810  -5.851  -6.979
  178    HE   ARG  27           HE       ARG  27   6.112  -4.758  -4.675
  179   HH11  ARG  27          1HH1      ARG  27   5.732  -4.464  -8.123
  180   HH12  ARG  27          2HH1      ARG  27   7.271  -3.704  -8.359
  181   HH21  ARG  27          1HH2      ARG  27   8.141  -3.759  -4.973
  182   HH22  ARG  27          2HH2      ARG  27   8.641  -3.304  -6.566
  183    H    LEU  28           H        LEU  28   2.699  -3.547  -2.095
  184    HA   LEU  28           HA       LEU  28   1.226  -1.156  -1.766
  185    HB2  LEU  28           1HB      LEU  28   0.411  -3.209  -0.839
  186    HB3  LEU  28           2HB      LEU  28   1.863  -3.398   0.142
  187    HG   LEU  28           HG       LEU  28   1.146  -1.284   1.352
  188   HD11  LEU  28          1HD1      LEU  28  -1.652  -1.730   0.708
  189   HD12  LEU  28          2HD1      LEU  28  -0.721  -1.141  -0.668
  190   HD13  LEU  28          3HD1      LEU  28  -0.744  -0.224   0.838
  191   HD21  LEU  28          3HD2      LEU  28  -0.232  -2.485   2.861
  192   HD22  LEU  28          1HD2      LEU  28   0.893  -3.654   2.170
  193   HD23  LEU  28          2HD2      LEU  28  -0.773  -3.590   1.597
  194    H    ARG  29           H        ARG  29   4.057  -2.433  -0.022
  195    HA   ARG  29           HA       ARG  29   4.446  -0.396   1.787
  196    HB2  ARG  29           1HB      ARG  29   6.606  -1.902   0.300
  197    HB3  ARG  29           2HB      ARG  29   6.807  -1.043   1.821
  198    HG2  ARG  29           1HG      ARG  29   4.982  -2.623   2.710
  199    HG3  ARG  29           2HG      ARG  29   5.341  -3.594   1.280
  200    HD2  ARG  29           1HD      ARG  29   7.491  -2.677   3.166
  201    HD3  ARG  29           2HD      ARG  29   6.583  -4.163   3.440
  202    HE   ARG  29           HE       ARG  29   7.521  -4.287   0.843
  203   HH11  ARG  29          1HH1      ARG  29   8.870  -4.079   4.045
  204   HH12  ARG  29          2HH1      ARG  29  10.318  -4.935   3.632
  205   HH21  ARG  29          1HH2      ARG  29   9.424  -5.414   0.286
  206   HH22  ARG  29          2HH2      ARG  29  10.633  -5.693   1.493
  207    H    ILE  30           H        ILE  30   6.019  -0.637  -1.409
  208    HA   ILE  30           HA       ILE  30   7.294   1.807  -1.429
  209    HB   ILE  30           HB       ILE  30   6.016   0.426  -3.792
  210   HG12  ILE  30          1HG1      ILE  30   8.926   0.296  -3.091
  211   HG13  ILE  30          2HG1      ILE  30   7.790  -0.764  -2.264
  212   HG21  ILE  30          1HG2      ILE  30   8.422   2.159  -4.022
  213   HG22  ILE  30          2HG2      ILE  30   7.161   1.812  -5.204
  214   HG23  ILE  30          3HG2      ILE  30   6.842   2.929  -3.877
  215   HD11  ILE  30          3HD1      ILE  30   8.982  -1.069  -4.821
  216   HD12  ILE  30          1HD1      ILE  30   7.907  -2.170  -3.960
  217   HD13  ILE  30          2HD1      ILE  30   7.236  -0.933  -5.024
  218    H    HIS  31           H        HIS  31   3.974   1.063  -2.428
  219    HA   HIS  31           HA       HIS  31   3.229   3.526  -3.446
  220    HB2  HIS  31           1HB      HIS  31   1.661   1.817  -3.735
  221    HB3  HIS  31           2HB      HIS  31   1.704   1.357  -2.036
  222    HD1  HIS  31           HD1      HIS  31   0.280   3.985  -4.329
  223    HD2  HIS  31           HD2      HIS  31  -0.125   2.640  -0.419
  224    HE1  HIS  31           HE1      HIS  31  -1.746   5.165  -3.418
  225    H    GLN  32           H        GLN  32   2.900   2.386  -0.085
  226    HA   GLN  32           HA       GLN  32   1.757   4.566   1.090
  227    HB2  GLN  32           1HB      GLN  32   3.878   2.690   2.107
  228    HB3  GLN  32           2HB      GLN  32   3.210   3.960   3.124
  229    HG2  GLN  32           1HG      GLN  32   1.361   2.083   1.735
  230    HG3  GLN  32           2HG      GLN  32   2.222   1.547   3.177
  231   HE21  GLN  32          1HE2      GLN  32  -0.392   1.530   3.390
  232   HE22  GLN  32          2HE2      GLN  32  -0.979   2.854   4.332
  233    H    LYS  33           H        LYS  33   5.281   4.068   0.829
  234    HA   LYS  33           HA       LYS  33   6.235   6.385   1.850
  235    HB2  LYS  33           1HB      LYS  33   7.204   5.069  -0.695
  236    HB3  LYS  33           2HB      LYS  33   8.127   6.207   0.277
  237    HG2  LYS  33           1HG      LYS  33   7.725   4.498   2.190
  238    HG3  LYS  33           2HG      LYS  33   7.388   3.377   0.869
  239    HD2  LYS  33           1HD      LYS  33   9.623   4.190  -0.113
  240    HD3  LYS  33           2HD      LYS  33   9.935   4.836   1.500
  241    HE2  LYS  33           1HE      LYS  33  10.925   2.688   1.439
  242    HE3  LYS  33           2HE      LYS  33   9.447   2.525   2.387
  243    HZ1  LYS  33           3HZ      LYS  33   9.098   2.042  -0.434
  244    HZ2  LYS  33           1HZ      LYS  33   8.556   1.144   0.894
  245    HZ3  LYS  33           2HZ      LYS  33  10.135   0.941   0.322
  246    H    CYS  34           H        CYS  34   4.646   5.982  -1.251
  247    HA   CYS  34           HA       CYS  34   5.279   8.422  -2.437
  248    HB2  CYS  34           1HB      CYS  34   4.075   6.473  -3.504
  249    HB3  CYS  34           2HB      CYS  34   2.618   7.014  -2.680
  250    HG   CYS  34           HG       CYS  34   3.218   7.746  -5.592
  251    H    HIS  35           H        HIS  35   2.493   7.591  -0.383
  252    HA   HIS  35           HA       HIS  35   1.165   9.995  -0.372
  253    HB2  HIS  35           1HB      HIS  35   1.536   7.950   1.811
  254    HB3  HIS  35           2HB      HIS  35   0.498   9.358   2.016
  255    HD1  HIS  35           HD1      HIS  35  -0.797   9.353  -0.815
  256    HD2  HIS  35           HD2      HIS  35  -0.384   6.012   1.619
  257    HE1  HIS  35           HE1      HIS  35  -2.567   7.739  -1.582
  258    H    THR  36           H        THR  36   3.224   9.064   2.376
  259    HA   THR  36           HA       THR  36   3.559  11.724   3.267
  260    HB   THR  36           HB       THR  36   3.794   9.854   4.808
  261    HG1  THR  36           HG1      THR  36   6.063  10.498   5.549
  262   HG21  THR  36          3HG2      THR  36   5.158   8.089   4.508
  263   HG22  THR  36          1HG2      THR  36   6.492   9.093   3.940
  264   HG23  THR  36          2HG2      THR  36   5.208   8.620   2.827
  265    H    GLY  37           H        GLY  37   4.661  13.254   2.233
  266    HA2  GLY  37           1HA      GLY  37   7.260  13.565   1.858
  267    HA3  GLY  37           2HA      GLY  37   6.891  12.517   0.496
  268    H    GLU  38           H        GLU  38   4.404  13.526  -0.247
  269    HA   GLU  38           HA       GLU  38   4.681  16.380  -0.663
  270    HB2  GLU  38           1HB      GLU  38   5.151  14.361  -2.813
  271    HB3  GLU  38           2HB      GLU  38   4.328  15.858  -3.230
  272    HG2  GLU  38           1HG      GLU  38   6.354  16.947  -1.966
  273    HG3  GLU  38           2HG      GLU  38   7.133  15.414  -2.356
  274    H    ARG  39           H        ARG  39   2.795  17.340  -1.644
  275    HA   ARG  39           HA       ARG  39   0.382  16.022  -0.826
  276    HB2  ARG  39           1HB      ARG  39  -0.738  18.070  -1.457
  277    HB3  ARG  39           2HB      ARG  39   0.733  18.464  -0.577
  278    HG2  ARG  39           1HG      ARG  39   1.760  18.620  -2.983
  279    HG3  ARG  39           2HG      ARG  39   0.076  18.862  -3.450
  280    HD2  ARG  39           1HD      ARG  39  -0.104  20.743  -1.932
  281    HD3  ARG  39           2HD      ARG  39   1.542  20.471  -1.364
  282    HE   ARG  39           HE       ARG  39   1.359  20.907  -4.198
  283   HH11  ARG  39          1HH1      ARG  39   1.610  22.433  -1.079
  284   HH12  ARG  39          2HH1      ARG  39   2.320  23.885  -1.702
  285   HH21  ARG  39          1HH2      ARG  39   2.292  22.814  -5.030
  286   HH22  ARG  39          2HH2      ARG  39   2.706  24.102  -3.950
  287    H    HIS  40           H        HIS  40  -0.627  14.555  -2.016
  288    HA   HIS  40           HA       HIS  40  -0.779  14.957  -4.924
  289    HB2  HIS  40           1HB      HIS  40  -0.337  12.294  -3.557
  290    HB3  HIS  40           2HB      HIS  40  -0.509  12.555  -5.291
  291    HD2  HIS  40           HD2      HIS  40   2.264  11.268  -4.042
  292    HE1  HIS  40           HE1      HIS  40   3.926  15.036  -5.063
  293    HE2  HIS  40           HE2      HIS  40   4.410  12.614  -4.566
  294    H    SER  41           H        SER  41  -2.488  13.335  -5.846
  295    HA   SER  41           HA       SER  41  -4.772  13.143  -4.009
  296    HB2  SER  41           1HB      SER  41  -5.121  15.181  -5.286
  297    HB3  SER  41           2HB      SER  41  -4.832  14.320  -6.798
  298    HG   SER  41           HG       SER  41  -6.800  13.563  -6.742
  299    H    GLY  42           H        GLY  42  -6.389  11.597  -4.633
  300    HA2  GLY  42           1HA      GLY  42  -5.310   9.520  -6.439
  301    HA3  GLY  42           2HA      GLY  42  -6.245   9.169  -4.993
  302    HA   PRO  43           HA       PRO  43  -9.360  11.015  -8.208
  303    HB2  PRO  43           1HB      PRO  43  -8.435  11.325 -10.742
  304    HB3  PRO  43           2HB      PRO  43  -8.341  12.601  -9.522
  305    HG2  PRO  43           1HG      PRO  43  -6.227  10.683 -10.425
  306    HG3  PRO  43           2HG      PRO  43  -6.094  12.420 -10.095
  307    HD2  PRO  43           1HD      PRO  43  -5.291  10.535  -8.324
  308    HD3  PRO  43           2HD      PRO  43  -5.949  12.104  -7.816
  309    H    SER  44           H        SER  44 -10.104   8.864  -7.844
  310    HA   SER  44           HA       SER  44  -9.398   6.869  -9.867
  311    HB2  SER  44           1HB      SER  44  -9.379   6.225  -7.456
  312    HB3  SER  44           2HB      SER  44 -11.113   6.538  -7.393
  313    HG   SER  44           HG       SER  44 -11.030   4.429  -7.842
  314    H    SER  45           H        SER  45 -10.863   9.011 -10.836
  315    HA   SER  45           HA       SER  45 -13.399   7.687 -11.507
  316    HB2  SER  45           1HB      SER  45 -14.603   9.788 -11.403
  317    HB3  SER  45           2HB      SER  45 -13.806   9.513  -9.854
  318    HG   SER  45           HG       SER  45 -12.860  11.352 -10.150
  319    H    GLY  46           H        GLY  46 -14.398   8.659 -13.512
  320    HA2  GLY  46           1HA      GLY  46 -13.466  10.263 -15.392
  321    HA3  GLY  46           2HA      GLY  46 -12.280   8.970 -15.502
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1 -21.083   9.651  -9.928
    2    HA2  GLY   1           1HA      GLY   1 -21.947   9.371 -12.578
    3    HA3  GLY   1           2HA      GLY   1 -20.862  10.752 -12.511
    4    H    SER   2           H        SER   2 -19.726   9.227 -14.063
    5    HA   SER   2           HA       SER   2 -18.273   7.067 -12.764
    6    HB2  SER   2           1HB      SER   2 -18.391   8.045 -15.619
    7    HB3  SER   2           2HB      SER   2 -17.288   6.774 -15.091
    8    HG   SER   2           HG       SER   2 -19.914   6.434 -14.321
    9    H    SER   3           H        SER   3 -17.689   9.568 -11.692
   10    HA   SER   3           HA       SER   3 -15.723  11.148 -12.556
   11    HB2  SER   3           1HB      SER   3 -16.187   9.915  -9.875
   12    HB3  SER   3           2HB      SER   3 -14.712  10.848 -10.125
   13    HG   SER   3           HG       SER   3 -16.444  12.396 -11.110
   14    H    GLY   4           H        GLY   4 -14.961   8.064 -10.919
   15    HA2  GLY   4           1HA      GLY   4 -12.441   8.013 -12.464
   16    HA3  GLY   4           2HA      GLY   4 -12.581   7.408 -10.820
   17    H    SER   5           H        SER   5 -11.783   5.375 -11.484
   18    HA   SER   5           HA       SER   5 -13.618   3.814 -13.176
   19    HB2  SER   5           1HB      SER   5 -10.687   3.422 -12.547
   20    HB3  SER   5           2HB      SER   5 -11.667   2.225 -13.392
   21    HG   SER   5           HG       SER   5 -11.746   4.826 -14.369
   22    H    SER   6           H        SER   6 -14.055   1.607 -12.558
   23    HA   SER   6           HA       SER   6 -13.810   1.139  -9.659
   24    HB2  SER   6           1HB      SER   6 -16.032   0.381  -9.517
   25    HB3  SER   6           2HB      SER   6 -16.141   1.804 -10.553
   26    HG   SER   6           HG       SER   6 -17.128   0.445 -11.831
   27    H    GLY   7           H        GLY   7 -13.261  -0.892  -9.005
   28    HA2  GLY   7           1HA      GLY   7 -13.529  -3.252 -10.480
   29    HA3  GLY   7           2HA      GLY   7 -11.941  -2.587 -10.835
   30    H    THR   8           H        THR   8 -13.870  -2.757  -7.846
   31    HA   THR   8           HA       THR   8 -11.641  -3.267  -6.199
   32    HB   THR   8           HB       THR   8 -13.261  -3.815  -4.440
   33    HG1  THR   8           HG1      THR   8 -15.454  -3.326  -6.076
   34   HG21  THR   8          3HG2      THR   8 -12.845  -1.408  -5.441
   35   HG22  THR   8          1HG2      THR   8 -14.060  -1.677  -4.192
   36   HG23  THR   8          2HG2      THR   8 -14.546  -1.546  -5.883
   37    H    GLY   9           H        GLY   9 -11.144  -5.194  -4.987
   38    HA2  GLY   9           1HA      GLY   9 -12.271  -7.722  -5.737
   39    HA3  GLY   9           2HA      GLY   9 -10.696  -7.455  -6.470
   40    H    GLU  10           H        GLU  10 -11.939  -9.185  -4.181
   41    HA   GLU  10           HA       GLU  10 -10.938  -8.646  -1.722
   42    HB2  GLU  10           1HB      GLU  10 -10.911 -11.295  -3.172
   43    HB3  GLU  10           2HB      GLU  10 -10.591 -11.120  -1.452
   44    HG2  GLU  10           1HG      GLU  10 -13.103  -9.966  -2.530
   45    HG3  GLU  10           2HG      GLU  10 -12.986 -11.718  -2.374
   46    H    LYS  11           H        LYS  11  -9.013  -8.240  -0.866
   47    HA   LYS  11           HA       LYS  11  -6.613  -9.435  -2.005
   48    HB2  LYS  11           1HB      LYS  11  -5.438  -7.321  -2.202
   49    HB3  LYS  11           2HB      LYS  11  -6.887  -7.289  -3.199
   50    HG2  LYS  11           1HG      LYS  11  -6.908  -6.163  -0.427
   51    HG3  LYS  11           2HG      LYS  11  -6.303  -5.220  -1.791
   52    HD2  LYS  11           1HD      LYS  11  -8.433  -5.459  -2.933
   53    HD3  LYS  11           2HD      LYS  11  -9.040  -6.484  -1.630
   54    HE2  LYS  11           1HE      LYS  11  -8.058  -3.699  -1.102
   55    HE3  LYS  11           2HE      LYS  11  -9.708  -4.001  -1.644
   56    HZ1  LYS  11           3HZ      LYS  11  -8.603  -4.296   0.947
   57    HZ2  LYS  11           1HZ      LYS  11  -9.251  -5.768   0.425
   58    HZ3  LYS  11           2HZ      LYS  11 -10.221  -4.383   0.462
   59    HA   PRO  12           HA       PRO  12  -5.584  -9.764   2.266
   60    HB2  PRO  12           1HB      PRO  12  -2.919 -10.219   2.015
   61    HB3  PRO  12           2HB      PRO  12  -4.142 -11.436   1.631
   62    HG2  PRO  12           1HG      PRO  12  -2.636  -9.618  -0.209
   63    HG3  PRO  12           2HG      PRO  12  -3.013 -11.340  -0.400
   64    HD2  PRO  12           1HD      PRO  12  -4.422  -9.393  -1.647
   65    HD3  PRO  12           2HD      PRO  12  -5.162 -10.918  -1.119
   66    H    TYR  13           H        TYR  13  -4.237  -7.375   0.176
   67    HA   TYR  13           HA       TYR  13  -3.362  -5.825   2.525
   68    HB2  TYR  13           1HB      TYR  13  -2.185  -5.490  -0.228
   69    HB3  TYR  13           2HB      TYR  13  -1.551  -4.911   1.309
   70    HD1  TYR  13           HD1      TYR  13  -0.695  -6.628   2.976
   71    HD2  TYR  13           HD2      TYR  13  -1.537  -7.578  -1.085
   72    HE1  TYR  13           HE1      TYR  13   0.701  -8.644   3.164
   73    HE2  TYR  13           HE2      TYR  13  -0.144  -9.597  -0.908
   74    HH   TYR  13           HH       TYR  13   2.006 -10.133   1.589
   75    H    LYS  14           H        LYS  14  -3.599  -3.518   2.361
   76    HA   LYS  14           HA       LYS  14  -4.960  -2.260   0.223
   77    HB2  LYS  14           1HB      LYS  14  -6.826  -3.630   1.162
   78    HB3  LYS  14           2HB      LYS  14  -6.643  -2.766   2.683
   79    HG2  LYS  14           1HG      LYS  14  -7.022  -0.644   1.291
   80    HG3  LYS  14           2HG      LYS  14  -7.622  -1.741   0.046
   81    HD2  LYS  14           1HD      LYS  14  -9.550  -1.153   1.206
   82    HD3  LYS  14           2HD      LYS  14  -9.106  -2.701   1.930
   83    HE2  LYS  14           1HE      LYS  14  -7.867  -1.339   3.688
   84    HE3  LYS  14           2HE      LYS  14  -8.721   0.064   3.047
   85    HZ1  LYS  14           3HZ      LYS  14  -9.660  -1.503   4.998
   86    HZ2  LYS  14           1HZ      LYS  14 -10.393  -2.220   3.652
   87    HZ3  LYS  14           2HZ      LYS  14 -10.642  -0.579   3.977
   88    H    CYS  15           H        CYS  15  -4.122  -0.292   0.299
   89    HA   CYS  15           HA       CYS  15  -2.809   0.809   2.508
   90    HB2  CYS  15           1HB      CYS  15  -2.413   1.496   0.162
   91    HB3  CYS  15           2HB      CYS  15  -3.991   2.276   0.140
   92    H    SER  16           H        SER  16  -3.597   1.597   4.334
   93    HA   SER  16           HA       SER  16  -6.407   2.227   4.577
   94    HB2  SER  16           1HB      SER  16  -4.945   1.015   6.323
   95    HB3  SER  16           2HB      SER  16  -4.343   2.620   6.736
   96    HG   SER  16           HG       SER  16  -6.839   3.006   6.754
   97    H    ASP  17           H        ASP  17  -3.443   3.925   4.127
   98    HA   ASP  17           HA       ASP  17  -4.066   6.419   5.221
   99    HB2  ASP  17           1HB      ASP  17  -2.435   5.922   2.723
  100    HB3  ASP  17           2HB      ASP  17  -2.335   7.318   3.792
  101    H    CYS  18           H        CYS  18  -4.564   5.215   1.909
  102    HA   CYS  18           HA       CYS  18  -6.414   7.460   1.455
  103    HB2  CYS  18           1HB      CYS  18  -6.041   7.067  -0.955
  104    HB3  CYS  18           2HB      CYS  18  -4.545   7.440  -0.106
  105    H    GLY  19           H        GLY  19  -5.963   3.992   0.798
  106    HA2  GLY  19           1HA      GLY  19  -7.892   2.565   1.441
  107    HA3  GLY  19           2HA      GLY  19  -8.906   3.759   0.643
  108    H    LYS  20           H        LYS  20  -5.826   2.418  -0.470
  109    HA   LYS  20           HA       LYS  20  -7.172   1.565  -2.929
  110    HB2  LYS  20           1HB      LYS  20  -4.360   2.300  -2.227
  111    HB3  LYS  20           2HB      LYS  20  -4.640   1.226  -3.591
  112    HG2  LYS  20           1HG      LYS  20  -6.288   3.027  -4.399
  113    HG3  LYS  20           2HG      LYS  20  -5.471   4.079  -3.241
  114    HD2  LYS  20           1HD      LYS  20  -3.310   3.158  -4.418
  115    HD3  LYS  20           2HD      LYS  20  -4.430   2.827  -5.741
  116    HE2  LYS  20           1HE      LYS  20  -5.127   5.179  -5.723
  117    HE3  LYS  20           2HE      LYS  20  -3.991   5.502  -4.414
  118    HZ1  LYS  20           3HZ      LYS  20  -2.481   5.906  -5.965
  119    HZ2  LYS  20           1HZ      LYS  20  -3.513   5.394  -7.204
  120    HZ3  LYS  20           2HZ      LYS  20  -2.529   4.274  -6.406
  121    H    SER  21           H        SER  21  -6.480  -0.484  -3.922
  122    HA   SER  21           HA       SER  21  -6.058  -2.539  -1.856
  123    HB2  SER  21           1HB      SER  21  -7.115  -4.089  -3.554
  124    HB3  SER  21           2HB      SER  21  -8.187  -2.847  -2.907
  125    HG   SER  21           HG       SER  21  -6.859  -2.838  -5.414
  126    H    PHE  22           H        PHE  22  -4.496  -4.081  -2.101
  127    HA   PHE  22           HA       PHE  22  -2.897  -4.091  -4.549
  128    HB2  PHE  22           1HB      PHE  22  -1.624  -3.872  -1.817
  129    HB3  PHE  22           2HB      PHE  22  -0.808  -3.858  -3.376
  130    HD1  PHE  22           HD1      PHE  22  -3.528  -1.985  -1.634
  131    HD2  PHE  22           HD2      PHE  22  -0.094  -1.825  -4.145
  132    HE1  PHE  22           HE1      PHE  22  -3.688   0.469  -1.690
  133    HE2  PHE  22           HE2      PHE  22  -0.248   0.630  -4.204
  134    HZ   PHE  22           HZ       PHE  22  -2.046   1.780  -2.975
  135    H    THR  23           H        THR  23  -2.377  -6.090  -5.167
  136    HA   THR  23           HA       THR  23  -3.178  -8.326  -3.534
  137    HB   THR  23           HB       THR  23  -2.204  -9.647  -5.532
  138    HG1  THR  23           HG1      THR  23  -2.370  -8.032  -7.433
  139   HG21  THR  23          3HG2      THR  23  -4.504  -7.743  -5.992
  140   HG22  THR  23          1HG2      THR  23  -4.607  -9.283  -5.140
  141   HG23  THR  23          2HG2      THR  23  -4.211  -9.251  -6.859
  142    H    TRP  24           H        TRP  24  -0.196  -6.762  -4.453
  143    HA   TRP  24           HA       TRP  24   1.310  -8.817  -2.974
  144    HB2  TRP  24           1HB      TRP  24   2.516  -6.862  -4.925
  145    HB3  TRP  24           2HB      TRP  24   3.211  -8.358  -4.308
  146    HD1  TRP  24           HD1      TRP  24   0.449  -7.155  -6.723
  147    HE1  TRP  24           HE1      TRP  24   0.040  -9.011  -8.460
  148    HE3  TRP  24           HE3      TRP  24   3.500 -10.770  -4.784
  149    HZ2  TRP  24           HZ2      TRP  24   0.896 -11.656  -8.943
  150    HZ3  TRP  24           HZ3      TRP  24   3.648 -12.935  -5.943
  151    HH2  TRP  24           HH2      TRP  24   2.372 -13.367  -7.979
  152    H    LYS  25           H        LYS  25   2.288  -8.244  -1.141
  153    HA   LYS  25           HA       LYS  25   1.880  -5.735   0.048
  154    HB2  LYS  25           1HB      LYS  25   2.290  -7.821   1.310
  155    HB3  LYS  25           2HB      LYS  25   3.956  -7.820   0.748
  156    HG2  LYS  25           1HG      LYS  25   4.277  -5.635   1.884
  157    HG3  LYS  25           2HG      LYS  25   2.648  -5.792   2.547
  158    HD2  LYS  25           1HD      LYS  25   4.598  -8.020   2.926
  159    HD3  LYS  25           2HD      LYS  25   4.739  -6.574   3.928
  160    HE2  LYS  25           1HE      LYS  25   2.134  -6.986   4.216
  161    HE3  LYS  25           2HE      LYS  25   2.609  -8.644   3.853
  162    HZ1  LYS  25           3HZ      LYS  25   4.411  -8.134   5.660
  163    HZ2  LYS  25           1HZ      LYS  25   2.852  -8.618   6.105
  164    HZ3  LYS  25           2HZ      LYS  25   3.282  -6.983   6.171
  165    H    SER  26           H        SER  26   4.922  -7.165  -1.152
  166    HA   SER  26           HA       SER  26   6.710  -5.205  -0.771
  167    HB2  SER  26           1HB      SER  26   6.359  -6.677  -3.395
  168    HB3  SER  26           2HB      SER  26   7.834  -5.876  -2.853
  169    HG   SER  26           HG       SER  26   6.558  -8.117  -1.673
  170    H    ARG  27           H        ARG  27   4.150  -5.153  -3.191
  171    HA   ARG  27           HA       ARG  27   5.005  -2.752  -4.459
  172    HB2  ARG  27           1HB      ARG  27   2.199  -3.862  -4.422
  173    HB3  ARG  27           2HB      ARG  27   2.926  -2.821  -5.639
  174    HG2  ARG  27           1HG      ARG  27   4.011  -5.557  -5.079
  175    HG3  ARG  27           2HG      ARG  27   2.653  -5.305  -6.178
  176    HD2  ARG  27           1HD      ARG  27   4.235  -3.518  -7.246
  177    HD3  ARG  27           2HD      ARG  27   5.501  -4.448  -6.445
  178    HE   ARG  27           HE       ARG  27   3.902  -5.265  -8.714
  179   HH11  ARG  27          1HH1      ARG  27   6.031  -6.248  -6.141
  180   HH12  ARG  27          2HH1      ARG  27   6.504  -7.722  -6.920
  181   HH21  ARG  27          1HH2      ARG  27   4.516  -7.203  -9.749
  182   HH22  ARG  27          2HH2      ARG  27   5.642  -8.264  -8.972
  183    H    LEU  28           H        LEU  28   2.594  -3.488  -1.965
  184    HA   LEU  28           HA       LEU  28   1.366  -1.067  -1.647
  185    HB2  LEU  28           1HB      LEU  28   0.746  -3.030  -0.375
  186    HB3  LEU  28           2HB      LEU  28   2.271  -2.972   0.507
  187    HG   LEU  28           HG       LEU  28   1.550  -0.808   1.497
  188   HD11  LEU  28          1HD1      LEU  28  -0.077  -0.316  -0.376
  189   HD12  LEU  28          2HD1      LEU  28  -0.654  -0.003   1.261
  190   HD13  LEU  28          3HD1      LEU  28  -1.175  -1.454   0.405
  191   HD21  LEU  28          3HD2      LEU  28  -0.499  -2.936   2.036
  192   HD22  LEU  28          1HD2      LEU  28   0.224  -1.787   3.162
  193   HD23  LEU  28          2HD2      LEU  28   1.188  -3.118   2.521
  194    H    ARG  29           H        ARG  29   4.446  -2.076  -0.185
  195    HA   ARG  29           HA       ARG  29   5.030   0.099   1.368
  196    HB2  ARG  29           1HB      ARG  29   6.775  -1.700  -0.285
  197    HB3  ARG  29           2HB      ARG  29   7.478  -0.367   0.622
  198    HG2  ARG  29           1HG      ARG  29   6.399  -1.310   2.674
  199    HG3  ARG  29           2HG      ARG  29   5.952  -2.718   1.710
  200    HD2  ARG  29           1HD      ARG  29   8.333  -3.088   1.194
  201    HD3  ARG  29           2HD      ARG  29   8.751  -1.714   2.217
  202    HE   ARG  29           HE       ARG  29   7.370  -3.262   3.910
  203   HH11  ARG  29          1HH1      ARG  29   9.960  -3.982   1.698
  204   HH12  ARG  29          2HH1      ARG  29  10.600  -5.271   2.663
  205   HH21  ARG  29          1HH2      ARG  29   8.203  -4.957   5.189
  206   HH22  ARG  29          2HH2      ARG  29   9.600  -5.825   4.648
  207    H    ILE  30           H        ILE  30   6.250  -0.255  -1.968
  208    HA   ILE  30           HA       ILE  30   7.261   2.243  -2.363
  209    HB   ILE  30           HB       ILE  30   5.692   0.669  -4.410
  210   HG12  ILE  30          1HG1      ILE  30   8.245   0.166  -5.024
  211   HG13  ILE  30          2HG1      ILE  30   8.443   0.426  -3.295
  212   HG21  ILE  30          1HG2      ILE  30   7.930   2.242  -5.370
  213   HG22  ILE  30          2HG2      ILE  30   6.265   2.179  -5.944
  214   HG23  ILE  30          3HG2      ILE  30   6.695   3.239  -4.602
  215   HD11  ILE  30          3HD1      ILE  30   6.232  -1.272  -3.580
  216   HD12  ILE  30          1HD1      ILE  30   7.472  -1.874  -4.681
  217   HD13  ILE  30          2HD1      ILE  30   7.837  -1.671  -2.967
  218    H    HIS  31           H        HIS  31   3.873   1.268  -2.647
  219    HA   HIS  31           HA       HIS  31   2.894   3.732  -3.614
  220    HB2  HIS  31           1HB      HIS  31   1.518   1.793  -3.849
  221    HB3  HIS  31           2HB      HIS  31   1.559   1.476  -2.117
  222    HD1  HIS  31           HD1      HIS  31  -0.128   3.579  -4.692
  223    HD2  HIS  31           HD2      HIS  31  -0.197   3.037  -0.574
  224    HE1  HIS  31           HE1      HIS  31  -2.185   4.782  -3.890
  225    H    GLN  32           H        GLN  32   3.541   2.524  -0.388
  226    HA   GLN  32           HA       GLN  32   2.182   4.613   0.995
  227    HB2  GLN  32           1HB      GLN  32   4.355   2.722   1.911
  228    HB3  GLN  32           2HB      GLN  32   3.455   3.798   2.971
  229    HG2  GLN  32           1HG      GLN  32   1.374   2.597   1.980
  230    HG3  GLN  32           2HG      GLN  32   2.539   1.348   1.540
  231   HE21  GLN  32          1HE2      GLN  32   0.672   2.725   4.025
  232   HE22  GLN  32          2HE2      GLN  32   1.223   1.721   5.319
  233    H    LYS  33           H        LYS  33   5.435   4.167  -0.228
  234    HA   LYS  33           HA       LYS  33   6.775   6.178   1.146
  235    HB2  LYS  33           1HB      LYS  33   7.158   5.245  -1.704
  236    HB3  LYS  33           2HB      LYS  33   8.302   6.244  -0.818
  237    HG2  LYS  33           1HG      LYS  33   7.451   3.615   0.309
  238    HG3  LYS  33           2HG      LYS  33   8.661   3.677  -0.974
  239    HD2  LYS  33           1HD      LYS  33   8.889   5.332   1.526
  240    HD3  LYS  33           2HD      LYS  33   9.512   3.683   1.430
  241    HE2  LYS  33           1HE      LYS  33  10.977   4.294  -0.383
  242    HE3  LYS  33           2HE      LYS  33  10.274   5.909  -0.458
  243    HZ1  LYS  33           3HZ      LYS  33  11.479   6.605   1.285
  244    HZ2  LYS  33           1HZ      LYS  33  12.493   5.307   0.897
  245    HZ3  LYS  33           2HZ      LYS  33  11.341   5.143   2.124
  246    H    CYS  34           H        CYS  34   4.421   6.393  -1.382
  247    HA   CYS  34           HA       CYS  34   5.013   9.219  -1.845
  248    HB2  CYS  34           1HB      CYS  34   4.537   7.604  -3.746
  249    HB3  CYS  34           2HB      CYS  34   2.873   7.558  -3.178
  250    HG   CYS  34           HG       CYS  34   3.592   9.332  -5.483
  251    H    HIS  35           H        HIS  35   3.960   8.325   0.707
  252    HA   HIS  35           HA       HIS  35   1.456   9.870   0.707
  253    HB2  HIS  35           1HB      HIS  35   2.008   7.185   1.882
  254    HB3  HIS  35           2HB      HIS  35   0.953   8.277   2.775
  255    HD1  HIS  35           HD1      HIS  35  -0.922   9.417   0.890
  256    HD2  HIS  35           HD2      HIS  35   0.509   5.553   0.358
  257    HE1  HIS  35           HE1      HIS  35  -2.606   8.274  -0.587
  258    H    THR  36           H        THR  36   3.821  11.110   1.146
  259    HA   THR  36           HA       THR  36   3.668  11.718   4.014
  260    HB   THR  36           HB       THR  36   6.168  12.060   4.011
  261    HG1  THR  36           HG1      THR  36   6.342  10.282   1.852
  262   HG21  THR  36          3HG2      THR  36   6.685   9.664   4.289
  263   HG22  THR  36          1HG2      THR  36   5.142   9.258   3.540
  264   HG23  THR  36          2HG2      THR  36   5.176  10.114   5.082
  265    H    GLY  37           H        GLY  37   4.052  13.861   4.568
  266    HA2  GLY  37           1HA      GLY  37   4.775  16.087   4.091
  267    HA3  GLY  37           2HA      GLY  37   4.644  15.727   2.376
  268    H    GLU  38           H        GLU  38   3.566  18.022   3.064
  269    HA   GLU  38           HA       GLU  38   0.671  17.480   3.160
  270    HB2  GLU  38           1HB      GLU  38   2.305  19.539   4.575
  271    HB3  GLU  38           2HB      GLU  38   0.676  19.965   4.073
  272    HG2  GLU  38           1HG      GLU  38  -0.199  18.046   5.325
  273    HG3  GLU  38           2HG      GLU  38   1.438  17.665   5.858
  274    H    ARG  39           H        ARG  39  -0.629  18.580   1.735
  275    HA   ARG  39           HA       ARG  39   0.539  19.450  -0.684
  276    HB2  ARG  39           1HB      ARG  39  -2.272  19.650   0.393
  277    HB3  ARG  39           2HB      ARG  39  -1.827  20.198  -1.217
  278    HG2  ARG  39           1HG      ARG  39  -1.035  17.903  -1.724
  279    HG3  ARG  39           2HG      ARG  39  -1.642  17.391  -0.148
  280    HD2  ARG  39           1HD      ARG  39  -3.896  18.103  -0.793
  281    HD3  ARG  39           2HD      ARG  39  -3.284  18.601  -2.370
  282    HE   ARG  39           HE       ARG  39  -2.696  15.868  -1.812
  283   HH11  ARG  39          1HH1      ARG  39  -5.208  18.033  -2.872
  284   HH12  ARG  39          2HH1      ARG  39  -6.058  16.817  -3.767
  285   HH21  ARG  39          1HH2      ARG  39  -3.805  14.259  -2.987
  286   HH22  ARG  39          2HH2      ARG  39  -5.259  14.670  -3.831
  287    H    HIS  40           H        HIS  40  -0.982  21.206   1.995
  288    HA   HIS  40           HA       HIS  40  -0.948  23.768   0.941
  289    HB2  HIS  40           1HB      HIS  40  -0.359  23.114   3.830
  290    HB3  HIS  40           2HB      HIS  40  -1.107  24.575   3.191
  291    HD2  HIS  40           HD2      HIS  40  -3.435  23.086   1.370
  292    HE1  HIS  40           HE1      HIS  40  -4.588  21.392   5.084
  293    HE2  HIS  40           HE2      HIS  40  -5.257  21.814   2.693
  294    H    SER  41           H        SER  41   1.526  22.344   3.085
  295    HA   SER  41           HA       SER  41   3.403  24.424   2.281
  296    HB2  SER  41           1HB      SER  41   3.804  22.186   4.278
  297    HB3  SER  41           2HB      SER  41   4.810  23.621   4.081
  298    HG   SER  41           HG       SER  41   3.147  24.878   4.850
  299    H    GLY  42           H        GLY  42   3.882  23.843   0.154
  300    HA2  GLY  42           1HA      GLY  42   5.713  21.560  -0.059
  301    HA3  GLY  42           2HA      GLY  42   4.365  21.654  -1.183
  302    HA   PRO  43           HA       PRO  43   7.930  23.744  -3.213
  303    HB2  PRO  43           1HB      PRO  43   7.388  22.747  -5.679
  304    HB3  PRO  43           2HB      PRO  43   8.340  21.870  -4.476
  305    HG2  PRO  43           1HG      PRO  43   5.451  21.562  -5.196
  306    HG3  PRO  43           2HG      PRO  43   6.666  20.309  -4.885
  307    HD2  PRO  43           1HD      PRO  43   4.839  21.059  -3.032
  308    HD3  PRO  43           2HD      PRO  43   6.471  20.510  -2.597
  309    H    SER  44           H        SER  44   4.689  23.273  -4.630
  310    HA   SER  44           HA       SER  44   4.550  26.165  -5.103
  311    HB2  SER  44           1HB      SER  44   3.478  25.703  -7.326
  312    HB3  SER  44           2HB      SER  44   5.184  25.261  -7.246
  313    HG   SER  44           HG       SER  44   3.334  23.295  -6.573
  314    H    SER  45           H        SER  45   2.830  26.919  -4.081
  315    HA   SER  45           HA       SER  45   0.365  25.315  -4.080
  316    HB2  SER  45           1HB      SER  45   1.500  25.141  -1.871
  317    HB3  SER  45           2HB      SER  45   1.400  26.895  -1.713
  318    HG   SER  45           HG       SER  45  -0.325  25.715  -0.669
  319    H    GLY  46           H        GLY  46   1.686  28.543  -3.333
  320    HA2  GLY  46           1HA      GLY  46   0.474  30.114  -5.115
  321    HA3  GLY  46           2HA      GLY  46  -0.861  29.773  -4.025
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1 -31.027   2.314   7.167
    2    HA2  GLY   1           1HA      GLY   1 -32.395   2.843   4.610
    3    HA3  GLY   1           2HA      GLY   1 -31.465   4.109   5.398
    4    H    SER   2           H        SER   2 -31.375   1.614   3.167
    5    HA   SER   2           HA       SER   2 -28.492   1.921   2.879
    6    HB2  SER   2           1HB      SER   2 -27.962  -0.371   2.960
    7    HB3  SER   2           2HB      SER   2 -29.047  -0.139   4.330
    8    HG   SER   2           HG       SER   2 -30.726  -0.743   2.629
    9    H    SER   3           H        SER   3 -28.093   2.380   0.828
   10    HA   SER   3           HA       SER   3 -29.515   0.973  -1.290
   11    HB2  SER   3           1HB      SER   3 -30.932   2.886  -1.066
   12    HB3  SER   3           2HB      SER   3 -29.550   3.976  -0.951
   13    HG   SER   3           HG       SER   3 -29.044   3.314  -3.140
   14    H    GLY   4           H        GLY   4 -27.950   0.167  -2.516
   15    HA2  GLY   4           1HA      GLY   4 -26.303   0.733  -4.244
   16    HA3  GLY   4           2HA      GLY   4 -25.625   1.891  -3.109
   17    H    SER   5           H        SER   5 -25.237  -1.116  -4.430
   18    HA   SER   5           HA       SER   5 -23.630  -2.036  -2.137
   19    HB2  SER   5           1HB      SER   5 -25.091  -3.646  -4.240
   20    HB3  SER   5           2HB      SER   5 -23.934  -4.342  -3.106
   21    HG   SER   5           HG       SER   5 -26.119  -4.499  -2.383
   22    H    SER   6           H        SER   6 -21.854  -0.775  -2.925
   23    HA   SER   6           HA       SER   6 -20.428  -2.119  -5.114
   24    HB2  SER   6           1HB      SER   6 -20.561   0.880  -4.714
   25    HB3  SER   6           2HB      SER   6 -19.605   0.044  -5.937
   26    HG   SER   6           HG       SER   6 -21.860  -0.895  -6.441
   27    H    GLY   7           H        GLY   7 -18.839  -3.120  -4.030
   28    HA2  GLY   7           1HA      GLY   7 -16.753  -1.587  -2.843
   29    HA3  GLY   7           2HA      GLY   7 -17.705  -2.403  -1.611
   30    H    THR   8           H        THR   8 -16.466  -3.310  -4.830
   31    HA   THR   8           HA       THR   8 -15.732  -5.925  -3.787
   32    HB   THR   8           HB       THR   8 -15.500  -4.860  -6.608
   33    HG1  THR   8           HG1      THR   8 -17.378  -6.534  -6.667
   34   HG21  THR   8          3HG2      THR   8 -14.221  -7.020  -5.564
   35   HG22  THR   8          1HG2      THR   8 -14.706  -6.871  -7.252
   36   HG23  THR   8          2HG2      THR   8 -15.729  -7.750  -6.114
   37    H    GLY   9           H        GLY   9 -13.802  -6.199  -2.885
   38    HA2  GLY   9           1HA      GLY   9 -11.417  -5.312  -4.253
   39    HA3  GLY   9           2HA      GLY   9 -11.700  -4.500  -2.720
   40    H    GLU  10           H        GLU  10 -11.702  -7.813  -4.045
   41    HA   GLU  10           HA       GLU  10 -10.944  -8.928  -1.505
   42    HB2  GLU  10           1HB      GLU  10 -11.058 -10.220  -4.236
   43    HB3  GLU  10           2HB      GLU  10 -10.885 -11.068  -2.706
   44    HG2  GLU  10           1HG      GLU  10 -13.071 -10.544  -2.040
   45    HG3  GLU  10           2HG      GLU  10 -13.241  -9.309  -3.287
   46    H    LYS  11           H        LYS  11  -8.972  -7.870  -1.057
   47    HA   LYS  11           HA       LYS  11  -6.687  -9.069  -2.442
   48    HB2  LYS  11           1HB      LYS  11  -7.162  -6.129  -2.013
   49    HB3  LYS  11           2HB      LYS  11  -5.536  -6.776  -2.186
   50    HG2  LYS  11           1HG      LYS  11  -5.945  -6.236  -4.349
   51    HG3  LYS  11           2HG      LYS  11  -6.600  -7.875  -4.346
   52    HD2  LYS  11           1HD      LYS  11  -8.844  -6.993  -3.992
   53    HD3  LYS  11           2HD      LYS  11  -8.203  -5.350  -3.937
   54    HE2  LYS  11           1HE      LYS  11  -7.618  -5.394  -6.218
   55    HE3  LYS  11           2HE      LYS  11  -7.802  -7.144  -6.314
   56    HZ1  LYS  11           3HZ      LYS  11 -10.254  -6.436  -5.580
   57    HZ2  LYS  11           1HZ      LYS  11  -9.777  -6.579  -7.197
   58    HZ3  LYS  11           2HZ      LYS  11  -9.817  -5.058  -6.459
   59    HA   PRO  12           HA       PRO  12  -5.414  -9.806   1.722
   60    HB2  PRO  12           1HB      PRO  12  -2.842 -10.503   1.206
   61    HB3  PRO  12           2HB      PRO  12  -4.211 -11.569   0.872
   62    HG2  PRO  12           1HG      PRO  12  -2.690  -9.798  -1.001
   63    HG3  PRO  12           2HG      PRO  12  -3.257 -11.460  -1.246
   64    HD2  PRO  12           1HD      PRO  12  -4.561  -9.312  -2.256
   65    HD3  PRO  12           2HD      PRO  12  -5.405 -10.787  -1.743
   66    H    TYR  13           H        TYR  13  -4.560  -7.194  -0.112
   67    HA   TYR  13           HA       TYR  13  -3.115  -5.988   2.135
   68    HB2  TYR  13           1HB      TYR  13  -2.262  -5.665  -0.749
   69    HB3  TYR  13           2HB      TYR  13  -1.491  -4.947   0.661
   70    HD1  TYR  13           HD1      TYR  13  -0.147  -6.319   2.178
   71    HD2  TYR  13           HD2      TYR  13  -1.909  -7.983  -1.319
   72    HE1  TYR  13           HE1      TYR  13   1.324  -8.280   2.377
   73    HE2  TYR  13           HE2      TYR  13  -0.443  -9.949  -1.129
   74    HH   TYR  13           HH       TYR  13   2.083 -10.245   0.129
   75    H    LYS  14           H        LYS  14  -3.603  -3.876   2.524
   76    HA   LYS  14           HA       LYS  14  -5.025  -2.287   0.571
   77    HB2  LYS  14           1HB      LYS  14  -6.815  -3.649   1.625
   78    HB3  LYS  14           2HB      LYS  14  -6.358  -2.995   3.192
   79    HG2  LYS  14           1HG      LYS  14  -6.989  -0.775   2.499
   80    HG3  LYS  14           2HG      LYS  14  -7.327  -1.348   0.865
   81    HD2  LYS  14           1HD      LYS  14  -9.059  -2.865   1.845
   82    HD3  LYS  14           2HD      LYS  14  -8.794  -2.071   3.399
   83    HE2  LYS  14           1HE      LYS  14  -9.472  -0.498   0.936
   84    HE3  LYS  14           2HE      LYS  14 -10.730  -1.248   1.918
   85    HZ1  LYS  14           3HZ      LYS  14 -10.136   1.139   2.443
   86    HZ2  LYS  14           1HZ      LYS  14  -8.691   0.546   3.091
   87    HZ3  LYS  14           2HZ      LYS  14 -10.172   0.069   3.752
   88    H    CYS  15           H        CYS  15  -4.549  -0.188   0.806
   89    HA   CYS  15           HA       CYS  15  -2.736   0.619   2.867
   90    HB2  CYS  15           1HB      CYS  15  -2.564   1.512   0.588
   91    HB3  CYS  15           2HB      CYS  15  -4.149   2.260   0.754
   92    H    SER  16           H        SER  16  -3.119   1.695   4.711
   93    HA   SER  16           HA       SER  16  -5.917   2.298   5.359
   94    HB2  SER  16           1HB      SER  16  -3.494   1.777   7.083
   95    HB3  SER  16           2HB      SER  16  -5.007   2.400   7.739
   96    HG   SER  16           HG       SER  16  -6.030   0.531   7.137
   97    H    ASP  17           H        ASP  17  -4.535   4.096   3.690
   98    HA   ASP  17           HA       ASP  17  -4.491   6.462   5.431
   99    HB2  ASP  17           1HB      ASP  17  -2.388   5.536   3.534
  100    HB3  ASP  17           2HB      ASP  17  -2.703   7.267   3.626
  101    H    CYS  18           H        CYS  18  -4.731   5.232   2.115
  102    HA   CYS  18           HA       CYS  18  -6.457   7.532   1.471
  103    HB2  CYS  18           1HB      CYS  18  -5.804   7.200  -0.884
  104    HB3  CYS  18           2HB      CYS  18  -4.413   7.538   0.140
  105    H    GLY  19           H        GLY  19  -5.941   4.066   0.898
  106    HA2  GLY  19           1HA      GLY  19  -7.913   2.626   1.244
  107    HA3  GLY  19           2HA      GLY  19  -8.841   3.838   0.374
  108    H    LYS  20           H        LYS  20  -5.769   2.136  -0.243
  109    HA   LYS  20           HA       LYS  20  -6.834   1.413  -2.895
  110    HB2  LYS  20           1HB      LYS  20  -4.148   2.351  -2.007
  111    HB3  LYS  20           2HB      LYS  20  -4.218   1.191  -3.326
  112    HG2  LYS  20           1HG      LYS  20  -5.770   2.737  -4.513
  113    HG3  LYS  20           2HG      LYS  20  -5.483   3.919  -3.234
  114    HD2  LYS  20           1HD      LYS  20  -3.211   4.145  -3.809
  115    HD3  LYS  20           2HD      LYS  20  -3.233   2.683  -4.798
  116    HE2  LYS  20           1HE      LYS  20  -3.270   4.402  -6.367
  117    HE3  LYS  20           2HE      LYS  20  -4.964   3.933  -6.232
  118    HZ1  LYS  20           3HZ      LYS  20  -3.636   6.311  -5.071
  119    HZ2  LYS  20           1HZ      LYS  20  -5.162   5.787  -4.560
  120    HZ3  LYS  20           2HZ      LYS  20  -4.926   6.265  -6.165
  121    H    SER  21           H        SER  21  -6.664  -0.674  -3.588
  122    HA   SER  21           HA       SER  21  -5.697  -2.615  -1.598
  123    HB2  SER  21           1HB      SER  21  -7.675  -3.073  -3.843
  124    HB3  SER  21           2HB      SER  21  -7.250  -4.213  -2.567
  125    HG   SER  21           HG       SER  21  -8.604  -3.244  -1.292
  126    H    PHE  22           H        PHE  22  -3.936  -3.743  -2.061
  127    HA   PHE  22           HA       PHE  22  -3.106  -3.950  -4.881
  128    HB2  PHE  22           1HB      PHE  22  -1.346  -3.914  -2.421
  129    HB3  PHE  22           2HB      PHE  22  -0.789  -4.031  -4.087
  130    HD1  PHE  22           HD1      PHE  22  -2.709  -1.821  -1.796
  131    HD2  PHE  22           HD2      PHE  22  -0.270  -2.112  -5.272
  132    HE1  PHE  22           HE1      PHE  22  -2.614   0.634  -1.930
  133    HE2  PHE  22           HE2      PHE  22  -0.170   0.342  -5.411
  134    HZ   PHE  22           HZ       PHE  22  -1.342   1.719  -3.739
  135    H    THR  23           H        THR  23  -1.710  -5.871  -5.341
  136    HA   THR  23           HA       THR  23  -2.927  -8.231  -4.119
  137    HB   THR  23           HB       THR  23  -1.185  -8.042  -6.585
  138    HG1  THR  23           HG1      THR  23  -2.990  -7.717  -7.672
  139   HG21  THR  23          3HG2      THR  23  -2.044 -10.299  -7.063
  140   HG22  THR  23          1HG2      THR  23  -2.881 -10.300  -5.512
  141   HG23  THR  23          2HG2      THR  23  -1.118 -10.253  -5.563
  142    H    TRP  24           H        TRP  24   0.237  -6.789  -4.732
  143    HA   TRP  24           HA       TRP  24   1.509  -8.922  -3.172
  144    HB2  TRP  24           1HB      TRP  24   2.657  -6.794  -4.985
  145    HB3  TRP  24           2HB      TRP  24   3.647  -7.873  -4.006
  146    HD1  TRP  24           HD1      TRP  24   0.803  -8.318  -6.628
  147    HE1  TRP  24           HE1      TRP  24   1.432 -10.309  -8.133
  148    HE3  TRP  24           HE3      TRP  24   5.204  -9.662  -4.400
  149    HZ2  TRP  24           HZ2      TRP  24   3.517 -12.200  -8.347
  150    HZ3  TRP  24           HZ3      TRP  24   6.453 -11.573  -5.316
  151    HH2  TRP  24           HH2      TRP  24   5.625 -12.815  -7.248
  152    H    LYS  25           H        LYS  25   2.900  -8.436  -1.427
  153    HA   LYS  25           HA       LYS  25   1.987  -6.302   0.228
  154    HB2  LYS  25           1HB      LYS  25   2.864  -8.603   0.953
  155    HB3  LYS  25           2HB      LYS  25   4.472  -7.934   0.710
  156    HG2  LYS  25           1HG      LYS  25   2.457  -6.608   2.492
  157    HG3  LYS  25           2HG      LYS  25   3.525  -7.889   3.069
  158    HD2  LYS  25           1HD      LYS  25   5.409  -6.425   2.042
  159    HD3  LYS  25           2HD      LYS  25   4.210  -5.133   2.121
  160    HE2  LYS  25           1HE      LYS  25   5.226  -4.884   4.160
  161    HE3  LYS  25           2HE      LYS  25   3.921  -5.990   4.587
  162    HZ1  LYS  25           3HZ      LYS  25   6.515  -6.403   5.143
  163    HZ2  LYS  25           1HZ      LYS  25   6.347  -7.285   3.709
  164    HZ3  LYS  25           2HZ      LYS  25   5.355  -7.629   5.034
  165    H    SER  26           H        SER  26   5.027  -6.952  -1.488
  166    HA   SER  26           HA       SER  26   6.507  -4.777  -0.637
  167    HB2  SER  26           1HB      SER  26   6.478  -6.179  -3.315
  168    HB3  SER  26           2HB      SER  26   7.680  -4.968  -2.870
  169    HG   SER  26           HG       SER  26   7.283  -7.550  -1.843
  170    H    ARG  27           H        ARG  27   4.331  -4.968  -3.446
  171    HA   ARG  27           HA       ARG  27   4.646  -2.446  -4.484
  172    HB2  ARG  27           1HB      ARG  27   2.032  -3.944  -4.225
  173    HB3  ARG  27           2HB      ARG  27   2.374  -2.651  -5.367
  174    HG2  ARG  27           1HG      ARG  27   4.009  -5.158  -5.340
  175    HG3  ARG  27           2HG      ARG  27   2.467  -5.076  -6.193
  176    HD2  ARG  27           1HD      ARG  27   4.849  -3.280  -6.640
  177    HD3  ARG  27           2HD      ARG  27   4.327  -4.594  -7.694
  178    HE   ARG  27           HE       ARG  27   2.196  -2.804  -7.363
  179   HH11  ARG  27          1HH1      ARG  27   5.345  -2.959  -8.840
  180   HH12  ARG  27          2HH1      ARG  27   4.958  -1.823 -10.090
  181   HH21  ARG  27          1HH2      ARG  27   1.675  -1.306  -9.003
  182   HH22  ARG  27          2HH2      ARG  27   2.871  -0.882 -10.181
  183    H    LEU  28           H        LEU  28   2.391  -3.420  -1.909
  184    HA   LEU  28           HA       LEU  28   1.155  -0.999  -1.442
  185    HB2  LEU  28           1HB      LEU  28   0.411  -2.996  -0.352
  186    HB3  LEU  28           2HB      LEU  28   1.947  -3.163   0.497
  187    HG   LEU  28           HG       LEU  28   1.389  -1.038   1.717
  188   HD11  LEU  28          1HD1      LEU  28  -1.452  -1.465   0.927
  189   HD12  LEU  28          2HD1      LEU  28  -0.402  -0.505  -0.115
  190   HD13  LEU  28          3HD1      LEU  28  -0.661  -0.022   1.562
  191   HD21  LEU  28          3HD2      LEU  28  -0.551  -3.321   2.064
  192   HD22  LEU  28          1HD2      LEU  28  -0.109  -2.123   3.281
  193   HD23  LEU  28          2HD2      LEU  28   1.095  -3.275   2.699
  194    H    ARG  29           H        ARG  29   4.135  -2.225   0.073
  195    HA   ARG  29           HA       ARG  29   4.684  -0.075   1.729
  196    HB2  ARG  29           1HB      ARG  29   6.460  -2.040   0.310
  197    HB3  ARG  29           2HB      ARG  29   7.142  -0.767   1.313
  198    HG2  ARG  29           1HG      ARG  29   5.726  -1.614   3.195
  199    HG3  ARG  29           2HG      ARG  29   5.301  -2.984   2.168
  200    HD2  ARG  29           1HD      ARG  29   7.101  -3.673   3.568
  201    HD3  ARG  29           2HD      ARG  29   7.748  -3.460   1.942
  202    HE   ARG  29           HE       ARG  29   8.274  -1.083   3.032
  203   HH11  ARG  29          1HH1      ARG  29   8.760  -4.312   4.239
  204   HH12  ARG  29          2HH1      ARG  29  10.146  -3.889   5.188
  205   HH21  ARG  29          1HH2      ARG  29  10.098  -0.513   4.277
  206   HH22  ARG  29          2HH2      ARG  29  10.905  -1.727   5.210
  207    H    ILE  30           H        ILE  30   5.869  -0.599  -1.592
  208    HA   ILE  30           HA       ILE  30   7.256   1.801  -1.869
  209    HB   ILE  30           HB       ILE  30   5.814   0.241  -4.017
  210   HG12  ILE  30          1HG1      ILE  30   8.764   0.139  -3.554
  211   HG13  ILE  30          2HG1      ILE  30   7.713  -0.791  -2.491
  212   HG21  ILE  30          1HG2      ILE  30   6.432   2.609  -4.586
  213   HG22  ILE  30          2HG2      ILE  30   8.117   2.148  -4.352
  214   HG23  ILE  30          3HG2      ILE  30   7.158   1.374  -5.614
  215   HD11  ILE  30          3HD1      ILE  30   8.011  -2.381  -4.042
  216   HD12  ILE  30          1HD1      ILE  30   6.732  -1.514  -4.890
  217   HD13  ILE  30          2HD1      ILE  30   8.421  -1.223  -5.306
  218    H    HIS  31           H        HIS  31   3.842   1.099  -2.164
  219    HA   HIS  31           HA       HIS  31   3.152   3.593  -3.391
  220    HB2  HIS  31           1HB      HIS  31   1.573   1.946  -3.827
  221    HB3  HIS  31           2HB      HIS  31   1.619   1.322  -2.180
  222    HD1  HIS  31           HD1      HIS  31   0.319   4.326  -4.094
  223    HD2  HIS  31           HD2      HIS  31  -0.370   2.246  -0.565
  224    HE1  HIS  31           HE1      HIS  31  -1.755   5.348  -3.106
  225    H    GLN  32           H        GLN  32   3.195   2.334  -0.096
  226    HA   GLN  32           HA       GLN  32   1.821   4.257   1.281
  227    HB2  GLN  32           1HB      GLN  32   4.212   2.596   1.948
  228    HB3  GLN  32           2HB      GLN  32   3.723   3.858   3.070
  229    HG2  GLN  32           1HG      GLN  32   1.702   1.902   2.082
  230    HG3  GLN  32           2HG      GLN  32   2.835   1.431   3.348
  231   HE21  GLN  32          1HE2      GLN  32   0.423   1.275   4.182
  232   HE22  GLN  32          2HE2      GLN  32  -0.071   2.626   5.138
  233    H    LYS  33           H        LYS  33   5.356   4.353   0.795
  234    HA   LYS  33           HA       LYS  33   5.777   6.929   1.723
  235    HB2  LYS  33           1HB      LYS  33   7.906   6.826   0.726
  236    HB3  LYS  33           2HB      LYS  33   7.500   5.152   1.081
  237    HG2  LYS  33           1HG      LYS  33   6.574   5.238  -1.398
  238    HG3  LYS  33           2HG      LYS  33   7.768   6.531  -1.529
  239    HD2  LYS  33           1HD      LYS  33   8.530   3.914  -0.298
  240    HD3  LYS  33           2HD      LYS  33   8.452   4.070  -2.054
  241    HE2  LYS  33           1HE      LYS  33  10.126   5.725  -2.084
  242    HE3  LYS  33           2HE      LYS  33   9.997   6.001  -0.347
  243    HZ1  LYS  33           3HZ      LYS  33  11.859   4.716  -0.428
  244    HZ2  LYS  33           1HZ      LYS  33  11.360   3.848  -1.792
  245    HZ3  LYS  33           2HZ      LYS  33  10.700   3.493  -0.275
  246    H    CYS  34           H        CYS  34   4.749   5.832  -1.455
  247    HA   CYS  34           HA       CYS  34   5.112   8.042  -3.017
  248    HB2  CYS  34           1HB      CYS  34   4.005   5.783  -3.588
  249    HB3  CYS  34           2HB      CYS  34   2.504   6.542  -3.072
  250    HG   CYS  34           HG       CYS  34   4.319   8.240  -5.349
  251    H    HIS  35           H        HIS  35   3.085   7.758  -0.267
  252    HA   HIS  35           HA       HIS  35   1.316   9.922  -0.923
  253    HB2  HIS  35           1HB      HIS  35   1.854   8.355   1.592
  254    HB3  HIS  35           2HB      HIS  35   0.775   9.747   1.585
  255    HD1  HIS  35           HD1      HIS  35  -1.157   9.488  -0.453
  256    HD2  HIS  35           HD2      HIS  35   0.519   6.053   1.175
  257    HE1  HIS  35           HE1      HIS  35  -2.767   7.633  -0.994
  258    H    THR  36           H        THR  36   3.756  10.909  -1.405
  259    HA   THR  36           HA       THR  36   4.111  12.860   0.763
  260    HB   THR  36           HB       THR  36   5.952  11.238   0.925
  261    HG1  THR  36           HG1      THR  36   7.161  13.521  -0.174
  262   HG21  THR  36          3HG2      THR  36   6.377  10.324  -1.137
  263   HG22  THR  36          1HG2      THR  36   7.669  11.521  -1.063
  264   HG23  THR  36          2HG2      THR  36   6.200  11.863  -1.978
  265    H    GLY  37           H        GLY  37   4.611  14.946   0.125
  266    HA2  GLY  37           1HA      GLY  37   5.109  16.676  -1.367
  267    HA3  GLY  37           2HA      GLY  37   5.122  15.509  -2.681
  268    H    GLU  38           H        GLU  38   3.798  16.595  -4.078
  269    HA   GLU  38           HA       GLU  38   1.411  17.902  -3.377
  270    HB2  GLU  38           1HB      GLU  38   2.752  18.121  -5.535
  271    HB3  GLU  38           2HB      GLU  38   1.956  16.645  -6.062
  272    HG2  GLU  38           1HG      GLU  38   0.675  18.332  -7.002
  273    HG3  GLU  38           2HG      GLU  38  -0.234  17.870  -5.564
  274    H    ARG  39           H        ARG  39  -0.589  17.195  -2.982
  275    HA   ARG  39           HA       ARG  39  -1.137  14.332  -3.397
  276    HB2  ARG  39           1HB      ARG  39  -1.140  15.059  -1.041
  277    HB3  ARG  39           2HB      ARG  39  -2.391  16.237  -1.413
  278    HG2  ARG  39           1HG      ARG  39  -3.971  14.514  -1.893
  279    HG3  ARG  39           2HG      ARG  39  -2.723  13.271  -1.784
  280    HD2  ARG  39           1HD      ARG  39  -3.829  13.141   0.267
  281    HD3  ARG  39           2HD      ARG  39  -2.388  14.094   0.619
  282    HE   ARG  39           HE       ARG  39  -5.133  14.999   0.665
  283   HH11  ARG  39          1HH1      ARG  39  -1.773  15.903   0.549
  284   HH12  ARG  39          2HH1      ARG  39  -2.046  17.498   1.168
  285   HH21  ARG  39          1HH2      ARG  39  -5.505  17.097   1.480
  286   HH22  ARG  39          2HH2      ARG  39  -4.169  18.176   1.698
  287    H    HIS  40           H        HIS  40  -2.584  13.823  -4.893
  288    HA   HIS  40           HA       HIS  40  -4.423  15.911  -5.841
  289    HB2  HIS  40           1HB      HIS  40  -2.930  14.979  -7.548
  290    HB3  HIS  40           2HB      HIS  40  -3.523  13.358  -7.195
  291    HD2  HIS  40           HD2      HIS  40  -5.373  12.608  -9.000
  292    HE1  HIS  40           HE1      HIS  40  -6.916  16.446  -9.939
  293    HE2  HIS  40           HE2      HIS  40  -7.108  13.969 -10.353
  294    H    SER  41           H        SER  41  -5.129  14.707  -3.471
  295    HA   SER  41           HA       SER  41  -7.590  13.358  -4.259
  296    HB2  SER  41           1HB      SER  41  -5.947  11.550  -3.780
  297    HB3  SER  41           2HB      SER  41  -5.751  12.198  -2.152
  298    HG   SER  41           HG       SER  41  -8.055  11.039  -3.314
  299    H    GLY  42           H        GLY  42  -9.151  13.218  -2.450
  300    HA2  GLY  42           1HA      GLY  42  -8.662  14.824  -0.105
  301    HA3  GLY  42           2HA      GLY  42  -9.721  15.598  -1.274
  302    HA   PRO  43           HA       PRO  43 -11.919  11.600   0.416
  303    HB2  PRO  43           1HB      PRO  43 -10.994  10.740   2.819
  304    HB3  PRO  43           2HB      PRO  43 -10.377  10.131   1.278
  305    HG2  PRO  43           1HG      PRO  43  -9.218  12.209   3.094
  306    HG3  PRO  43           2HG      PRO  43  -8.399  10.893   2.234
  307    HD2  PRO  43           1HD      PRO  43  -8.381  13.449   1.342
  308    HD3  PRO  43           2HD      PRO  43  -8.351  12.054   0.244
  309    H    SER  44           H        SER  44 -11.195  14.546   1.693
  310    HA   SER  44           HA       SER  44 -13.046  14.403   3.942
  311    HB2  SER  44           1HB      SER  44 -11.466  16.774   2.917
  312    HB3  SER  44           2HB      SER  44 -12.324  16.669   4.454
  313    HG   SER  44           HG       SER  44  -9.940  15.427   3.651
  314    H    SER  45           H        SER  45 -14.636  16.254   4.148
  315    HA   SER  45           HA       SER  45 -16.440  17.428   3.398
  316    HB2  SER  45           1HB      SER  45 -14.730  18.473   1.847
  317    HB3  SER  45           2HB      SER  45 -15.232  17.299   0.631
  318    HG   SER  45           HG       SER  45 -17.181  18.244   0.496
  319    H    GLY  46           H        GLY  46 -16.632  14.679   3.665
  320    HA2  GLY  46           1HA      GLY  46 -17.983  13.643   1.303
  321    HA3  GLY  46           2HA      GLY  46 -17.662  12.765   2.791
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1 -20.704  10.315  -7.130
    2    HA2  GLY   1           1HA      GLY   1 -18.922  11.346  -9.050
    3    HA3  GLY   1           2HA      GLY   1 -18.006  10.897  -7.619
    4    H    SER   2           H        SER   2 -17.929   9.758 -10.314
    5    HA   SER   2           HA       SER   2 -19.149   7.142 -10.069
    6    HB2  SER   2           1HB      SER   2 -18.729   8.580 -12.241
    7    HB3  SER   2           2HB      SER   2 -17.148   7.800 -12.196
    8    HG   SER   2           HG       SER   2 -18.250   5.783 -12.171
    9    H    SER   3           H        SER   3 -18.084   5.208  -9.778
   10    HA   SER   3           HA       SER   3 -15.671   5.320  -8.247
   11    HB2  SER   3           1HB      SER   3 -15.970   2.997  -7.883
   12    HB3  SER   3           2HB      SER   3 -17.601   3.663  -7.960
   13    HG   SER   3           HG       SER   3 -17.760   2.920 -10.081
   14    H    GLY   4           H        GLY   4 -13.849   3.733  -8.763
   15    HA2  GLY   4           1HA      GLY   4 -13.036   4.219 -11.545
   16    HA3  GLY   4           2HA      GLY   4 -11.949   3.898 -10.202
   17    H    SER   5           H        SER   5 -14.746   2.254 -11.691
   18    HA   SER   5           HA       SER   5 -15.099   0.062 -12.208
   19    HB2  SER   5           1HB      SER   5 -12.300   0.598 -13.131
   20    HB3  SER   5           2HB      SER   5 -12.941  -1.042 -13.234
   21    HG   SER   5           HG       SER   5 -14.836   0.286 -14.238
   22    H    SER   6           H        SER   6 -14.604   0.494  -9.499
   23    HA   SER   6           HA       SER   6 -12.950  -1.810  -8.719
   24    HB2  SER   6           1HB      SER   6 -12.517   0.542  -7.756
   25    HB3  SER   6           2HB      SER   6 -13.993   0.288  -6.824
   26    HG   SER   6           HG       SER   6 -11.522  -0.664  -6.369
   27    H    GLY   7           H        GLY   7 -14.067  -3.615  -8.408
   28    HA2  GLY   7           1HA      GLY   7 -16.621  -3.436  -6.951
   29    HA3  GLY   7           2HA      GLY   7 -16.520  -4.376  -8.433
   30    H    THR   8           H        THR   8 -16.469  -6.470  -8.011
   31    HA   THR   8           HA       THR   8 -15.854  -7.590  -5.512
   32    HB   THR   8           HB       THR   8 -17.226  -8.902  -6.902
   33    HG1  THR   8           HG1      THR   8 -15.920 -10.837  -7.195
   34   HG21  THR   8          3HG2      THR   8 -15.404  -8.027  -8.985
   35   HG22  THR   8          1HG2      THR   8 -17.073  -8.583  -9.110
   36   HG23  THR   8          2HG2      THR   8 -15.753  -9.753  -9.093
   37    H    GLY   9           H        GLY   9 -13.931  -7.658  -4.559
   38    HA2  GLY   9           1HA      GLY   9 -11.678  -8.878  -5.786
   39    HA3  GLY   9           2HA      GLY   9 -11.476  -7.133  -5.743
   40    H    GLU  10           H        GLU  10 -11.083 -10.009  -4.046
   41    HA   GLU  10           HA       GLU  10 -10.845  -8.596  -1.477
   42    HB2  GLU  10           1HB      GLU  10 -12.271 -10.776  -1.847
   43    HB3  GLU  10           2HB      GLU  10 -10.711 -11.576  -1.710
   44    HG2  GLU  10           1HG      GLU  10 -10.503 -10.128   0.460
   45    HG3  GLU  10           2HG      GLU  10 -12.261 -10.077   0.340
   46    H    LYS  11           H        LYS  11  -8.822  -7.719  -1.596
   47    HA   LYS  11           HA       LYS  11  -6.578  -9.525  -2.175
   48    HB2  LYS  11           1HB      LYS  11  -6.431  -6.527  -1.892
   49    HB3  LYS  11           2HB      LYS  11  -5.259  -7.602  -2.643
   50    HG2  LYS  11           1HG      LYS  11  -8.023  -7.401  -3.755
   51    HG3  LYS  11           2HG      LYS  11  -6.823  -6.159  -4.122
   52    HD2  LYS  11           1HD      LYS  11  -6.410  -7.579  -5.856
   53    HD3  LYS  11           2HD      LYS  11  -5.337  -8.297  -4.652
   54    HE2  LYS  11           1HE      LYS  11  -6.535 -10.093  -5.604
   55    HE3  LYS  11           2HE      LYS  11  -7.269  -9.806  -4.027
   56    HZ1  LYS  11           3HZ      LYS  11  -8.368  -8.581  -6.481
   57    HZ2  LYS  11           1HZ      LYS  11  -9.130  -8.823  -4.990
   58    HZ3  LYS  11           2HZ      LYS  11  -8.813 -10.141  -6.001
   59    HA   PRO  12           HA       PRO  12  -5.483  -9.682   2.088
   60    HB2  PRO  12           1HB      PRO  12  -2.862 -10.334   1.824
   61    HB3  PRO  12           2HB      PRO  12  -4.172 -11.483   1.528
   62    HG2  PRO  12           1HG      PRO  12  -2.579  -9.879  -0.434
   63    HG3  PRO  12           2HG      PRO  12  -3.078 -11.579  -0.522
   64    HD2  PRO  12           1HD      PRO  12  -4.372  -9.610  -1.856
   65    HD3  PRO  12           2HD      PRO  12  -5.205 -11.048  -1.232
   66    H    TYR  13           H        TYR  13  -4.581  -7.264   0.023
   67    HA   TYR  13           HA       TYR  13  -3.224  -5.806   2.186
   68    HB2  TYR  13           1HB      TYR  13  -2.487  -5.598  -0.739
   69    HB3  TYR  13           2HB      TYR  13  -1.704  -4.777   0.607
   70    HD1  TYR  13           HD1      TYR  13  -0.242  -6.009   2.135
   71    HD2  TYR  13           HD2      TYR  13  -2.036  -7.921  -1.216
   72    HE1  TYR  13           HE1      TYR  13   1.333  -7.884   2.370
   73    HE2  TYR  13           HE2      TYR  13  -0.467  -9.801  -0.990
   74    HH   TYR  13           HH       TYR  13   2.160  -9.866   0.252
   75    H    LYS  14           H        LYS  14  -3.517  -3.523   2.164
   76    HA   LYS  14           HA       LYS  14  -5.084  -2.143   0.278
   77    HB2  LYS  14           1HB      LYS  14  -6.829  -3.662   1.298
   78    HB3  LYS  14           2HB      LYS  14  -6.590  -2.799   2.811
   79    HG2  LYS  14           1HG      LYS  14  -7.242  -0.705   1.682
   80    HG3  LYS  14           2HG      LYS  14  -7.566  -1.630   0.214
   81    HD2  LYS  14           1HD      LYS  14  -9.669  -1.537   1.135
   82    HD3  LYS  14           2HD      LYS  14  -9.078  -3.052   1.821
   83    HE2  LYS  14           1HE      LYS  14  -8.240  -1.503   3.754
   84    HE3  LYS  14           2HE      LYS  14  -9.455  -0.391   3.125
   85    HZ1  LYS  14           3HZ      LYS  14 -11.142  -1.697   3.820
   86    HZ2  LYS  14           1HZ      LYS  14  -9.995  -2.227   4.945
   87    HZ3  LYS  14           2HZ      LYS  14 -10.304  -3.143   3.557
   88    H    CYS  15           H        CYS  15  -4.241  -0.183   0.453
   89    HA   CYS  15           HA       CYS  15  -2.831   0.755   2.693
   90    HB2  CYS  15           1HB      CYS  15  -2.464   1.588   0.400
   91    HB3  CYS  15           2HB      CYS  15  -4.048   2.357   0.433
   92    H    SER  16           H        SER  16  -3.373   2.024   4.398
   93    HA   SER  16           HA       SER  16  -6.227   2.369   4.903
   94    HB2  SER  16           1HB      SER  16  -4.435   1.374   6.552
   95    HB3  SER  16           2HB      SER  16  -4.108   3.071   6.902
   96    HG   SER  16           HG       SER  16  -5.960   3.225   7.907
   97    H    ASP  17           H        ASP  17  -3.426   4.199   4.101
   98    HA   ASP  17           HA       ASP  17  -4.108   6.712   5.128
   99    HB2  ASP  17           1HB      ASP  17  -1.892   6.198   4.201
  100    HB3  ASP  17           2HB      ASP  17  -2.593   6.062   2.591
  101    H    CYS  18           H        CYS  18  -4.656   5.428   1.845
  102    HA   CYS  18           HA       CYS  18  -6.763   7.454   1.499
  103    HB2  CYS  18           1HB      CYS  18  -6.468   7.024  -0.949
  104    HB3  CYS  18           2HB      CYS  18  -5.041   7.693  -0.165
  105    H    GLY  19           H        GLY  19  -5.975   4.062   0.748
  106    HA2  GLY  19           1HA      GLY  19  -7.738   2.452   1.504
  107    HA3  GLY  19           2HA      GLY  19  -8.880   3.518   0.698
  108    H    LYS  20           H        LYS  20  -5.702   2.628  -0.527
  109    HA   LYS  20           HA       LYS  20  -6.950   1.622  -2.953
  110    HB2  LYS  20           1HB      LYS  20  -4.857   3.177  -2.761
  111    HB3  LYS  20           2HB      LYS  20  -3.989   1.674  -2.479
  112    HG2  LYS  20           1HG      LYS  20  -5.064   0.848  -4.639
  113    HG3  LYS  20           2HG      LYS  20  -5.486   2.537  -4.929
  114    HD2  LYS  20           1HD      LYS  20  -2.977   2.989  -4.472
  115    HD3  LYS  20           2HD      LYS  20  -2.778   1.262  -4.773
  116    HE2  LYS  20           1HE      LYS  20  -4.102   3.194  -6.673
  117    HE3  LYS  20           2HE      LYS  20  -2.420   2.677  -6.783
  118    HZ1  LYS  20           3HZ      LYS  20  -4.572   0.669  -6.718
  119    HZ2  LYS  20           1HZ      LYS  20  -3.020   0.552  -7.383
  120    HZ3  LYS  20           2HZ      LYS  20  -4.208   1.466  -8.166
  121    H    SER  21           H        SER  21  -6.726  -0.452  -3.755
  122    HA   SER  21           HA       SER  21  -6.005  -2.469  -1.754
  123    HB2  SER  21           1HB      SER  21  -7.601  -2.728  -4.314
  124    HB3  SER  21           2HB      SER  21  -7.290  -4.037  -3.174
  125    HG   SER  21           HG       SER  21  -8.546  -3.035  -1.674
  126    H    PHE  22           H        PHE  22  -4.359  -3.860  -2.028
  127    HA   PHE  22           HA       PHE  22  -2.987  -3.885  -4.631
  128    HB2  PHE  22           1HB      PHE  22  -1.574  -3.973  -1.962
  129    HB3  PHE  22           2HB      PHE  22  -0.840  -3.838  -3.557
  130    HD1  PHE  22           HD1      PHE  22  -3.155  -2.053  -1.256
  131    HD2  PHE  22           HD2      PHE  22  -0.299  -1.755  -4.398
  132    HE1  PHE  22           HE1      PHE  22  -3.205   0.399  -1.064
  133    HE2  PHE  22           HE2      PHE  22  -0.344   0.698  -4.211
  134    HZ   PHE  22           HZ       PHE  22  -1.798   1.778  -2.542
  135    H    THR  23           H        THR  23  -1.798  -5.812  -5.109
  136    HA   THR  23           HA       THR  23  -2.964  -8.171  -3.818
  137    HB   THR  23           HB       THR  23  -1.473  -7.950  -6.440
  138    HG1  THR  23           HG1      THR  23  -3.373  -7.284  -7.090
  139   HG21  THR  23          3HG2      THR  23  -2.720 -10.264  -6.674
  140   HG22  THR  23          1HG2      THR  23  -2.606 -10.247  -4.915
  141   HG23  THR  23          2HG2      THR  23  -1.142 -10.156  -5.894
  142    H    TRP  24           H        TRP  24   0.130  -6.707  -4.654
  143    HA   TRP  24           HA       TRP  24   1.512  -8.842  -3.177
  144    HB2  TRP  24           1HB      TRP  24   2.517  -6.844  -5.209
  145    HB3  TRP  24           2HB      TRP  24   3.581  -7.888  -4.270
  146    HD1  TRP  24           HD1      TRP  24   0.596  -8.290  -6.725
  147    HE1  TRP  24           HE1      TRP  24   0.995 -10.426  -8.106
  148    HE3  TRP  24           HE3      TRP  24   4.905  -9.905  -4.497
  149    HZ2  TRP  24           HZ2      TRP  24   2.886 -12.518  -8.233
  150    HZ3  TRP  24           HZ3      TRP  24   5.945 -11.983  -5.307
  151    HH2  TRP  24           HH2      TRP  24   4.954 -13.261  -7.136
  152    H    LYS  25           H        LYS  25   2.653  -8.414  -1.363
  153    HA   LYS  25           HA       LYS  25   2.087  -6.173   0.183
  154    HB2  LYS  25           1HB      LYS  25   3.935  -6.921   1.638
  155    HB3  LYS  25           2HB      LYS  25   2.880  -8.247   1.168
  156    HG2  LYS  25           1HG      LYS  25   4.515  -8.890  -0.565
  157    HG3  LYS  25           2HG      LYS  25   5.586  -7.610   0.011
  158    HD2  LYS  25           1HD      LYS  25   6.423  -9.393   1.181
  159    HD3  LYS  25           2HD      LYS  25   5.216  -8.811   2.329
  160    HE2  LYS  25           1HE      LYS  25   3.706 -10.516   1.771
  161    HE3  LYS  25           2HE      LYS  25   4.559 -10.902   0.278
  162    HZ1  LYS  25           3HZ      LYS  25   5.518 -12.513   1.450
  163    HZ2  LYS  25           1HZ      LYS  25   5.001 -11.882   2.932
  164    HZ3  LYS  25           2HZ      LYS  25   6.422 -11.308   2.218
  165    H    SER  26           H        SER  26   5.021  -6.900  -1.695
  166    HA   SER  26           HA       SER  26   6.568  -4.724  -1.094
  167    HB2  SER  26           1HB      SER  26   7.263  -6.585  -2.581
  168    HB3  SER  26           2HB      SER  26   6.240  -5.922  -3.856
  169    HG   SER  26           HG       SER  26   8.082  -4.198  -2.682
  170    H    ARG  27           H        ARG  27   4.166  -4.893  -3.722
  171    HA   ARG  27           HA       ARG  27   4.375  -2.361  -4.741
  172    HB2  ARG  27           1HB      ARG  27   1.804  -3.887  -4.282
  173    HB3  ARG  27           2HB      ARG  27   2.022  -2.558  -5.413
  174    HG2  ARG  27           1HG      ARG  27   3.532  -5.156  -5.560
  175    HG3  ARG  27           2HG      ARG  27   2.048  -4.815  -6.453
  176    HD2  ARG  27           1HD      ARG  27   4.363  -2.938  -6.648
  177    HD3  ARG  27           2HD      ARG  27   4.375  -4.438  -7.574
  178    HE   ARG  27           HE       ARG  27   2.651  -3.621  -8.893
  179   HH11  ARG  27          1HH1      ARG  27   3.338  -1.447  -6.262
  180   HH12  ARG  27          2HH1      ARG  27   2.416  -0.141  -6.929
  181   HH21  ARG  27          1HH2      ARG  27   1.435  -1.908  -9.781
  182   HH22  ARG  27          2HH2      ARG  27   1.334  -0.404  -8.930
  183    H    LEU  28           H        LEU  28   2.337  -3.364  -2.000
  184    HA   LEU  28           HA       LEU  28   1.129  -0.969  -1.399
  185    HB2  LEU  28           1HB      LEU  28   0.557  -3.008  -0.255
  186    HB3  LEU  28           2HB      LEU  28   2.159  -3.090   0.476
  187    HG   LEU  28           HG       LEU  28   1.636  -1.054   1.774
  188   HD11  LEU  28          1HD1      LEU  28  -1.076  -1.362   0.499
  189   HD12  LEU  28          2HD1      LEU  28   0.031   0.000   0.334
  190   HD13  LEU  28          3HD1      LEU  28  -0.732  -0.331   1.889
  191   HD21  LEU  28          3HD2      LEU  28  -0.597  -2.482   2.735
  192   HD22  LEU  28          1HD2      LEU  28   1.063  -2.528   3.329
  193   HD23  LEU  28          2HD2      LEU  28   0.537  -3.671   2.093
  194    H    ARG  29           H        ARG  29   4.279  -2.131  -0.222
  195    HA   ARG  29           HA       ARG  29   4.985  -0.060   1.433
  196    HB2  ARG  29           1HB      ARG  29   6.759  -1.594  -0.475
  197    HB3  ARG  29           2HB      ARG  29   7.345  -0.589   0.844
  198    HG2  ARG  29           1HG      ARG  29   6.018  -2.059   2.401
  199    HG3  ARG  29           2HG      ARG  29   5.769  -3.138   1.027
  200    HD2  ARG  29           1HD      ARG  29   8.076  -3.592   0.839
  201    HD3  ARG  29           2HD      ARG  29   8.504  -2.248   1.897
  202    HE   ARG  29           HE       ARG  29   7.764  -4.895   2.689
  203   HH11  ARG  29          1HH1      ARG  29   7.749  -1.549   3.650
  204   HH12  ARG  29          2HH1      ARG  29   7.716  -1.901   5.346
  205   HH21  ARG  29          1HH2      ARG  29   7.721  -5.372   4.920
  206   HH22  ARG  29          2HH2      ARG  29   7.701  -4.076   6.067
  207    H    ILE  30           H        ILE  30   6.031  -0.277  -1.974
  208    HA   ILE  30           HA       ILE  30   7.106   2.210  -2.285
  209    HB   ILE  30           HB       ILE  30   5.400   0.802  -4.342
  210   HG12  ILE  30          1HG1      ILE  30   7.901   0.220  -5.081
  211   HG13  ILE  30          2HG1      ILE  30   8.176   0.381  -3.350
  212   HG21  ILE  30          1HG2      ILE  30   7.709   2.602  -4.948
  213   HG22  ILE  30          2HG2      ILE  30   6.349   2.143  -5.971
  214   HG23  ILE  30          3HG2      ILE  30   6.109   3.278  -4.642
  215   HD11  ILE  30          3HD1      ILE  30   7.195  -1.842  -4.750
  216   HD12  ILE  30          1HD1      ILE  30   7.374  -1.646  -3.007
  217   HD13  ILE  30          2HD1      ILE  30   5.854  -1.217  -3.791
  218    H    HIS  31           H        HIS  31   3.700   1.354  -2.245
  219    HA   HIS  31           HA       HIS  31   2.746   3.897  -3.109
  220    HB2  HIS  31           1HB      HIS  31   1.359   1.916  -3.356
  221    HB3  HIS  31           2HB      HIS  31   1.358   1.665  -1.612
  222    HD1  HIS  31           HD1      HIS  31  -0.114   3.855  -4.276
  223    HD2  HIS  31           HD2      HIS  31  -0.447   3.226  -0.182
  224    HE1  HIS  31           HE1      HIS  31  -2.158   5.136  -3.562
  225    H    GLN  32           H        GLN  32   2.980   2.339   0.081
  226    HA   GLN  32           HA       GLN  32   1.897   4.337   1.644
  227    HB2  GLN  32           1HB      GLN  32   4.088   2.348   2.185
  228    HB3  GLN  32           2HB      GLN  32   3.548   3.476   3.422
  229    HG2  GLN  32           1HG      GLN  32   1.499   1.848   2.023
  230    HG3  GLN  32           2HG      GLN  32   2.536   1.054   3.206
  231   HE21  GLN  32          1HE2      GLN  32   1.796   1.034   5.195
  232   HE22  GLN  32          2HE2      GLN  32   0.694   2.170   5.887
  233    H    LYS  33           H        LYS  33   5.351   3.908   0.867
  234    HA   LYS  33           HA       LYS  33   6.216   6.297   2.069
  235    HB2  LYS  33           1HB      LYS  33   8.303   5.891   1.070
  236    HB3  LYS  33           2HB      LYS  33   7.612   4.290   1.301
  237    HG2  LYS  33           1HG      LYS  33   8.349   4.063  -0.830
  238    HG3  LYS  33           2HG      LYS  33   6.742   4.712  -1.163
  239    HD2  LYS  33           1HD      LYS  33   7.861   7.013  -1.118
  240    HD3  LYS  33           2HD      LYS  33   9.389   6.134  -1.219
  241    HE2  LYS  33           1HE      LYS  33   8.888   5.276  -3.334
  242    HE3  LYS  33           2HE      LYS  33   7.167   5.616  -3.164
  243    HZ1  LYS  33           3HZ      LYS  33   9.367   7.481  -3.770
  244    HZ2  LYS  33           1HZ      LYS  33   7.933   8.053  -3.077
  245    HZ3  LYS  33           2HZ      LYS  33   7.895   7.272  -4.577
  246    H    CYS  34           H        CYS  34   4.948   5.598  -1.120
  247    HA   CYS  34           HA       CYS  34   5.717   7.856  -2.519
  248    HB2  CYS  34           1HB      CYS  34   4.485   5.886  -3.454
  249    HB3  CYS  34           2HB      CYS  34   3.016   6.512  -2.716
  250    HG   CYS  34           HG       CYS  34   4.834   8.151  -5.109
  251    H    HIS  35           H        HIS  35   2.997   7.434  -0.300
  252    HA   HIS  35           HA       HIS  35   1.650   9.809  -0.682
  253    HB2  HIS  35           1HB      HIS  35   2.076   8.087   1.739
  254    HB3  HIS  35           2HB      HIS  35   1.177   9.596   1.873
  255    HD1  HIS  35           HD1      HIS  35  -0.811   9.711  -0.151
  256    HD2  HIS  35           HD2      HIS  35   0.427   6.011   1.276
  257    HE1  HIS  35           HE1      HIS  35  -2.661   8.112  -0.737
  258    H    THR  36           H        THR  36   3.093  11.484  -1.147
  259    HA   THR  36           HA       THR  36   4.422  12.615   1.222
  260    HB   THR  36           HB       THR  36   6.271  13.416  -0.152
  261    HG1  THR  36           HG1      THR  36   6.401  12.905  -2.319
  262   HG21  THR  36          3HG2      THR  36   7.209  11.502   0.514
  263   HG22  THR  36          1HG2      THR  36   6.766  10.827  -1.053
  264   HG23  THR  36          2HG2      THR  36   5.693  10.621   0.331
  265    H    GLY  37           H        GLY  37   2.596  13.976   1.499
  266    HA2  GLY  37           1HA      GLY  37   1.468  15.962   1.275
  267    HA3  GLY  37           2HA      GLY  37   2.809  16.498   0.274
  268    H    GLU  38           H        GLU  38  -0.051  14.380   0.106
  269    HA   GLU  38           HA       GLU  38  -0.827  15.655  -2.385
  270    HB2  GLU  38           1HB      GLU  38   0.638  13.844  -3.139
  271    HB3  GLU  38           2HB      GLU  38  -0.304  12.682  -2.217
  272    HG2  GLU  38           1HG      GLU  38  -2.066  12.734  -3.683
  273    HG3  GLU  38           2HG      GLU  38  -1.673  14.350  -4.267
  274    H    ARG  39           H        ARG  39  -3.011  15.181  -3.011
  275    HA   ARG  39           HA       ARG  39  -4.635  14.170  -0.771
  276    HB2  ARG  39           1HB      ARG  39  -4.822  16.629  -1.371
  277    HB3  ARG  39           2HB      ARG  39  -5.549  16.115  -2.887
  278    HG2  ARG  39           1HG      ARG  39  -7.332  14.983  -1.623
  279    HG3  ARG  39           2HG      ARG  39  -6.617  15.581  -0.124
  280    HD2  ARG  39           1HD      ARG  39  -8.291  17.131  -0.571
  281    HD3  ARG  39           2HD      ARG  39  -6.840  17.909  -1.203
  282    HE   ARG  39           HE       ARG  39  -7.919  16.526  -3.320
  283   HH11  ARG  39          1HH1      ARG  39  -8.971  19.041  -1.155
  284   HH12  ARG  39          2HH1      ARG  39 -10.026  19.778  -2.315
  285   HH21  ARG  39          1HH2      ARG  39  -9.305  17.487  -4.856
  286   HH22  ARG  39          2HH2      ARG  39 -10.216  18.892  -4.419
  287    H    HIS  40           H        HIS  40  -4.495  12.018  -1.602
  288    HA   HIS  40           HA       HIS  40  -6.277  11.573  -3.902
  289    HB2  HIS  40           1HB      HIS  40  -3.781  11.137  -4.324
  290    HB3  HIS  40           2HB      HIS  40  -3.966   9.753  -3.251
  291    HD2  HIS  40           HD2      HIS  40  -3.363   8.237  -5.651
  292    HE1  HIS  40           HE1      HIS  40  -7.267   8.756  -7.229
  293    HE2  HIS  40           HE2      HIS  40  -5.133   7.424  -7.353
  294    H    SER  41           H        SER  41  -8.040  11.222  -2.531
  295    HA   SER  41           HA       SER  41  -7.845   8.904  -0.733
  296    HB2  SER  41           1HB      SER  41  -9.671  11.293  -0.801
  297    HB3  SER  41           2HB      SER  41 -10.135   9.830   0.067
  298    HG   SER  41           HG       SER  41  -8.969  10.617   1.620
  299    H    GLY  42           H        GLY  42  -8.362   7.085  -1.776
  300    HA2  GLY  42           1HA      GLY  42  -9.759   5.534  -2.769
  301    HA3  GLY  42           2HA      GLY  42 -11.009   6.768  -2.840
  302    HA   PRO  43           HA       PRO  43  -9.224   5.851  -7.109
  303    HB2  PRO  43           1HB      PRO  43 -11.500   4.851  -8.198
  304    HB3  PRO  43           2HB      PRO  43 -10.307   3.842  -7.372
  305    HG2  PRO  43           1HG      PRO  43 -12.890   4.949  -6.340
  306    HG3  PRO  43           2HG      PRO  43 -12.202   3.328  -6.127
  307    HD2  PRO  43           1HD      PRO  43 -12.057   5.236  -4.211
  308    HD3  PRO  43           2HD      PRO  43 -10.791   4.012  -4.438
  309    H    SER  44           H        SER  44 -11.412   7.821  -5.600
  310    HA   SER  44           HA       SER  44 -13.098   9.010  -7.281
  311    HB2  SER  44           1HB      SER  44 -11.068  10.556  -5.650
  312    HB3  SER  44           2HB      SER  44 -12.615  11.170  -6.232
  313    HG   SER  44           HG       SER  44 -12.059   9.591  -4.067
  314    H    SER  45           H        SER  45  -9.587   9.497  -7.390
  315    HA   SER  45           HA       SER  45  -9.899  10.491 -10.142
  316    HB2  SER  45           1HB      SER  45  -8.065  12.075  -9.767
  317    HB3  SER  45           2HB      SER  45  -9.387  12.379  -8.639
  318    HG   SER  45           HG       SER  45  -7.276  12.374  -7.660
  319    H    GLY  46           H        GLY  46  -9.509   8.163 -10.565
  320    HA2  GLY  46           1HA      GLY  46  -8.138   6.475 -11.298
  321    HA3  GLY  46           2HA      GLY  46  -6.898   7.710 -11.460
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1 -20.530  13.181   5.018
    2    HA2  GLY   1           1HA      GLY   1 -21.451  11.426   6.466
    3    HA3  GLY   1           2HA      GLY   1 -23.023  11.780   5.765
    4    H    SER   2           H        SER   2 -23.641  10.769   3.925
    5    HA   SER   2           HA       SER   2 -23.686   9.012   2.455
    6    HB2  SER   2           1HB      SER   2 -22.295   9.337   0.596
    7    HB3  SER   2           2HB      SER   2 -22.362  10.940   1.329
    8    HG   SER   2           HG       SER   2 -20.370  10.056   2.504
    9    H    SER   3           H        SER   3 -22.815   8.175   4.956
   10    HA   SER   3           HA       SER   3 -20.440   6.847   5.207
   11    HB2  SER   3           1HB      SER   3 -23.191   6.320   6.240
   12    HB3  SER   3           2HB      SER   3 -21.962   5.077   6.473
   13    HG   SER   3           HG       SER   3 -22.327   7.157   7.964
   14    H    GLY   4           H        GLY   4 -19.700   4.736   4.780
   15    HA2  GLY   4           1HA      GLY   4 -21.102   2.741   3.420
   16    HA3  GLY   4           2HA      GLY   4 -20.328   3.750   2.208
   17    H    SER   5           H        SER   5 -19.096   1.889   1.592
   18    HA   SER   5           HA       SER   5 -16.692   1.596   3.229
   19    HB2  SER   5           1HB      SER   5 -18.250  -0.766   2.149
   20    HB3  SER   5           2HB      SER   5 -16.703  -0.847   2.992
   21    HG   SER   5           HG       SER   5 -17.986   0.365   4.708
   22    H    SER   6           H        SER   6 -14.864   0.752   2.051
   23    HA   SER   6           HA       SER   6 -14.803   1.723  -0.652
   24    HB2  SER   6           1HB      SER   6 -12.726   0.413   1.107
   25    HB3  SER   6           2HB      SER   6 -12.399   0.913  -0.552
   26    HG   SER   6           HG       SER   6 -13.503   2.731   1.291
   27    H    GLY   7           H        GLY   7 -14.389  -1.458   0.890
   28    HA2  GLY   7           1HA      GLY   7 -14.229  -3.561  -0.089
   29    HA3  GLY   7           2HA      GLY   7 -15.777  -3.055  -0.749
   30    H    THR   8           H        THR   8 -15.814  -3.704  -2.801
   31    HA   THR   8           HA       THR   8 -15.121  -4.186  -4.933
   32    HB   THR   8           HB       THR   8 -14.280  -2.263  -6.180
   33    HG1  THR   8           HG1      THR   8 -14.002  -0.287  -4.732
   34   HG21  THR   8          3HG2      THR   8 -16.091  -0.839  -4.361
   35   HG22  THR   8          1HG2      THR   8 -16.681  -2.413  -4.894
   36   HG23  THR   8          2HG2      THR   8 -16.253  -1.182  -6.083
   37    H    GLY   9           H        GLY   9 -13.377  -5.295  -3.032
   38    HA2  GLY   9           1HA      GLY   9 -11.179  -5.988  -4.596
   39    HA3  GLY   9           2HA      GLY   9 -10.656  -4.694  -3.530
   40    H    GLU  10           H        GLU  10 -10.479  -7.867  -3.834
   41    HA   GLU  10           HA       GLU  10 -10.737  -8.371  -0.941
   42    HB2  GLU  10           1HB      GLU  10 -11.192 -10.171  -3.306
   43    HB3  GLU  10           2HB      GLU  10 -10.843 -10.833  -1.715
   44    HG2  GLU  10           1HG      GLU  10 -13.186  -9.127  -2.511
   45    HG3  GLU  10           2HG      GLU  10 -13.203 -10.820  -2.020
   46    H    LYS  11           H        LYS  11  -8.448  -7.171  -1.962
   47    HA   LYS  11           HA       LYS  11  -6.426  -9.166  -2.437
   48    HB2  LYS  11           1HB      LYS  11  -6.012  -6.253  -1.760
   49    HB3  LYS  11           2HB      LYS  11  -4.882  -7.334  -2.566
   50    HG2  LYS  11           1HG      LYS  11  -7.542  -6.520  -3.713
   51    HG3  LYS  11           2HG      LYS  11  -6.015  -5.711  -4.071
   52    HD2  LYS  11           1HD      LYS  11  -6.094  -7.178  -5.823
   53    HD3  LYS  11           2HD      LYS  11  -5.253  -8.180  -4.637
   54    HE2  LYS  11           1HE      LYS  11  -6.879  -9.631  -5.365
   55    HE3  LYS  11           2HE      LYS  11  -7.679  -8.901  -3.974
   56    HZ1  LYS  11           3HZ      LYS  11  -8.854  -7.415  -5.441
   57    HZ2  LYS  11           1HZ      LYS  11  -9.118  -9.012  -5.933
   58    HZ3  LYS  11           2HZ      LYS  11  -8.040  -8.031  -6.790
   59    HA   PRO  12           HA       PRO  12  -5.248 -10.020   1.708
   60    HB2  PRO  12           1HB      PRO  12  -2.597 -10.508   1.385
   61    HB3  PRO  12           2HB      PRO  12  -3.853 -11.628   0.844
   62    HG2  PRO  12           1HG      PRO  12  -2.300  -9.617  -0.738
   63    HG3  PRO  12           2HG      PRO  12  -2.725 -11.286  -1.160
   64    HD2  PRO  12           1HD      PRO  12  -4.082  -9.150  -2.123
   65    HD3  PRO  12           2HD      PRO  12  -4.862 -10.712  -1.805
   66    H    TYR  13           H        TYR  13  -4.189  -7.281   0.060
   67    HA   TYR  13           HA       TYR  13  -3.293  -6.071   2.566
   68    HB2  TYR  13           1HB      TYR  13  -1.753  -5.658   0.004
   69    HB3  TYR  13           2HB      TYR  13  -1.317  -5.122   1.622
   70    HD1  TYR  13           HD1      TYR  13  -0.775  -6.909   3.363
   71    HD2  TYR  13           HD2      TYR  13  -1.017  -7.731  -0.805
   72    HE1  TYR  13           HE1      TYR  13   0.528  -8.968   3.699
   73    HE2  TYR  13           HE2      TYR  13   0.284  -9.792  -0.480
   74    HH   TYR  13           HH       TYR  13   1.682 -10.872   1.003
   75    H    LYS  14           H        LYS  14  -3.469  -3.777   2.617
   76    HA   LYS  14           HA       LYS  14  -4.667  -2.402   0.373
   77    HB2  LYS  14           1HB      LYS  14  -6.627  -3.445   1.398
   78    HB3  LYS  14           2HB      LYS  14  -6.192  -2.762   2.960
   79    HG2  LYS  14           1HG      LYS  14  -6.343  -0.489   1.699
   80    HG3  LYS  14           2HG      LYS  14  -7.310  -1.413   0.547
   81    HD2  LYS  14           1HD      LYS  14  -8.573  -2.214   2.689
   82    HD3  LYS  14           2HD      LYS  14  -7.873  -0.763   3.410
   83    HE2  LYS  14           1HE      LYS  14  -8.813   0.395   1.261
   84    HE3  LYS  14           2HE      LYS  14  -9.864  -1.019   1.199
   85    HZ1  LYS  14           3HZ      LYS  14 -10.337   1.230   2.632
   86    HZ2  LYS  14           1HZ      LYS  14  -9.723   0.177   3.806
   87    HZ3  LYS  14           2HZ      LYS  14 -11.076  -0.269   2.894
   88    H    CYS  15           H        CYS  15  -4.519  -0.164   0.520
   89    HA   CYS  15           HA       CYS  15  -2.561   0.795   2.410
   90    HB2  CYS  15           1HB      CYS  15  -2.670   1.439  -0.048
   91    HB3  CYS  15           2HB      CYS  15  -4.064   2.431   0.366
   92    H    SER  16           H        SER  16  -3.088   1.485   4.365
   93    HA   SER  16           HA       SER  16  -5.806   2.313   4.956
   94    HB2  SER  16           1HB      SER  16  -4.582   0.811   6.503
   95    HB3  SER  16           2HB      SER  16  -3.410   2.095   6.796
   96    HG   SER  16           HG       SER  16  -4.743   2.876   8.204
   97    H    ASP  17           H        ASP  17  -4.117   3.994   3.251
   98    HA   ASP  17           HA       ASP  17  -4.002   6.413   4.931
   99    HB2  ASP  17           1HB      ASP  17  -2.378   5.682   2.488
  100    HB3  ASP  17           2HB      ASP  17  -2.373   7.281   3.226
  101    H    CYS  18           H        CYS  18  -4.643   5.268   1.624
  102    HA   CYS  18           HA       CYS  18  -6.476   7.550   1.283
  103    HB2  CYS  18           1HB      CYS  18  -6.128   7.190  -1.180
  104    HB3  CYS  18           2HB      CYS  18  -4.694   7.723  -0.310
  105    H    GLY  19           H        GLY  19  -5.993   4.110   0.560
  106    HA2  GLY  19           1HA      GLY  19  -7.937   2.670   1.118
  107    HA3  GLY  19           2HA      GLY  19  -8.928   3.866   0.297
  108    H    LYS  20           H        LYS  20  -5.964   2.021  -0.443
  109    HA   LYS  20           HA       LYS  20  -7.212   1.262  -3.002
  110    HB2  LYS  20           1HB      LYS  20  -4.475   2.289  -2.403
  111    HB3  LYS  20           2HB      LYS  20  -4.659   1.110  -3.695
  112    HG2  LYS  20           1HG      LYS  20  -6.166   2.555  -4.876
  113    HG3  LYS  20           2HG      LYS  20  -6.185   3.700  -3.534
  114    HD2  LYS  20           1HD      LYS  20  -3.879   4.247  -3.885
  115    HD3  LYS  20           2HD      LYS  20  -3.704   2.958  -5.078
  116    HE2  LYS  20           1HE      LYS  20  -5.237   4.100  -6.573
  117    HE3  LYS  20           2HE      LYS  20  -5.512   5.356  -5.367
  118    HZ1  LYS  20           3HZ      LYS  20  -3.954   6.243  -6.846
  119    HZ2  LYS  20           1HZ      LYS  20  -3.049   4.815  -6.912
  120    HZ3  LYS  20           2HZ      LYS  20  -3.033   5.763  -5.511
  121    H    SER  21           H        SER  21  -6.955  -0.836  -3.694
  122    HA   SER  21           HA       SER  21  -6.031  -2.713  -1.652
  123    HB2  SER  21           1HB      SER  21  -7.661  -3.147  -4.166
  124    HB3  SER  21           2HB      SER  21  -7.214  -4.419  -3.030
  125    HG   SER  21           HG       SER  21  -9.360  -3.301  -2.802
  126    H    PHE  22           H        PHE  22  -4.191  -3.808  -1.832
  127    HA   PHE  22           HA       PHE  22  -2.867  -3.887  -4.463
  128    HB2  PHE  22           1HB      PHE  22  -1.579  -3.712  -1.731
  129    HB3  PHE  22           2HB      PHE  22  -0.711  -3.860  -3.255
  130    HD1  PHE  22           HD1      PHE  22  -3.261  -1.687  -1.618
  131    HD2  PHE  22           HD2      PHE  22   0.066  -1.947  -4.260
  132    HE1  PHE  22           HE1      PHE  22  -3.254   0.763  -1.845
  133    HE2  PHE  22           HE2      PHE  22   0.079   0.503  -4.490
  134    HZ   PHE  22           HZ       PHE  22  -1.582   1.861  -3.281
  135    H    THR  23           H        THR  23  -2.253  -5.821  -5.224
  136    HA   THR  23           HA       THR  23  -3.073  -8.188  -3.821
  137    HB   THR  23           HB       THR  23  -1.516  -7.988  -6.405
  138    HG1  THR  23           HG1      THR  23  -3.811  -7.017  -6.093
  139   HG21  THR  23          3HG2      THR  23  -2.782 -10.212  -4.899
  140   HG22  THR  23          1HG2      THR  23  -1.335 -10.208  -5.905
  141   HG23  THR  23          2HG2      THR  23  -2.931 -10.229  -6.655
  142    H    TRP  24           H        TRP  24   0.017  -6.729  -4.743
  143    HA   TRP  24           HA       TRP  24   1.405  -8.770  -3.142
  144    HB2  TRP  24           1HB      TRP  24   2.415  -6.936  -5.323
  145    HB3  TRP  24           2HB      TRP  24   3.461  -7.960  -4.343
  146    HD1  TRP  24           HD1      TRP  24   0.966  -8.102  -7.213
  147    HE1  TRP  24           HE1      TRP  24   1.054 -10.442  -8.281
  148    HE3  TRP  24           HE3      TRP  24   3.955 -10.445  -3.790
  149    HZ2  TRP  24           HZ2      TRP  24   2.234 -12.949  -7.744
  150    HZ3  TRP  24           HZ3      TRP  24   4.516 -12.815  -4.141
  151    HH2  TRP  24           HH2      TRP  24   3.672 -14.039  -6.077
  152    H    LYS  25           H        LYS  25   1.874  -8.160  -1.143
  153    HA   LYS  25           HA       LYS  25   1.626  -5.688  -0.011
  154    HB2  LYS  25           1HB      LYS  25   3.305  -6.495   1.704
  155    HB3  LYS  25           2HB      LYS  25   1.933  -7.557   1.418
  156    HG2  LYS  25           1HG      LYS  25   3.364  -8.907  -0.096
  157    HG3  LYS  25           2HG      LYS  25   4.733  -7.892   0.364
  158    HD2  LYS  25           1HD      LYS  25   4.650  -8.632   2.608
  159    HD3  LYS  25           2HD      LYS  25   3.058  -9.362   2.387
  160    HE2  LYS  25           1HE      LYS  25   4.738 -11.094   2.441
  161    HE3  LYS  25           2HE      LYS  25   4.060 -10.985   0.817
  162    HZ1  LYS  25           3HZ      LYS  25   6.604  -9.697   1.640
  163    HZ2  LYS  25           1HZ      LYS  25   5.982  -9.815   0.071
  164    HZ3  LYS  25           2HZ      LYS  25   6.511 -11.204   0.878
  165    H    SER  26           H        SER  26   4.533  -7.042  -1.522
  166    HA   SER  26           HA       SER  26   6.358  -5.058  -0.934
  167    HB2  SER  26           1HB      SER  26   6.802  -7.230  -2.152
  168    HB3  SER  26           2HB      SER  26   6.192  -6.452  -3.612
  169    HG   SER  26           HG       SER  26   8.066  -5.552  -3.823
  170    H    ARG  27           H        ARG  27   3.757  -5.043  -3.268
  171    HA   ARG  27           HA       ARG  27   4.640  -2.660  -4.608
  172    HB2  ARG  27           1HB      ARG  27   1.955  -4.050  -4.650
  173    HB3  ARG  27           2HB      ARG  27   2.449  -2.756  -5.733
  174    HG2  ARG  27           1HG      ARG  27   3.928  -5.363  -5.543
  175    HG3  ARG  27           2HG      ARG  27   2.578  -5.103  -6.649
  176    HD2  ARG  27           1HD      ARG  27   5.056  -3.390  -6.569
  177    HD3  ARG  27           2HD      ARG  27   4.835  -4.755  -7.663
  178    HE   ARG  27           HE       ARG  27   2.743  -2.774  -7.784
  179   HH11  ARG  27          1HH1      ARG  27   5.833  -3.794  -9.021
  180   HH12  ARG  27          2HH1      ARG  27   5.668  -2.929 -10.513
  181   HH21  ARG  27          1HH2      ARG  27   2.513  -1.631  -9.745
  182   HH22  ARG  27          2HH2      ARG  27   3.779  -1.699 -10.923
  183    H    LEU  28           H        LEU  28   2.573  -3.431  -1.910
  184    HA   LEU  28           HA       LEU  28   1.236  -0.924  -1.769
  185    HB2  LEU  28           1HB      LEU  28   0.154  -2.673  -0.676
  186    HB3  LEU  28           2HB      LEU  28   1.630  -3.211   0.122
  187    HG   LEU  28           HG       LEU  28   1.506  -1.064   1.475
  188   HD11  LEU  28          1HD1      LEU  28  -1.354  -1.068   0.538
  189   HD12  LEU  28          2HD1      LEU  28  -0.122   0.028  -0.083
  190   HD13  LEU  28          3HD1      LEU  28  -0.572   0.084   1.621
  191   HD21  LEU  28          3HD2      LEU  28   0.453  -3.565   1.886
  192   HD22  LEU  28          1HD2      LEU  28  -0.916  -2.505   2.225
  193   HD23  LEU  28          2HD2      LEU  28   0.599  -2.296   3.104
  194    H    ARG  29           H        ARG  29   3.845  -2.313   0.232
  195    HA   ARG  29           HA       ARG  29   4.422  -0.202   1.851
  196    HB2  ARG  29           1HB      ARG  29   6.492  -1.173   2.251
  197    HB3  ARG  29           2HB      ARG  29   5.560  -2.529   1.630
  198    HG2  ARG  29           1HG      ARG  29   6.618  -2.420  -0.476
  199    HG3  ARG  29           2HG      ARG  29   7.320  -0.840  -0.121
  200    HD2  ARG  29           1HD      ARG  29   9.142  -2.140   0.293
  201    HD3  ARG  29           2HD      ARG  29   8.396  -2.194   1.890
  202    HE   ARG  29           HE       ARG  29   7.325  -4.321   0.545
  203   HH11  ARG  29          1HH1      ARG  29  10.542  -3.252   1.338
  204   HH12  ARG  29          2HH1      ARG  29  11.197  -4.854   1.412
  205   HH21  ARG  29          1HH2      ARG  29   8.175  -6.435   0.639
  206   HH22  ARG  29          2HH2      ARG  29   9.850  -6.664   1.013
  207    H    ILE  30           H        ILE  30   5.444  -0.628  -1.505
  208    HA   ILE  30           HA       ILE  30   7.122   1.644  -1.627
  209    HB   ILE  30           HB       ILE  30   5.633   0.262  -3.862
  210   HG12  ILE  30          1HG1      ILE  30   8.494  -0.063  -2.933
  211   HG13  ILE  30          2HG1      ILE  30   7.190  -1.189  -2.572
  212   HG21  ILE  30          1HG2      ILE  30   6.491   2.638  -4.251
  213   HG22  ILE  30          2HG2      ILE  30   8.105   1.938  -4.145
  214   HG23  ILE  30          3HG2      ILE  30   6.989   1.394  -5.398
  215   HD11  ILE  30          3HD1      ILE  30   7.579  -2.250  -4.465
  216   HD12  ILE  30          1HD1      ILE  30   7.251  -0.777  -5.376
  217   HD13  ILE  30          2HD1      ILE  30   8.889  -1.126  -4.823
  218    H    HIS  31           H        HIS  31   3.716   1.145  -2.490
  219    HA   HIS  31           HA       HIS  31   3.245   3.745  -3.468
  220    HB2  HIS  31           1HB      HIS  31   1.640   2.133  -4.060
  221    HB3  HIS  31           2HB      HIS  31   1.452   1.579  -2.399
  222    HD1  HIS  31           HD1      HIS  31   0.346   4.260  -4.758
  223    HD2  HIS  31           HD2      HIS  31  -0.332   3.063  -0.838
  224    HE1  HIS  31           HE1      HIS  31  -1.659   5.572  -3.992
  225    H    GLN  32           H        GLN  32   2.813   2.317  -0.252
  226    HA   GLN  32           HA       GLN  32   1.564   4.385   1.061
  227    HB2  GLN  32           1HB      GLN  32   3.686   2.481   2.051
  228    HB3  GLN  32           2HB      GLN  32   2.805   3.575   3.110
  229    HG2  GLN  32           1HG      GLN  32   0.704   2.513   2.466
  230    HG3  GLN  32           2HG      GLN  32   1.584   1.419   1.400
  231   HE21  GLN  32          1HE2      GLN  32   0.539   2.044   4.577
  232   HE22  GLN  32          2HE2      GLN  32   1.262   0.671   5.337
  233    H    LYS  33           H        LYS  33   4.944   4.090   0.159
  234    HA   LYS  33           HA       LYS  33   5.989   6.195   1.685
  235    HB2  LYS  33           1HB      LYS  33   6.897   5.287  -1.052
  236    HB3  LYS  33           2HB      LYS  33   7.851   6.193   0.115
  237    HG2  LYS  33           1HG      LYS  33   7.353   4.136   1.658
  238    HG3  LYS  33           2HG      LYS  33   7.078   3.319   0.118
  239    HD2  LYS  33           1HD      LYS  33   9.357   4.364  -0.554
  240    HD3  LYS  33           2HD      LYS  33   9.588   4.557   1.185
  241    HE2  LYS  33           1HE      LYS  33   8.830   1.931  -0.068
  242    HE3  LYS  33           2HE      LYS  33  10.507   2.434   0.136
  243    HZ1  LYS  33           3HZ      LYS  33   9.605   2.841   2.587
  244    HZ2  LYS  33           1HZ      LYS  33  10.244   1.357   2.084
  245    HZ3  LYS  33           2HZ      LYS  33   8.568   1.584   2.133
  246    H    CYS  34           H        CYS  34   4.758   6.183  -1.654
  247    HA   CYS  34           HA       CYS  34   5.203   8.710  -2.482
  248    HB2  CYS  34           1HB      CYS  34   2.558   7.264  -2.748
  249    HB3  CYS  34           2HB      CYS  34   3.105   8.598  -3.757
  250    HG   CYS  34           HG       CYS  34   4.949   5.744  -3.596
  251    H    HIS  35           H        HIS  35   2.802   7.724  -0.104
  252    HA   HIS  35           HA       HIS  35   1.476  10.204   0.124
  253    HB2  HIS  35           1HB      HIS  35   1.765   7.873   2.017
  254    HB3  HIS  35           2HB      HIS  35   0.800   9.293   2.407
  255    HD1  HIS  35           HD1      HIS  35  -0.768   9.799  -0.075
  256    HD2  HIS  35           HD2      HIS  35  -0.002   5.960   1.315
  257    HE1  HIS  35           HE1      HIS  35  -2.561   8.350  -1.081
  258    H    THR  36           H        THR  36   3.214  11.731   0.120
  259    HA   THR  36           HA       THR  36   3.929  12.635   2.699
  260    HB   THR  36           HB       THR  36   5.570  10.849   2.667
  261    HG1  THR  36           HG1      THR  36   6.565  12.467   3.658
  262   HG21  THR  36          3HG2      THR  36   6.719  12.095   0.173
  263   HG22  THR  36          1HG2      THR  36   5.675  10.674   0.163
  264   HG23  THR  36          2HG2      THR  36   7.241  10.613   0.973
  265    H    GLY  37           H        GLY  37   5.329  14.581   2.617
  266    HA2  GLY  37           1HA      GLY  37   6.298  16.396   1.455
  267    HA3  GLY  37           2HA      GLY  37   5.590  15.790  -0.035
  268    H    GLU  38           H        GLU  38   3.522  16.394  -0.614
  269    HA   GLU  38           HA       GLU  38   2.623  18.900   0.140
  270    HB2  GLU  38           1HB      GLU  38   1.985  17.429  -1.895
  271    HB3  GLU  38           2HB      GLU  38   0.725  16.791  -0.847
  272    HG2  GLU  38           1HG      GLU  38   0.121  19.283  -0.478
  273    HG3  GLU  38           2HG      GLU  38   1.047  19.544  -1.955
  274    H    ARG  39           H        ARG  39   1.160  15.774   1.047
  275    HA   ARG  39           HA       ARG  39  -0.849  16.446   2.664
  276    HB2  ARG  39           1HB      ARG  39   0.343  14.140   2.278
  277    HB3  ARG  39           2HB      ARG  39   1.137  14.517   3.802
  278    HG2  ARG  39           1HG      ARG  39  -0.662  13.292   4.517
  279    HG3  ARG  39           2HG      ARG  39  -1.295  14.935   4.642
  280    HD2  ARG  39           1HD      ARG  39  -2.598  14.707   2.721
  281    HD3  ARG  39           2HD      ARG  39  -1.667  13.325   2.143
  282    HE   ARG  39           HE       ARG  39  -3.070  12.867   4.619
  283   HH11  ARG  39          1HH1      ARG  39  -3.227  12.739   1.144
  284   HH12  ARG  39          2HH1      ARG  39  -4.489  11.552   1.114
  285   HH21  ARG  39          1HH2      ARG  39  -4.731  11.304   4.594
  286   HH22  ARG  39          2HH2      ARG  39  -5.344  10.737   3.077
  287    H    HIS  40           H        HIS  40  -1.081  17.997   4.123
  288    HA   HIS  40           HA       HIS  40   1.207  18.831   5.736
  289    HB2  HIS  40           1HB      HIS  40  -1.543  20.076   5.533
  290    HB3  HIS  40           2HB      HIS  40  -0.129  20.782   6.311
  291    HD2  HIS  40           HD2      HIS  40   1.529  22.197   4.647
  292    HE1  HIS  40           HE1      HIS  40  -0.418  21.212   1.009
  293    HE2  HIS  40           HE2      HIS  40   1.418  22.556   2.088
  294    H    SER  41           H        SER  41   1.464  17.481   7.428
  295    HA   SER  41           HA       SER  41  -0.586  17.480   9.469
  296    HB2  SER  41           1HB      SER  41  -1.239  15.538   8.115
  297    HB3  SER  41           2HB      SER  41   0.387  14.874   8.271
  298    HG   SER  41           HG       SER  41  -1.269  15.460  10.494
  299    H    GLY  42           H        GLY  42   0.509  18.066  11.217
  300    HA2  GLY  42           1HA      GLY  42   3.331  17.362  11.471
  301    HA3  GLY  42           2HA      GLY  42   2.451  18.510  12.469
  302    HA   PRO  43           HA       PRO  43   2.727  14.061  14.309
  303    HB2  PRO  43           1HB      PRO  43   5.111  14.156  15.605
  304    HB3  PRO  43           2HB      PRO  43   4.938  13.547  13.954
  305    HG2  PRO  43           1HG      PRO  43   5.850  16.239  14.894
  306    HG3  PRO  43           2HG      PRO  43   6.517  15.218  13.606
  307    HD2  PRO  43           1HD      PRO  43   4.892  17.325  13.102
  308    HD3  PRO  43           2HD      PRO  43   4.910  15.868  12.087
  309    H    SER  44           H        SER  44   1.342  14.271  15.954
  310    HA   SER  44           HA       SER  44   1.447  16.459  17.797
  311    HB2  SER  44           1HB      SER  44  -0.452  15.275  18.908
  312    HB3  SER  44           2HB      SER  44  -0.709  15.541  17.183
  313    HG   SER  44           HG       SER  44  -0.897  13.279  18.415
  314    H    SER  45           H        SER  45   1.877  12.939  18.147
  315    HA   SER  45           HA       SER  45   3.584  13.476  20.485
  316    HB2  SER  45           1HB      SER  45   2.685  11.441  21.558
  317    HB3  SER  45           2HB      SER  45   1.423  12.641  21.279
  318    HG   SER  45           HG       SER  45   1.905  10.665  19.344
  319    H    GLY  46           H        GLY  46   5.255  13.339  18.779
  320    HA2  GLY  46           1HA      GLY  46   5.764  11.041  17.268
  321    HA3  GLY  46           2HA      GLY  46   6.977  12.212  17.765
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1 -20.425   8.574 -14.965
    2    HA2  GLY   1           1HA      GLY   1 -19.076   9.934 -17.049
    3    HA3  GLY   1           2HA      GLY   1 -18.580  10.592 -15.497
    4    H    SER   2           H        SER   2 -17.002   9.590 -14.414
    5    HA   SER   2           HA       SER   2 -15.278   7.798 -15.439
    6    HB2  SER   2           1HB      SER   2 -16.121   8.182 -12.571
    7    HB3  SER   2           2HB      SER   2 -14.822   7.074 -13.014
    8    HG   SER   2           HG       SER   2 -14.864   9.830 -12.982
    9    H    SER   3           H        SER   3 -14.938   5.565 -15.405
   10    HA   SER   3           HA       SER   3 -16.895   3.881 -16.143
   11    HB2  SER   3           1HB      SER   3 -14.410   3.378 -15.977
   12    HB3  SER   3           2HB      SER   3 -14.697   2.950 -14.290
   13    HG   SER   3           HG       SER   3 -14.832   1.097 -15.540
   14    H    GLY   4           H        GLY   4 -15.914   4.418 -12.766
   15    HA2  GLY   4           1HA      GLY   4 -17.247   4.358 -10.866
   16    HA3  GLY   4           2HA      GLY   4 -18.607   3.881 -11.871
   17    H    SER   5           H        SER   5 -15.439   2.333 -11.497
   18    HA   SER   5           HA       SER   5 -16.329  -0.269 -11.505
   19    HB2  SER   5           1HB      SER   5 -13.931   0.962 -10.143
   20    HB3  SER   5           2HB      SER   5 -14.203  -0.780 -10.201
   21    HG   SER   5           HG       SER   5 -13.824   0.995 -12.377
   22    H    SER   6           H        SER   6 -16.310  -1.856  -9.695
   23    HA   SER   6           HA       SER   6 -17.361  -0.699  -7.201
   24    HB2  SER   6           1HB      SER   6 -19.249  -1.515  -8.537
   25    HB3  SER   6           2HB      SER   6 -18.482  -3.097  -8.674
   26    HG   SER   6           HG       SER   6 -19.329  -3.571  -6.823
   27    H    GLY   7           H        GLY   7 -14.712  -1.472  -7.563
   28    HA2  GLY   7           1HA      GLY   7 -13.074  -2.727  -6.558
   29    HA3  GLY   7           2HA      GLY   7 -14.293  -3.159  -5.369
   30    H    THR   8           H        THR   8 -13.357  -3.938  -8.717
   31    HA   THR   8           HA       THR   8 -14.500  -6.583  -8.496
   32    HB   THR   8           HB       THR   8 -13.643  -6.912 -10.797
   33    HG1  THR   8           HG1      THR   8 -12.254  -4.616 -10.140
   34   HG21  THR   8          3HG2      THR   8 -14.958  -4.226 -10.770
   35   HG22  THR   8          1HG2      THR   8 -15.821  -5.628 -10.139
   36   HG23  THR   8          2HG2      THR   8 -15.267  -5.613 -11.813
   37    H    GLY   9           H        GLY   9 -12.570  -6.243  -6.549
   38    HA2  GLY   9           1HA      GLY   9 -10.939  -8.503  -6.942
   39    HA3  GLY   9           2HA      GLY   9  -9.976  -7.062  -7.231
   40    H    GLU  10           H        GLU  10 -10.337  -9.262  -5.015
   41    HA   GLU  10           HA       GLU  10 -10.230  -7.362  -2.765
   42    HB2  GLU  10           1HB      GLU  10 -11.200 -10.224  -2.783
   43    HB3  GLU  10           2HB      GLU  10 -10.982  -9.259  -1.330
   44    HG2  GLU  10           1HG      GLU  10 -12.729  -8.248  -3.524
   45    HG3  GLU  10           2HG      GLU  10 -13.330  -9.481  -2.418
   46    H    LYS  11           H        LYS  11  -8.307  -7.192  -1.841
   47    HA   LYS  11           HA       LYS  11  -6.441  -9.465  -2.043
   48    HB2  LYS  11           1HB      LYS  11  -5.876  -6.498  -2.098
   49    HB3  LYS  11           2HB      LYS  11  -4.626  -7.719  -1.901
   50    HG2  LYS  11           1HG      LYS  11  -4.562  -7.236  -4.166
   51    HG3  LYS  11           2HG      LYS  11  -5.534  -8.708  -4.092
   52    HD2  LYS  11           1HD      LYS  11  -7.574  -7.383  -4.235
   53    HD3  LYS  11           2HD      LYS  11  -6.622  -5.896  -4.256
   54    HE2  LYS  11           1HE      LYS  11  -7.308  -6.475  -6.505
   55    HE3  LYS  11           2HE      LYS  11  -5.560  -6.633  -6.349
   56    HZ1  LYS  11           3HZ      LYS  11  -5.881  -8.635  -7.249
   57    HZ2  LYS  11           1HZ      LYS  11  -7.540  -8.643  -6.918
   58    HZ3  LYS  11           2HZ      LYS  11  -6.437  -9.106  -5.723
   59    HA   PRO  12           HA       PRO  12  -6.141  -9.554   2.336
   60    HB2  PRO  12           1HB      PRO  12  -3.552 -10.298   2.676
   61    HB3  PRO  12           2HB      PRO  12  -4.800 -11.404   2.089
   62    HG2  PRO  12           1HG      PRO  12  -2.747  -9.871   0.541
   63    HG3  PRO  12           2HG      PRO  12  -3.272 -11.553   0.343
   64    HD2  PRO  12           1HD      PRO  12  -4.160  -9.552  -1.252
   65    HD3  PRO  12           2HD      PRO  12  -5.163 -10.956  -0.834
   66    H    TYR  13           H        TYR  13  -4.401  -7.317   0.484
   67    HA   TYR  13           HA       TYR  13  -3.642  -5.833   2.914
   68    HB2  TYR  13           1HB      TYR  13  -2.202  -5.698   0.261
   69    HB3  TYR  13           2HB      TYR  13  -1.715  -4.944   1.775
   70    HD1  TYR  13           HD1      TYR  13  -1.113  -6.487   3.726
   71    HD2  TYR  13           HD2      TYR  13  -1.455  -7.846  -0.291
   72    HE1  TYR  13           HE1      TYR  13   0.223  -8.474   4.291
   73    HE2  TYR  13           HE2      TYR  13  -0.122  -9.837   0.263
   74    HH   TYR  13           HH       TYR  13   1.675 -10.399   2.088
   75    H    LYS  14           H        LYS  14  -4.222  -3.721   3.032
   76    HA   LYS  14           HA       LYS  14  -5.267  -2.371   0.669
   77    HB2  LYS  14           1HB      LYS  14  -7.204  -3.527   1.698
   78    HB3  LYS  14           2HB      LYS  14  -6.895  -2.668   3.201
   79    HG2  LYS  14           1HG      LYS  14  -7.484  -0.593   2.255
   80    HG3  LYS  14           2HG      LYS  14  -7.437  -1.243   0.614
   81    HD2  LYS  14           1HD      LYS  14  -9.461  -2.320   0.839
   82    HD3  LYS  14           2HD      LYS  14  -9.326  -2.431   2.596
   83    HE2  LYS  14           1HE      LYS  14  -9.945  -0.192   2.896
   84    HE3  LYS  14           2HE      LYS  14  -9.626   0.214   1.210
   85    HZ1  LYS  14           3HZ      LYS  14 -12.017  -0.788   2.410
   86    HZ2  LYS  14           1HZ      LYS  14 -11.539  -1.729   1.088
   87    HZ3  LYS  14           2HZ      LYS  14 -11.793  -0.068   0.896
   88    H    CYS  15           H        CYS  15  -4.786  -0.256   0.652
   89    HA   CYS  15           HA       CYS  15  -3.125   0.823   2.701
   90    HB2  CYS  15           1HB      CYS  15  -2.742   1.494   0.422
   91    HB3  CYS  15           2HB      CYS  15  -4.396   2.075   0.262
   92    H    SER  16           H        SER  16  -3.938   1.366   4.619
   93    HA   SER  16           HA       SER  16  -6.649   2.284   4.927
   94    HB2  SER  16           1HB      SER  16  -5.227   0.855   6.578
   95    HB3  SER  16           2HB      SER  16  -4.579   2.409   7.102
   96    HG   SER  16           HG       SER  16  -7.340   2.231   6.888
   97    H    ASP  17           H        ASP  17  -4.185   3.824   3.653
   98    HA   ASP  17           HA       ASP  17  -4.347   6.303   5.170
   99    HB2  ASP  17           1HB      ASP  17  -2.237   5.248   3.989
  100    HB3  ASP  17           2HB      ASP  17  -2.879   6.077   2.573
  101    H    CYS  18           H        CYS  18  -4.976   5.208   1.840
  102    HA   CYS  18           HA       CYS  18  -6.776   7.519   1.518
  103    HB2  CYS  18           1HB      CYS  18  -6.360   7.377  -0.887
  104    HB3  CYS  18           2HB      CYS  18  -4.847   7.568  -0.008
  105    H    GLY  19           H        GLY  19  -6.323   4.089   0.735
  106    HA2  GLY  19           1HA      GLY  19  -8.406   2.762   1.310
  107    HA3  GLY  19           2HA      GLY  19  -9.231   3.901   0.256
  108    H    LYS  20           H        LYS  20  -6.040   2.936  -0.613
  109    HA   LYS  20           HA       LYS  20  -7.049   1.680  -3.013
  110    HB2  LYS  20           1HB      LYS  20  -4.327   2.454  -2.012
  111    HB3  LYS  20           2HB      LYS  20  -4.489   1.379  -3.395
  112    HG2  LYS  20           1HG      LYS  20  -5.974   3.963  -3.371
  113    HG3  LYS  20           2HG      LYS  20  -4.248   3.950  -3.738
  114    HD2  LYS  20           1HD      LYS  20  -5.242   3.758  -5.834
  115    HD3  LYS  20           2HD      LYS  20  -4.847   2.088  -5.421
  116    HE2  LYS  20           1HE      LYS  20  -7.035   1.502  -5.117
  117    HE3  LYS  20           2HE      LYS  20  -7.516   3.126  -4.629
  118    HZ1  LYS  20           3HZ      LYS  20  -8.292   2.285  -6.889
  119    HZ2  LYS  20           1HZ      LYS  20  -6.701   2.539  -7.407
  120    HZ3  LYS  20           2HZ      LYS  20  -7.619   3.836  -6.827
  121    H    SER  21           H        SER  21  -6.143  -0.412  -3.759
  122    HA   SER  21           HA       SER  21  -5.800  -2.283  -1.508
  123    HB2  SER  21           1HB      SER  21  -7.998  -2.286  -2.995
  124    HB3  SER  21           2HB      SER  21  -6.978  -3.220  -4.088
  125    HG   SER  21           HG       SER  21  -6.788  -4.793  -2.593
  126    H    PHE  22           H        PHE  22  -4.434  -4.078  -1.837
  127    HA   PHE  22           HA       PHE  22  -2.895  -4.247  -4.288
  128    HB2  PHE  22           1HB      PHE  22  -1.405  -3.857  -1.696
  129    HB3  PHE  22           2HB      PHE  22  -0.759  -3.850  -3.334
  130    HD1  PHE  22           HD1      PHE  22  -3.172  -1.999  -1.182
  131    HD2  PHE  22           HD2      PHE  22  -0.349  -1.832  -4.363
  132    HE1  PHE  22           HE1      PHE  22  -3.408   0.449  -1.258
  133    HE2  PHE  22           HE2      PHE  22  -0.579   0.616  -4.443
  134    HZ   PHE  22           HZ       PHE  22  -2.109   1.760  -2.889
  135    H    THR  23           H        THR  23  -2.075  -6.259  -4.650
  136    HA   THR  23           HA       THR  23  -2.869  -8.327  -2.747
  137    HB   THR  23           HB       THR  23  -3.314  -8.351  -5.329
  138    HG1  THR  23           HG1      THR  23  -3.886 -10.304  -4.778
  139   HG21  THR  23          3HG2      THR  23  -0.801  -8.066  -5.754
  140   HG22  THR  23          1HG2      THR  23  -1.650  -9.293  -6.693
  141   HG23  THR  23          2HG2      THR  23  -0.663  -9.767  -5.311
  142    H    TRP  24           H        TRP  24  -0.001  -7.060  -4.357
  143    HA   TRP  24           HA       TRP  24   1.724  -9.030  -3.118
  144    HB2  TRP  24           1HB      TRP  24   2.054  -6.853  -5.118
  145    HB3  TRP  24           2HB      TRP  24   3.474  -7.308  -4.180
  146    HD1  TRP  24           HD1      TRP  24   0.902  -8.888  -6.594
  147    HE1  TRP  24           HE1      TRP  24   2.024 -10.892  -7.756
  148    HE3  TRP  24           HE3      TRP  24   5.342  -8.916  -4.059
  149    HZ2  TRP  24           HZ2      TRP  24   4.467 -12.299  -7.616
  150    HZ3  TRP  24           HZ3      TRP  24   7.017 -10.624  -4.634
  151    HH2  TRP  24           HH2      TRP  24   6.586 -12.280  -6.375
  152    H    LYS  25           H        LYS  25   3.705  -8.253  -1.941
  153    HA   LYS  25           HA       LYS  25   2.866  -6.402   0.147
  154    HB2  LYS  25           1HB      LYS  25   5.391  -8.056   0.017
  155    HB3  LYS  25           2HB      LYS  25   4.711  -7.265   1.434
  156    HG2  LYS  25           1HG      LYS  25   4.093  -9.458   1.753
  157    HG3  LYS  25           2HG      LYS  25   2.656  -8.779   0.984
  158    HD2  LYS  25           1HD      LYS  25   3.003  -9.910  -0.973
  159    HD3  LYS  25           2HD      LYS  25   4.756  -9.940  -0.771
  160    HE2  LYS  25           1HE      LYS  25   3.039 -11.489   1.115
  161    HE3  LYS  25           2HE      LYS  25   3.335 -12.128  -0.501
  162    HZ1  LYS  25           3HZ      LYS  25   4.935 -12.912   1.188
  163    HZ2  LYS  25           1HZ      LYS  25   5.477 -11.322   1.388
  164    HZ3  LYS  25           2HZ      LYS  25   5.676 -12.102  -0.099
  165    H    SER  26           H        SER  26   5.507  -6.811  -2.180
  166    HA   SER  26           HA       SER  26   6.938  -4.491  -1.421
  167    HB2  SER  26           1HB      SER  26   6.938  -6.254  -3.854
  168    HB3  SER  26           2HB      SER  26   7.869  -4.756  -3.844
  169    HG   SER  26           HG       SER  26   8.968  -6.742  -3.107
  170    H    ARG  27           H        ARG  27   4.547  -5.103  -3.970
  171    HA   ARG  27           HA       ARG  27   4.605  -2.619  -5.216
  172    HB2  ARG  27           1HB      ARG  27   2.395  -4.632  -4.847
  173    HB3  ARG  27           2HB      ARG  27   2.157  -3.152  -5.766
  174    HG2  ARG  27           1HG      ARG  27   2.705  -5.148  -7.143
  175    HG3  ARG  27           2HG      ARG  27   3.806  -3.786  -7.363
  176    HD2  ARG  27           1HD      ARG  27   5.453  -4.828  -5.947
  177    HD3  ARG  27           2HD      ARG  27   4.336  -6.131  -5.545
  178    HE   ARG  27           HE       ARG  27   4.503  -6.338  -8.214
  179   HH11  ARG  27          1HH1      ARG  27   6.937  -6.051  -5.741
  180   HH12  ARG  27          2HH1      ARG  27   8.124  -6.956  -6.622
  181   HH21  ARG  27          1HH2      ARG  27   6.057  -7.531  -9.383
  182   HH22  ARG  27          2HH2      ARG  27   7.622  -7.796  -8.693
  183    H    LEU  28           H        LEU  28   2.678  -3.698  -2.439
  184    HA   LEU  28           HA       LEU  28   1.144  -1.401  -2.083
  185    HB2  LEU  28           1HB      LEU  28   0.592  -3.370  -0.879
  186    HB3  LEU  28           2HB      LEU  28   2.182  -3.431  -0.121
  187    HG   LEU  28           HG       LEU  28   1.561  -1.299   1.079
  188   HD11  LEU  28          1HD1      LEU  28  -1.080  -1.957  -0.185
  189   HD12  LEU  28          2HD1      LEU  28  -0.211  -0.423  -0.178
  190   HD13  LEU  28          3HD1      LEU  28  -0.961  -1.017   1.303
  191   HD21  LEU  28          3HD2      LEU  28   0.633  -2.462   2.842
  192   HD22  LEU  28          1HD2      LEU  28   1.371  -3.760   1.903
  193   HD23  LEU  28          2HD2      LEU  28  -0.365  -3.469   1.791
  194    H    ARG  29           H        ARG  29   4.175  -2.273  -0.412
  195    HA   ARG  29           HA       ARG  29   4.624  -0.120   1.142
  196    HB2  ARG  29           1HB      ARG  29   6.580  -1.607  -0.605
  197    HB3  ARG  29           2HB      ARG  29   7.091  -0.376   0.541
  198    HG2  ARG  29           1HG      ARG  29   5.756  -1.793   2.260
  199    HG3  ARG  29           2HG      ARG  29   5.927  -3.073   1.056
  200    HD2  ARG  29           1HD      ARG  29   7.733  -3.227   2.644
  201    HD3  ARG  29           2HD      ARG  29   8.372  -2.718   1.082
  202    HE   ARG  29           HE       ARG  29   7.981  -0.371   2.325
  203   HH11  ARG  29          1HH1      ARG  29   9.542  -3.316   3.332
  204   HH12  ARG  29          2HH1      ARG  29  10.672  -2.514   4.372
  205   HH21  ARG  29          1HH2      ARG  29   9.464   0.695   3.691
  206   HH22  ARG  29          2HH2      ARG  29  10.626  -0.233   4.577
  207    H    ILE  30           H        ILE  30   5.852  -0.238  -2.208
  208    HA   ILE  30           HA       ILE  30   6.769   2.274  -2.545
  209    HB   ILE  30           HB       ILE  30   5.058   0.781  -4.536
  210   HG12  ILE  30          1HG1      ILE  30   8.051   0.951  -4.585
  211   HG13  ILE  30          2HG1      ILE  30   7.262  -0.219  -3.534
  212   HG21  ILE  30          1HG2      ILE  30   5.358   3.248  -4.958
  213   HG22  ILE  30          2HG2      ILE  30   7.084   2.925  -5.122
  214   HG23  ILE  30          3HG2      ILE  30   5.938   2.178  -6.235
  215   HD11  ILE  30          3HD1      ILE  30   7.099  -0.037  -6.527
  216   HD12  ILE  30          1HD1      ILE  30   7.815  -1.323  -5.555
  217   HD13  ILE  30          2HD1      ILE  30   6.067  -1.084  -5.553
  218    H    HIS  31           H        HIS  31   3.402   1.336  -2.324
  219    HA   HIS  31           HA       HIS  31   2.248   3.743  -3.225
  220    HB2  HIS  31           1HB      HIS  31   1.066   1.535  -2.889
  221    HB3  HIS  31           2HB      HIS  31   1.071   1.877  -1.161
  222    HD1  HIS  31           HD1      HIS  31  -0.256   3.365  -4.389
  223    HD2  HIS  31           HD2      HIS  31  -1.029   3.384  -0.307
  224    HE1  HIS  31           HE1      HIS  31  -2.409   4.634  -4.119
  225    H    GLN  32           H        GLN  32   3.037   2.609   0.052
  226    HA   GLN  32           HA       GLN  32   2.173   4.993   1.337
  227    HB2  GLN  32           1HB      GLN  32   4.072   2.851   2.310
  228    HB3  GLN  32           2HB      GLN  32   3.336   4.093   3.314
  229    HG2  GLN  32           1HG      GLN  32   1.883   2.423   3.741
  230    HG3  GLN  32           2HG      GLN  32   1.118   3.053   2.283
  231   HE21  GLN  32          1HE2      GLN  32   3.444   0.647   3.414
  232   HE22  GLN  32          2HE2      GLN  32   3.096  -0.524   2.192
  233    H    LYS  33           H        LYS  33   5.364   3.762   0.389
  234    HA   LYS  33           HA       LYS  33   7.048   5.621   1.427
  235    HB2  LYS  33           1HB      LYS  33   7.042   4.075  -1.113
  236    HB3  LYS  33           2HB      LYS  33   8.208   5.384  -0.973
  237    HG2  LYS  33           1HG      LYS  33   9.309   3.421  -0.270
  238    HG3  LYS  33           2HG      LYS  33   8.953   4.343   1.193
  239    HD2  LYS  33           1HD      LYS  33   6.961   2.329   0.285
  240    HD3  LYS  33           2HD      LYS  33   8.456   1.746   1.022
  241    HE2  LYS  33           1HE      LYS  33   6.590   3.766   2.262
  242    HE3  LYS  33           2HE      LYS  33   6.610   2.046   2.647
  243    HZ1  LYS  33           3HZ      LYS  33   7.890   3.106   4.290
  244    HZ2  LYS  33           1HZ      LYS  33   8.730   4.048   3.163
  245    HZ3  LYS  33           2HZ      LYS  33   9.014   2.383   3.252
  246    H    CYS  34           H        CYS  34   4.997   6.016  -1.422
  247    HA   CYS  34           HA       CYS  34   5.990   8.633  -2.037
  248    HB2  CYS  34           1HB      CYS  34   4.965   7.045  -3.706
  249    HB3  CYS  34           2HB      CYS  34   3.403   7.379  -2.968
  250    HG   CYS  34           HG       CYS  34   3.626   8.806  -5.376
  251    H    HIS  35           H        HIS  35   3.081   7.352  -0.467
  252    HA   HIS  35           HA       HIS  35   1.582   9.601  -0.113
  253    HB2  HIS  35           1HB      HIS  35   2.009   7.149   1.516
  254    HB3  HIS  35           2HB      HIS  35   1.156   8.486   2.281
  255    HD1  HIS  35           HD1      HIS  35  -0.704   9.483   0.206
  256    HD2  HIS  35           HD2      HIS  35   0.122   5.435   0.640
  257    HE1  HIS  35           HE1      HIS  35  -2.654   8.284  -0.835
  258    H    THR  36           H        THR  36   4.409   8.621   1.768
  259    HA   THR  36           HA       THR  36   4.236  11.003   3.428
  260    HB   THR  36           HB       THR  36   6.251  10.108   4.554
  261    HG1  THR  36           HG1      THR  36   6.909   7.959   3.921
  262   HG21  THR  36          3HG2      THR  36   3.861   8.313   4.217
  263   HG22  THR  36          1HG2      THR  36   4.220   9.428   5.535
  264   HG23  THR  36          2HG2      THR  36   5.156   7.944   5.356
  265    H    GLY  37           H        GLY  37   5.270  12.847   3.019
  266    HA2  GLY  37           1HA      GLY  37   7.831  13.234   2.140
  267    HA3  GLY  37           2HA      GLY  37   6.889  13.106   0.662
  268    H    GLU  38           H        GLU  38   6.063  14.593   3.780
  269    HA   GLU  38           HA       GLU  38   5.401  16.699   4.328
  270    HB2  GLU  38           1HB      GLU  38   7.193  17.368   1.992
  271    HB3  GLU  38           2HB      GLU  38   6.453  18.584   3.024
  272    HG2  GLU  38           1HG      GLU  38   7.591  17.186   4.933
  273    HG3  GLU  38           2HG      GLU  38   8.644  16.668   3.618
  274    H    ARG  39           H        ARG  39   3.621  15.201   2.800
  275    HA   ARG  39           HA       ARG  39   2.569  16.850   0.678
  276    HB2  ARG  39           1HB      ARG  39   1.795  14.237   1.922
  277    HB3  ARG  39           2HB      ARG  39   0.638  15.096   0.914
  278    HG2  ARG  39           1HG      ARG  39   3.411  14.390  -0.007
  279    HG3  ARG  39           2HG      ARG  39   2.011  13.341  -0.243
  280    HD2  ARG  39           1HD      ARG  39   1.006  14.795  -1.730
  281    HD3  ARG  39           2HD      ARG  39   1.885  16.194  -1.114
  282    HE   ARG  39           HE       ARG  39   3.777  14.512  -2.221
  283   HH11  ARG  39          1HH1      ARG  39   0.969  16.263  -3.301
  284   HH12  ARG  39          2HH1      ARG  39   1.564  16.481  -4.913
  285   HH21  ARG  39          1HH2      ARG  39   4.571  14.793  -4.341
  286   HH22  ARG  39          2HH2      ARG  39   3.612  15.644  -5.504
  287    H    HIS  40           H        HIS  40   1.605  15.948   3.969
  288    HA   HIS  40           HA       HIS  40  -0.136  16.700   5.279
  289    HB2  HIS  40           1HB      HIS  40   0.011  19.236   5.557
  290    HB3  HIS  40           2HB      HIS  40   1.480  18.318   5.874
  291    HD2  HIS  40           HD2      HIS  40   3.647  19.115   4.427
  292    HE1  HIS  40           HE1      HIS  40   1.596  21.626   1.691
  293    HE2  HIS  40           HE2      HIS  40   3.839  20.757   2.438
  294    H    SER  41           H        SER  41  -1.048  16.076   2.673
  295    HA   SER  41           HA       SER  41  -2.931  18.230   2.037
  296    HB2  SER  41           1HB      SER  41  -3.392  16.913  -0.021
  297    HB3  SER  41           2HB      SER  41  -1.690  17.345   0.139
  298    HG   SER  41           HG       SER  41  -2.572  14.984  -0.290
  299    H    GLY  42           H        GLY  42  -2.871  14.743   2.729
  300    HA2  GLY  42           1HA      GLY  42  -4.438  13.687   4.170
  301    HA3  GLY  42           2HA      GLY  42  -5.564  15.002   3.863
  302    HA   PRO  43           HA       PRO  43  -6.478  11.179   1.214
  303    HB2  PRO  43           1HB      PRO  43  -8.784  10.440   2.441
  304    HB3  PRO  43           2HB      PRO  43  -7.198   9.832   2.929
  305    HG2  PRO  43           1HG      PRO  43  -8.840  12.024   4.137
  306    HG3  PRO  43           2HG      PRO  43  -7.922  10.739   4.944
  307    HD2  PRO  43           1HD      PRO  43  -6.984  13.267   4.704
  308    HD3  PRO  43           2HD      PRO  43  -5.916  11.849   4.708
  309    H    SER  44           H        SER  44  -7.787  14.151   2.059
  310    HA   SER  44           HA       SER  44 -10.188  13.979   0.467
  311    HB2  SER  44           1HB      SER  44 -10.161  16.534   0.887
  312    HB3  SER  44           2HB      SER  44 -10.405  15.466   2.269
  313    HG   SER  44           HG       SER  44  -7.784  16.164   1.624
  314    H    SER  45           H        SER  45  -6.929  14.394  -0.189
  315    HA   SER  45           HA       SER  45  -7.283  16.144  -2.477
  316    HB2  SER  45           1HB      SER  45  -5.247  16.409  -1.193
  317    HB3  SER  45           2HB      SER  45  -4.850  14.702  -1.397
  318    HG   SER  45           HG       SER  45  -4.924  16.721  -3.384
  319    H    GLY  46           H        GLY  46  -6.261  12.780  -1.897
  320    HA2  GLY  46           1HA      GLY  46  -7.675  11.533  -3.859
  321    HA3  GLY  46           2HA      GLY  46  -6.269  12.157  -4.708
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1 -18.343   9.690  -0.898
    2    HA2  GLY   1           1HA      GLY   1 -20.673   9.484  -0.146
    3    HA3  GLY   1           2HA      GLY   1 -21.099  10.621  -1.417
    4    H    SER   2           H        SER   2 -19.680   7.405  -0.905
    5    HA   SER   2           HA       SER   2 -20.754   6.604  -3.526
    6    HB2  SER   2           1HB      SER   2 -19.106   4.791  -3.498
    7    HB3  SER   2           2HB      SER   2 -18.310   6.350  -3.285
    8    HG   SER   2           HG       SER   2 -17.901   5.882  -1.215
    9    H    SER   3           H        SER   3 -22.867   6.301  -2.621
   10    HA   SER   3           HA       SER   3 -23.459   4.636  -0.453
   11    HB2  SER   3           1HB      SER   3 -25.185   5.075  -2.899
   12    HB3  SER   3           2HB      SER   3 -25.729   4.596  -1.291
   13    HG   SER   3           HG       SER   3 -25.934   6.893  -1.849
   14    H    GLY   4           H        GLY   4 -23.215   2.523  -0.189
   15    HA2  GLY   4           1HA      GLY   4 -23.322   0.257  -0.679
   16    HA3  GLY   4           2HA      GLY   4 -23.793   0.667  -2.322
   17    H    SER   5           H        SER   5 -21.066   0.317  -0.128
   18    HA   SER   5           HA       SER   5 -19.186   0.450  -2.357
   19    HB2  SER   5           1HB      SER   5 -17.443   0.462  -0.680
   20    HB3  SER   5           2HB      SER   5 -18.686   1.619  -0.203
   21    HG   SER   5           HG       SER   5 -19.480   0.090   1.258
   22    H    SER   6           H        SER   6 -18.824  -1.340  -3.474
   23    HA   SER   6           HA       SER   6 -18.350  -3.842  -2.049
   24    HB2  SER   6           1HB      SER   6 -20.444  -3.467  -4.191
   25    HB3  SER   6           2HB      SER   6 -19.764  -5.047  -3.803
   26    HG   SER   6           HG       SER   6 -20.395  -4.268  -1.514
   27    H    GLY   7           H        GLY   7 -16.689  -4.961  -2.882
   28    HA2  GLY   7           1HA      GLY   7 -15.863  -4.392  -5.650
   29    HA3  GLY   7           2HA      GLY   7 -14.692  -4.249  -4.347
   30    H    THR   8           H        THR   8 -15.575  -6.195  -6.763
   31    HA   THR   8           HA       THR   8 -15.735  -8.761  -5.617
   32    HB   THR   8           HB       THR   8 -15.111  -9.617  -7.841
   33    HG1  THR   8           HG1      THR   8 -14.714  -7.996  -9.494
   34   HG21  THR   8          3HG2      THR   8 -17.233  -9.262  -8.418
   35   HG22  THR   8          1HG2      THR   8 -16.859  -7.597  -8.860
   36   HG23  THR   8          2HG2      THR   8 -17.332  -7.985  -7.206
   37    H    GLY   9           H        GLY   9 -12.957  -6.957  -6.925
   38    HA2  GLY   9           1HA      GLY   9 -11.004  -8.911  -6.545
   39    HA3  GLY   9           2HA      GLY   9 -10.704  -7.179  -6.554
   40    H    GLU  10           H        GLU  10 -10.857 -10.006  -4.665
   41    HA   GLU  10           HA       GLU  10 -10.936  -8.557  -2.138
   42    HB2  GLU  10           1HB      GLU  10 -11.051 -11.441  -2.926
   43    HB3  GLU  10           2HB      GLU  10 -10.568 -11.020  -1.289
   44    HG2  GLU  10           1HG      GLU  10 -13.062  -9.853  -2.430
   45    HG3  GLU  10           2HG      GLU  10 -13.061 -11.515  -1.843
   46    H    LYS  11           H        LYS  11  -9.030  -7.455  -1.966
   47    HA   LYS  11           HA       LYS  11  -6.523  -8.928  -2.295
   48    HB2  LYS  11           1HB      LYS  11  -7.284  -6.048  -2.271
   49    HB3  LYS  11           2HB      LYS  11  -5.662  -6.471  -1.739
   50    HG2  LYS  11           1HG      LYS  11  -5.320  -6.086  -3.970
   51    HG3  LYS  11           2HG      LYS  11  -5.592  -7.830  -3.963
   52    HD2  LYS  11           1HD      LYS  11  -7.844  -7.558  -4.700
   53    HD3  LYS  11           2HD      LYS  11  -7.774  -5.810  -4.458
   54    HE2  LYS  11           1HE      LYS  11  -6.099  -5.633  -6.231
   55    HE3  LYS  11           2HE      LYS  11  -6.155  -7.380  -6.464
   56    HZ1  LYS  11           3HZ      LYS  11  -7.930  -5.355  -7.442
   57    HZ2  LYS  11           1HZ      LYS  11  -8.755  -6.615  -6.672
   58    HZ3  LYS  11           2HZ      LYS  11  -7.719  -6.950  -7.966
   59    HA   PRO  12           HA       PRO  12  -6.184  -9.505   2.076
   60    HB2  PRO  12           1HB      PRO  12  -3.568 -10.229   2.131
   61    HB3  PRO  12           2HB      PRO  12  -4.852 -11.308   1.571
   62    HG2  PRO  12           1HG      PRO  12  -2.959  -9.627  -0.027
   63    HG3  PRO  12           2HG      PRO  12  -3.483 -11.298  -0.308
   64    HD2  PRO  12           1HD      PRO  12  -4.527  -9.197  -1.659
   65    HD3  PRO  12           2HD      PRO  12  -5.475 -10.645  -1.265
   66    H    TYR  13           H        TYR  13  -4.836  -7.021   0.307
   67    HA   TYR  13           HA       TYR  13  -3.820  -5.741   2.753
   68    HB2  TYR  13           1HB      TYR  13  -2.605  -5.178   0.062
   69    HB3  TYR  13           2HB      TYR  13  -1.942  -4.857   1.660
   70    HD1  TYR  13           HD1      TYR  13  -2.155  -7.397   3.031
   71    HD2  TYR  13           HD2      TYR  13  -1.150  -6.610  -1.028
   72    HE1  TYR  13           HE1      TYR  13  -0.899  -9.510   2.939
   73    HE2  TYR  13           HE2      TYR  13   0.107  -8.722  -1.132
   74    HH   TYR  13           HH       TYR  13  -0.215 -11.143   0.624
   75    H    LYS  14           H        LYS  14  -4.239  -3.556   2.979
   76    HA   LYS  14           HA       LYS  14  -5.578  -2.110   0.852
   77    HB2  LYS  14           1HB      LYS  14  -7.413  -3.332   1.964
   78    HB3  LYS  14           2HB      LYS  14  -6.953  -2.609   3.500
   79    HG2  LYS  14           1HG      LYS  14  -7.586  -0.822   1.205
   80    HG3  LYS  14           2HG      LYS  14  -8.906  -1.615   2.068
   81    HD2  LYS  14           1HD      LYS  14  -7.617  -0.716   4.182
   82    HD3  LYS  14           2HD      LYS  14  -6.976   0.447   3.019
   83    HE2  LYS  14           1HE      LYS  14  -8.913   1.419   4.008
   84    HE3  LYS  14           2HE      LYS  14  -9.338   0.955   2.361
   85    HZ1  LYS  14           3HZ      LYS  14 -11.110   0.113   3.478
   86    HZ2  LYS  14           1HZ      LYS  14 -10.244  -0.172   4.903
   87    HZ3  LYS  14           2HZ      LYS  14 -10.085  -1.228   3.592
   88    H    CYS  15           H        CYS  15  -4.714  -0.151   0.827
   89    HA   CYS  15           HA       CYS  15  -3.117   0.841   2.959
   90    HB2  CYS  15           1HB      CYS  15  -2.769   1.341   0.520
   91    HB3  CYS  15           2HB      CYS  15  -4.179   2.392   0.593
   92    H    SER  16           H        SER  16  -4.569   0.861   4.744
   93    HA   SER  16           HA       SER  16  -7.015   2.089   4.940
   94    HB2  SER  16           1HB      SER  16  -5.563   0.811   6.718
   95    HB3  SER  16           2HB      SER  16  -5.052   2.435   7.178
   96    HG   SER  16           HG       SER  16  -7.479   2.820   7.159
   97    H    ASP  17           H        ASP  17  -3.896   3.559   4.634
   98    HA   ASP  17           HA       ASP  17  -4.437   6.114   5.649
   99    HB2  ASP  17           1HB      ASP  17  -2.454   4.961   3.754
  100    HB3  ASP  17           2HB      ASP  17  -2.658   6.710   3.742
  101    H    CYS  18           H        CYS  18  -4.558   4.979   2.269
  102    HA   CYS  18           HA       CYS  18  -6.234   7.304   1.623
  103    HB2  CYS  18           1HB      CYS  18  -5.608   6.965  -0.687
  104    HB3  CYS  18           2HB      CYS  18  -4.149   6.980   0.299
  105    H    GLY  19           H        GLY  19  -6.003   3.794   1.102
  106    HA2  GLY  19           1HA      GLY  19  -8.072   2.519   1.541
  107    HA3  GLY  19           2HA      GLY  19  -8.928   3.784   0.671
  108    H    LYS  20           H        LYS  20  -5.839   2.510  -0.368
  109    HA   LYS  20           HA       LYS  20  -7.118   1.563  -2.823
  110    HB2  LYS  20           1HB      LYS  20  -4.986   3.124  -2.604
  111    HB3  LYS  20           2HB      LYS  20  -4.155   1.581  -2.461
  112    HG2  LYS  20           1HG      LYS  20  -5.099   0.876  -4.606
  113    HG3  LYS  20           2HG      LYS  20  -5.914   2.435  -4.752
  114    HD2  LYS  20           1HD      LYS  20  -3.774   3.580  -4.785
  115    HD3  LYS  20           2HD      LYS  20  -2.927   2.051  -4.538
  116    HE2  LYS  20           1HE      LYS  20  -2.743   2.362  -6.825
  117    HE3  LYS  20           2HE      LYS  20  -4.151   1.309  -6.697
  118    HZ1  LYS  20           3HZ      LYS  20  -4.130   4.237  -7.162
  119    HZ2  LYS  20           1HZ      LYS  20  -5.532   3.368  -6.785
  120    HZ3  LYS  20           2HZ      LYS  20  -4.685   3.031  -8.210
  121    H    SER  21           H        SER  21  -6.480  -0.484  -3.759
  122    HA   SER  21           HA       SER  21  -5.847  -2.486  -1.694
  123    HB2  SER  21           1HB      SER  21  -7.127  -4.092  -3.037
  124    HB3  SER  21           2HB      SER  21  -8.120  -2.693  -2.627
  125    HG   SER  21           HG       SER  21  -7.942  -3.588  -4.952
  126    H    PHE  22           H        PHE  22  -4.274  -3.984  -2.055
  127    HA   PHE  22           HA       PHE  22  -2.871  -3.886  -4.638
  128    HB2  PHE  22           1HB      PHE  22  -1.508  -4.020  -1.942
  129    HB3  PHE  22           2HB      PHE  22  -0.721  -3.950  -3.515
  130    HD1  PHE  22           HD1      PHE  22  -3.088  -2.028  -1.378
  131    HD2  PHE  22           HD2      PHE  22  -0.035  -1.911  -4.341
  132    HE1  PHE  22           HE1      PHE  22  -3.059   0.429  -1.246
  133    HE2  PHE  22           HE2      PHE  22   0.000   0.546  -4.213
  134    HZ   PHE  22           HZ       PHE  22  -1.512   1.719  -2.664
  135    H    THR  23           H        THR  23  -1.510  -5.790  -5.046
  136    HA   THR  23           HA       THR  23  -2.729  -8.197  -3.873
  137    HB   THR  23           HB       THR  23  -1.289  -7.890  -6.516
  138    HG1  THR  23           HG1      THR  23  -3.985  -7.819  -5.739
  139   HG21  THR  23          3HG2      THR  23  -1.838 -10.150  -6.969
  140   HG22  THR  23          1HG2      THR  23  -2.878 -10.260  -5.550
  141   HG23  THR  23          2HG2      THR  23  -1.129 -10.140  -5.355
  142    H    TRP  24           H        TRP  24   0.363  -6.779  -4.853
  143    HA   TRP  24           HA       TRP  24   1.782  -8.927  -3.449
  144    HB2  TRP  24           1HB      TRP  24   2.663  -6.849  -5.447
  145    HB3  TRP  24           2HB      TRP  24   3.821  -7.796  -4.515
  146    HD1  TRP  24           HD1      TRP  24   1.367  -8.071  -7.407
  147    HE1  TRP  24           HE1      TRP  24   1.716 -10.332  -8.588
  148    HE3  TRP  24           HE3      TRP  24   4.579 -10.240  -4.073
  149    HZ2  TRP  24           HZ2      TRP  24   3.162 -12.719  -8.162
  150    HZ3  TRP  24           HZ3      TRP  24   5.398 -12.514  -4.533
  151    HH2  TRP  24           HH2      TRP  24   4.702 -13.726  -6.535
  152    H    LYS  25           H        LYS  25   2.785  -8.606  -1.560
  153    HA   LYS  25           HA       LYS  25   2.274  -6.493   0.110
  154    HB2  LYS  25           1HB      LYS  25   4.529  -8.475   0.025
  155    HB3  LYS  25           2HB      LYS  25   4.487  -7.224   1.260
  156    HG2  LYS  25           1HG      LYS  25   2.111  -8.981   0.823
  157    HG3  LYS  25           2HG      LYS  25   3.488  -9.554   1.768
  158    HD2  LYS  25           1HD      LYS  25   3.261  -7.425   3.126
  159    HD3  LYS  25           2HD      LYS  25   1.713  -7.184   2.313
  160    HE2  LYS  25           1HE      LYS  25   1.005  -8.305   4.173
  161    HE3  LYS  25           2HE      LYS  25   1.310  -9.670   3.100
  162    HZ1  LYS  25           3HZ      LYS  25   3.045 -10.356   4.327
  163    HZ2  LYS  25           1HZ      LYS  25   2.305  -9.467   5.562
  164    HZ3  LYS  25           2HZ      LYS  25   3.578  -8.790   4.678
  165    H    SER  26           H        SER  26   5.397  -6.999  -1.547
  166    HA   SER  26           HA       SER  26   6.733  -4.748  -0.937
  167    HB2  SER  26           1HB      SER  26   7.364  -6.622  -2.598
  168    HB3  SER  26           2HB      SER  26   6.604  -5.605  -3.822
  169    HG   SER  26           HG       SER  26   9.045  -5.393  -2.764
  170    H    ARG  27           H        ARG  27   4.609  -4.909  -3.802
  171    HA   ARG  27           HA       ARG  27   4.617  -2.384  -4.694
  172    HB2  ARG  27           1HB      ARG  27   2.089  -3.977  -4.230
  173    HB3  ARG  27           2HB      ARG  27   2.274  -2.643  -5.361
  174    HG2  ARG  27           1HG      ARG  27   3.834  -5.212  -5.511
  175    HG3  ARG  27           2HG      ARG  27   2.347  -4.893  -6.407
  176    HD2  ARG  27           1HD      ARG  27   3.569  -2.796  -7.265
  177    HD3  ARG  27           2HD      ARG  27   5.033  -3.588  -6.684
  178    HE   ARG  27           HE       ARG  27   4.894  -5.074  -8.431
  179   HH11  ARG  27          1HH1      ARG  27   1.918  -3.285  -8.176
  180   HH12  ARG  27          2HH1      ARG  27   1.287  -3.867  -9.681
  181   HH21  ARG  27          1HH2      ARG  27   4.074  -5.847 -10.414
  182   HH22  ARG  27          2HH2      ARG  27   2.514  -5.324 -10.953
  183    H    LEU  28           H        LEU  28   2.503  -3.453  -2.029
  184    HA   LEU  28           HA       LEU  28   1.317  -1.060  -1.390
  185    HB2  LEU  28           1HB      LEU  28   0.674  -3.125  -0.332
  186    HB3  LEU  28           2HB      LEU  28   2.247  -3.256   0.452
  187    HG   LEU  28           HG       LEU  28   1.687  -1.198   1.752
  188   HD11  LEU  28          1HD1      LEU  28  -1.167  -1.608   0.989
  189   HD12  LEU  28          2HD1      LEU  28  -0.132  -0.592  -0.014
  190   HD13  LEU  28          3HD1      LEU  28  -0.380  -0.192   1.685
  191   HD21  LEU  28          3HD2      LEU  28   1.352  -2.925   3.152
  192   HD22  LEU  28          1HD2      LEU  28   0.392  -3.827   1.979
  193   HD23  LEU  28          2HD2      LEU  28  -0.354  -2.537   2.923
  194    H    ARG  29           H        ARG  29   4.440  -2.290  -0.228
  195    HA   ARG  29           HA       ARG  29   5.106  -0.281   1.544
  196    HB2  ARG  29           1HB      ARG  29   6.959  -1.745  -0.346
  197    HB3  ARG  29           2HB      ARG  29   7.458  -0.858   1.088
  198    HG2  ARG  29           1HG      ARG  29   5.449  -3.022   1.406
  199    HG3  ARG  29           2HG      ARG  29   7.132  -3.469   1.117
  200    HD2  ARG  29           1HD      ARG  29   6.386  -1.478   3.232
  201    HD3  ARG  29           2HD      ARG  29   6.332  -3.212   3.549
  202    HE   ARG  29           HE       ARG  29   8.829  -2.357   2.437
  203   HH11  ARG  29          1HH1      ARG  29   6.983  -2.650   5.374
  204   HH12  ARG  29          2HH1      ARG  29   8.379  -2.717   6.399
  205   HH21  ARG  29          1HH2      ARG  29  10.674  -2.443   3.776
  206   HH22  ARG  29          2HH2      ARG  29  10.478  -2.598   5.489
  207    H    ILE  30           H        ILE  30   6.324  -0.435  -1.807
  208    HA   ILE  30           HA       ILE  30   7.411   2.063  -1.999
  209    HB   ILE  30           HB       ILE  30   5.823   0.867  -4.261
  210   HG12  ILE  30          1HG1      ILE  30   8.288  -0.117  -4.687
  211   HG13  ILE  30          2HG1      ILE  30   8.295  -0.101  -2.927
  212   HG21  ILE  30          1HG2      ILE  30   7.334   3.162  -4.091
  213   HG22  ILE  30          2HG2      ILE  30   8.445   1.998  -4.811
  214   HG23  ILE  30          3HG2      ILE  30   6.890   2.321  -5.576
  215   HD11  ILE  30          3HD1      ILE  30   7.364  -2.114  -3.104
  216   HD12  ILE  30          1HD1      ILE  30   5.879  -1.238  -3.475
  217   HD13  ILE  30          2HD1      ILE  30   6.892  -1.853  -4.782
  218    H    HIS  31           H        HIS  31   4.022   1.186  -2.599
  219    HA   HIS  31           HA       HIS  31   3.017   3.586  -3.473
  220    HB2  HIS  31           1HB      HIS  31   1.613   1.633  -3.386
  221    HB3  HIS  31           2HB      HIS  31   1.747   1.554  -1.631
  222    HD1  HIS  31           HD1      HIS  31   0.350   3.894  -4.281
  223    HD2  HIS  31           HD2      HIS  31  -0.275   2.799  -0.322
  224    HE1  HIS  31           HE1      HIS  31  -1.730   5.113  -3.567
  225    H    GLN  32           H        GLN  32   3.216   2.530  -0.072
  226    HA   GLN  32           HA       GLN  32   2.235   4.776   1.164
  227    HB2  GLN  32           1HB      GLN  32   4.400   2.859   2.002
  228    HB3  GLN  32           2HB      GLN  32   3.860   4.162   3.051
  229    HG2  GLN  32           1HG      GLN  32   1.554   3.254   2.893
  230    HG3  GLN  32           2HG      GLN  32   2.205   1.887   1.990
  231   HE21  GLN  32          1HE2      GLN  32   0.979   1.013   4.015
  232   HE22  GLN  32          2HE2      GLN  32   1.993   0.643   5.363
  233    H    LYS  33           H        LYS  33   5.630   4.156   0.288
  234    HA   LYS  33           HA       LYS  33   6.822   6.435   1.219
  235    HB2  LYS  33           1HB      LYS  33   7.328   4.770  -1.226
  236    HB3  LYS  33           2HB      LYS  33   8.294   6.207  -0.919
  237    HG2  LYS  33           1HG      LYS  33   9.560   4.507   0.008
  238    HG3  LYS  33           2HG      LYS  33   8.705   5.172   1.402
  239    HD2  LYS  33           1HD      LYS  33   7.152   3.375   1.414
  240    HD3  LYS  33           2HD      LYS  33   7.700   2.804  -0.164
  241    HE2  LYS  33           1HE      LYS  33   8.811   1.332   1.180
  242    HE3  LYS  33           2HE      LYS  33  10.012   2.620   1.100
  243    HZ1  LYS  33           3HZ      LYS  33   8.903   3.492   3.196
  244    HZ2  LYS  33           1HZ      LYS  33   9.843   2.094   3.350
  245    HZ3  LYS  33           2HZ      LYS  33   8.156   1.979   3.310
  246    H    CYS  34           H        CYS  34   4.988   6.048  -1.780
  247    HA   CYS  34           HA       CYS  34   5.493   8.555  -2.902
  248    HB2  CYS  34           1HB      CYS  34   4.288   6.518  -3.920
  249    HB3  CYS  34           2HB      CYS  34   2.840   7.153  -3.149
  250    HG   CYS  34           HG       CYS  34   4.113   9.664  -4.713
  251    H    HIS  35           H        HIS  35   2.778   7.527  -0.838
  252    HA   HIS  35           HA       HIS  35   1.286   9.777  -0.675
  253    HB2  HIS  35           1HB      HIS  35   2.001   7.696   1.339
  254    HB3  HIS  35           2HB      HIS  35   1.126   9.120   1.894
  255    HD1  HIS  35           HD1      HIS  35  -0.781   9.482  -0.512
  256    HD2  HIS  35           HD2      HIS  35  -0.006   5.850   1.351
  257    HE1  HIS  35           HE1      HIS  35  -2.769   8.028  -1.020
  258    H    THR  36           H        THR  36   4.208   9.148   1.254
  259    HA   THR  36           HA       THR  36   4.180  11.699   2.525
  260    HB   THR  36           HB       THR  36   6.472  11.134   3.265
  261    HG1  THR  36           HG1      THR  36   6.079   8.848   1.606
  262   HG21  THR  36          3HG2      THR  36   5.725   9.700   4.853
  263   HG22  THR  36          1HG2      THR  36   5.047   8.579   3.674
  264   HG23  THR  36          2HG2      THR  36   4.161  10.039   4.113
  265    H    GLY  37           H        GLY  37   5.912  10.343  -0.253
  266    HA2  GLY  37           1HA      GLY  37   7.368  12.799  -0.714
  267    HA3  GLY  37           2HA      GLY  37   7.404  11.358  -1.719
  268    H    GLU  38           H        GLU  38   4.736  13.483  -0.698
  269    HA   GLU  38           HA       GLU  38   3.961  13.705  -3.521
  270    HB2  GLU  38           1HB      GLU  38   2.462  13.814  -0.942
  271    HB3  GLU  38           2HB      GLU  38   1.828  14.709  -2.316
  272    HG2  GLU  38           1HG      GLU  38   1.850  12.623  -3.638
  273    HG3  GLU  38           2HG      GLU  38   2.376  11.753  -2.198
  274    H    ARG  39           H        ARG  39   2.646  15.889  -3.850
  275    HA   ARG  39           HA       ARG  39   4.417  18.058  -2.931
  276    HB2  ARG  39           1HB      ARG  39   2.853  17.883  -5.514
  277    HB3  ARG  39           2HB      ARG  39   3.896  19.214  -5.030
  278    HG2  ARG  39           1HG      ARG  39   5.064  16.486  -5.143
  279    HG3  ARG  39           2HG      ARG  39   4.730  17.324  -6.660
  280    HD2  ARG  39           1HD      ARG  39   6.854  18.064  -6.281
  281    HD3  ARG  39           2HD      ARG  39   5.954  19.309  -5.416
  282    HE   ARG  39           HE       ARG  39   6.407  17.458  -3.506
  283   HH11  ARG  39          1HH1      ARG  39   8.479  19.070  -5.792
  284   HH12  ARG  39          2HH1      ARG  39   9.874  19.015  -4.765
  285   HH21  ARG  39          1HH2      ARG  39   8.236  17.379  -2.145
  286   HH22  ARG  39          2HH2      ARG  39   9.734  18.052  -2.691
  287    H    HIS  40           H        HIS  40   1.083  17.301  -3.899
  288    HA   HIS  40           HA       HIS  40   0.069  19.766  -2.799
  289    HB2  HIS  40           1HB      HIS  40  -2.117  18.947  -3.480
  290    HB3  HIS  40           2HB      HIS  40  -0.961  18.708  -4.786
  291    HD2  HIS  40           HD2      HIS  40  -3.428  16.691  -2.681
  292    HE1  HIS  40           HE1      HIS  40  -1.074  13.899  -4.840
  293    HE2  HIS  40           HE2      HIS  40  -3.162  14.244  -3.474
  294    H    SER  41           H        SER  41  -1.768  19.704  -1.216
  295    HA   SER  41           HA       SER  41  -0.941  18.153   1.089
  296    HB2  SER  41           1HB      SER  41  -2.277  19.614   2.383
  297    HB3  SER  41           2HB      SER  41  -1.590  20.636   1.120
  298    HG   SER  41           HG       SER  41  -4.203  19.542   1.232
  299    H    GLY  42           H        GLY  42  -2.509  16.995   2.425
  300    HA2  GLY  42           1HA      GLY  42  -4.953  16.113   1.115
  301    HA3  GLY  42           2HA      GLY  42  -3.721  14.879   1.337
  302    HA   PRO  43           HA       PRO  43  -5.328  16.320   5.701
  303    HB2  PRO  43           1HB      PRO  43  -7.816  17.406   5.665
  304    HB3  PRO  43           2HB      PRO  43  -6.342  18.376   5.549
  305    HG2  PRO  43           1HG      PRO  43  -8.180  17.454   3.373
  306    HG3  PRO  43           2HG      PRO  43  -7.420  19.040   3.598
  307    HD2  PRO  43           1HD      PRO  43  -6.460  17.198   1.861
  308    HD3  PRO  43           2HD      PRO  43  -5.407  18.340   2.720
  309    H    SER  44           H        SER  44  -5.646  14.266   6.348
  310    HA   SER  44           HA       SER  44  -8.300  13.184   6.323
  311    HB2  SER  44           1HB      SER  44  -7.919  11.209   5.040
  312    HB3  SER  44           2HB      SER  44  -7.355  12.555   4.050
  313    HG   SER  44           HG       SER  44  -5.976  10.437   4.990
  314    H    SER  45           H        SER  45  -8.611  11.745   7.960
  315    HA   SER  45           HA       SER  45  -6.351  11.345   9.761
  316    HB2  SER  45           1HB      SER  45  -9.298  10.788  10.183
  317    HB3  SER  45           2HB      SER  45  -8.043  10.700  11.418
  318    HG   SER  45           HG       SER  45  -7.744  13.054  10.447
  319    H    GLY  46           H        GLY  46  -9.051   9.348   8.540
  320    HA2  GLY  46           1HA      GLY  46  -9.210   7.035   8.418
  321    HA3  GLY  46           2HA      GLY  46  -7.777   7.263   7.426
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1 -22.398   2.076  -3.981
    2    HA2  GLY   1           1HA      GLY   1 -22.807  -0.392  -5.388
    3    HA3  GLY   1           2HA      GLY   1 -23.860   1.015  -5.421
    4    H    SER   2           H        SER   2 -22.270   2.971  -6.425
    5    HA   SER   2           HA       SER   2 -22.372   2.548  -9.168
    6    HB2  SER   2           1HB      SER   2 -22.295   4.780  -8.051
    7    HB3  SER   2           2HB      SER   2 -20.578   4.524  -7.738
    8    HG   SER   2           HG       SER   2 -20.223   5.200  -9.683
    9    H    SER   3           H        SER   3 -19.496   2.590  -7.065
   10    HA   SER   3           HA       SER   3 -18.076   1.053  -9.141
   11    HB2  SER   3           1HB      SER   3 -17.311   3.479  -8.411
   12    HB3  SER   3           2HB      SER   3 -16.580   2.602  -7.067
   13    HG   SER   3           HG       SER   3 -15.538   1.278  -8.672
   14    H    GLY   4           H        GLY   4 -18.431   1.547  -5.645
   15    HA2  GLY   4           1HA      GLY   4 -16.842  -0.274  -4.498
   16    HA3  GLY   4           2HA      GLY   4 -18.512  -0.083  -3.988
   17    H    SER   5           H        SER   5 -16.233  -2.208  -5.227
   18    HA   SER   5           HA       SER   5 -18.347  -4.107  -6.012
   19    HB2  SER   5           1HB      SER   5 -16.936  -3.451  -7.927
   20    HB3  SER   5           2HB      SER   5 -15.504  -3.986  -7.048
   21    HG   SER   5           HG       SER   5 -16.467  -6.096  -7.008
   22    H    SER   6           H        SER   6 -18.508  -4.824  -3.835
   23    HA   SER   6           HA       SER   6 -16.236  -6.496  -2.980
   24    HB2  SER   6           1HB      SER   6 -17.014  -6.110  -0.635
   25    HB3  SER   6           2HB      SER   6 -16.447  -4.645  -1.436
   26    HG   SER   6           HG       SER   6 -19.024  -5.377  -0.666
   27    H    GLY   7           H        GLY   7 -16.738  -8.557  -3.323
   28    HA2  GLY   7           1HA      GLY   7 -18.913  -9.816  -2.037
   29    HA3  GLY   7           2HA      GLY   7 -19.307  -9.578  -3.733
   30    H    THR   8           H        THR   8 -17.505 -10.312  -5.271
   31    HA   THR   8           HA       THR   8 -17.146 -13.068  -4.977
   32    HB   THR   8           HB       THR   8 -15.547 -12.882  -6.887
   33    HG1  THR   8           HG1      THR   8 -16.129 -10.096  -6.738
   34   HG21  THR   8          3HG2      THR   8 -17.857 -11.141  -7.592
   35   HG22  THR   8          1HG2      THR   8 -18.188 -12.755  -6.966
   36   HG23  THR   8          2HG2      THR   8 -17.216 -12.557  -8.425
   37    H    GLY   9           H        GLY   9 -14.802 -10.416  -4.574
   38    HA2  GLY   9           1HA      GLY   9 -13.466 -11.267  -2.384
   39    HA3  GLY   9           2HA      GLY   9 -12.749 -12.237  -3.663
   40    H    GLU  10           H        GLU  10 -11.800  -9.940  -1.879
   41    HA   GLU  10           HA       GLU  10 -10.748  -8.251  -4.053
   42    HB2  GLU  10           1HB      GLU  10 -11.210  -7.483  -1.165
   43    HB3  GLU  10           2HB      GLU  10 -10.534  -6.439  -2.409
   44    HG2  GLU  10           1HG      GLU  10 -12.798  -7.035  -3.632
   45    HG3  GLU  10           2HG      GLU  10 -13.333  -7.313  -1.976
   46    H    LYS  11           H        LYS  11  -8.656  -7.071  -3.167
   47    HA   LYS  11           HA       LYS  11  -6.695  -9.089  -2.859
   48    HB2  LYS  11           1HB      LYS  11  -6.707  -6.117  -2.967
   49    HB3  LYS  11           2HB      LYS  11  -5.289  -6.892  -2.274
   50    HG2  LYS  11           1HG      LYS  11  -4.811  -6.563  -4.554
   51    HG3  LYS  11           2HG      LYS  11  -5.170  -8.282  -4.375
   52    HD2  LYS  11           1HD      LYS  11  -7.409  -6.447  -5.056
   53    HD3  LYS  11           2HD      LYS  11  -6.233  -6.825  -6.317
   54    HE2  LYS  11           1HE      LYS  11  -6.655  -9.182  -6.070
   55    HE3  LYS  11           2HE      LYS  11  -7.704  -8.889  -4.684
   56    HZ1  LYS  11           3HZ      LYS  11  -8.878  -7.379  -6.540
   57    HZ2  LYS  11           1HZ      LYS  11  -9.303  -8.989  -6.238
   58    HZ3  LYS  11           2HZ      LYS  11  -8.260  -8.615  -7.516
   59    HA   PRO  12           HA       PRO  12  -6.579  -9.594   1.513
   60    HB2  PRO  12           1HB      PRO  12  -4.039 -10.517   1.771
   61    HB3  PRO  12           2HB      PRO  12  -5.354 -11.496   1.109
   62    HG2  PRO  12           1HG      PRO  12  -3.217  -9.971  -0.330
   63    HG3  PRO  12           2HG      PRO  12  -3.844 -11.598  -0.656
   64    HD2  PRO  12           1HD      PRO  12  -4.615  -9.427  -2.080
   65    HD3  PRO  12           2HD      PRO  12  -5.699 -10.797  -1.766
   66    H    TYR  13           H        TYR  13  -4.770  -7.297  -0.165
   67    HA   TYR  13           HA       TYR  13  -3.814  -6.112   2.360
   68    HB2  TYR  13           1HB      TYR  13  -2.585  -5.662  -0.362
   69    HB3  TYR  13           2HB      TYR  13  -1.943  -5.163   1.199
   70    HD1  TYR  13           HD1      TYR  13  -1.221  -6.980   2.831
   71    HD2  TYR  13           HD2      TYR  13  -2.027  -7.750  -1.275
   72    HE1  TYR  13           HE1      TYR  13   0.060  -9.074   2.979
   73    HE2  TYR  13           HE2      TYR  13  -0.750  -9.848  -1.138
   74    HH   TYR  13           HH       TYR  13   1.256 -10.676   0.497
   75    H    LYS  14           H        LYS  14  -4.094  -3.910   2.664
   76    HA   LYS  14           HA       LYS  14  -5.373  -2.317   0.605
   77    HB2  LYS  14           1HB      LYS  14  -7.255  -3.483   1.712
   78    HB3  LYS  14           2HB      LYS  14  -6.746  -2.809   3.255
   79    HG2  LYS  14           1HG      LYS  14  -7.062  -0.528   2.219
   80    HG3  LYS  14           2HG      LYS  14  -7.850  -1.352   0.872
   81    HD2  LYS  14           1HD      LYS  14  -9.433  -2.368   2.502
   82    HD3  LYS  14           2HD      LYS  14  -8.696  -1.383   3.768
   83    HE2  LYS  14           1HE      LYS  14  -9.652  -0.019   1.307
   84    HE3  LYS  14           2HE      LYS  14 -10.859  -0.596   2.455
   85    HZ1  LYS  14           3HZ      LYS  14 -10.478   1.434   3.338
   86    HZ2  LYS  14           1HZ      LYS  14  -8.901   1.544   2.736
   87    HZ3  LYS  14           2HZ      LYS  14  -9.216   0.621   4.118
   88    H    CYS  15           H        CYS  15  -4.491  -0.363   0.653
   89    HA   CYS  15           HA       CYS  15  -2.682   0.461   2.640
   90    HB2  CYS  15           1HB      CYS  15  -2.686   1.252   0.270
   91    HB3  CYS  15           2HB      CYS  15  -4.114   2.215   0.636
   92    H    SER  16           H        SER  16  -3.115   1.102   4.635
   93    HA   SER  16           HA       SER  16  -5.760   2.109   5.307
   94    HB2  SER  16           1HB      SER  16  -3.385   1.216   6.928
   95    HB3  SER  16           2HB      SER  16  -4.730   2.077   7.677
   96    HG   SER  16           HG       SER  16  -5.031  -0.176   7.783
   97    H    ASP  17           H        ASP  17  -4.380   3.859   3.677
   98    HA   ASP  17           HA       ASP  17  -3.950   6.112   5.514
   99    HB2  ASP  17           1HB      ASP  17  -2.251   5.409   3.113
  100    HB3  ASP  17           2HB      ASP  17  -2.168   6.949   3.964
  101    H    CYS  18           H        CYS  18  -4.917   4.951   2.352
  102    HA   CYS  18           HA       CYS  18  -6.453   7.431   1.981
  103    HB2  CYS  18           1HB      CYS  18  -5.984   7.338  -0.439
  104    HB3  CYS  18           2HB      CYS  18  -4.513   7.551   0.506
  105    H    GLY  19           H        GLY  19  -6.052   4.035   1.026
  106    HA2  GLY  19           1HA      GLY  19  -8.087   2.647   1.422
  107    HA3  GLY  19           2HA      GLY  19  -8.976   3.922   0.601
  108    H    LYS  20           H        LYS  20  -6.068   1.950  -0.027
  109    HA   LYS  20           HA       LYS  20  -7.116   1.478  -2.742
  110    HB2  LYS  20           1HB      LYS  20  -4.308   1.904  -1.755
  111    HB3  LYS  20           2HB      LYS  20  -4.617   1.065  -3.269
  112    HG2  LYS  20           1HG      LYS  20  -5.922   3.696  -2.854
  113    HG3  LYS  20           2HG      LYS  20  -4.185   3.668  -3.170
  114    HD2  LYS  20           1HD      LYS  20  -4.515   2.512  -5.241
  115    HD3  LYS  20           2HD      LYS  20  -6.229   2.274  -4.894
  116    HE2  LYS  20           1HE      LYS  20  -6.375   4.081  -6.278
  117    HE3  LYS  20           2HE      LYS  20  -6.190   4.915  -4.736
  118    HZ1  LYS  20           3HZ      LYS  20  -3.642   4.355  -5.758
  119    HZ2  LYS  20           1HZ      LYS  20  -4.362   5.864  -5.503
  120    HZ3  LYS  20           2HZ      LYS  20  -4.549   5.078  -6.989
  121    H    SER  21           H        SER  21  -5.919  -0.549  -3.714
  122    HA   SER  21           HA       SER  21  -5.752  -2.677  -1.701
  123    HB2  SER  21           1HB      SER  21  -7.648  -2.518  -4.015
  124    HB3  SER  21           2HB      SER  21  -7.036  -4.094  -3.510
  125    HG   SER  21           HG       SER  21  -8.125  -2.297  -1.632
  126    H    PHE  22           H        PHE  22  -3.981  -3.853  -1.970
  127    HA   PHE  22           HA       PHE  22  -2.794  -4.013  -4.662
  128    HB2  PHE  22           1HB      PHE  22  -1.322  -3.870  -2.022
  129    HB3  PHE  22           2HB      PHE  22  -0.574  -4.038  -3.607
  130    HD1  PHE  22           HD1      PHE  22  -2.826  -1.784  -1.683
  131    HD2  PHE  22           HD2      PHE  22   0.100  -2.151  -4.752
  132    HE1  PHE  22           HE1      PHE  22  -2.750   0.666  -1.899
  133    HE2  PHE  22           HE2      PHE  22   0.181   0.298  -4.972
  134    HZ   PHE  22           HZ       PHE  22  -1.245   1.710  -3.544
  135    H    THR  23           H        THR  23  -1.648  -5.946  -5.165
  136    HA   THR  23           HA       THR  23  -2.666  -8.267  -3.687
  137    HB   THR  23           HB       THR  23  -1.387  -8.261  -6.424
  138    HG1  THR  23           HG1      THR  23  -3.810  -8.607  -6.909
  139   HG21  THR  23          3HG2      THR  23  -2.751 -10.293  -4.720
  140   HG22  THR  23          1HG2      THR  23  -1.331 -10.460  -5.751
  141   HG23  THR  23          2HG2      THR  23  -2.940 -10.390  -6.471
  142    H    TRP  24           H        TRP  24   0.015  -6.420  -3.693
  143    HA   TRP  24           HA       TRP  24   1.709  -8.682  -2.887
  144    HB2  TRP  24           1HB      TRP  24   3.047  -6.347  -4.149
  145    HB3  TRP  24           2HB      TRP  24   3.488  -8.052  -4.181
  146    HD1  TRP  24           HD1      TRP  24   3.055  -9.256  -6.400
  147    HE1  TRP  24           HE1      TRP  24   1.659  -8.781  -8.510
  148    HE3  TRP  24           HE3      TRP  24   0.635  -5.031  -4.838
  149    HZ2  TRP  24           HZ2      TRP  24  -0.218  -6.868  -9.395
  150    HZ3  TRP  24           HZ3      TRP  24  -0.944  -3.940  -6.378
  151    HH2  TRP  24           HH2      TRP  24  -1.360  -4.840  -8.609
  152    H    LYS  25           H        LYS  25   3.078  -8.312  -1.161
  153    HA   LYS  25           HA       LYS  25   2.288  -6.257   0.649
  154    HB2  LYS  25           1HB      LYS  25   4.271  -8.485   0.676
  155    HB3  LYS  25           2HB      LYS  25   4.457  -7.195   1.857
  156    HG2  LYS  25           1HG      LYS  25   2.323  -7.635   2.800
  157    HG3  LYS  25           2HG      LYS  25   1.899  -8.731   1.482
  158    HD2  LYS  25           1HD      LYS  25   3.360 -10.392   2.238
  159    HD3  LYS  25           2HD      LYS  25   4.273  -9.261   3.239
  160    HE2  LYS  25           1HE      LYS  25   3.048 -10.283   4.865
  161    HE3  LYS  25           2HE      LYS  25   1.923  -8.997   4.432
  162    HZ1  LYS  25           3HZ      LYS  25   1.813 -11.859   3.730
  163    HZ2  LYS  25           1HZ      LYS  25   0.998 -10.713   2.789
  164    HZ3  LYS  25           2HZ      LYS  25   0.615 -10.889   4.428
  165    H    SER  26           H        SER  26   5.189  -6.840  -1.303
  166    HA   SER  26           HA       SER  26   6.613  -4.572  -0.371
  167    HB2  SER  26           1HB      SER  26   7.725  -6.490  -1.450
  168    HB3  SER  26           2HB      SER  26   6.930  -6.090  -2.972
  169    HG   SER  26           HG       SER  26   8.040  -3.887  -2.352
  170    H    ARG  27           H        ARG  27   4.792  -5.162  -3.375
  171    HA   ARG  27           HA       ARG  27   5.110  -2.725  -4.605
  172    HB2  ARG  27           1HB      ARG  27   2.554  -4.337  -4.548
  173    HB3  ARG  27           2HB      ARG  27   3.023  -3.166  -5.773
  174    HG2  ARG  27           1HG      ARG  27   4.596  -5.661  -5.192
  175    HG3  ARG  27           2HG      ARG  27   3.315  -5.575  -6.403
  176    HD2  ARG  27           1HD      ARG  27   4.727  -3.462  -7.179
  177    HD3  ARG  27           2HD      ARG  27   6.027  -4.368  -6.405
  178    HE   ARG  27           HE       ARG  27   4.628  -6.098  -8.103
  179   HH11  ARG  27          1HH1      ARG  27   6.702  -3.308  -8.276
  180   HH12  ARG  27          2HH1      ARG  27   7.345  -3.720  -9.831
  181   HH21  ARG  27          1HH2      ARG  27   5.467  -6.652 -10.150
  182   HH22  ARG  27          2HH2      ARG  27   6.641  -5.622 -10.897
  183    H    LEU  28           H        LEU  28   3.079  -3.542  -1.882
  184    HA   LEU  28           HA       LEU  28   1.476  -1.201  -1.916
  185    HB2  LEU  28           1HB      LEU  28   0.774  -3.184  -0.727
  186    HB3  LEU  28           2HB      LEU  28   2.184  -3.086   0.327
  187    HG   LEU  28           HG       LEU  28   1.261  -0.901   1.175
  188   HD11  LEU  28          1HD1      LEU  28  -1.181  -1.831  -0.328
  189   HD12  LEU  28          2HD1      LEU  28  -0.228  -0.386  -0.668
  190   HD13  LEU  28          3HD1      LEU  28  -1.137  -0.508   0.838
  191   HD21  LEU  28          3HD2      LEU  28  -0.059  -1.945   2.789
  192   HD22  LEU  28          1HD2      LEU  28   1.010  -3.231   2.226
  193   HD23  LEU  28          2HD2      LEU  28  -0.657  -3.156   1.654
  194    H    ARG  29           H        ARG  29   4.441  -2.083  -0.181
  195    HA   ARG  29           HA       ARG  29   4.735   0.107   1.459
  196    HB2  ARG  29           1HB      ARG  29   6.805  -1.520  -0.012
  197    HB3  ARG  29           2HB      ARG  29   7.233  -0.272   1.151
  198    HG2  ARG  29           1HG      ARG  29   5.610  -1.612   2.714
  199    HG3  ARG  29           2HG      ARG  29   5.970  -2.927   1.594
  200    HD2  ARG  29           1HD      ARG  29   8.010  -1.291   3.099
  201    HD3  ARG  29           2HD      ARG  29   7.482  -2.918   3.530
  202    HE   ARG  29           HE       ARG  29   9.330  -2.186   1.451
  203   HH11  ARG  29          1HH1      ARG  29   7.091  -4.602   2.578
  204   HH12  ARG  29          2HH1      ARG  29   7.845  -5.895   1.705
  205   HH21  ARG  29          1HH2      ARG  29  10.332  -3.879   0.298
  206   HH22  ARG  29          2HH2      ARG  29   9.689  -5.483   0.409
  207    H    ILE  30           H        ILE  30   6.100  -0.225  -1.822
  208    HA   ILE  30           HA       ILE  30   7.216   2.248  -2.139
  209    HB   ILE  30           HB       ILE  30   5.668   0.717  -4.232
  210   HG12  ILE  30          1HG1      ILE  30   8.182   0.195  -4.857
  211   HG13  ILE  30          2HG1      ILE  30   8.452   0.544  -3.153
  212   HG21  ILE  30          1HG2      ILE  30   6.919   1.967  -5.874
  213   HG22  ILE  30          2HG2      ILE  30   6.055   3.084  -4.820
  214   HG23  ILE  30          3HG2      ILE  30   7.787   2.829  -4.604
  215   HD11  ILE  30          3HD1      ILE  30   6.249  -1.313  -3.747
  216   HD12  ILE  30          1HD1      ILE  30   7.875  -1.892  -4.110
  217   HD13  ILE  30          2HD1      ILE  30   7.471  -1.361  -2.477
  218    H    HIS  31           H        HIS  31   3.807   1.388  -2.459
  219    HA   HIS  31           HA       HIS  31   2.915   3.881  -3.442
  220    HB2  HIS  31           1HB      HIS  31   1.482   1.980  -3.682
  221    HB3  HIS  31           2HB      HIS  31   1.494   1.675  -1.948
  222    HD1  HIS  31           HD1      HIS  31  -0.086   3.824  -4.555
  223    HD2  HIS  31           HD2      HIS  31  -0.235   3.292  -0.437
  224    HE1  HIS  31           HE1      HIS  31  -2.114   5.097  -3.785
  225    H    GLN  32           H        GLN  32   2.621   2.517  -0.155
  226    HA   GLN  32           HA       GLN  32   1.613   4.703   1.151
  227    HB2  GLN  32           1HB      GLN  32   3.553   2.596   2.085
  228    HB3  GLN  32           2HB      GLN  32   2.921   3.827   3.170
  229    HG2  GLN  32           1HG      GLN  32   0.608   3.032   2.414
  230    HG3  GLN  32           2HG      GLN  32   1.452   1.621   1.778
  231   HE21  GLN  32          1HE2      GLN  32   1.510  -0.039   3.095
  232   HE22  GLN  32          2HE2      GLN  32   1.479   0.020   4.822
  233    H    LYS  33           H        LYS  33   4.886   4.169   0.054
  234    HA   LYS  33           HA       LYS  33   6.060   6.313   1.529
  235    HB2  LYS  33           1HB      LYS  33   6.987   4.769  -0.894
  236    HB3  LYS  33           2HB      LYS  33   7.957   6.008  -0.109
  237    HG2  LYS  33           1HG      LYS  33   8.299   4.730   1.784
  238    HG3  LYS  33           2HG      LYS  33   6.881   3.722   1.484
  239    HD2  LYS  33           1HD      LYS  33   7.973   2.415  -0.065
  240    HD3  LYS  33           2HD      LYS  33   9.128   3.684  -0.479
  241    HE2  LYS  33           1HE      LYS  33   9.871   3.333   2.032
  242    HE3  LYS  33           2HE      LYS  33   9.154   1.743   1.777
  243    HZ1  LYS  33           3HZ      LYS  33  11.357   2.973   0.215
  244    HZ2  LYS  33           1HZ      LYS  33  10.597   1.520  -0.202
  245    HZ3  LYS  33           2HZ      LYS  33  11.463   1.636   1.246
  246    H    CYS  34           H        CYS  34   4.791   5.955  -1.752
  247    HA   CYS  34           HA       CYS  34   5.583   8.363  -2.852
  248    HB2  CYS  34           1HB      CYS  34   3.022   6.814  -3.269
  249    HB3  CYS  34           2HB      CYS  34   3.521   8.169  -4.276
  250    HG   CYS  34           HG       CYS  34   4.305   5.018  -4.564
  251    H    HIS  35           H        HIS  35   2.674   7.678  -0.934
  252    HA   HIS  35           HA       HIS  35   1.235   9.924  -1.010
  253    HB2  HIS  35           1HB      HIS  35   2.053   8.292   1.379
  254    HB3  HIS  35           2HB      HIS  35   0.980   9.678   1.558
  255    HD1  HIS  35           HD1      HIS  35  -0.842   9.314  -0.858
  256    HD2  HIS  35           HD2      HIS  35   0.350   6.193   1.612
  257    HE1  HIS  35           HE1      HIS  35  -2.586   7.525  -1.145
  258    H    THR  36           H        THR  36   4.065   9.611   1.140
  259    HA   THR  36           HA       THR  36   4.071  12.389   1.805
  260    HB   THR  36           HB       THR  36   6.213  11.931   2.918
  261    HG1  THR  36           HG1      THR  36   5.958   9.456   1.553
  262   HG21  THR  36          3HG2      THR  36   3.786  11.057   3.693
  263   HG22  THR  36          1HG2      THR  36   5.243  10.863   4.665
  264   HG23  THR  36          2HG2      THR  36   4.665   9.529   3.666
  265    H    GLY  37           H        GLY  37   4.240  13.612  -0.059
  266    HA2  GLY  37           1HA      GLY  37   6.838  14.170  -0.998
  267    HA3  GLY  37           2HA      GLY  37   6.013  13.163  -2.178
  268    H    GLU  38           H        GLU  38   6.611  15.333  -3.317
  269    HA   GLU  38           HA       GLU  38   4.302  17.146  -3.062
  270    HB2  GLU  38           1HB      GLU  38   6.648  18.051  -2.535
  271    HB3  GLU  38           2HB      GLU  38   6.950  17.925  -4.262
  272    HG2  GLU  38           1HG      GLU  38   6.301  20.126  -3.997
  273    HG3  GLU  38           2HG      GLU  38   4.818  19.334  -4.526
  274    H    ARG  39           H        ARG  39   3.055  17.472  -4.808
  275    HA   ARG  39           HA       ARG  39   4.049  16.692  -7.448
  276    HB2  ARG  39           1HB      ARG  39   1.672  15.529  -6.033
  277    HB3  ARG  39           2HB      ARG  39   1.689  15.640  -7.788
  278    HG2  ARG  39           1HG      ARG  39   2.529  13.545  -7.525
  279    HG3  ARG  39           2HG      ARG  39   4.032  14.468  -7.495
  280    HD2  ARG  39           1HD      ARG  39   4.330  13.174  -5.636
  281    HD3  ARG  39           2HD      ARG  39   3.519  14.562  -4.911
  282    HE   ARG  39           HE       ARG  39   1.667  12.563  -5.748
  283   HH11  ARG  39          1HH1      ARG  39   3.909  13.423  -3.228
  284   HH12  ARG  39          2HH1      ARG  39   3.088  12.510  -2.006
  285   HH21  ARG  39          1HH2      ARG  39   0.577  11.356  -4.149
  286   HH22  ARG  39          2HH2      ARG  39   1.193  11.333  -2.531
  287    H    HIS  40           H        HIS  40   3.319  17.951  -9.084
  288    HA   HIS  40           HA       HIS  40   1.421  20.082  -8.360
  289    HB2  HIS  40           1HB      HIS  40   3.755  20.767  -8.985
  290    HB3  HIS  40           2HB      HIS  40   3.455  20.121 -10.596
  291    HD2  HIS  40           HD2      HIS  40   3.584  22.633 -11.800
  292    HE1  HIS  40           HE1      HIS  40   0.189  24.236  -9.824
  293    HE2  HIS  40           HE2      HIS  40   1.833  24.534 -11.708
  294    H    SER  41           H        SER  41  -0.555  19.536  -9.037
  295    HA   SER  41           HA       SER  41  -0.992  19.091 -11.860
  296    HB2  SER  41           1HB      SER  41  -2.212  17.002 -11.607
  297    HB3  SER  41           2HB      SER  41  -0.577  16.802 -10.978
  298    HG   SER  41           HG       SER  41  -3.006  17.030  -9.570
  299    H    GLY  42           H        GLY  42  -3.157  19.440 -12.505
  300    HA2  GLY  42           1HA      GLY  42  -5.055  20.255 -10.429
  301    HA3  GLY  42           2HA      GLY  42  -4.581  21.462 -11.615
  302    HA   PRO  43           HA       PRO  43  -6.924  18.057 -14.118
  303    HB2  PRO  43           1HB      PRO  43  -8.081  16.059 -12.692
  304    HB3  PRO  43           2HB      PRO  43  -6.430  15.962 -13.315
  305    HG2  PRO  43           1HG      PRO  43  -7.377  16.652 -10.560
  306    HG3  PRO  43           2HG      PRO  43  -6.030  15.608 -11.052
  307    HD2  PRO  43           1HD      PRO  43  -5.668  18.159 -10.218
  308    HD3  PRO  43           2HD      PRO  43  -4.621  17.393 -11.430
  309    H    SER  44           H        SER  44  -8.533  19.466 -14.586
  310    HA   SER  44           HA       SER  44 -10.971  19.283 -12.984
  311    HB2  SER  44           1HB      SER  44  -9.536  21.339 -12.344
  312    HB3  SER  44           2HB      SER  44 -10.023  21.986 -13.910
  313    HG   SER  44           HG       SER  44 -12.030  20.960 -12.277
  314    H    SER  45           H        SER  45 -12.670  18.941 -14.248
  315    HA   SER  45           HA       SER  45 -12.565  18.632 -16.985
  316    HB2  SER  45           1HB      SER  45 -14.985  19.365 -15.319
  317    HB3  SER  45           2HB      SER  45 -15.031  18.683 -16.945
  318    HG   SER  45           HG       SER  45 -15.148  16.900 -15.777
  319    H    GLY  46           H        GLY  46 -13.989  21.405 -15.242
  320    HA2  GLY  46           1HA      GLY  46 -14.130  23.625 -15.831
  321    HA3  GLY  46           2HA      GLY  46 -12.921  23.308 -17.066