*HEADER    TRANSCRIPTION                           29-MAR-07   2EOS              
*TITLE     SOLUTION STRUCTURE OF THE C2H2 TYPE ZINC FINGER (REGION 626-          
*TITLE    2 654) OF HUMAN B-CELL LYMPHOMA 6 PROTEIN                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: B-CELL LYMPHOMA 6 PROTEIN;                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-C2H2 DOMAIN;                                            
*COMPND   5 SYNONYM: BCL-6, ZINC FINGER PROTEIN 51, LAZ-3 PROTEIN, BCL-          
*COMPND   6 5, ZINC FINGER AND BTB DOMAIN-CONTAINING PROTEIN 27;                 
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: BCL6;                                                          
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P070115-03;                               
*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 2EOS    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.
**************************************************************

14 CYSS SG   201 ZN   ZN   2.19  5.00E+00
14 CYSS CB   201 ZN   ZN   3.25  5.00E+00
17 CYSS SG   201 ZN   ZN   2.19  5.00E+00
17 CYSS CB   201 ZN   ZN   3.25  5.00E+00
30 HIS NE2   201 ZN   ZN   1.90  5.00E+00
34 HIS NE2   201 ZN   ZN   1.90  5.00E+00
14 CYSS SG  17 CYSS SG   3.56  5.00E+00
14 CYSS SG  30 HIS NE2   3.32  5.00E+00
14 CYSS SG  34 HIS NE2   3.32  5.00E+00
17 CYSS SG  30 HIS NE2   3.32  5.00E+00
17 CYSS SG  34 HIS NE2   3.32  5.00E+00
30 HIS NE2  34 HIS NE2   3.00  5.00E+00

14 CYSS SG   201 ZN   ZN   2.39  5.00E+00
14 CYSS CB   201 ZN   ZN   3.51  5.00E+00
17 CYSS SG   201 ZN   ZN   2.39  5.00E+00
17 CYSS CB   201 ZN   ZN   3.51  5.00E+00
30 HIS NE2   201 ZN   ZN   2.10  5.00E+00
34 HIS NE2   201 ZN   ZN   2.10  5.00E+00
14 CYSS SG  17 CYSS SG   3.96  5.00E+00
14 CYSS SG  30 HIS NE2   3.72  5.00E+00
14 CYSS SG  34 HIS NE2   3.72  5.00E+00
17 CYSS SG  30 HIS NE2   3.72  5.00E+00
17 CYSS SG  34 HIS NE2   3.72  5.00E+00
30 HIS NE2  34 HIS NE2   3.60  5.00E+00

 27 LEU  HN     28 LYS  HB2     4.93 #SUP  0.66  #QF  0.66
 27 LEU  HN     28 LYS  HN      3.57 #SUP  1.00
 21 PHE  QD     27 LEU  HN      4.33 #SUP  1.00
 26 THR  HB     27 LEU  HN      3.66 #SUP  0.98  #QF  0.98
 24 LEU  HA     27 LEU  HN      3.74 #SUP  0.95  #QF  0.95
 27 LEU  HN     27 LEU  HB3     3.40 #SUP  0.99  #QF  0.99
 27 LEU  HN     27 LEU  HG      4.64 #SUP  1.00
 27 LEU  HN     27 LEU  HB2     3.33 #SUP  1.00
 27 LEU  HN     27 LEU  QD2     4.25 #SUP  1.00
 30 HIS  HN     32 ARG  HN      4.52 #SUP  0.61  #QF  0.61
 30 HIS  HN     30 HIS  HD2     4.66 #SUP  0.98  #QF  0.98
 21 PHE  QE     30 HIS  HN      4.93 #SUP  0.92  #QF  0.92
 19 THR  HA     20 ARG  HN      3.00 #SUP  0.88  #QF  0.88
 29 SER  QB     30 HIS  HN      3.42 #SUP  0.94  #QF  0.94
 19 THR  HB     20 ARG  HN      4.60 #SUP  0.99  #QF  0.99
 20 ARG  HN     20 ARG  HD2     4.49 #SUP  0.99  #QF  0.99
 30 HIS  HN     30 HIS  HB2     3.25 #SUP  0.83  #QF  0.83
 20 ARG  HN     20 ARG  HD3     4.49 #SUP  0.97  #QF  0.97
 14 CYSS HB2    20 ARG  HN      5.35 #SUP  0.98  #QF  0.98
 30 HIS  HN     30 HIS  HB3     3.33 #SUP  0.94  #QF  0.94
 30 HIS  HN     31 LEU  HG      4.46 #SUP  0.43  #QF  0.43
 20 ARG  HN     20 ARG  HB2     4.11 #SUP  0.93  #QF  0.67
 20 ARG  HN     20 ARG  HG3     4.24 #SUP  0.93  #QF  0.67
 20 ARG  HN     20 ARG  HB3     3.81 #SUP  0.99  #QF  0.99
 26 THR  QG2    30 HIS  HN      4.24 #SUP  0.71  #QF  0.71
 20 ARG  HN     20 ARG  HG2     3.90 #SUP  0.98  #QF  0.98
 27 LEU  QD1    30 HIS  HN      4.01 #SUP  0.76  #QF  0.76
 13 PRO  HA     20 ARG  HN      4.54 #SUP  0.89  #QF  0.89
 14 CYSS HN     18 GLY  HN      4.55 #SUP  0.83  #QF  0.83
 14 CYSS HN     19 THR  HN      4.45 #SUP  0.96  #QF  0.96
 14 CYSS HN     21 PHE  QD      4.68 #SUP  0.99  #QF  0.99
 13 PRO  HA     14 CYSS HN      3.31 #SUP  0.95  #QF  0.95
 14 CYSS HN     18 GLY  HA1     4.43 #SUP  0.58  #QF  0.58
 14 CYSS HN     19 THR  HB      4.98 #SUP  0.99  #QF  0.99
 14 CYSS HN     14 CYSS HB3     3.52 #SUP  0.98  #QF  0.98
 14 CYSS HN     14 CYSS HB2     3.51 #SUP  0.98  #QF  0.98
 13 PRO  HB2    14 CYSS HN      4.13 #SUP  0.98  #QF  0.98
 13 PRO  HB3    14 CYSS HN      4.13 #SUP  0.97  #QF  0.92
 14 CYSS HN     20 ARG  HG3     4.41 #SUP  0.97  #QF  0.92
 14 CYSS HN     20 ARG  HG2     4.34 #SUP  0.98  #QF  0.44
 16 ILE  HN     17 CYSS HA      5.50 #SUP  0.99  #QF  0.99
 14 CYSS HB2    16 ILE  HN      4.71 #SUP  0.99  #QF  0.99
 15 GLU  QG     16 ILE  HN      4.46 #SUP  0.99  #QF  0.99
 15 GLU  HB3    16 ILE  HN      4.72 #SUP  0.97  #QF  0.97
 15 GLU  HN     16 ILE  HN      4.11 #SUP  1.00
 16 ILE  HN     18 GLY  HN      4.21 #SUP  1.00
 14 CYSS HB3    16 ILE  HN      4.76 #SUP  0.94  #QF  0.94
 15 GLU  HB2    16 ILE  HN      4.72 #SUP  0.75  #QF  0.75
 16 ILE  HN     16 ILE  HG12    4.00 #SUP  0.95  #QF  0.95
 16 ILE  HN     16 ILE  HB      3.41 #SUP  0.82  #QF  0.82
  9 GLU  HN      9 GLU  HG2     5.41 #SUP  0.98  #QF  0.78
  9 GLU  HN      9 GLU  HG3     5.41 #SUP  0.98  #QF  0.78
 14 CYSS HB2    19 THR  HN      4.23 #SUP  1.00
 19 THR  HN     19 THR  QG2     4.24 #SUP  0.98  #QF  0.98
 15 GLU  HN     18 GLY  HA1     4.73 #SUP  0.36  #QF  0.36
 14 CYSS HB3    15 GLU  HN      4.74 #SUP  0.97  #QF  0.97
 14 CYSS HB2    15 GLU  HN      4.47 #SUP  0.95  #QF  0.95
 15 GLU  HN     15 GLU  QG      3.96 #SUP  0.98  #QF  0.98
 15 GLU  HN     15 GLU  HB2     4.00 #SUP  0.99  #QF  0.99
 15 GLU  HN     15 GLU  HB3     4.00 #SUP  0.96  #QF  0.96
 15 GLU  HN     31 LEU  QD2     4.51 #SUP  0.85  #QF  0.85
 15 GLU  HN     27 LEU  QD1     4.13 #SUP  0.91  #QF  0.88
 33 ILE  HN     34 HIS  HN      3.24 #SUP  1.00
 34 HIS  HN     35 THR  HN      3.96 #SUP  0.98  #QF  0.98
 34 HIS  HN     34 HIS  HD2     4.00 #SUP  0.98  #QF  0.98
 34 HIS  HN     35 THR  HA      5.50 #SUP  0.84  #QF  0.72
 34 HIS  HN     35 THR  HB      5.50 #SUP  0.84  #QF  0.72
 32 ARG  HA     34 HIS  HN      4.45 #SUP  0.97  #QF  0.97
 31 LEU  HA     34 HIS  HN      4.08 #SUP  0.99  #QF  0.99
 34 HIS  HN     34 HIS  HB2     3.49 #SUP  0.96  #QF  0.96
 34 HIS  HN     34 HIS  HB3     3.75 #SUP  0.99  #QF  0.99
 34 HIS  HN     35 THR  QG2     4.23 #SUP  0.57  #QF  0.57
 33 ILE  HG12   34 HIS  HN      4.16 #SUP  0.95  #QF  0.95
 24 LEU  HA     28 LYS  HN      4.56 #SUP  0.97  #QF  0.97
 27 LEU  HB3    28 LYS  HN      3.70 #SUP  0.99  #QF  0.99
 28 LYS  HN     28 LYS  HB2     3.25 #SUP  0.85  #QF  0.85
 28 LYS  HN     28 LYS  HG3     3.59 #SUP  1.00  #QF  0.98
 27 LEU  HB2    28 LYS  HN      4.19 #SUP  1.00
 14 CYSS HN     21 PHE  HN      5.45 #SUP  0.99  #QF  0.99
 20 ARG  HN     21 PHE  HN      4.71 #SUP  0.95  #QF  0.95
 21 PHE  HN     23 HIST HN      5.50 #SUP  0.99  #QF  0.99
 21 PHE  HN     21 PHE  QD      3.60 #SUP  0.95  #QF  0.95
 13 PRO  HA     21 PHE  HN      3.94 #SUP  0.85  #QF  0.85
 12 TYR  HB3    21 PHE  HN      4.89 #SUP  0.95  #QF  0.95
 12 TYR  HB2    21 PHE  HN      3.56 #SUP  0.80  #QF  0.80
 20 ARG  HB3    21 PHE  HN      3.85 #SUP  0.97  #QF  0.92
 20 ARG  HG2    21 PHE  HN      4.70 #SUP  0.97  #QF  0.57
 21 PHE  HN     27 LEU  QD1     4.94 #SUP  0.97  #QF  0.57
 16 ILE  HN     17 CYSS HN      3.40 #SUP  1.00
 17 CYSS HN     18 GLY  HN      3.23 #SUP  1.00
 17 CYSS HN     19 THR  HN      4.48 #SUP  0.98  #QF  0.98
 17 CYSS HN     34 HIS  HD2     4.65 #SUP  0.98  #QF  0.98
 17 CYSS HN     17 CYSS HB2     3.90 #SUP  0.99  #QF  0.99
 14 CYSS HB3    17 CYSS HN      4.04 #SUP  0.93  #QF  0.93
 17 CYSS HN     17 CYSS HB3     3.67 #SUP  0.93  #QF  0.93
 16 ILE  HG12   17 CYSS HN      4.72 #SUP  0.95  #QF  0.95
 16 ILE  HB     17 CYSS HN      3.40 #SUP  0.95  #QF  0.95
 16 ILE  QD1    17 CYSS HN      4.03 #SUP  0.96  #QF  0.96
 16 ILE  QG2    17 CYSS HN      3.63 #SUP  0.98  #QF  0.98
 30 HIS  HD2    31 LEU  HN      4.44 #SUP  0.96  #QF  0.96
 31 LEU  HN     34 HIS  HD2     4.50 #SUP  1.00
 29 SER  HA     31 LEU  HN      4.45 #SUP  0.94  #QF  0.42
 30 HIS  HB3    31 LEU  HN      3.89 #SUP  0.95  #QF  0.95
 31 LEU  HN     31 LEU  HG      3.48 #SUP  0.97  #QF  0.25
 31 LEU  HN     31 LEU  HB2     3.36 #SUP  0.97  #QF  0.97
 31 LEU  HN     31 LEU  HB3     3.57 #SUP  0.95  #QF  0.95
 31 LEU  HN     31 LEU  QD2     3.67 #SUP  0.99  #QF  0.99
 31 LEU  HN     31 LEU  QD1     3.69 #SUP  1.00
 25 GLN  HN     25 GLN  QG      4.47 #SUP  0.98  #QF  0.98
 24 LEU  HB3    25 GLN  HN      4.47 #SUP  0.91  #QF  0.91
 12 TYR  HN     21 PHE  HN      4.07 #SUP  0.99  #QF  0.99
 12 TYR  HN     12 TYR  QD      3.59 #SUP  0.97  #QF  0.97
 12 TYR  HN     13 PRO  HD2     4.75 #SUP  0.94  #QF  0.94
 12 TYR  HN     13 PRO  HD3     4.39 #SUP  0.99  #QF  0.99
 11 PRO  HD3    12 TYR  HN      4.41 #SUP  0.98  #QF  0.98
 12 TYR  HN     12 TYR  HB3     3.82 #SUP  0.99  #QF  0.99
 12 TYR  HN     12 TYR  HB2     3.48 #SUP  0.98  #QF  0.98
 11 PRO  HB2    12 TYR  HN      4.20 #SUP  0.93  #QF  0.93
 11 PRO  HG3    12 TYR  HN      5.00 #SUP  0.98  #QF  0.97
 12 TYR  HN     20 ARG  HB2     5.45 #SUP  0.98  #QF  0.97
 11 PRO  HG2    12 TYR  HN      4.05 #SUP  0.99  #QF  0.99
 12 TYR  HN     20 ARG  HB3     4.47 #SUP  0.77  #QF  0.77
 12 TYR  HN     27 LEU  QD2     5.33 #SUP  1.00
 31 LEU  HN     33 ILE  HN      4.95 #SUP  0.98  #QF  0.98
 33 ILE  HN     34 HIS  HD2     5.37 #SUP  0.99  #QF  0.99
 31 LEU  HA     33 ILE  HN      4.28 #SUP  1.00
 33 ILE  HN     34 HIS  HB2     4.68 #SUP  0.83  #QF  0.83
 32 ARG  QD     33 ILE  HN      4.44 #SUP  0.73  #QF  0.73
 32 ARG  HB2    33 ILE  HN      3.68 #SUP  0.93  #QF  0.93
 33 ILE  HN     33 ILE  HB      3.75 #SUP  0.97  #QF  0.97
 31 LEU  QD2    33 ILE  HN      5.50 #SUP  0.84  #QF  0.74
 33 ILE  HN     35 THR  QG2     5.50 #SUP  0.84  #QF  0.74
 33 ILE  HN     33 ILE  HG12    3.69 #SUP  0.98  #QF  0.98
 33 ILE  HN     33 ILE  QG2     3.30 #SUP  0.99  #QF  0.99
 31 LEU  HN     32 ARG  HN      3.62 #SUP  0.99  #QF  0.99
 32 ARG  HN     33 ILE  HN      3.43 #SUP  0.99  #QF  0.99
 32 ARG  HN     34 HIS  HN      4.43 #SUP  1.00
 32 ARG  HN     32 ARG  QD      3.73 #SUP  0.99  #QF  0.99
 31 LEU  HG     32 ARG  HN      4.40 #SUP  0.93  #QF  0.93
 32 ARG  HN     32 ARG  HB2     2.94 #SUP  0.89  #QF  0.89
 32 ARG  HN     32 ARG  HG3     4.19 #SUP  1.00
 31 LEU  QD2    32 ARG  HN      4.47 #SUP  0.97  #QF  0.97
 31 LEU  QD1    32 ARG  HN      5.19 #SUP  0.99  #QF  0.99
 16 ILE  QD1    32 ARG  HN      5.21 #SUP  0.95  #QF  0.95
 32 ARG  HN     33 ILE  QG2     4.30 #SUP  0.98  #QF  0.98
 25 GLN  HN     26 THR  HN      4.33 #SUP  0.99  #QF  0.99
 26 THR  HN     28 LYS  HN      4.68 #SUP  0.92  #QF  0.92
 23 HIST HN     26 THR  HN      5.09 #SUP  1.00  #QF  0.99
 23 HIST HA     26 THR  HN      5.13 #SUP  0.95  #QF  0.95
 26 THR  HN     26 THR  HB      3.58 #SUP  0.97  #QF  0.97
 23 HIST HB2    26 THR  HN      3.66 #SUP  0.97  #QF  0.97
 23 HIST HB3    26 THR  HN      3.73 #SUP  0.93  #QF  0.93
 25 GLN  QG     26 THR  HN      4.07 #SUP  0.99  #QF  0.99
 25 GLN  HB3    26 THR  HN      4.57 #SUP  0.83  #QF  0.83
 26 THR  HN     26 THR  QG2     3.88 #SUP  0.97  #QF  0.97
 12 TYR  QE     24 LEU  HN      4.21 #SUP  1.00
 12 TYR  QD     24 LEU  HN      4.64 #SUP  0.98  #QF  0.98
 23 HIST HA     24 LEU  HN      3.50 #SUP  0.97  #QF  0.97
 23 HIST HB3    24 LEU  HN      4.41 #SUP  0.95  #QF  0.95
 24 LEU  HN     24 LEU  HB3     3.79 #SUP  0.99  #QF  0.99
 24 LEU  HN     24 LEU  HG      4.82 #SUP  0.96  #QF  0.96
 24 LEU  HN     24 LEU  HB2     3.81 #SUP  0.98  #QF  0.98
 24 LEU  HN     24 LEU  QD1     4.45 #SUP  0.98  #QF  0.98
 18 GLY  HN     19 THR  HN      3.89 #SUP  0.99  #QF  0.99
 18 GLY  HN     19 THR  HB      4.89 #SUP  0.99  #QF  0.96
 14 CYSS HB3    18 GLY  HN      3.92 #SUP  0.98  #QF  0.98
 14 CYSS HB2    18 GLY  HN      4.06 #SUP  1.00  #QF  0.99
 17 CYSS HB3    18 GLY  HN      4.61 #SUP  1.00  #QF  0.99
 16 ILE  HB     18 GLY  HN      4.44 #SUP  0.93  #QF  0.93
 16 ILE  QD1    18 GLY  HN      4.94 #SUP  0.60  #QF  0.60
 16 ILE  QG2    18 GLY  HN      4.89 #SUP  1.00
 28 LYS  HN     29 SER  HN      3.50 #SUP  0.99  #QF  0.99
 29 SER  HN     30 HIS  HN      3.46 #SUP  0.99  #QF  0.99
 27 LEU  HN     29 SER  HN      4.52 #SUP  0.95  #QF  0.95
 29 SER  HN     29 SER  QB      2.94 #SUP  0.91  #QF  0.91
 27 LEU  HA     29 SER  HN      4.13 #SUP  0.97  #QF  0.97
 29 SER  HN     30 HIS  HB3     4.39 #SUP  0.90  #QF  0.90
 27 LEU  HB3    29 SER  HN      4.98 #SUP  0.99  #QF  0.99
 28 LYS  HB2    29 SER  HN      3.40 #SUP  0.75  #QF  0.75
 27 LEU  HG     29 SER  HN      5.50 #SUP  1.00  #QF  0.23
 28 LYS  HG3    29 SER  HN      5.50 #SUP  1.00  #QF  0.23
 26 THR  QG2    29 SER  HN      4.37 #SUP  0.77  #QF  0.77
 27 LEU  QD1    29 SER  HN      5.28 #SUP  0.65  #QF  0.54
 29 SER  HN     31 LEU  QD1     5.50 #SUP  0.65  #QF  0.54
 22 ARG  HN     23 HIST HN      4.57 #SUP  0.96  #QF  0.96
 23 HIST HN     26 THR  HB      4.00 #SUP  0.91  #QF  0.91
 23 HIST HN     23 HIST HB3     3.83 #SUP  0.98  #QF  0.98
 23 HIST HN     26 THR  QG2     4.31 #SUP  0.97  #QF  0.97
 23 HIST HN     23 HIST HB2     3.81 #SUP  0.88  #QF  0.88
 21 PHE  HB3    23 HIST HN      4.35 #SUP  0.97  #QF  0.97
 25 GLN  QG     25 GLN  HE21    4.02 #SUP  0.97  #QF  0.97
 25 GLN  QG     25 GLN  HE22    4.02 #SUP  0.98  #QF  0.98
 34 HIS  HB3    35 THR  HN      4.65 #SUP  0.96  #QF  0.96
 35 THR  HN     35 THR  QG2     4.17 #SUP  0.99  #QF  0.99
 30 HIS  HN     31 LEU  HN      3.53 #SUP  0.99  #QF  0.99
 20 ARG  HB2    21 PHE  HN      3.86 #SUP  0.74  #QF  0.74
 26 THR  HN     27 LEU  HN      3.51 #SUP  0.86  #QF  0.86
 24 LEU  HN     24 LEU  QD2     4.45 #SUP  1.00
 12 TYR  QD     24 LEU  QD2     4.59 #SUP  1.00
 24 LEU  HA     24 LEU  QD2     3.69 #SUP  1.00
 24 LEU  QD2    28 LYS  QE      3.59 #SUP  0.96  #QF  0.96
 24 LEU  QD2    27 LEU  HB3     4.82 #SUP  0.98  #QF  0.98
 24 LEU  QD2    28 LYS  QD      4.06 #SUP  0.99  #QF  0.99
 24 LEU  QD2    28 LYS  HG3     4.21 #SUP  1.00  #QF  0.81
 24 LEU  HB3    24 LEU  QD2     3.27 #SUP  0.99  #QF  0.99
 24 LEU  HB2    24 LEU  QD2     3.37 #SUP  0.95  #QF  0.74
 14 CYSS HN     27 LEU  QD1     4.15 #SUP  0.99  #QF  0.99
 27 LEU  QD1    31 LEU  HN      3.94 #SUP  0.89  #QF  0.89
 21 PHE  QD     27 LEU  QD1     3.44 #SUP  1.00
 27 LEU  HN     27 LEU  QD1     4.26 #SUP  1.00
 27 LEU  QD1    30 HIS  HD2     3.50 #SUP  1.00
 21 PHE  QE     27 LEU  QD1     3.60 #SUP  1.00
 27 LEU  QD1    30 HIS  HA      4.98 #SUP  1.00
 27 LEU  QD1    28 LYS  HA      4.41 #SUP  0.85  #QF  0.85
 14 CYSS HB3    27 LEU  QD1     3.83 #SUP  0.99  #QF  0.99
 27 LEU  HA     27 LEU  QD1     3.24 #SUP  0.99  #QF  0.99
 14 CYSS HB2    27 LEU  QD1     3.55 #SUP  1.00  #QF  0.98
 27 LEU  QD1    30 HIS  HB3     3.80 #SUP  1.00  #QF  0.98
 27 LEU  HB3    27 LEU  QD1     3.41 #SUP  0.79  #QF  0.79
 27 LEU  QD1    31 LEU  QD2     3.27 #SUP  0.68  #QF  0.68
 19 THR  QG2    20 ARG  HN      3.28 #SUP  0.97  #QF  0.97
 19 THR  QG2    21 PHE  QD      4.23 #SUP  1.00
 19 THR  QG2    21 PHE  QE      3.58 #SUP  1.00
 19 THR  QG2    21 PHE  HZ      3.64 #SUP  1.00
 19 THR  HA     19 THR  QG2     3.24 #SUP  1.00
 14 CYSS HB3    19 THR  QG2     4.73 #SUP  1.00
 14 CYSS HB2    19 THR  QG2     4.05 #SUP  1.00
 19 THR  QG2    20 ARG  HG3     5.04 #SUP  0.97  #QF  0.97
 19 THR  QG2    20 ARG  HB3     5.24 #SUP  0.96  #QF  0.96
 19 THR  QG2    27 LEU  QD1     3.95 #SUP  0.98  #QF  0.98
 32 ARG  HA     35 THR  QG2     3.96 #SUP  0.83  #QF  0.83
 34 HIS  HB2    35 THR  QG2     4.54 #SUP  0.88  #QF  0.88
 34 HIS  HB3    35 THR  QG2     4.48 #SUP  0.87  #QF  0.87
 16 ILE  QD1    35 THR  QG2     4.57 #SUP  0.74  #QF  0.74
 17 CYSS HN     18 GLY  HA2     5.00 #SUP  0.99  #QF  0.99
 17 CYSS HN     18 GLY  HA1     4.63 #SUP  0.99  #QF  0.99
 38 GLY  HA2    39 PRO  QD      3.36 #SUP  0.91  #QF  0.91
 23 HIST HA     23 HIST HD2     4.87 #SUP  0.96  #QF  0.96
 19 THR  HN     19 THR  HB      3.48 #SUP  0.97  #QF  0.97
 19 THR  HB     21 PHE  QE      4.00 #SUP  1.00
 19 THR  HB     21 PHE  HZ      4.31 #SUP  1.00
 32 ARG  HA     32 ARG  QD      3.70 #SUP  0.88  #QF  0.88
 29 SER  QB     32 ARG  QD      4.14 #SUP  0.93  #QF  0.93
 14 CYSS HB2    19 THR  HB      4.34 #SUP  1.00
 32 ARG  HB2    32 ARG  QD      3.16 #SUP  0.99  #QF  0.69
 22 ARG  HB3    22 ARG  QD      3.96 #SUP  1.00  #QF  0.69
 19 THR  HB     27 LEU  QD1     4.79 #SUP  0.99  #QF  0.99
 10 LYS  HB2    20 ARG  HD2     4.52 #SUP  0.94  #QF  0.94
 20 ARG  HB3    20 ARG  HD2     3.94 #SUP  1.00
 20 ARG  HB3    20 ARG  HD3     3.94 #SUP  1.00
 21 PHE  HB2    27 LEU  QD1     4.60 #SUP  0.97  #QF  0.97
 21 PHE  HB2    23 HIST HN      4.35 #SUP  0.98  #QF  0.98
 11 PRO  HG2    12 TYR  QE      3.95 #SUP  1.00
 21 PHE  HB3    27 LEU  QD1     4.60 #SUP  0.66  #QF  0.66
 12 TYR  HN     12 TYR  QE      5.01 #SUP  0.98  #QF  0.98
 12 TYR  QE     23 HIST HA      3.84 #SUP  0.94  #QF  0.94
 21 PHE  HB2    26 THR  HB      4.26 #SUP  0.99  #QF  0.99
 12 TYR  QE     24 LEU  HA      4.81 #SUP  0.99  #QF  0.99
 21 PHE  HB3    26 THR  HB      4.26 #SUP  1.00
 11 PRO  HB2    12 TYR  QE      4.46 #SUP  0.99  #QF  0.99
 11 PRO  HG3    12 TYR  QE      4.22 #SUP  1.00
 12 TYR  QE     24 LEU  HB3     4.22 #SUP  1.00
 12 TYR  QE     24 LEU  HG      4.63 #SUP  0.97  #QF  0.97
 12 TYR  QE     24 LEU  HB2     3.74 #SUP  0.91  #QF  0.91
 31 LEU  HB2    32 ARG  HN      4.42 #SUP  1.00
 31 LEU  HB3    32 ARG  HN      4.52 #SUP  1.00
 10 LYS  HA     10 LYS  QE      4.74 #SUP  1.00
 31 LEU  HB3    31 LEU  QD2     3.56 #SUP  1.00
 10 LYS  HG2    10 LYS  QE      3.52 #SUP  1.00
 28 LYS  HN     28 LYS  QE      4.92 #SUP  0.90  #QF  0.90
 25 GLN  HA     28 LYS  QE      4.73 #SUP  0.97  #QF  0.97
 28 LYS  HB2    28 LYS  QE      4.46 #SUP  1.00  #QF  0.82
 24 LEU  QD1    28 LYS  QE      3.59 #SUP  0.89  #QF  0.89
 16 ILE  HN     16 ILE  QG2     3.79 #SUP  1.00
 30 HIS  HE1    33 ILE  QG2     4.74 #SUP  0.80  #QF  0.80
 33 ILE  QG2    34 HIS  HN      3.91 #SUP  0.99  #QF  0.99
 16 ILE  QG2    34 HIS  HD2     4.20 #SUP  1.00
 16 ILE  QG2    17 CYSS HA      4.14 #SUP  1.00
 30 HIS  HA     33 ILE  QG2     4.03 #SUP  0.95  #QF  0.95
 33 ILE  HA     33 ILE  QG2     3.19 #SUP  1.00
 16 ILE  HA     16 ILE  QG2     3.14 #SUP  1.00
 16 ILE  QG2    17 CYSS HB2     4.71 #SUP  1.00
 16 ILE  QG2    34 HIS  HB2     3.94 #SUP  0.99  #QF  0.99
 32 ARG  QD     33 ILE  QG2     4.87 #SUP  0.83  #QF  0.83
 16 ILE  QG2    34 HIS  HB3     4.15 #SUP  1.00
 16 ILE  QG2    17 CYSS HB3     3.90 #SUP  0.99  #QF  0.99
 32 ARG  HB3    33 ILE  QG2     4.60 #SUP  0.92  #QF  0.41
 32 ARG  HB2    33 ILE  QG2     4.80 #SUP  0.92  #QF  0.41
 16 ILE  QG2    16 ILE  HG12    3.53 #SUP  1.00
 33 ILE  QG2    33 ILE  HG12    3.23 #SUP  1.00
 23 HIST HA     24 LEU  HB3     5.03 #SUP  0.99  #QF  0.99
 21 PHE  QD     27 LEU  HB2     4.49 #SUP  1.00
 12 TYR  HB2    27 LEU  HB3     4.37 #SUP  0.98  #QF  0.98
 27 LEU  HB2    27 LEU  QD1     3.82 #SUP  0.96  #QF  0.96
 26 THR  HA     29 SER  HN      4.21 #SUP  0.83  #QF  0.83
 17 CYSS HN     34 HIS  HE1     4.75 #SUP  0.98  #QF  0.98
 33 ILE  HN     33 ILE  QD1     3.99 #SUP  1.00
 17 CYSS HA     34 HIS  HE1     4.56 #SUP  0.99  #QF  0.99
 30 HIS  HA     33 ILE  QD1     4.52 #SUP  0.79  #QF  0.79
 33 ILE  HA     33 ILE  QD1     4.17 #SUP  1.00
 17 CYSS HB2    34 HIS  HE1     4.21 #SUP  0.99  #QF  0.99
 17 CYSS HB3    34 HIS  HE1     3.54 #SUP  0.99  #QF  0.99
 33 ILE  HB     33 ILE  QD1     3.27 #SUP  1.00
 19 THR  HA     20 ARG  HG3     4.40 #SUP  0.95  #QF  0.95
 16 ILE  HB     34 HIS  HE1     4.80 #SUP  0.96  #QF  0.96
 19 THR  HA     20 ARG  HG2     5.50 #SUP  0.90  #QF  0.90
 16 ILE  QG2    34 HIS  HE1     3.90 #SUP  1.00
 12 TYR  HB3    27 LEU  HB3     4.75 #SUP  0.95  #QF  0.95
 12 TYR  HB2    27 LEU  HB2     4.57 #SUP  0.99  #QF  0.99
 12 TYR  HB3    27 LEU  HB2     4.42 #SUP  0.99  #QF  0.99
 21 PHE  HZ     30 HIS  HE1     4.72 #SUP  0.99  #QF  0.99
 37 SER  HA     37 SER  QB      2.95 #SUP  0.85  #QF  0.85
 19 THR  HB     30 HIS  HE1     4.79 #SUP  0.79  #QF  0.79
 14 CYSS HB2    30 HIS  HE1     5.50 #SUP  1.00  #QF  0.60
 30 HIS  HE1    33 ILE  HG12    4.78 #SUP  0.97  #QF  0.97
 30 HIS  HE1    33 ILE  QD1     3.41 #SUP  0.93  #QF  0.93
 11 PRO  HA     20 ARG  HB3     4.75 #SUP  0.73  #QF  0.73
 11 PRO  HA     12 TYR  QD      5.05 #SUP  1.00
 16 ILE  HA     16 ILE  HG12    3.72 #SUP  1.00
 16 ILE  HA     16 ILE  HG13    3.72 #SUP  0.94  #QF  0.94
 16 ILE  HA     16 ILE  QD1     3.49 #SUP  1.00
 16 ILE  HB     16 ILE  QD1     3.69 #SUP  1.00
 33 ILE  HA     33 ILE  HG12    3.96 #SUP  1.00
 16 ILE  HN     16 ILE  QD1     3.75 #SUP  1.00
 28 LYS  HN     29 SER  QB      5.43 #SUP  0.97  #QF  0.89
 29 SER  QB     31 LEU  HN      5.50 #SUP  0.97  #QF  0.89
 33 ILE  HB     34 HIS  HN      4.30 #SUP  0.99  #QF  0.99
 16 ILE  QD1    34 HIS  HN      4.65 #SUP  0.99  #QF  0.99
 16 ILE  QD1    34 HIS  HD2     3.56 #SUP  1.00
 15 GLU  HA     16 ILE  QD1     4.89 #SUP  1.00
 16 ILE  QD1    34 HIS  HB2     3.61 #SUP  1.00
 16 ILE  QD1    34 HIS  HB3     3.65 #SUP  0.99  #QF  0.99
 14 CYSS HB2    16 ILE  QD1     4.61 #SUP  0.83  #QF  0.83
 29 SER  QB     30 HIS  HB3     5.06 #SUP  0.94  #QF  0.94
 15 GLU  QG     16 ILE  QD1     3.97 #SUP  0.99  #QF  0.99
 15 GLU  HB2    16 ILE  QD1     4.42 #SUP  1.00
 15 GLU  HB3    16 ILE  QD1     4.42 #SUP  0.99  #QF  0.75
 16 ILE  QD1    31 LEU  HG      4.72 #SUP  0.99  #QF  0.75
 28 LYS  HB2    29 SER  QB      5.50 #SUP  0.98  #QF  0.84
 29 SER  QB     32 ARG  HB2     5.50 #SUP  0.98  #QF  0.84
 16 ILE  QG2    16 ILE  QD1     3.18 #SUP  1.00
 35 THR  HA     35 THR  QG2     3.31 #SUP  0.89  #QF  0.89
 15 GLU  QG     31 LEU  QD1     4.55 #SUP  0.82  #QF  0.52
 29 SER  HA     32 ARG  HN      4.56 #SUP  0.90  #QF  0.90
 29 SER  HA     32 ARG  QD      4.04 #SUP  0.90  #QF  0.90
 28 LYS  HB3    29 SER  HA      4.75 #SUP  0.88  #QF  0.49
 29 SER  HA     32 ARG  HB2     5.25 #SUP  0.88  #QF  0.49
 29 SER  HA     32 ARG  HG2     5.29 #SUP  0.88  #QF  0.49
 29 SER  HA     32 ARG  HG3     5.29 #SUP  0.99  #QF  0.99
 28 LYS  HA     28 LYS  QD      4.13 #SUP  0.96  #QF  0.96
 28 LYS  HA     28 LYS  HG3     3.80 #SUP  1.00  #QF  0.75
 28 LYS  HA     28 LYS  HG2     3.64 #SUP  1.00
 30 HIS  HA     33 ILE  HG12    4.60 #SUP  0.91  #QF  0.91
 29 SER  QB     30 HIS  HA      4.19 #SUP  0.79  #QF  0.79
 25 GLN  HA     28 LYS  HN      4.07 #SUP  0.97  #QF  0.97
 10 LYS  HB3    10 LYS  QE      4.53 #SUP  0.99  #QF  0.99
 10 LYS  HB2    10 LYS  QE      4.54 #SUP  0.99  #QF  0.99
 25 GLN  HA     28 LYS  HB2     3.52 #SUP  0.81  #QF  0.81
 10 LYS  HB2    20 ARG  HB2     4.15 #SUP  0.99  #QF  0.99
 10 LYS  HB3    20 ARG  HB2     4.32 #SUP  0.92  #QF  0.92
 25 GLN  HA     28 LYS  QD      4.00 #SUP  0.90  #QF  0.90
 25 GLN  HA     28 LYS  HG3     4.29 #SUP  0.98  #QF  0.98
 10 LYS  HB3    10 LYS  HD3     4.14 #SUP  0.99  #QF  0.99
 24 LEU  HB3    25 GLN  HA      4.37 #SUP  0.86  #QF  0.86
 25 GLN  HA     25 GLN  QG      3.46 #SUP  1.00
 23 HIST HB2    25 GLN  QG      4.56 #SUP  0.93  #QF  0.93
 23 HIST HB2    26 THR  QG2     4.65 #SUP  0.86  #QF  0.86
 23 HIST HB3    24 LEU  HB3     4.71 #SUP  0.95  #QF  0.95
 24 LEU  HB3    25 GLN  QG      4.99 #SUP  0.90  #QF  0.68
 25 GLN  QG     26 THR  QG2     5.47 #SUP  0.90  #QF  0.68
 23 HIST HB2    24 LEU  HN      4.72 #SUP  0.99  #QF  0.99
 13 PRO  HD3    20 ARG  HB3     4.67 #SUP  0.43  #QF  0.43
 10 LYS  HB2    20 ARG  HB3     4.35 #SUP  0.98  #QF  0.98
 15 GLU  HA     18 GLY  HN      5.35 #SUP  0.91  #QF  0.91
 15 GLU  HA     15 GLU  QG      3.41 #SUP  0.99  #QF  0.99
 32 ARG  HA     32 ARG  HG3     3.87 #SUP  1.00
 27 LEU  HA     30 HIS  HD2     4.48 #SUP  0.98  #QF  0.98
 12 TYR  QD     22 ARG  HA      5.20 #SUP  0.99  #QF  0.99
 31 LEU  HA     34 HIS  HD2     3.45 #SUP  1.00
 11 PRO  HD3    22 ARG  HA      3.95 #SUP  0.92  #QF  0.92
 31 LEU  HA     34 HIS  HB2     4.58 #SUP  0.99  #QF  0.99
 31 LEU  HA     34 HIS  HB3     4.54 #SUP  0.98  #QF  0.98
 22 ARG  HA     22 ARG  QD      4.50 #SUP  1.00
 31 LEU  HA     31 LEU  HG      3.85 #SUP  1.00
 22 ARG  HA     22 ARG  HG2     4.06 #SUP  0.97  #QF  0.97
 22 ARG  HA     22 ARG  HG3     4.06 #SUP  0.90  #QF  0.90
 10 LYS  HB3    22 ARG  HA      4.74 #SUP  0.97  #QF  0.97
 31 LEU  HA     31 LEU  QD1     3.90 #SUP  1.00
 16 ILE  QD1    31 LEU  HA      4.21 #SUP  1.00
 27 LEU  HA     30 HIS  HN      4.21 #SUP  0.94  #QF  0.94
 21 PHE  QE     27 LEU  HA      4.44 #SUP  0.99  #QF  0.99
 12 TYR  HA     12 TYR  QD      3.62 #SUP  0.99  #QF  0.99
 12 TYR  QD     23 HIST HA      4.04 #SUP  0.99  #QF  0.99
 12 TYR  QD     13 PRO  HD2     4.42 #SUP  1.00
 12 TYR  QD     13 PRO  HD3     5.21 #SUP  1.00
 11 PRO  HD3    12 TYR  QD      4.44 #SUP  1.00
 12 TYR  QD     24 LEU  HA      4.19 #SUP  1.00
 27 LEU  HA     30 HIS  HB3     3.76 #SUP  0.98  #QF  0.67
 11 PRO  HB2    12 TYR  QD      4.39 #SUP  1.00
 11 PRO  HG3    12 TYR  QD      4.28 #SUP  1.00
 11 PRO  HG2    12 TYR  QD      4.01 #SUP  1.00
 27 LEU  HA     27 LEU  HG      4.08 #SUP  1.00
 12 TYR  QD     24 LEU  HB3     4.37 #SUP  0.99  #QF  0.99
 12 TYR  QD     24 LEU  HG      4.38 #SUP  0.80  #QF  0.80
 12 TYR  QD     24 LEU  HB2     3.66 #SUP  0.75  #QF  0.67
 12 TYR  QD     24 LEU  QD1     4.59 #SUP  1.00
 17 CYSS HB2    18 GLY  HN      3.81 #SUP  0.48  #QF  0.48
 16 ILE  QD1    17 CYSS HB3     5.50 #SUP  0.90  #QF  0.83
 17 CYSS HB3    33 ILE  QD1     5.50 #SUP  0.90  #QF  0.83
 11 PRO  HB3    12 TYR  HN      4.64 #SUP  0.99  #QF  0.99
 11 PRO  HB3    12 TYR  QD      4.74 #SUP  1.00
 11 PRO  HB3    12 TYR  QE      4.93 #SUP  1.00
 23 HIST HA     24 LEU  HA      4.71 #SUP  1.00
 12 TYR  HB2    24 LEU  HA      4.47 #SUP  0.95  #QF  0.95
 24 LEU  HA     27 LEU  HB3     3.88 #SUP  1.00
 24 LEU  HA     27 LEU  HG      5.50 #SUP  1.00
 24 LEU  HA     28 LYS  HG3     5.50 #SUP  1.00
 24 LEU  HA     27 LEU  HB2     4.06 #SUP  1.00  #QF  0.99
 24 LEU  HA     24 LEU  HG      3.83 #SUP  0.97  #QF  0.97
 13 PRO  HB2    20 ARG  HG2     4.17 #SUP  0.99  #QF  0.99
 13 PRO  HB3    20 ARG  HG2     4.17 #SUP  0.99  #QF  0.99
  8 GLY  QA      9 GLU  HA      4.62 #SUP  0.85  #QF  0.85
  9 GLU  HA     10 LYS  HB2     5.11 #SUP  0.88  #QF  0.88
 28 LYS  HB3    31 LEU  QD1     4.42 #SUP  0.93  #QF  0.93
 21 PHE  QD     23 HIST HN      4.81 #SUP  0.95  #QF  0.95
 21 PHE  QD     21 PHE  HZ      4.19 #SUP  1.00
 21 PHE  QD     26 THR  HB      4.10 #SUP  1.00
 21 PHE  QD     27 LEU  HA      4.06 #SUP  0.99  #QF  0.99
 28 LYS  HB3    28 LYS  QE      4.53 #SUP  0.94  #QF  0.94
 21 PHE  QD     27 LEU  HB3     4.92 #SUP  0.99  #QF  0.99
 21 PHE  QD     26 THR  QG2     3.34 #SUP  1.00  #QF  0.99
 22 ARG  HB2    22 ARG  QD      3.96 #SUP  1.00
 11 PRO  HB2    12 TYR  HA      5.09 #SUP  1.00  #QF  0.73
 32 ARG  HB3    33 ILE  HN      5.16 #SUP  1.00  #QF  0.99
 21 PHE  HN     21 PHE  QE      5.26 #SUP  0.93  #QF  0.93
 21 PHE  QE     30 HIS  HE1     4.88 #SUP  0.91  #QF  0.91
 21 PHE  QE     26 THR  HB      5.50 #SUP  1.00
 19 THR  HA     21 PHE  QE      5.09 #SUP  0.99  #QF  0.99
 14 CYSS HB3    21 PHE  QE      4.30 #SUP  1.00
 21 PHE  QE     30 HIS  HB2     4.27 #SUP  0.87  #QF  0.49
 14 CYSS HB2    21 PHE  QE      3.69 #SUP  1.00  #QF  0.99
 10 LYS  HB3    10 LYS  HD2     4.14 #SUP  1.00
 14 CYSS HN     21 PHE  QE      5.15 #SUP  1.00
 14 CYSS HB2    17 CYSS HN      4.60 #SUP  0.99  #QF  0.99
 14 CYSS HB3    19 THR  HN      4.11 #SUP  1.00
 14 CYSS HB2    21 PHE  QD      4.67 #SUP  0.99  #QF  0.99
 14 CYSS HB3    30 HIS  HD2     4.40 #SUP  0.99  #QF  0.99
 14 CYSS HB2    30 HIS  HD2     3.85 #SUP  0.99  #QF  0.99
 13 PRO  HA     14 CYSS HB2     4.89 #SUP  0.95  #QF  0.95
 14 CYSS HB2    18 GLY  HA1     4.58 #SUP  0.95  #QF  0.95
 14 CYSS HB3    19 THR  HB      4.38 #SUP  0.99  #QF  0.99
 14 CYSS HB2    31 LEU  QD2     4.59 #SUP  0.97  #QF  0.97
 15 GLU  HB2    31 LEU  QD1     5.06 #SUP  0.44  #QF  0.44
 15 GLU  HB3    31 LEU  QD1     5.06 #SUP  0.66  #QF  0.34
 23 HIST HA     24 LEU  HB2     4.69 #SUP  1.00
 28 LYS  HN     28 LYS  QD      4.29 #SUP  1.00
 13 PRO  HA     20 ARG  HG3     4.57 #SUP  1.00
 13 PRO  HA     20 ARG  HG2     4.30 #SUP  1.00
 28 LYS  HB2    28 LYS  QD      3.73 #SUP  1.00  #QF  0.94
 28 LYS  HB3    28 LYS  QD      4.05 #SUP  1.00  #QF  0.94
 31 LEU  QD2    34 HIS  HB3     5.31 #SUP  1.00
 21 PHE  HZ     30 HIS  HD2     4.84 #SUP  1.00
 10 LYS  HA     22 ARG  HA      3.90 #SUP  0.94  #QF  0.94
 10 LYS  HA     20 ARG  HB2     4.79 #SUP  0.64  #QF  0.34
 16 ILE  HN     16 ILE  HG13    4.00 #SUP  1.00
 16 ILE  HG13   17 CYSS HN      4.72 #SUP  1.00
 21 PHE  HZ     30 HIS  HB2     4.67 #SUP  0.99  #QF  0.99
 21 PHE  HZ     30 HIS  HB3     4.27 #SUP  1.00
 21 PHE  HZ     27 LEU  QD1     4.90 #SUP  1.00
 16 ILE  QG2    16 ILE  HG13    3.53 #SUP  1.00
 27 LEU  HG     28 LYS  HN      4.51 #SUP  1.00
 30 HIS  HB2    31 LEU  HN      4.49 #SUP  0.98  #QF  0.98
 21 PHE  QE     30 HIS  HB3     4.50 #SUP  1.00
 27 LEU  HG     28 LYS  HA      4.54 #SUP  0.99  #QF  0.99
 27 LEU  HG     30 HIS  HB3     4.55 #SUP  0.94  #QF  0.94
 27 LEU  QD1    30 HIS  HB2     4.21 #SUP  0.98  #QF  0.98
 25 GLN  HB2    26 THR  HN      4.57 #SUP  0.99  #QF  0.99
 32 ARG  HN     32 ARG  HG2     4.19 #SUP  1.00
 32 ARG  HA     32 ARG  HG2     3.87 #SUP  1.00
 30 HIS  HD2    34 HIS  HD2     4.43 #SUP  0.98  #QF  0.98
 34 HIS  HB3    34 HIS  HD2     3.85 #SUP  1.00
 31 LEU  HB2    34 HIS  HD2     4.82 #SUP  1.00
 31 LEU  HB3    34 HIS  HD2     4.66 #SUP  1.00
 16 ILE  HB     34 HIS  HD2     4.24 #SUP  0.98  #QF  0.98
 28 LYS  HA     31 LEU  HG      3.81 #SUP  1.00  #QF  0.93
 31 LEU  HG     34 HIS  HD2     5.23 #SUP  0.98  #QF  0.98
 24 LEU  HG     28 LYS  QE      4.53 #SUP  1.00
 24 LEU  HG     28 LYS  QD      4.69 #SUP  1.00
 24 LEU  HG     28 LYS  HG3     5.10 #SUP  1.00
 14 CYSS HN     30 HIS  HD2     5.50 #SUP  1.00
 21 PHE  QE     30 HIS  HD2     4.01 #SUP  0.95  #QF  0.95
 12 TYR  HA     13 PRO  HG2     4.68 #SUP  1.00
 10 LYS  HA     11 PRO  HG3     5.07 #SUP  1.00
 10 LYS  HA     11 PRO  HG2     4.48 #SUP  1.00
 30 HIS  HA     30 HIS  HD2     5.17 #SUP  1.00
 30 HIS  HD2    31 LEU  HA      4.31 #SUP  1.00
 30 HIS  HD2    31 LEU  HG      4.99 #SUP  1.00
 30 HIS  HD2    31 LEU  HB3     5.50 #SUP  1.00
 19 THR  QG2    30 HIS  HD2     4.71 #SUP  0.92  #QF  0.92
 27 LEU  QD2    28 LYS  HN      4.41 #SUP  1.00
 12 TYR  QD     27 LEU  QD2     4.40 #SUP  0.99  #QF  0.99
 27 LEU  QD2    30 HIS  HD2     4.88 #SUP  0.99  #QF  0.99
 12 TYR  HA     13 PRO  HG3     4.68 #SUP  1.00
 12 TYR  HA     27 LEU  QD2     4.19 #SUP  0.99  #QF  0.99
 24 LEU  HA     27 LEU  QD2     3.80 #SUP  0.96  #QF  0.96
 27 LEU  HA     27 LEU  QD2     4.12 #SUP  1.00
 12 TYR  HB3    27 LEU  QD2     3.49 #SUP  1.00
 12 TYR  HB2    27 LEU  QD2     3.42 #SUP  0.99  #QF  0.99
 27 LEU  HB3    27 LEU  QD2     3.39 #SUP  1.00
 27 LEU  HB2    27 LEU  QD2     3.31 #SUP  1.00
 12 TYR  HA     13 PRO  HD2     3.36 #SUP  1.00
 12 TYR  HA     13 PRO  HD3     3.43 #SUP  1.00
 12 TYR  HB3    13 PRO  HD2     4.57 #SUP  1.00
 12 TYR  HB3    13 PRO  HD3     5.05 #SUP  1.00
 12 TYR  HB2    13 PRO  HD2     4.92 #SUP  1.00
 12 TYR  HB2    13 PRO  HD3     5.32 #SUP  1.00
 13 PRO  HD2    27 LEU  QD2     4.48 #SUP  0.97  #QF  0.97
 13 PRO  HD3    27 LEU  QD2     5.39 #SUP  0.95  #QF  0.95
 28 LYS  HN     28 LYS  HG2     4.13 #SUP  1.00
 11 PRO  HD2    12 TYR  HN      4.41 #SUP  0.99  #QF  0.99
 30 HIS  HD2    31 LEU  QD1     5.00 #SUP  0.99  #QF  0.99
 11 PRO  HD2    12 TYR  QD      4.44 #SUP  1.00
 31 LEU  QD1    34 HIS  HD2     4.70 #SUP  0.99  #QF  0.99
 10 LYS  HA     11 PRO  HD2     3.52 #SUP  0.99  #QF  0.99
 10 LYS  HA     11 PRO  HD3     3.52 #SUP  0.99  #QF  0.99
 11 PRO  HD2    22 ARG  HA      3.95 #SUP  0.95  #QF  0.95
 28 LYS  HA     31 LEU  QD1     3.22 #SUP  0.98  #QF  0.98
 31 LEU  QD1    34 HIS  HB2     5.09 #SUP  0.97  #QF  0.97
 31 LEU  QD1    32 ARG  QD      5.00 #SUP  0.55  #QF  0.55
 28 LYS  HG3    28 LYS  QE      3.98 #SUP  1.00
 28 LYS  HG2    28 LYS  QE      3.97 #SUP  1.00
 31 LEU  HB2    31 LEU  QD1     3.26 #SUP  1.00
 31 LEU  HB3    31 LEU  QD1     3.21 #SUP  1.00  #QF  0.59
 28 LYS  HG3    31 LEU  QD1     4.46 #SUP  0.63  #QF  0.63
 28 LYS  HG2    31 LEU  QD1     3.90 #SUP  0.79  #QF  0.79
 16 ILE  QD1    31 LEU  QD1     3.90 #SUP  0.92  #QF  0.92
 24 LEU  QD1    27 LEU  HB3     4.82 #SUP  0.87  #QF  0.87
 30 HIS  HD2    31 LEU  QD2     3.55 #SUP  1.00
 12 TYR  QE     24 LEU  QD1     4.83 #SUP  1.00
 31 LEU  QD2    34 HIS  HD2     3.26 #SUP  1.00
 30 HIS  HA     31 LEU  QD2     4.68 #SUP  0.95  #QF  0.95
 31 LEU  HA     31 LEU  QD2     2.98 #SUP  1.00
 24 LEU  HA     24 LEU  QD1     3.69 #SUP  1.00
 31 LEU  QD2    34 HIS  HB2     4.25 #SUP  0.99  #QF  0.99
 27 LEU  HA     31 LEU  QD2     3.90 #SUP  0.63  #QF  0.63
 30 HIS  HB3    31 LEU  QD2     4.52 #SUP  0.94  #QF  0.63
 31 LEU  HB2    31 LEU  QD2     3.41 #SUP  1.00
 24 LEU  QD1    28 LYS  QD      4.06 #SUP  0.98  #QF  0.98
 24 LEU  QD1    28 LYS  HG3     4.21 #SUP  0.97  #QF  0.97
 24 LEU  HB3    24 LEU  QD1     3.27 #SUP  1.00
 24 LEU  HB2    24 LEU  QD1     3.37 #SUP  0.96  #QF  0.96
 16 ILE  QD1    31 LEU  QD2     3.26 #SUP  0.95  #QF  0.95
 16 ILE  QG2    31 LEU  QD2     4.75 #SUP  1.00
 16 ILE  HN     31 LEU  QD2     4.55 #SUP  0.94  #QF  0.94
 26 THR  QG2    27 LEU  HN      4.31 #SUP  0.98  #QF  0.98
 21 PHE  QE     26 THR  QG2     3.84 #SUP  1.00
 38 GLY  HA1    39 PRO  QD      3.36 #SUP  0.86  #QF  0.68
 26 THR  HA     26 THR  QG2     3.23 #SUP  0.99  #QF  0.99
 21 PHE  HB2    26 THR  QG2     4.23 #SUP  0.98  #QF  0.98
 26 THR  QG2    27 LEU  HA      4.33 #SUP  0.93  #QF  0.93
 21 PHE  HB3    26 THR  QG2     4.23 #SUP  0.90  #QF  0.90
 26 THR  QG2    27 LEU  QD1     4.99 #SUP  0.95  #QF  0.95
 33 ILE  QD1    34 HIS  HN      4.48 #SUP  0.98  #QF  0.98
 33 ILE  HN     33 ILE  HG13    4.28 #SUP  1.00
 10 LYS  HG3    10 LYS  QE      3.52 #SUP  0.98  #QF  0.98
 12 TYR  QD     21 PHE  HN      5.00 #SUP  0.99  #QF  0.99
 12 TYR  QD     23 HIST HN      5.20 #SUP  0.97  #QF  0.97
 12 TYR  QE     24 LEU  QD2     4.83 #SUP  0.99  #QF  0.99
 13 PRO  HA     20 ARG  HA      4.36 #SUP  0.81  #QF  0.81
 10 LYS  HB2    20 ARG  HD3     4.52 #SUP  0.94  #QF  0.94
 21 PHE  QD     27 LEU  QD2     4.07 #SUP  1.00
 21 PHE  QD     27 LEU  HG      4.91 #SUP  1.00
 21 PHE  QD     30 HIS  HD2     4.55 #SUP  0.99  #QF  0.99
 21 PHE  HZ     26 THR  QG2     5.41 #SUP  1.00
 21 PHE  HZ     30 HIS  HA      5.15 #SUP  0.98  #QF  0.98
 23 HIST HE1    25 GLN  QG      5.49 #SUP  0.58  #QF  0.58
 26 THR  QG2    29 SER  QB      4.01 #SUP  0.51  #QF  0.51
 33 ILE  QG2    33 ILE  HG13    3.82 #SUP  1.00
  8 GLY  QA      9 GLU  QB      4.55 
  9 GLU  HN      9 GLU  QB      3.64 
  9 GLU  HN      9 GLU  QG      4.60 
  9 GLU  HA      9 GLU  QG      3.64 
  9 GLU  QB     10 LYS  HN      4.33 
  9 GLU  QB     10 LYS  HB2     5.34 
 10 LYS  HN     10 LYS  QG      3.88 
 10 LYS  HA     10 LYS  QG      3.73 
 10 LYS  HA     22 ARG  QB      5.18 
 10 LYS  HB2    10 LYS  QD      3.57 
 10 LYS  HB3    10 LYS  QD      3.61 
 10 LYS  QG     22 ARG  HA      4.30 
 11 PRO  QD     12 TYR  HN      3.71 
 11 PRO  QD     12 TYR  QD      3.79 
 11 PRO  QD     12 TYR  QE      4.26 
 11 PRO  QD     22 ARG  HA      3.36 
 12 TYR  HA     13 PRO  QG      4.00 
 12 TYR  HA     24 LEU  QQD     4.53 
 12 TYR  HB3    24 LEU  QQD     4.36 
 12 TYR  QD     24 LEU  QQD     3.55 
 12 TYR  QE     24 LEU  QQD     3.78 
 13 PRO  QB     20 ARG  HG3     4.44 
 13 PRO  QG     20 ARG  HG2     4.54 
 15 GLU  HN     15 GLU  QB      3.51 
 15 GLU  QB     16 ILE  HN      4.10 
 15 GLU  QB     16 ILE  QD1     3.89 
 15 GLU  QG     16 ILE  QG1     4.26 
 16 ILE  HN     16 ILE  QG1     3.42 
 16 ILE  QG2    16 ILE  QG1     3.08 
 16 ILE  QG1    17 CYSS HN      4.14 
 16 ILE  QG1    34 HIS  HD2     4.10 
 20 ARG  HN     20 ARG  QD      3.93 
 21 PHE  HN     21 PHE  QB      3.62 
 21 PHE  QB     23 HIST HN      3.71 
 21 PHE  QB     26 THR  HB      3.72 
 21 PHE  QB     26 THR  QG2     3.65 
 21 PHE  QB     27 LEU  HN      3.90 
 21 PHE  QB     27 LEU  HA      4.46 
 21 PHE  QB     27 LEU  HB2     3.86 
 21 PHE  QB     27 LEU  QD2     4.68 
 22 ARG  HA     22 ARG  QG      3.54 
 22 ARG  QB     22 ARG  QD      3.17 
 22 ARG  QB     23 HIST HN      3.82 
 22 ARG  QB     23 HIST HD2     4.62 
 22 ARG  QG     23 HIST HN      4.45 
 22 ARG  QG     23 HIST HD2     4.70 
 23 HIST HB3    25 GLN  QE2     4.75 
 24 LEU  HN     24 LEU  QQD     3.87 
 24 LEU  HA     24 LEU  QQD     3.02 
 24 LEU  QQD    25 GLN  HA      4.54 
 24 LEU  QQD    27 LEU  HN      4.38 
 24 LEU  QQD    27 LEU  HB3     3.73 
 24 LEU  QQD    27 LEU  QD2     3.56 
 24 LEU  QQD    28 LYS  HN      4.27 
 24 LEU  QQD    28 LYS  HB2     4.58 
 24 LEU  QQD    28 LYS  HG2     4.43 
 24 LEU  QQD    28 LYS  HG3     3.51 
 24 LEU  QQD    28 LYS  QD      3.55 
 24 LEU  QQD    28 LYS  QE      3.15 
 25 GLN  QB     26 THR  HN      3.80 
 25 GLN  QE2    26 THR  HN      5.31 
 29 SER  HA     32 ARG  QG      4.50 
 32 ARG  HN     32 ARG  QG      3.59 
 32 ARG  HA     32 ARG  QG      3.28 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1 -15.326   6.281  13.244
    2    HA2  GLY   1           1HA      GLY   1 -18.059   6.245  14.107
    3    HA3  GLY   1           2HA      GLY   1 -17.722   7.594  13.032
    4    H    SER   2           H        SER   2 -18.174   7.218  10.978
    5    HA   SER   2           HA       SER   2 -18.494   4.485  10.049
    6    HB2  SER   2           1HB      SER   2 -19.093   7.164   8.785
    7    HB3  SER   2           2HB      SER   2 -19.322   5.629   7.947
    8    HG   SER   2           HG       SER   2 -21.202   6.533   9.092
    9    H    SER   3           H        SER   3 -17.611   3.835   7.934
   10    HA   SER   3           HA       SER   3 -14.903   4.932   7.548
   11    HB2  SER   3           1HB      SER   3 -14.196   2.720   6.835
   12    HB3  SER   3           2HB      SER   3 -14.978   2.597   8.411
   13    HG   SER   3           HG       SER   3 -16.836   1.845   7.385
   14    H    GLY   4           H        GLY   4 -14.244   5.503   5.533
   15    HA2  GLY   4           1HA      GLY   4 -14.876   4.736   3.070
   16    HA3  GLY   4           2HA      GLY   4 -16.320   5.646   3.489
   17    H    SER   5           H        SER   5 -15.857   7.102   1.774
   18    HA   SER   5           HA       SER   5 -13.547   8.488   1.283
   19    HB2  SER   5           1HB      SER   5 -15.801   8.604   0.052
   20    HB3  SER   5           2HB      SER   5 -16.231   9.860   1.212
   21    HG   SER   5           HG       SER   5 -15.084  11.194   0.083
   22    H    SER   6           H        SER   6 -12.933  10.714   1.796
   23    HA   SER   6           HA       SER   6 -13.570  11.384   4.595
   24    HB2  SER   6           1HB      SER   6 -11.010  11.433   3.055
   25    HB3  SER   6           2HB      SER   6 -11.246  12.630   4.328
   26    HG   SER   6           HG       SER   6 -10.963   9.864   4.506
   27    H    GLY   7           H        GLY   7 -12.596  12.822   1.484
   28    HA2  GLY   7           1HA      GLY   7 -13.639  14.665   0.459
   29    HA3  GLY   7           2HA      GLY   7 -14.433  15.035   1.983
   30    H    GLY   8           H        GLY   8 -11.087  14.789   0.755
   31    HA2  GLY   8           1HA      GLY   8 -10.430  17.474   1.031
   32    HA3  GLY   8           2HA      GLY   8 -10.074  16.715   2.575
   33    H    GLU   9           H        GLU   9  -8.561  14.915   2.587
   34    HA   GLU   9           HA       GLU   9  -6.774  14.839   0.259
   35    HB2  GLU   9           1HB      GLU   9  -5.882  15.181   3.127
   36    HB3  GLU   9           2HB      GLU   9  -4.813  14.923   1.755
   37    HG2  GLU   9           1HG      GLU   9  -6.699  17.249   1.875
   38    HG3  GLU   9           2HG      GLU   9  -5.095  17.304   2.603
   39    H    LYS  10           H        LYS  10  -6.496  12.819  -0.384
   40    HA   LYS  10           HA       LYS  10  -6.195  10.561  -0.370
   41    HB2  LYS  10           1HB      LYS  10  -5.924  10.730   2.630
   42    HB3  LYS  10           2HB      LYS  10  -5.303   9.477   1.564
   43    HG2  LYS  10           1HG      LYS  10  -3.534  10.749   0.866
   44    HG3  LYS  10           2HG      LYS  10  -4.370  12.274   1.170
   45    HD2  LYS  10           1HD      LYS  10  -2.757  12.176   2.855
   46    HD3  LYS  10           2HD      LYS  10  -4.230  11.621   3.652
   47    HE2  LYS  10           1HE      LYS  10  -2.702  10.042   4.347
   48    HE3  LYS  10           2HE      LYS  10  -3.399   9.259   2.930
   49    HZ1  LYS  10           3HZ      LYS  10  -0.717  10.267   3.354
   50    HZ2  LYS  10           1HZ      LYS  10  -1.376  10.613   1.835
   51    HZ3  LYS  10           2HZ      LYS  10  -1.258   9.010   2.360
   52    HA   PRO  11           HA       PRO  11 -10.622  10.359   1.268
   53    HB2  PRO  11           1HB      PRO  11 -11.856  10.346  -1.150
   54    HB3  PRO  11           2HB      PRO  11 -11.492  11.832  -0.265
   55    HG2  PRO  11           1HG      PRO  11 -10.001  10.562  -2.529
   56    HG3  PRO  11           2HG      PRO  11 -10.391  12.272  -2.266
   57    HD2  PRO  11           1HD      PRO  11  -7.952  11.233  -1.716
   58    HD3  PRO  11           2HD      PRO  11  -8.653  12.570  -0.782
   59    H    TYR  12           H        TYR  12  -8.400   8.548  -0.344
   60    HA   TYR  12           HA       TYR  12 -10.224   6.243  -0.569
   61    HB2  TYR  12           1HB      TYR  12  -7.686   6.818  -2.111
   62    HB3  TYR  12           2HB      TYR  12  -8.595   5.314  -2.209
   63    HD1  TYR  12           HD1      TYR  12  -8.735   8.942  -2.918
   64    HD2  TYR  12           HD2      TYR  12 -10.530   5.140  -3.571
   65    HE1  TYR  12           HE1      TYR  12 -10.139   9.916  -4.687
   66    HE2  TYR  12           HE2      TYR  12 -11.939   6.103  -5.342
   67    HH   TYR  12           HH       TYR  12 -11.596   9.490  -6.325
   68    HA   PRO  13           HA       PRO  13  -7.416   5.245   2.918
   69    HB2  PRO  13           1HB      PRO  13  -9.268   3.779   4.256
   70    HB3  PRO  13           2HB      PRO  13  -9.159   5.539   4.386
   71    HG2  PRO  13           1HG      PRO  13 -11.010   3.873   2.725
   72    HG3  PRO  13           2HG      PRO  13 -11.366   5.320   3.686
   73    HD2  PRO  13           1HD      PRO  13 -11.034   5.401   1.000
   74    HD3  PRO  13           2HD      PRO  13 -10.574   6.748   2.060
   75    H    CYS  14           H        CYS  14  -6.191   3.444   3.127
   76    HA   CYS  14           HA       CYS  14  -6.334   1.404   1.188
   77    HB2  CYS  14           1HB      CYS  14  -4.208   1.972   2.159
   78    HB3  CYS  14           2HB      CYS  14  -4.788   1.592   3.777
   79    H    GLU  15           H        GLU  15  -6.508  -0.930   1.633
   80    HA   GLU  15           HA       GLU  15  -8.755  -1.437   3.444
   81    HB2  GLU  15           1HB      GLU  15  -9.301  -2.181   1.288
   82    HB3  GLU  15           2HB      GLU  15  -7.696  -2.841   1.009
   83    HG2  GLU  15           1HG      GLU  15  -9.246  -4.640   1.296
   84    HG3  GLU  15           2HG      GLU  15  -8.159  -4.592   2.683
   85    H    ILE  16           H        ILE  16  -5.494  -2.531   2.685
   86    HA   ILE  16           HA       ILE  16  -5.438  -4.712   4.485
   87    HB   ILE  16           HB       ILE  16  -3.135  -3.059   3.441
   88   HG12  ILE  16          1HG1      ILE  16  -2.990  -5.334   2.047
   89   HG13  ILE  16          2HG1      ILE  16  -4.726  -5.321   2.337
   90   HG21  ILE  16          1HG2      ILE  16  -3.283  -5.570   5.042
   91   HG22  ILE  16          2HG2      ILE  16  -1.971  -5.358   3.884
   92   HG23  ILE  16          3HG2      ILE  16  -2.184  -4.200   5.196
   93   HD11  ILE  16          3HD1      ILE  16  -3.244  -3.909   0.385
   94   HD12  ILE  16          1HD1      ILE  16  -4.986  -3.916   0.657
   95   HD13  ILE  16          2HD1      ILE  16  -3.970  -2.732   1.480
   96    H    CYS  17           H        CYS  17  -3.524  -1.728   4.806
   97    HA   CYS  17           HA       CYS  17  -3.632  -2.010   7.705
   98    HB2  CYS  17           1HB      CYS  17  -1.910  -0.253   7.727
   99    HB3  CYS  17           2HB      CYS  17  -1.452  -1.590   6.677
  100    H    GLY  18           H        GLY  18  -4.357   0.436   5.226
  101    HA2  GLY  18           1HA      GLY  18  -6.637   1.483   5.688
  102    HA3  GLY  18           2HA      GLY  18  -5.936   1.895   7.246
  103    H    THR  19           H        THR  19  -3.289   2.388   5.953
  104    HA   THR  19           HA       THR  19  -3.232   5.085   5.798
  105    HB   THR  19           HB       THR  19  -1.602   3.071   4.268
  106    HG1  THR  19           HG1      THR  19  -1.113   3.160   6.437
  107   HG21  THR  19          3HG2      THR  19  -0.099   5.326   4.151
  108   HG22  THR  19          1HG2      THR  19  -1.714   5.991   3.910
  109   HG23  THR  19          2HG2      THR  19  -1.106   4.738   2.828
  110    H    ARG  20           H        ARG  20  -4.300   6.530   4.633
  111    HA   ARG  20           HA       ARG  20  -5.638   5.795   2.194
  112    HB2  ARG  20           1HB      ARG  20  -5.385   8.572   3.343
  113    HB3  ARG  20           2HB      ARG  20  -6.636   7.957   2.270
  114    HG2  ARG  20           1HG      ARG  20  -7.767   6.921   3.951
  115    HG3  ARG  20           2HG      ARG  20  -6.312   6.645   4.910
  116    HD2  ARG  20           1HD      ARG  20  -6.353   8.756   5.825
  117    HD3  ARG  20           2HD      ARG  20  -7.249   9.440   4.470
  118    HE   ARG  20           HE       ARG  20  -9.223   8.801   5.476
  119   HH11  ARG  20          1HH1      ARG  20  -6.514   7.407   7.160
  120   HH12  ARG  20          2HH1      ARG  20  -7.459   6.881   8.514
  121   HH21  ARG  20          1HH2      ARG  20 -10.478   8.113   7.253
  122   HH22  ARG  20          2HH2      ARG  20  -9.713   7.282   8.565
  123    H    PHE  21           H        PHE  21  -5.496   7.375   0.293
  124    HA   PHE  21           HA       PHE  21  -2.794   8.393  -0.144
  125    HB2  PHE  21           1HB      PHE  21  -4.117   6.250  -1.801
  126    HB3  PHE  21           2HB      PHE  21  -2.824   7.261  -2.438
  127    HD1  PHE  21           HD2      PHE  21  -3.625   4.964   0.373
  128    HD2  PHE  21           HD1      PHE  21  -0.614   6.654  -2.116
  129    HE1  PHE  21           HE2      PHE  21  -1.960   3.447   1.362
  130    HE2  PHE  21           HE1      PHE  21   1.056   5.139  -1.131
  131    HZ   PHE  21           HZ       PHE  21   0.384   3.533   0.612
  132    H    ARG  22           H        ARG  22  -2.795  10.263  -1.229
  133    HA   ARG  22           HA       ARG  22  -4.858  11.893  -1.650
  134    HB2  ARG  22           1HB      ARG  22  -2.386  11.545  -3.325
  135    HB3  ARG  22           2HB      ARG  22  -3.561  12.801  -3.691
  136    HG2  ARG  22           1HG      ARG  22  -2.352  12.533  -0.962
  137    HG3  ARG  22           2HG      ARG  22  -1.547  13.426  -2.254
  138    HD2  ARG  22           1HD      ARG  22  -4.352  13.962  -1.285
  139    HD3  ARG  22           2HD      ARG  22  -2.925  14.852  -0.758
  140    HE   ARG  22           HE       ARG  22  -4.352  15.196  -3.203
  141   HH11  ARG  22          1HH1      ARG  22  -1.195  15.391  -1.750
  142   HH12  ARG  22          2HH1      ARG  22  -0.604  16.566  -2.879
  143   HH21  ARG  22          1HH2      ARG  22  -3.587  16.741  -4.696
  144   HH22  ARG  22          2HH2      ARG  22  -1.966  17.333  -4.554
  145    H    HIS  23           H        HIS  23  -3.767   9.512  -4.053
  146    HA   HIS  23           HA       HIS  23  -6.382   9.795  -5.384
  147    HB2  HIS  23           1HB      HIS  23  -3.627   9.547  -6.480
  148    HB3  HIS  23           2HB      HIS  23  -4.919   8.725  -7.350
  149    HD2  HIS  23           HD2      HIS  23  -4.101  12.424  -6.219
  150    HE1  HIS  23           HE1      HIS  23  -6.594  12.501  -9.652
  151    HE2  HIS  23           HE2      HIS  23  -5.203  13.870  -8.060
  152    H    LEU  24           H        LEU  24  -7.131   7.818  -6.507
  153    HA   LEU  24           HA       LEU  24  -6.945   5.565  -4.740
  154    HB2  LEU  24           1HB      LEU  24  -9.035   6.268  -5.883
  155    HB3  LEU  24           2HB      LEU  24  -8.320   5.770  -7.415
  156    HG   LEU  24           HG       LEU  24  -9.960   4.160  -6.394
  157   HD11  LEU  24          1HD1      LEU  24  -7.573   3.719  -7.761
  158   HD12  LEU  24          2HD1      LEU  24  -8.947   2.622  -7.631
  159   HD13  LEU  24          3HD1      LEU  24  -7.609   2.499  -6.489
  160   HD21  LEU  24          3HD2      LEU  24  -7.903   3.079  -4.604
  161   HD22  LEU  24          1HD2      LEU  24  -9.647   3.214  -4.383
  162   HD23  LEU  24          2HD2      LEU  24  -8.610   4.608  -4.078
  163    H    GLN  25           H        GLN  25  -6.448   5.821  -8.267
  164    HA   GLN  25           HA       GLN  25  -5.365   3.471  -8.906
  165    HB2  GLN  25           1HB      GLN  25  -3.942   4.590 -10.561
  166    HB3  GLN  25           2HB      GLN  25  -5.544   5.314 -10.499
  167    HG2  GLN  25           1HG      GLN  25  -4.742   7.209  -9.330
  168    HG3  GLN  25           2HG      GLN  25  -3.182   6.445  -9.028
  169   HE21  GLN  25          1HE2      GLN  25  -2.400   8.478  -9.965
  170   HE22  GLN  25          2HE2      GLN  25  -2.248   8.590 -11.682
  171    H    THR  26           H        THR  26  -3.731   5.959  -7.035
  172    HA   THR  26           HA       THR  26  -1.178   4.729  -6.996
  173    HB   THR  26           HB       THR  26  -2.365   6.643  -4.977
  174    HG1  THR  26           HG1      THR  26  -0.840   8.042  -6.386
  175   HG21  THR  26          3HG2      THR  26  -0.279   6.920  -4.076
  176   HG22  THR  26          1HG2      THR  26   0.546   6.481  -5.571
  177   HG23  THR  26          2HG2      THR  26  -0.162   5.226  -4.554
  178    H    LEU  27           H        LEU  27  -3.807   4.804  -4.592
  179    HA   LEU  27           HA       LEU  27  -2.677   3.279  -2.606
  180    HB2  LEU  27           1HB      LEU  27  -4.786   4.305  -2.245
  181    HB3  LEU  27           2HB      LEU  27  -5.520   3.414  -3.576
  182    HG   LEU  27           HG       LEU  27  -5.438   1.363  -2.305
  183   HD11  LEU  27          1HD1      LEU  27  -4.048   3.018  -0.205
  184   HD12  LEU  27          2HD1      LEU  27  -3.383   1.652  -1.100
  185   HD13  LEU  27          3HD1      LEU  27  -4.687   1.395   0.058
  186   HD21  LEU  27          3HD2      LEU  27  -7.022   3.572  -1.710
  187   HD22  LEU  27          1HD2      LEU  27  -6.524   2.937  -0.142
  188   HD23  LEU  27          2HD2      LEU  27  -7.349   1.888  -1.296
  189    H    LYS  28           H        LYS  28  -4.528   2.100  -5.406
  190    HA   LYS  28           HA       LYS  28  -4.557  -0.590  -4.924
  191    HB2  LYS  28           1HB      LYS  28  -4.352   1.016  -7.438
  192    HB3  LYS  28           2HB      LYS  28  -4.206  -0.734  -7.533
  193    HG2  LYS  28           1HG      LYS  28  -6.386  -1.089  -6.891
  194    HG3  LYS  28           2HG      LYS  28  -6.509   0.469  -6.069
  195    HD2  LYS  28           1HD      LYS  28  -6.665   1.639  -8.132
  196    HD3  LYS  28           2HD      LYS  28  -6.214   0.204  -9.055
  197    HE2  LYS  28           1HE      LYS  28  -8.732   0.498  -7.420
  198    HE3  LYS  28           2HE      LYS  28  -8.630   0.701  -9.168
  199    HZ1  LYS  28           3HZ      LYS  28  -7.474  -1.743  -8.619
  200    HZ2  LYS  28           1HZ      LYS  28  -8.982  -1.466  -9.334
  201    HZ3  LYS  28           2HZ      LYS  28  -8.867  -1.686  -7.661
  202    H    SER  29           H        SER  29  -1.860   1.353  -6.074
  203    HA   SER  29           HA       SER  29  -0.161  -0.917  -6.556
  204    HB2  SER  29           1HB      SER  29   0.257   2.062  -6.560
  205    HB3  SER  29           2HB      SER  29   1.625   0.956  -6.676
  206    HG   SER  29           HG       SER  29   0.610   1.706  -8.712
  207    H    HIS  30           H        HIS  30  -0.947   1.092  -3.868
  208    HA   HIS  30           HA       HIS  30   1.419   0.622  -2.343
  209    HB2  HIS  30           1HB      HIS  30   0.309   2.500  -1.589
  210    HB3  HIS  30           2HB      HIS  30  -1.282   1.773  -1.795
  211    HD1  HIS  30           HD1      HIS  30   1.729   1.423   0.502
  212    HD2  HIS  30           HD2      HIS  30  -2.395   0.923   0.524
  213    HE1  HIS  30           HE1      HIS  30   1.134   0.851   2.877
  214    H    LEU  31           H        LEU  31  -1.280  -1.281  -3.115
  215    HA   LEU  31           HA       LEU  31  -1.297  -2.881  -0.726
  216    HB2  LEU  31           1HB      LEU  31  -2.428  -3.820  -3.322
  217    HB3  LEU  31           2HB      LEU  31  -3.028  -4.069  -1.684
  218    HG   LEU  31           HG       LEU  31  -3.295  -1.615  -3.405
  219   HD11  LEU  31          1HD1      LEU  31  -5.737  -2.157  -2.429
  220   HD12  LEU  31          2HD1      LEU  31  -5.060  -3.785  -2.472
  221   HD13  LEU  31          3HD1      LEU  31  -5.124  -2.817  -3.945
  222   HD21  LEU  31          3HD2      LEU  31  -4.484  -0.640  -1.423
  223   HD22  LEU  31          1HD2      LEU  31  -2.733  -0.775  -1.250
  224   HD23  LEU  31          2HD2      LEU  31  -3.790  -1.939  -0.451
  225    H    ARG  32           H        ARG  32   0.718  -2.685  -3.400
  226    HA   ARG  32           HA       ARG  32   1.344  -5.384  -3.886
  227    HB2  ARG  32           1HB      ARG  32   2.680  -2.770  -4.387
  228    HB3  ARG  32           2HB      ARG  32   3.660  -4.225  -4.510
  229    HG2  ARG  32           1HG      ARG  32   2.962  -4.067  -6.663
  230    HG3  ARG  32           2HG      ARG  32   1.633  -5.026  -6.008
  231    HD2  ARG  32           1HD      ARG  32   0.430  -3.411  -7.073
  232    HD3  ARG  32           2HD      ARG  32   0.637  -2.625  -5.508
  233    HE   ARG  32           HE       ARG  32   1.913  -1.032  -6.531
  234   HH11  ARG  32          1HH1      ARG  32   1.725  -3.822  -8.605
  235   HH12  ARG  32          2HH1      ARG  32   2.532  -3.053  -9.931
  236   HH21  ARG  32          1HH2      ARG  32   2.976  -0.008  -8.270
  237   HH22  ARG  32          2HH2      ARG  32   3.244  -0.884  -9.739
  238    H    ILE  33           H        ILE  33   2.678  -3.030  -1.608
  239    HA   ILE  33           HA       ILE  33   4.738  -4.718  -0.624
  240    HB   ILE  33           HB       ILE  33   5.102  -3.107   1.070
  241   HG12  ILE  33          1HG1      ILE  33   2.387  -1.920   0.470
  242   HG13  ILE  33          2HG1      ILE  33   2.705  -3.016   1.810
  243   HG21  ILE  33          1HG2      ILE  33   4.300  -2.052  -1.587
  244   HG22  ILE  33          2HG2      ILE  33   4.664  -0.892  -0.310
  245   HG23  ILE  33          3HG2      ILE  33   5.881  -2.069  -0.804
  246   HD11  ILE  33          3HD1      ILE  33   4.593  -0.882   1.881
  247   HD12  ILE  33          1HD1      ILE  33   2.963  -0.221   1.750
  248   HD13  ILE  33          2HD1      ILE  33   3.364  -1.325   3.066
  249    H    HIS  34           H        HIS  34   1.359  -4.396   0.080
  250    HA   HIS  34           HA       HIS  34   1.418  -5.663   2.638
  251    HB2  HIS  34           1HB      HIS  34  -0.763  -5.013   0.671
  252    HB3  HIS  34           2HB      HIS  34  -1.096  -5.977   2.106
  253    HD1  HIS  34           HD1      HIS  34   0.275  -4.560   4.310
  254    HD2  HIS  34           HD2      HIS  34  -1.586  -2.506   1.215
  255    HE1  HIS  34           HE1      HIS  34  -0.211  -2.267   5.221
  256    H    THR  35           H        THR  35   0.396  -6.781  -0.589
  257    HA   THR  35           HA       THR  35   0.594  -9.549   0.372
  258    HB   THR  35           HB       THR  35  -1.554  -8.967  -0.642
  259    HG1  THR  35           HG1      THR  35  -0.392 -10.567  -2.619
  260   HG21  THR  35          3HG2      THR  35  -0.747  -7.196  -2.150
  261   HG22  THR  35          1HG2      THR  35  -1.725  -8.389  -3.003
  262   HG23  THR  35          2HG2      THR  35   0.032  -8.418  -3.154
  263    H    GLY  36           H        GLY  36   2.141 -10.884  -0.346
  264    HA2  GLY  36           1HA      GLY  36   3.281 -11.223  -2.748
  265    HA3  GLY  36           2HA      GLY  36   4.147  -9.814  -2.153
  266    H    SER  37           H        SER  37   3.369 -13.185  -1.423
  267    HA   SER  37           HA       SER  37   5.624 -13.311   0.436
  268    HB2  SER  37           1HB      SER  37   3.273 -15.097  -0.121
  269    HB3  SER  37           2HB      SER  37   4.689 -15.729   0.719
  270    HG   SER  37           HG       SER  37   4.254 -13.569   1.978
  271    H    GLY  38           H        GLY  38   7.502 -13.524  -0.639
  272    HA2  GLY  38           1HA      GLY  38   8.854 -15.473  -1.496
  273    HA3  GLY  38           2HA      GLY  38   7.634 -15.580  -2.756
  274    HA   PRO  39           HA       PRO  39  11.091 -13.064  -4.466
  275    HB2  PRO  39           1HB      PRO  39  10.953 -14.166  -6.944
  276    HB3  PRO  39           2HB      PRO  39  11.878 -14.888  -5.622
  277    HG2  PRO  39           1HG      PRO  39   9.148 -15.591  -6.630
  278    HG3  PRO  39           2HG      PRO  39  10.477 -16.666  -6.155
  279    HD2  PRO  39           1HD      PRO  39   8.379 -16.137  -4.527
  280    HD3  PRO  39           2HD      PRO  39  10.012 -16.455  -3.908
  281    H    SER  40           H        SER  40   7.767 -13.448  -5.075
  282    HA   SER  40           HA       SER  40   7.599 -11.579  -7.263
  283    HB2  SER  40           1HB      SER  40   5.145 -11.800  -6.934
  284    HB3  SER  40           2HB      SER  40   5.948 -13.360  -7.106
  285    HG   SER  40           HG       SER  40   5.308 -13.863  -5.175
  286    H    SER  41           H        SER  41   7.484  -9.440  -7.120
  287    HA   SER  41           HA       SER  41   7.249  -7.332  -6.295
  288    HB2  SER  41           1HB      SER  41   4.988  -8.373  -5.570
  289    HB3  SER  41           2HB      SER  41   5.699  -8.422  -3.957
  290    HG   SER  41           HG       SER  41   4.449  -6.443  -4.795
  291    H    GLY  42           H        GLY  42   9.563  -8.728  -5.654
  292    HA2  GLY  42           1HA      GLY  42  11.373  -7.851  -4.351
  293    HA3  GLY  42           2HA      GLY  42  10.224  -7.478  -3.075
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1  18.215  24.226   5.969
    2    HA2  GLY   1           1HA      GLY   1  15.801  24.651   6.398
    3    HA3  GLY   1           2HA      GLY   1  16.248  25.048   4.746
    4    H    SER   2           H        SER   2  14.024  23.475   6.583
    5    HA   SER   2           HA       SER   2  13.548  21.121   5.080
    6    HB2  SER   2           1HB      SER   2  11.474  20.961   6.288
    7    HB3  SER   2           2HB      SER   2  12.695  21.571   7.405
    8    HG   SER   2           HG       SER   2  11.782  23.727   6.514
    9    H    SER   3           H        SER   3  11.370  20.785   3.953
   10    HA   SER   3           HA       SER   3  10.562  23.124   2.387
   11    HB2  SER   3           1HB      SER   3  11.787  20.608   1.327
   12    HB3  SER   3           2HB      SER   3  10.547  21.419   0.371
   13    HG   SER   3           HG       SER   3  12.109  22.665  -0.257
   14    H    GLY   4           H        GLY   4   8.423  23.288   2.364
   15    HA2  GLY   4           1HA      GLY   4   6.830  20.913   3.041
   16    HA3  GLY   4           2HA      GLY   4   6.302  22.582   3.198
   17    H    SER   5           H        SER   5   4.893  23.254   1.734
   18    HA   SER   5           HA       SER   5   3.595  23.341  -0.134
   19    HB2  SER   5           1HB      SER   5   6.161  22.429  -1.460
   20    HB3  SER   5           2HB      SER   5   4.759  23.084  -2.306
   21    HG   SER   5           HG       SER   5   5.788  24.902  -1.985
   22    H    SER   6           H        SER   6   3.317  21.023   1.373
   23    HA   SER   6           HA       SER   6   2.583  19.102  -0.724
   24    HB2  SER   6           1HB      SER   6   4.601  18.203   0.260
   25    HB3  SER   6           2HB      SER   6   3.967  18.448   1.887
   26    HG   SER   6           HG       SER   6   3.780  16.263   1.055
   27    H    GLY   7           H        GLY   7   0.545  18.392  -0.579
   28    HA2  GLY   7           1HA      GLY   7  -0.863  17.834   1.767
   29    HA3  GLY   7           2HA      GLY   7  -1.245  19.487   1.311
   30    H    GLY   8           H        GLY   8  -1.896  16.191   0.770
   31    HA2  GLY   8           1HA      GLY   8  -3.833  16.944  -1.313
   32    HA3  GLY   8           2HA      GLY   8  -2.755  15.585  -1.592
   33    H    GLU   9           H        GLU   9  -5.741  16.535  -0.397
   34    HA   GLU   9           HA       GLU   9  -6.324  14.894   1.712
   35    HB2  GLU   9           1HB      GLU   9  -8.061  15.572  -0.665
   36    HB3  GLU   9           2HB      GLU   9  -8.660  14.808   0.801
   37    HG2  GLU   9           1HG      GLU   9  -7.988  16.749   2.104
   38    HG3  GLU   9           2HG      GLU   9  -7.352  17.515   0.650
   39    H    LYS  10           H        LYS  10  -6.576  12.770   2.059
   40    HA   LYS  10           HA       LYS  10  -6.249  10.974  -0.247
   41    HB2  LYS  10           1HB      LYS  10  -5.733  10.431   2.683
   42    HB3  LYS  10           2HB      LYS  10  -5.437   9.310   1.361
   43    HG2  LYS  10           1HG      LYS  10  -3.337  10.123   1.626
   44    HG3  LYS  10           2HG      LYS  10  -3.952  11.315   0.478
   45    HD2  LYS  10           1HD      LYS  10  -4.234  12.938   2.131
   46    HD3  LYS  10           2HD      LYS  10  -4.205  11.748   3.435
   47    HE2  LYS  10           1HE      LYS  10  -1.808  12.192   1.690
   48    HE3  LYS  10           2HE      LYS  10  -2.134  13.244   3.066
   49    HZ1  LYS  10           3HZ      LYS  10  -1.587  10.335   3.086
   50    HZ2  LYS  10           1HZ      LYS  10  -2.259  11.135   4.418
   51    HZ3  LYS  10           2HZ      LYS  10  -0.722  11.567   3.858
   52    HA   PRO  11           HA       PRO  11 -10.633  10.414   1.209
   53    HB2  PRO  11           1HB      PRO  11 -11.718  10.451  -1.279
   54    HB3  PRO  11           2HB      PRO  11 -11.433  11.917  -0.334
   55    HG2  PRO  11           1HG      PRO  11  -9.786  10.733  -2.535
   56    HG3  PRO  11           2HG      PRO  11 -10.220  12.428  -2.250
   57    HD2  PRO  11           1HD      PRO  11  -7.802  11.411  -1.581
   58    HD3  PRO  11           2HD      PRO  11  -8.580  12.711  -0.656
   59    H    TYR  12           H        TYR  12  -8.287   8.682  -0.312
   60    HA   TYR  12           HA       TYR  12 -10.055   6.355  -0.700
   61    HB2  TYR  12           1HB      TYR  12  -7.458   7.023  -2.098
   62    HB3  TYR  12           2HB      TYR  12  -8.322   5.500  -2.277
   63    HD1  TYR  12           HD1      TYR  12  -8.510   9.138  -2.913
   64    HD2  TYR  12           HD2      TYR  12 -10.193   5.316  -3.728
   65    HE1  TYR  12           HE1      TYR  12  -9.850  10.121  -4.726
   66    HE2  TYR  12           HE2      TYR  12 -11.537   6.289  -5.544
   67    HH   TYR  12           HH       TYR  12 -11.419   8.286  -7.056
   68    HA   PRO  13           HA       PRO  13  -7.395   5.320   2.896
   69    HB2  PRO  13           1HB      PRO  13  -9.291   3.814   4.124
   70    HB3  PRO  13           2HB      PRO  13  -9.203   5.572   4.292
   71    HG2  PRO  13           1HG      PRO  13 -10.966   3.924   2.521
   72    HG3  PRO  13           2HG      PRO  13 -11.375   5.349   3.494
   73    HD2  PRO  13           1HD      PRO  13 -10.929   5.486   0.826
   74    HD3  PRO  13           2HD      PRO  13 -10.526   6.816   1.931
   75    H    CYS  14           H        CYS  14  -6.294   3.432   3.317
   76    HA   CYS  14           HA       CYS  14  -6.325   1.437   1.272
   77    HB2  CYS  14           1HB      CYS  14  -4.212   1.998   2.244
   78    HB3  CYS  14           2HB      CYS  14  -4.806   1.679   3.870
   79    H    GLU  15           H        GLU  15  -6.469  -0.901   1.732
   80    HA   GLU  15           HA       GLU  15  -8.722  -1.426   3.536
   81    HB2  GLU  15           1HB      GLU  15  -9.064  -3.472   2.219
   82    HB3  GLU  15           2HB      GLU  15  -9.085  -2.037   1.205
   83    HG2  GLU  15           1HG      GLU  15  -6.813  -2.485   0.482
   84    HG3  GLU  15           2HG      GLU  15  -6.741  -3.894   1.538
   85    H    ILE  16           H        ILE  16  -5.472  -2.516   2.725
   86    HA   ILE  16           HA       ILE  16  -5.398  -4.722   4.492
   87    HB   ILE  16           HB       ILE  16  -3.098  -3.052   3.468
   88   HG12  ILE  16          1HG1      ILE  16  -2.978  -5.287   2.007
   89   HG13  ILE  16          2HG1      ILE  16  -4.712  -5.270   2.308
   90   HG21  ILE  16          1HG2      ILE  16  -3.260  -5.536   5.078
   91   HG22  ILE  16          2HG2      ILE  16  -2.019  -5.455   3.828
   92   HG23  ILE  16          3HG2      ILE  16  -2.063  -4.241   5.107
   93   HD11  ILE  16          3HD1      ILE  16  -3.196  -3.771   0.420
   94   HD12  ILE  16          1HD1      ILE  16  -4.945  -3.853   0.632
   95   HD13  ILE  16          2HD1      ILE  16  -4.002  -2.664   1.531
   96    H    CYS  17           H        CYS  17  -3.499  -1.729   4.841
   97    HA   CYS  17           HA       CYS  17  -3.539  -2.069   7.732
   98    HB2  CYS  17           1HB      CYS  17  -1.899  -0.199   7.722
   99    HB3  CYS  17           2HB      CYS  17  -1.394  -1.565   6.733
  100    H    GLY  18           H        GLY  18  -4.407   0.405   5.328
  101    HA2  GLY  18           1HA      GLY  18  -6.705   1.370   5.877
  102    HA3  GLY  18           2HA      GLY  18  -5.971   1.772   7.422
  103    H    THR  19           H        THR  19  -3.389   2.289   5.865
  104    HA   THR  19           HA       THR  19  -3.347   5.002   5.851
  105    HB   THR  19           HB       THR  19  -1.865   3.079   4.067
  106    HG1  THR  19           HG1      THR  19  -0.155   4.105   5.548
  107   HG21  THR  19          3HG2      THR  19  -1.720   6.077   4.162
  108   HG22  THR  19          1HG2      THR  19  -1.790   5.016   2.755
  109   HG23  THR  19          2HG2      THR  19  -0.315   5.107   3.718
  110    H    ARG  20           H        ARG  20  -3.909   6.660   4.519
  111    HA   ARG  20           HA       ARG  20  -5.621   5.963   2.238
  112    HB2  ARG  20           1HB      ARG  20  -5.409   8.664   3.560
  113    HB3  ARG  20           2HB      ARG  20  -6.687   8.072   2.507
  114    HG2  ARG  20           1HG      ARG  20  -7.697   6.881   4.166
  115    HG3  ARG  20           2HG      ARG  20  -6.191   6.620   5.047
  116    HD2  ARG  20           1HD      ARG  20  -6.291   8.660   6.095
  117    HD3  ARG  20           2HD      ARG  20  -7.249   9.393   4.809
  118    HE   ARG  20           HE       ARG  20  -8.656   7.344   6.240
  119   HH11  ARG  20          1HH1      ARG  20  -7.767  10.710   6.228
  120   HH12  ARG  20          2HH1      ARG  20  -9.109  11.203   7.208
  121   HH21  ARG  20          1HH2      ARG  20 -10.426   7.980   7.531
  122   HH22  ARG  20          2HH2      ARG  20 -10.620   9.649   7.949
  123    H    PHE  21           H        PHE  21  -5.353   6.937   0.226
  124    HA   PHE  21           HA       PHE  21  -2.798   8.351  -0.164
  125    HB2  PHE  21           1HB      PHE  21  -4.070   6.207  -1.864
  126    HB3  PHE  21           2HB      PHE  21  -2.786   7.253  -2.458
  127    HD1  PHE  21           HD2      PHE  21  -3.592   4.837   0.244
  128    HD2  PHE  21           HD1      PHE  21  -0.561   6.706  -2.089
  129    HE1  PHE  21           HE2      PHE  21  -1.915   3.319   1.213
  130    HE2  PHE  21           HE1      PHE  21   1.120   5.190  -1.124
  131    HZ   PHE  21           HZ       PHE  21   0.445   3.495   0.530
  132    H    ARG  22           H        ARG  22  -2.795  10.114  -1.488
  133    HA   ARG  22           HA       ARG  22  -4.920  11.749  -1.759
  134    HB2  ARG  22           1HB      ARG  22  -2.408  12.030  -2.477
  135    HB3  ARG  22           2HB      ARG  22  -3.025  11.613  -4.070
  136    HG2  ARG  22           1HG      ARG  22  -4.474  13.503  -4.088
  137    HG3  ARG  22           2HG      ARG  22  -4.126  13.853  -2.393
  138    HD2  ARG  22           1HD      ARG  22  -1.840  14.398  -2.929
  139    HD3  ARG  22           2HD      ARG  22  -2.079  13.906  -4.605
  140    HE   ARG  22           HE       ARG  22  -2.796  16.413  -3.425
  141   HH11  ARG  22          1HH1      ARG  22  -3.584  14.137  -5.939
  142   HH12  ARG  22          2HH1      ARG  22  -4.317  15.325  -6.965
  143   HH21  ARG  22          1HH2      ARG  22  -3.758  17.987  -4.767
  144   HH22  ARG  22          2HH2      ARG  22  -4.414  17.515  -6.298
  145    H    HIS  23           H        HIS  23  -3.897   9.399  -4.231
  146    HA   HIS  23           HA       HIS  23  -6.622   9.537  -5.347
  147    HB2  HIS  23           1HB      HIS  23  -3.958   9.485  -6.698
  148    HB3  HIS  23           2HB      HIS  23  -5.316   8.690  -7.489
  149    HD2  HIS  23           HD2      HIS  23  -5.815  12.094  -5.618
  150    HE1  HIS  23           HE1      HIS  23  -6.272  12.738  -9.787
  151    HE2  HIS  23           HE2      HIS  23  -6.379  13.780  -7.496
  152    H    LEU  24           H        LEU  24  -7.302   7.540  -6.484
  153    HA   LEU  24           HA       LEU  24  -6.830   5.262  -4.821
  154    HB2  LEU  24           1HB      LEU  24  -9.002   5.899  -5.961
  155    HB3  LEU  24           2HB      LEU  24  -8.285   5.293  -7.452
  156    HG   LEU  24           HG       LEU  24  -8.341   3.080  -6.723
  157   HD11  LEU  24          1HD1      LEU  24  -8.369   4.281  -4.004
  158   HD12  LEU  24          2HD1      LEU  24  -7.402   2.954  -4.646
  159   HD13  LEU  24          3HD1      LEU  24  -9.095   2.689  -4.230
  160   HD21  LEU  24          3HD2      LEU  24 -10.777   4.438  -5.576
  161   HD22  LEU  24          1HD2      LEU  24 -10.640   2.713  -5.917
  162   HD23  LEU  24          2HD2      LEU  24 -10.565   3.881  -7.236
  163    H    GLN  25           H        GLN  25  -6.300   5.873  -8.295
  164    HA   GLN  25           HA       GLN  25  -5.139   3.596  -9.133
  165    HB2  GLN  25           1HB      GLN  25  -3.693   4.973 -10.626
  166    HB3  GLN  25           2HB      GLN  25  -5.382   5.462 -10.629
  167    HG2  GLN  25           1HG      GLN  25  -4.958   7.423  -9.494
  168    HG3  GLN  25           2HG      GLN  25  -3.448   6.821  -8.810
  169   HE21  GLN  25          1HE2      GLN  25  -4.730   8.875 -11.020
  170   HE22  GLN  25          2HE2      GLN  25  -3.382   9.036 -12.089
  171    H    THR  26           H        THR  26  -3.708   5.932  -6.957
  172    HA   THR  26           HA       THR  26  -1.097   4.716  -7.009
  173    HB   THR  26           HB       THR  26  -2.219   6.726  -5.047
  174    HG1  THR  26           HG1      THR  26  -2.078   7.306  -7.388
  175   HG21  THR  26          3HG2      THR  26   0.075   5.237  -4.823
  176   HG22  THR  26          1HG2      THR  26  -0.204   6.801  -4.059
  177   HG23  THR  26          2HG2      THR  26   0.653   6.711  -5.598
  178    H    LEU  27           H        LEU  27  -3.871   4.748  -4.809
  179    HA   LEU  27           HA       LEU  27  -2.733   3.322  -2.695
  180    HB2  LEU  27           1HB      LEU  27  -4.815   4.422  -2.378
  181    HB3  LEU  27           2HB      LEU  27  -5.567   3.510  -3.684
  182    HG   LEU  27           HG       LEU  27  -5.658   1.535  -2.370
  183   HD11  LEU  27          1HD1      LEU  27  -3.389   1.876  -1.346
  184   HD12  LEU  27          2HD1      LEU  27  -4.623   1.243  -0.257
  185   HD13  LEU  27          3HD1      LEU  27  -4.161   2.943  -0.172
  186   HD21  LEU  27          3HD2      LEU  27  -7.431   2.259  -1.246
  187   HD22  LEU  27          1HD2      LEU  27  -6.930   3.909  -1.620
  188   HD23  LEU  27          2HD2      LEU  27  -6.415   3.151  -0.113
  189    H    LYS  28           H        LYS  28  -4.593   2.137  -5.485
  190    HA   LYS  28           HA       LYS  28  -4.647  -0.557  -4.902
  191    HB2  LYS  28           1HB      LYS  28  -4.390   0.844  -7.564
  192    HB3  LYS  28           2HB      LYS  28  -4.660  -0.888  -7.413
  193    HG2  LYS  28           1HG      LYS  28  -6.797  -0.598  -6.520
  194    HG3  LYS  28           2HG      LYS  28  -6.497   1.096  -6.121
  195    HD2  LYS  28           1HD      LYS  28  -6.731   1.786  -8.327
  196    HD3  LYS  28           2HD      LYS  28  -6.411   0.173  -8.969
  197    HE2  LYS  28           1HE      LYS  28  -8.837   0.729  -7.296
  198    HE3  LYS  28           2HE      LYS  28  -8.827   1.068  -9.026
  199    HZ1  LYS  28           3HZ      LYS  28  -9.643  -1.216  -8.183
  200    HZ2  LYS  28           1HZ      LYS  28  -7.996  -1.580  -8.046
  201    HZ3  LYS  28           2HZ      LYS  28  -8.645  -1.152  -9.548
  202    H    SER  29           H        SER  29  -1.973   1.393  -5.959
  203    HA   SER  29           HA       SER  29  -0.314  -0.900  -6.594
  204    HB2  SER  29           1HB      SER  29  -0.127   1.213  -7.889
  205    HB3  SER  29           2HB      SER  29   0.439   2.028  -6.432
  206    HG   SER  29           HG       SER  29   2.318   1.008  -6.566
  207    H    HIS  30           H        HIS  30  -1.051   1.055  -3.881
  208    HA   HIS  30           HA       HIS  30   1.394   0.671  -2.452
  209    HB2  HIS  30           1HB      HIS  30   0.286   2.500  -1.614
  210    HB3  HIS  30           2HB      HIS  30  -1.303   1.772  -1.830
  211    HD1  HIS  30           HD1      HIS  30   1.709   1.438   0.461
  212    HD2  HIS  30           HD2      HIS  30  -2.399   0.814   0.460
  213    HE1  HIS  30           HE1      HIS  30   1.126   0.798   2.822
  214    H    LEU  31           H        LEU  31  -1.340  -1.274  -3.069
  215    HA   LEU  31           HA       LEU  31  -1.183  -2.891  -0.706
  216    HB2  LEU  31           1HB      LEU  31  -2.414  -3.884  -3.227
  217    HB3  LEU  31           2HB      LEU  31  -2.949  -4.086  -1.560
  218    HG   LEU  31           HG       LEU  31  -3.330  -1.718  -3.372
  219   HD11  LEU  31          1HD1      LEU  31  -5.196  -3.504  -1.821
  220   HD12  LEU  31          2HD1      LEU  31  -5.005  -3.426  -3.572
  221   HD13  LEU  31          3HD1      LEU  31  -5.692  -2.056  -2.698
  222   HD21  LEU  31          3HD2      LEU  31  -3.521  -1.864  -0.377
  223   HD22  LEU  31          1HD2      LEU  31  -4.432  -0.687  -1.323
  224   HD23  LEU  31          2HD2      LEU  31  -2.669  -0.680  -1.371
  225    H    ARG  32           H        ARG  32   0.858  -2.566  -3.256
  226    HA   ARG  32           HA       ARG  32   1.473  -5.265  -3.884
  227    HB2  ARG  32           1HB      ARG  32   2.732  -2.613  -4.363
  228    HB3  ARG  32           2HB      ARG  32   3.760  -4.032  -4.509
  229    HG2  ARG  32           1HG      ARG  32   2.985  -3.659  -6.670
  230    HG3  ARG  32           2HG      ARG  32   1.954  -4.957  -6.064
  231    HD2  ARG  32           1HD      ARG  32   0.395  -2.997  -5.340
  232    HD3  ARG  32           2HD      ARG  32   1.305  -2.079  -6.539
  233    HE   ARG  32           HE       ARG  32   0.261  -3.267  -8.206
  234   HH11  ARG  32          1HH1      ARG  32  -0.335  -4.791  -5.133
  235   HH12  ARG  32          2HH1      ARG  32  -1.529  -5.880  -5.757
  236   HH21  ARG  32          1HH2      ARG  32  -1.309  -4.696  -9.040
  237   HH22  ARG  32          2HH2      ARG  32  -2.081  -5.826  -7.980
  238    H    ILE  33           H        ILE  33   2.507  -3.057  -1.384
  239    HA   ILE  33           HA       ILE  33   4.698  -4.727  -0.522
  240    HB   ILE  33           HB       ILE  33   5.101  -3.127   1.180
  241   HG12  ILE  33          1HG1      ILE  33   2.422  -1.866   0.568
  242   HG13  ILE  33          2HG1      ILE  33   2.701  -2.972   1.908
  243   HG21  ILE  33          1HG2      ILE  33   4.663  -2.311  -1.538
  244   HG22  ILE  33          2HG2      ILE  33   4.383  -0.960  -0.441
  245   HG23  ILE  33          3HG2      ILE  33   5.925  -1.815  -0.411
  246   HD11  ILE  33          3HD1      ILE  33   4.357  -0.505   1.617
  247   HD12  ILE  33          1HD1      ILE  33   2.746  -0.430   2.330
  248   HD13  ILE  33          2HD1      ILE  33   3.990  -1.444   3.064
  249    H    HIS  34           H        HIS  34   1.338  -4.604  -0.001
  250    HA   HIS  34           HA       HIS  34   1.390  -5.796   2.631
  251    HB2  HIS  34           1HB      HIS  34  -0.799  -5.106   0.684
  252    HB3  HIS  34           2HB      HIS  34  -1.127  -6.058   2.129
  253    HD1  HIS  34           HD1      HIS  34   0.300  -4.646   4.304
  254    HD2  HIS  34           HD2      HIS  34  -1.589  -2.588   1.229
  255    HE1  HIS  34           HE1      HIS  34  -0.145  -2.342   5.210
  256    H    THR  35           H        THR  35   0.536  -6.840  -0.657
  257    HA   THR  35           HA       THR  35   0.691  -9.632   0.274
  258    HB   THR  35           HB       THR  35  -1.517  -8.994  -0.633
  259    HG1  THR  35           HG1      THR  35   0.088 -11.005  -1.591
  260   HG21  THR  35          3HG2      THR  35  -0.430  -7.353  -2.311
  261   HG22  THR  35          1HG2      THR  35  -1.858  -8.255  -2.819
  262   HG23  THR  35          2HG2      THR  35  -0.256  -8.770  -3.346
  263    H    GLY  36           H        GLY  36   2.447 -10.705  -0.334
  264    HA2  GLY  36           1HA      GLY  36   3.540 -10.261  -3.014
  265    HA3  GLY  36           2HA      GLY  36   4.616 -10.010  -1.646
  266    H    SER  37           H        SER  37   5.215 -11.863  -3.592
  267    HA   SER  37           HA       SER  37   4.693 -14.431  -2.241
  268    HB2  SER  37           1HB      SER  37   3.851 -14.148  -4.628
  269    HB3  SER  37           2HB      SER  37   5.544 -14.106  -5.121
  270    HG   SER  37           HG       SER  37   5.633 -16.182  -3.840
  271    H    GLY  38           H        GLY  38   6.422 -14.323  -0.808
  272    HA2  GLY  38           1HA      GLY  38   8.584 -15.294  -0.467
  273    HA3  GLY  38           2HA      GLY  38   9.046 -14.742  -2.070
  274    HA   PRO  39           HA       PRO  39  10.316 -11.741   1.422
  275    HB2  PRO  39           1HB      PRO  39  12.933 -12.431   1.642
  276    HB3  PRO  39           2HB      PRO  39  11.660 -13.162   2.628
  277    HG2  PRO  39           1HG      PRO  39  12.984 -14.217   0.160
  278    HG3  PRO  39           2HG      PRO  39  12.566 -15.070   1.657
  279    HD2  PRO  39           1HD      PRO  39  11.057 -15.237  -0.585
  280    HD3  PRO  39           2HD      PRO  39  10.358 -15.323   1.044
  281    H    SER  40           H        SER  40  10.244  -9.980   0.111
  282    HA   SER  40           HA       SER  40  12.297  -9.718  -1.976
  283    HB2  SER  40           1HB      SER  40   9.946  -9.468  -2.711
  284    HB3  SER  40           2HB      SER  40   9.754  -8.117  -1.593
  285    HG   SER  40           HG       SER  40  11.481  -7.082  -2.773
  286    H    SER  41           H        SER  41  13.954  -8.398  -1.653
  287    HA   SER  41           HA       SER  41  14.517  -7.088   0.698
  288    HB2  SER  41           1HB      SER  41  16.089  -7.590  -1.250
  289    HB3  SER  41           2HB      SER  41  15.499  -6.097  -1.980
  290    HG   SER  41           HG       SER  41  16.359  -5.978   0.667
  291    H    GLY  42           H        GLY  42  13.007  -5.763   1.581
  292    HA2  GLY  42           1HA      GLY  42  12.743  -3.128   0.451
  293    HA3  GLY  42           2HA      GLY  42  11.244  -4.046   0.419
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1  -7.453  18.698  23.574
    2    HA2  GLY   1           1HA      GLY   1  -5.250  18.644  22.912
    3    HA3  GLY   1           2HA      GLY   1  -5.608  17.151  22.057
    4    H    SER   2           H        SER   2  -4.294  17.786  20.311
    5    HA   SER   2           HA       SER   2  -5.636  19.641  18.485
    6    HB2  SER   2           1HB      SER   2  -3.692  20.878  17.985
    7    HB3  SER   2           2HB      SER   2  -3.678  20.746  19.743
    8    HG   SER   2           HG       SER   2  -1.735  20.113  18.208
    9    H    SER   3           H        SER   3  -6.043  18.586  16.670
   10    HA   SER   3           HA       SER   3  -4.971  16.068  16.031
   11    HB2  SER   3           1HB      SER   3  -7.171  17.094  15.227
   12    HB3  SER   3           2HB      SER   3  -6.209  17.952  14.023
   13    HG   SER   3           HG       SER   3  -6.823  16.091  13.048
   14    H    GLY   4           H        GLY   4  -4.472  19.178  14.343
   15    HA2  GLY   4           1HA      GLY   4  -2.474  20.034  13.498
   16    HA3  GLY   4           2HA      GLY   4  -1.669  18.539  13.953
   17    H    SER   5           H        SER   5  -3.712  20.071  11.534
   18    HA   SER   5           HA       SER   5  -4.229  18.194   9.700
   19    HB2  SER   5           1HB      SER   5  -4.623  20.638   9.395
   20    HB3  SER   5           2HB      SER   5  -2.919  20.827   8.981
   21    HG   SER   5           HG       SER   5  -3.423  20.242   7.039
   22    H    SER   6           H        SER   6  -3.191  17.162   7.970
   23    HA   SER   6           HA       SER   6  -0.272  16.936   8.289
   24    HB2  SER   6           1HB      SER   6  -2.309  14.922   7.319
   25    HB3  SER   6           2HB      SER   6  -0.566  14.680   7.199
   26    HG   SER   6           HG       SER   6  -1.933  15.209   9.628
   27    H    GLY   7           H        GLY   7  -2.855  16.814   5.840
   28    HA2  GLY   7           1HA      GLY   7  -2.564  18.345   3.917
   29    HA3  GLY   7           2HA      GLY   7  -0.884  17.831   3.885
   30    H    GLY   8           H        GLY   8  -3.755  17.478   2.362
   31    HA2  GLY   8           1HA      GLY   8  -3.742  16.054   0.377
   32    HA3  GLY   8           2HA      GLY   8  -2.992  14.806   1.361
   33    H    GLU   9           H        GLU   9  -5.779  15.609  -0.097
   34    HA   GLU   9           HA       GLU   9  -7.781  15.168   1.807
   35    HB2  GLU   9           1HB      GLU   9  -7.733  14.613  -1.161
   36    HB3  GLU   9           2HB      GLU   9  -9.179  14.479  -0.170
   37    HG2  GLU   9           1HG      GLU   9  -7.559  16.998  -0.438
   38    HG3  GLU   9           2HG      GLU   9  -8.965  16.616  -1.430
   39    H    LYS  10           H        LYS  10  -6.068  12.887  -0.300
   40    HA   LYS  10           HA       LYS  10  -6.166  10.586  -0.407
   41    HB2  LYS  10           1HB      LYS  10  -5.769  11.050   2.556
   42    HB3  LYS  10           2HB      LYS  10  -5.408   9.554   1.703
   43    HG2  LYS  10           1HG      LYS  10  -3.568  10.448   0.635
   44    HG3  LYS  10           2HG      LYS  10  -4.133  12.109   0.831
   45    HD2  LYS  10           1HD      LYS  10  -3.397  10.415   3.197
   46    HD3  LYS  10           2HD      LYS  10  -2.176  11.315   2.295
   47    HE2  LYS  10           1HE      LYS  10  -3.360  13.393   2.729
   48    HE3  LYS  10           2HE      LYS  10  -4.637  12.512   3.567
   49    HZ1  LYS  10           3HZ      LYS  10  -3.399  13.090   5.348
   50    HZ2  LYS  10           1HZ      LYS  10  -1.957  13.205   4.471
   51    HZ3  LYS  10           2HZ      LYS  10  -2.539  11.690   4.945
   52    HA   PRO  11           HA       PRO  11 -10.568  10.408   1.330
   53    HB2  PRO  11           1HB      PRO  11 -11.868  10.417  -1.053
   54    HB3  PRO  11           2HB      PRO  11 -11.478  11.896  -0.166
   55    HG2  PRO  11           1HG      PRO  11 -10.051  10.643  -2.480
   56    HG3  PRO  11           2HG      PRO  11 -10.432  12.351  -2.192
   57    HD2  PRO  11           1HD      PRO  11  -7.979  11.306  -1.718
   58    HD3  PRO  11           2HD      PRO  11  -8.653  12.636  -0.754
   59    H    TYR  12           H        TYR  12  -8.392   8.610  -0.358
   60    HA   TYR  12           HA       TYR  12 -10.226   6.312  -0.571
   61    HB2  TYR  12           1HB      TYR  12  -7.698   6.882  -2.129
   62    HB3  TYR  12           2HB      TYR  12  -8.626   5.390  -2.237
   63    HD1  TYR  12           HD1      TYR  12  -8.754   9.036  -2.876
   64    HD2  TYR  12           HD2      TYR  12 -10.547   5.248  -3.610
   65    HE1  TYR  12           HE1      TYR  12 -10.162  10.047  -4.622
   66    HE2  TYR  12           HE2      TYR  12 -11.959   6.248  -5.359
   67    HH   TYR  12           HH       TYR  12 -11.396   9.335  -6.633
   68    HA   PRO  13           HA       PRO  13  -7.397   5.263   2.881
   69    HB2  PRO  13           1HB      PRO  13  -9.240   3.777   4.209
   70    HB3  PRO  13           2HB      PRO  13  -9.132   5.534   4.362
   71    HG2  PRO  13           1HG      PRO  13 -10.990   3.889   2.688
   72    HG3  PRO  13           2HG      PRO  13 -11.343   5.322   3.671
   73    HD2  PRO  13           1HD      PRO  13 -11.026   5.441   0.985
   74    HD3  PRO  13           2HD      PRO  13 -10.561   6.774   2.061
   75    H    CYS  14           H        CYS  14  -6.249   3.397   3.201
   76    HA   CYS  14           HA       CYS  14  -6.377   1.396   1.188
   77    HB2  CYS  14           1HB      CYS  14  -4.238   1.931   2.123
   78    HB3  CYS  14           2HB      CYS  14  -4.802   1.596   3.757
   79    H    GLU  15           H        GLU  15  -6.538  -0.944   1.634
   80    HA   GLU  15           HA       GLU  15  -8.776  -1.455   3.456
   81    HB2  GLU  15           1HB      GLU  15  -9.242  -2.130   1.211
   82    HB3  GLU  15           2HB      GLU  15  -7.704  -2.971   1.079
   83    HG2  GLU  15           1HG      GLU  15  -9.102  -4.734   1.407
   84    HG3  GLU  15           2HG      GLU  15  -8.660  -4.376   3.075
   85    H    ILE  16           H        ILE  16  -5.531  -2.571   2.652
   86    HA   ILE  16           HA       ILE  16  -5.451  -4.761   4.427
   87    HB   ILE  16           HB       ILE  16  -3.172  -3.064   3.402
   88   HG12  ILE  16          1HG1      ILE  16  -2.981  -5.339   2.011
   89   HG13  ILE  16          2HG1      ILE  16  -4.718  -5.359   2.300
   90   HG21  ILE  16          1HG2      ILE  16  -2.203  -5.596   3.868
   91   HG22  ILE  16          2HG2      ILE  16  -1.955  -4.187   4.898
   92   HG23  ILE  16          3HG2      ILE  16  -3.267  -5.314   5.246
   93   HD11  ILE  16          3HD1      ILE  16  -3.257  -3.917   0.350
   94   HD12  ILE  16          1HD1      ILE  16  -5.000  -3.966   0.613
   95   HD13  ILE  16          2HD1      ILE  16  -4.017  -2.758   1.440
   96    H    CYS  17           H        CYS  17  -3.589  -1.749   4.807
   97    HA   CYS  17           HA       CYS  17  -3.721  -2.085   7.705
   98    HB2  CYS  17           1HB      CYS  17  -1.992  -0.321   7.764
   99    HB3  CYS  17           2HB      CYS  17  -1.520  -1.677   6.746
  100    H    GLY  18           H        GLY  18  -4.369   0.409   5.249
  101    HA2  GLY  18           1HA      GLY  18  -6.660   1.460   5.706
  102    HA3  GLY  18           2HA      GLY  18  -5.953   1.869   7.262
  103    H    THR  19           H        THR  19  -3.304   2.312   5.909
  104    HA   THR  19           HA       THR  19  -3.187   5.005   5.783
  105    HB   THR  19           HB       THR  19  -1.667   3.020   4.093
  106    HG1  THR  19           HG1      THR  19  -1.216   2.921   6.304
  107   HG21  THR  19          3HG2      THR  19  -0.063   4.828   3.642
  108   HG22  THR  19          1HG2      THR  19  -1.146   5.977   4.426
  109   HG23  THR  19          2HG2      THR  19  -1.644   5.170   2.939
  110    H    ARG  20           H        ARG  20  -4.156   6.531   4.632
  111    HA   ARG  20           HA       ARG  20  -5.604   5.843   2.222
  112    HB2  ARG  20           1HB      ARG  20  -5.324   8.584   3.448
  113    HB3  ARG  20           2HB      ARG  20  -6.593   8.005   2.377
  114    HG2  ARG  20           1HG      ARG  20  -7.674   6.864   4.044
  115    HG3  ARG  20           2HG      ARG  20  -6.207   6.662   5.004
  116    HD2  ARG  20           1HD      ARG  20  -6.377   8.734   5.952
  117    HD3  ARG  20           2HD      ARG  20  -7.210   9.422   4.558
  118    HE   ARG  20           HE       ARG  20  -8.832   7.500   5.876
  119   HH11  ARG  20          1HH1      ARG  20  -7.662  10.770   6.118
  120   HH12  ARG  20          2HH1      ARG  20  -9.018  11.325   7.043
  121   HH21  ARG  20          1HH2      ARG  20 -10.622   8.218   7.094
  122   HH22  ARG  20          2HH2      ARG  20 -10.701   9.872   7.599
  123    H    PHE  21           H        PHE  21  -5.464   7.334   0.312
  124    HA   PHE  21           HA       PHE  21  -2.785   8.426  -0.123
  125    HB2  PHE  21           1HB      PHE  21  -4.106   6.303  -1.811
  126    HB3  PHE  21           2HB      PHE  21  -2.799   7.316  -2.417
  127    HD1  PHE  21           HD2      PHE  21  -3.641   4.989   0.359
  128    HD2  PHE  21           HD1      PHE  21  -0.600   6.677  -2.095
  129    HE1  PHE  21           HE2      PHE  21  -1.996   3.444   1.340
  130    HE2  PHE  21           HE1      PHE  21   1.049   5.134  -1.119
  131    HZ   PHE  21           HZ       PHE  21   0.352   3.516   0.602
  132    H    ARG  22           H        ARG  22  -2.774  10.264  -1.286
  133    HA   ARG  22           HA       ARG  22  -4.883  11.888  -1.647
  134    HB2  ARG  22           1HB      ARG  22  -3.631  13.051  -3.409
  135    HB3  ARG  22           2HB      ARG  22  -2.584  12.592  -2.073
  136    HG2  ARG  22           1HG      ARG  22  -1.683  10.759  -3.331
  137    HG3  ARG  22           2HG      ARG  22  -2.837  11.039  -4.638
  138    HD2  ARG  22           1HD      ARG  22  -1.778  12.994  -5.320
  139    HD3  ARG  22           2HD      ARG  22  -0.956  13.201  -3.773
  140    HE   ARG  22           HE       ARG  22  -0.105  11.559  -5.999
  141   HH11  ARG  22          1HH1      ARG  22   0.241  12.289  -2.612
  142   HH12  ARG  22          2HH1      ARG  22   1.824  11.596  -2.491
  143   HH21  ARG  22          1HH2      ARG  22   1.980  10.644  -5.852
  144   HH22  ARG  22          2HH2      ARG  22   2.813  10.662  -4.334
  145    H    HIS  23           H        HIS  23  -3.796   9.463  -3.994
  146    HA   HIS  23           HA       HIS  23  -6.379   9.772  -5.379
  147    HB2  HIS  23           1HB      HIS  23  -3.616   9.334  -6.459
  148    HB3  HIS  23           2HB      HIS  23  -5.011   8.747  -7.361
  149    HD2  HIS  23           HD2      HIS  23  -4.728  12.271  -5.591
  150    HE1  HIS  23           HE1      HIS  23  -5.398  12.813  -9.745
  151    HE2  HIS  23           HE2      HIS  23  -5.061  13.955  -7.526
  152    H    LEU  24           H        LEU  24  -7.124   7.785  -6.497
  153    HA   LEU  24           HA       LEU  24  -6.962   5.547  -4.698
  154    HB2  LEU  24           1HB      LEU  24  -9.067   6.232  -5.780
  155    HB3  LEU  24           2HB      LEU  24  -8.381   5.805  -7.346
  156    HG   LEU  24           HG       LEU  24  -9.963   4.120  -6.459
  157   HD11  LEU  24          1HD1      LEU  24  -7.644   3.729  -7.798
  158   HD12  LEU  24          2HD1      LEU  24  -8.825   2.463  -7.460
  159   HD13  LEU  24          3HD1      LEU  24  -7.416   2.657  -6.416
  160   HD21  LEU  24          3HD2      LEU  24  -9.854   3.369  -4.373
  161   HD22  LEU  24          1HD2      LEU  24  -8.569   4.538  -4.069
  162   HD23  LEU  24          2HD2      LEU  24  -8.166   2.898  -4.576
  163    H    GLN  25           H        GLN  25  -6.470   5.812  -8.225
  164    HA   GLN  25           HA       GLN  25  -5.443   3.442  -8.886
  165    HB2  GLN  25           1HB      GLN  25  -3.986   4.547 -10.525
  166    HB3  GLN  25           2HB      GLN  25  -5.577   5.295 -10.466
  167    HG2  GLN  25           1HG      GLN  25  -4.285   7.158 -10.494
  168    HG3  GLN  25           2HG      GLN  25  -4.378   6.898  -8.753
  169   HE21  GLN  25          1HE2      GLN  25  -2.373   8.402  -9.566
  170   HE22  GLN  25          2HE2      GLN  25  -0.869   7.554  -9.516
  171    H    THR  26           H        THR  26  -3.579   5.980  -7.249
  172    HA   THR  26           HA       THR  26  -1.128   4.628  -7.139
  173    HB   THR  26           HB       THR  26  -2.220   6.624  -5.145
  174    HG1  THR  26           HG1      THR  26  -1.901   8.021  -6.691
  175   HG21  THR  26          3HG2      THR  26  -0.339   6.157  -4.024
  176   HG22  THR  26          1HG2      THR  26   0.518   6.949  -5.346
  177   HG23  THR  26          2HG2      THR  26   0.310   5.198  -5.354
  178    H    LEU  27           H        LEU  27  -3.690   4.859  -4.670
  179    HA   LEU  27           HA       LEU  27  -2.576   3.314  -2.692
  180    HB2  LEU  27           1HB      LEU  27  -4.602   4.404  -2.224
  181    HB3  LEU  27           2HB      LEU  27  -5.421   3.644  -3.587
  182    HG   LEU  27           HG       LEU  27  -5.377   1.495  -2.398
  183   HD11  LEU  27          1HD1      LEU  27  -3.357   1.873  -1.073
  184   HD12  LEU  27          2HD1      LEU  27  -4.719   1.396  -0.060
  185   HD13  LEU  27          3HD1      LEU  27  -4.212   3.084  -0.116
  186   HD21  LEU  27          3HD2      LEU  27  -6.911   3.792  -1.756
  187   HD22  LEU  27          1HD2      LEU  27  -6.623   2.895  -0.265
  188   HD23  LEU  27          2HD2      LEU  27  -7.375   2.094  -1.645
  189    H    LYS  28           H        LYS  28  -4.589   2.171  -5.396
  190    HA   LYS  28           HA       LYS  28  -4.738  -0.497  -4.884
  191    HB2  LYS  28           1HB      LYS  28  -4.540   1.088  -7.394
  192    HB3  LYS  28           2HB      LYS  28  -4.356  -0.656  -7.522
  193    HG2  LYS  28           1HG      LYS  28  -6.522  -1.058  -6.733
  194    HG3  LYS  28           2HG      LYS  28  -6.687   0.581  -6.097
  195    HD2  LYS  28           1HD      LYS  28  -6.931   1.504  -8.245
  196    HD3  LYS  28           2HD      LYS  28  -6.319   0.048  -9.032
  197    HE2  LYS  28           1HE      LYS  28  -8.355  -1.135  -8.062
  198    HE3  LYS  28           2HE      LYS  28  -8.977   0.472  -7.692
  199    HZ1  LYS  28           3HZ      LYS  28  -9.812   0.398  -9.743
  200    HZ2  LYS  28           1HZ      LYS  28  -8.830  -0.897 -10.214
  201    HZ3  LYS  28           2HZ      LYS  28  -8.235   0.684 -10.285
  202    H    SER  29           H        SER  29  -1.940   1.278  -6.042
  203    HA   SER  29           HA       SER  29  -0.378  -1.097  -6.514
  204    HB2  SER  29           1HB      SER  29   0.125   1.851  -6.661
  205    HB3  SER  29           2HB      SER  29   1.501   0.750  -6.598
  206    HG   SER  29           HG       SER  29  -0.580   0.257  -8.415
  207    H    HIS  30           H        HIS  30  -0.797   1.239  -3.939
  208    HA   HIS  30           HA       HIS  30   1.463   0.680  -2.402
  209    HB2  HIS  30           1HB      HIS  30   0.337   2.513  -1.596
  210    HB3  HIS  30           2HB      HIS  30  -1.247   1.783  -1.839
  211    HD1  HIS  30           HD1      HIS  30   1.720   1.468   0.511
  212    HD2  HIS  30           HD2      HIS  30  -2.383   0.821   0.432
  213    HE1  HIS  30           HE1      HIS  30   1.094   0.833   2.863
  214    H    LEU  31           H        LEU  31  -1.346  -1.210  -2.998
  215    HA   LEU  31           HA       LEU  31  -1.245  -2.829  -0.658
  216    HB2  LEU  31           1HB      LEU  31  -2.352  -3.804  -3.254
  217    HB3  LEU  31           2HB      LEU  31  -2.932  -4.091  -1.615
  218    HG   LEU  31           HG       LEU  31  -3.336  -1.674  -3.351
  219   HD11  LEU  31          1HD1      LEU  31  -5.712  -2.112  -2.529
  220   HD12  LEU  31          2HD1      LEU  31  -5.103  -3.672  -1.977
  221   HD13  LEU  31          3HD1      LEU  31  -5.029  -3.253  -3.688
  222   HD21  LEU  31          3HD2      LEU  31  -2.679  -0.733  -1.269
  223   HD22  LEU  31          1HD2      LEU  31  -3.645  -1.899  -0.364
  224   HD23  LEU  31          2HD2      LEU  31  -4.440  -0.660  -1.336
  225    H    ARG  32           H        ARG  32   0.784  -2.597  -3.309
  226    HA   ARG  32           HA       ARG  32   1.477  -5.261  -3.827
  227    HB2  ARG  32           1HB      ARG  32   2.778  -2.616  -4.215
  228    HB3  ARG  32           2HB      ARG  32   3.806  -4.039  -4.312
  229    HG2  ARG  32           1HG      ARG  32   3.134  -3.590  -6.513
  230    HG3  ARG  32           2HG      ARG  32   2.147  -4.956  -5.989
  231    HD2  ARG  32           1HD      ARG  32   0.454  -3.099  -5.292
  232    HD3  ARG  32           2HD      ARG  32   1.368  -2.104  -6.425
  233    HE   ARG  32           HE       ARG  32   0.456  -3.291  -8.164
  234   HH11  ARG  32          1HH1      ARG  32  -0.159  -4.957  -5.170
  235   HH12  ARG  32          2HH1      ARG  32  -1.254  -6.098  -5.878
  236   HH21  ARG  32          1HH2      ARG  32  -0.983  -4.788  -9.109
  237   HH22  ARG  32          2HH2      ARG  32  -1.721  -6.002  -8.119
  238    H    ILE  33           H        ILE  33   2.854  -2.930  -1.526
  239    HA   ILE  33           HA       ILE  33   4.829  -4.663  -0.492
  240    HB   ILE  33           HB       ILE  33   5.153  -3.083   1.251
  241   HG12  ILE  33          1HG1      ILE  33   2.514  -1.799   0.533
  242   HG13  ILE  33          2HG1      ILE  33   2.707  -2.946   1.854
  243   HG21  ILE  33          1HG2      ILE  33   6.049  -2.033  -0.553
  244   HG22  ILE  33          2HG2      ILE  33   4.527  -2.023  -1.442
  245   HG23  ILE  33          3HG2      ILE  33   4.803  -0.851  -0.154
  246   HD11  ILE  33          3HD1      ILE  33   3.997  -0.242   1.597
  247   HD12  ILE  33          1HD1      ILE  33   2.741  -0.727   2.737
  248   HD13  ILE  33          2HD1      ILE  33   4.363  -1.407   2.869
  249    H    HIS  34           H        HIS  34   1.443  -4.486  -0.008
  250    HA   HIS  34           HA       HIS  34   1.434  -5.748   2.583
  251    HB2  HIS  34           1HB      HIS  34  -0.704  -5.015   0.597
  252    HB3  HIS  34           2HB      HIS  34  -1.072  -6.001   2.009
  253    HD1  HIS  34           HD1      HIS  34   0.512  -4.561   4.168
  254    HD2  HIS  34           HD2      HIS  34  -1.720  -2.593   1.268
  255    HE1  HIS  34           HE1      HIS  34  -0.008  -2.300   5.139
  256    H    THR  35           H        THR  35   0.375  -6.757  -0.671
  257    HA   THR  35           HA       THR  35   0.429  -9.546   0.198
  258    HB   THR  35           HB       THR  35  -1.553  -8.850  -1.030
  259    HG1  THR  35           HG1      THR  35  -0.960 -10.359  -3.012
  260   HG21  THR  35          3HG2      THR  35   0.377  -8.172  -3.252
  261   HG22  THR  35          1HG2      THR  35  -0.635  -7.041  -2.353
  262   HG23  THR  35          2HG2      THR  35  -1.377  -8.230  -3.424
  263    H    GLY  36           H        GLY  36   1.974 -10.952  -0.375
  264    HA2  GLY  36           1HA      GLY  36   3.522 -11.871  -1.958
  265    HA3  GLY  36           2HA      GLY  36   3.753 -10.256  -2.613
  266    H    SER  37           H        SER  37   4.585  -8.658  -0.827
  267    HA   SER  37           HA       SER  37   7.114  -9.722   0.030
  268    HB2  SER  37           1HB      SER  37   5.954  -6.978   0.560
  269    HB3  SER  37           2HB      SER  37   7.650  -7.448   0.668
  270    HG   SER  37           HG       SER  37   6.265  -7.820  -1.744
  271    H    GLY  38           H        GLY  38   7.939  -9.238   2.268
  272    HA2  GLY  38           1HA      GLY  38   6.345 -10.570   4.176
  273    HA3  GLY  38           2HA      GLY  38   7.835  -9.701   4.514
  274    HA   PRO  39           HA       PRO  39   3.866  -7.436   5.982
  275    HB2  PRO  39           1HB      PRO  39   3.736  -8.312   8.548
  276    HB3  PRO  39           2HB      PRO  39   2.882  -9.103   7.218
  277    HG2  PRO  39           1HG      PRO  39   5.473  -9.851   8.516
  278    HG3  PRO  39           2HG      PRO  39   4.127 -10.895   8.023
  279    HD2  PRO  39           1HD      PRO  39   6.379 -10.625   6.544
  280    HD3  PRO  39           2HD      PRO  39   4.786 -10.914   5.814
  281    H    SER  40           H        SER  40   7.105  -7.690   6.560
  282    HA   SER  40           HA       SER  40   8.671  -6.297   7.446
  283    HB2  SER  40           1HB      SER  40   6.348  -4.379   7.765
  284    HB3  SER  40           2HB      SER  40   8.058  -3.955   7.856
  285    HG   SER  40           HG       SER  40   6.753  -3.757   5.749
  286    H    SER  41           H        SER  41   7.669  -8.212   9.132
  287    HA   SER  41           HA       SER  41   7.251  -8.772  11.321
  288    HB2  SER  41           1HB      SER  41   9.721  -8.026  11.121
  289    HB3  SER  41           2HB      SER  41   9.204  -6.581  11.991
  290    HG   SER  41           HG       SER  41   9.407  -9.218  12.869
  291    H    GLY  42           H        GLY  42   5.270  -7.062  10.458
  292    HA2  GLY  42           1HA      GLY  42   4.116  -6.181  12.826
  293    HA3  GLY  42           2HA      GLY  42   4.917  -4.787  12.116
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1   8.810   4.921   6.680
    2    HA2  GLY   1           1HA      GLY   1   7.071   5.616   5.273
    3    HA3  GLY   1           2HA      GLY   1   6.140   6.081   6.689
    4    H    SER   2           H        SER   2   5.702   7.977   5.271
    5    HA   SER   2           HA       SER   2   7.906   9.913   5.237
    6    HB2  SER   2           1HB      SER   2   5.335   9.677   3.701
    7    HB3  SER   2           2HB      SER   2   6.162  11.230   3.817
    8    HG   SER   2           HG       SER   2   7.526   8.893   3.017
    9    H    SER   3           H        SER   3   7.912  11.669   6.503
   10    HA   SER   3           HA       SER   3   6.217  11.880   8.718
   11    HB2  SER   3           1HB      SER   3   8.557  12.876   8.395
   12    HB3  SER   3           2HB      SER   3   7.751  14.207   7.565
   13    HG   SER   3           HG       SER   3   7.280  14.981   9.448
   14    H    GLY   4           H        GLY   4   5.049  14.049   9.220
   15    HA2  GLY   4           1HA      GLY   4   2.666  14.229   8.013
   16    HA3  GLY   4           2HA      GLY   4   3.465  15.656   8.656
   17    H    SER   5           H        SER   5   1.657  15.477   6.397
   18    HA   SER   5           HA       SER   5   3.265  16.935   4.494
   19    HB2  SER   5           1HB      SER   5   3.687  14.770   3.588
   20    HB3  SER   5           2HB      SER   5   2.002  14.286   3.779
   21    HG   SER   5           HG       SER   5   3.100  16.133   1.940
   22    H    SER   6           H        SER   6   2.066  18.314   3.216
   23    HA   SER   6           HA       SER   6  -0.850  18.271   3.640
   24    HB2  SER   6           1HB      SER   6  -0.745  20.786   3.561
   25    HB3  SER   6           2HB      SER   6   0.018  20.068   4.979
   26    HG   SER   6           HG       SER   6   2.006  20.192   3.552
   27    H    GLY   7           H        GLY   7  -2.086  19.436   1.964
   28    HA2  GLY   7           1HA      GLY   7  -2.474  20.136  -0.223
   29    HA3  GLY   7           2HA      GLY   7  -0.766  19.912  -0.570
   30    H    GLY   8           H        GLY   8  -3.858  18.259  -0.214
   31    HA2  GLY   8           1HA      GLY   8  -4.299  16.702  -2.134
   32    HA3  GLY   8           2HA      GLY   8  -2.730  16.005  -1.757
   33    H    GLU   9           H        GLU   9  -6.044  16.378  -0.673
   34    HA   GLU   9           HA       GLU   9  -5.826  14.856   1.696
   35    HB2  GLU   9           1HB      GLU   9  -8.081  15.731  -0.057
   36    HB3  GLU   9           2HB      GLU   9  -8.387  14.500   1.159
   37    HG2  GLU   9           1HG      GLU   9  -8.954  16.577   2.125
   38    HG3  GLU   9           2HG      GLU   9  -7.433  16.072   2.859
   39    H    LYS  10           H        LYS  10  -6.391  12.705   2.124
   40    HA   LYS  10           HA       LYS  10  -6.137  10.922  -0.201
   41    HB2  LYS  10           1HB      LYS  10  -5.566  10.406   2.723
   42    HB3  LYS  10           2HB      LYS  10  -5.408   9.212   1.442
   43    HG2  LYS  10           1HG      LYS  10  -3.566  10.285   0.502
   44    HG3  LYS  10           2HG      LYS  10  -3.905  11.800   1.341
   45    HD2  LYS  10           1HD      LYS  10  -2.988  11.073   3.310
   46    HD3  LYS  10           2HD      LYS  10  -3.351   9.377   2.978
   47    HE2  LYS  10           1HE      LYS  10  -1.089   9.352   2.672
   48    HE3  LYS  10           2HE      LYS  10  -1.603   9.752   1.034
   49    HZ1  LYS  10           3HZ      LYS  10  -1.166  11.995   2.836
   50    HZ2  LYS  10           1HZ      LYS  10  -0.797  11.837   1.193
   51    HZ3  LYS  10           2HZ      LYS  10   0.216  11.144   2.357
   52    HA   PRO  11           HA       PRO  11 -10.522  10.462   1.285
   53    HB2  PRO  11           1HB      PRO  11 -11.624  10.542  -1.194
   54    HB3  PRO  11           2HB      PRO  11 -11.295  11.994  -0.242
   55    HG2  PRO  11           1HG      PRO  11  -9.695  10.783  -2.463
   56    HG3  PRO  11           2HG      PRO  11 -10.084  12.487  -2.165
   57    HD2  PRO  11           1HD      PRO  11  -7.687  11.405  -1.520
   58    HD3  PRO  11           2HD      PRO  11  -8.425  12.718  -0.581
   59    H    TYR  12           H        TYR  12  -8.232   8.679  -0.255
   60    HA   TYR  12           HA       TYR  12 -10.061   6.400  -0.645
   61    HB2  TYR  12           1HB      TYR  12  -7.459   7.006  -2.062
   62    HB3  TYR  12           2HB      TYR  12  -8.371   5.512  -2.246
   63    HD1  TYR  12           HD1      TYR  12  -8.446   9.157  -2.857
   64    HD2  TYR  12           HD2      TYR  12 -10.266   5.399  -3.675
   65    HE1  TYR  12           HE1      TYR  12  -9.772  10.196  -4.649
   66    HE2  TYR  12           HE2      TYR  12 -11.596   6.427  -5.471
   67    HH   TYR  12           HH       TYR  12 -12.437   8.928  -5.934
   68    HA   PRO  13           HA       PRO  13  -7.394   5.278   2.919
   69    HB2  PRO  13           1HB      PRO  13  -9.313   3.809   4.155
   70    HB3  PRO  13           2HB      PRO  13  -9.182   5.562   4.333
   71    HG2  PRO  13           1HG      PRO  13 -11.000   3.969   2.568
   72    HG3  PRO  13           2HG      PRO  13 -11.366   5.397   3.553
   73    HD2  PRO  13           1HD      PRO  13 -10.941   5.540   0.883
   74    HD3  PRO  13           2HD      PRO  13 -10.497   6.853   1.992
   75    H    CYS  14           H        CYS  14  -6.362   3.342   3.355
   76    HA   CYS  14           HA       CYS  14  -6.459   1.364   1.286
   77    HB2  CYS  14           1HB      CYS  14  -4.315   1.864   2.213
   78    HB3  CYS  14           2HB      CYS  14  -4.886   1.577   3.854
   79    H    GLU  15           H        GLU  15  -6.646  -0.972   1.747
   80    HA   GLU  15           HA       GLU  15  -8.894  -1.448   3.568
   81    HB2  GLU  15           1HB      GLU  15  -9.398  -2.134   1.347
   82    HB3  GLU  15           2HB      GLU  15  -7.852  -2.952   1.174
   83    HG2  GLU  15           1HG      GLU  15  -9.354  -4.687   1.468
   84    HG3  GLU  15           2HG      GLU  15  -8.663  -4.467   3.075
   85    H    ILE  16           H        ILE  16  -5.667  -2.615   2.759
   86    HA   ILE  16           HA       ILE  16  -5.630  -4.788   4.568
   87    HB   ILE  16           HB       ILE  16  -3.290  -3.194   3.514
   88   HG12  ILE  16          1HG1      ILE  16  -3.263  -5.455   2.069
   89   HG13  ILE  16          2HG1      ILE  16  -4.995  -5.337   2.356
   90   HG21  ILE  16          1HG2      ILE  16  -3.050  -4.781   5.560
   91   HG22  ILE  16          2HG2      ILE  16  -3.177  -6.059   4.352
   92   HG23  ILE  16          3HG2      ILE  16  -1.879  -4.870   4.244
   93   HD11  ILE  16          3HD1      ILE  16  -5.110  -3.957   0.636
   94   HD12  ILE  16          1HD1      ILE  16  -4.191  -2.781   1.576
   95   HD13  ILE  16          2HD1      ILE  16  -3.352  -3.900   0.501
   96    H    CYS  17           H        CYS  17  -3.635  -1.853   4.849
   97    HA   CYS  17           HA       CYS  17  -3.675  -2.128   7.745
   98    HB2  CYS  17           1HB      CYS  17  -1.966  -0.345   7.709
   99    HB3  CYS  17           2HB      CYS  17  -1.527  -1.703   6.678
  100    H    GLY  18           H        GLY  18  -4.465   0.339   5.304
  101    HA2  GLY  18           1HA      GLY  18  -6.734   1.380   5.830
  102    HA3  GLY  18           2HA      GLY  18  -5.997   1.775   7.376
  103    H    THR  19           H        THR  19  -3.382   2.251   5.955
  104    HA   THR  19           HA       THR  19  -3.298   4.952   5.862
  105    HB   THR  19           HB       THR  19  -1.768   2.940   4.232
  106    HG1  THR  19           HG1      THR  19  -1.561   3.654   6.666
  107   HG21  THR  19          3HG2      THR  19  -1.597   5.939   4.119
  108   HG22  THR  19          1HG2      THR  19  -1.676   4.788   2.785
  109   HG23  THR  19          2HG2      THR  19  -0.207   4.917   3.753
  110    H    ARG  20           H        ARG  20  -4.046   6.552   4.618
  111    HA   ARG  20           HA       ARG  20  -5.603   5.845   2.254
  112    HB2  ARG  20           1HB      ARG  20  -5.353   8.580   3.496
  113    HB3  ARG  20           2HB      ARG  20  -6.628   7.980   2.443
  114    HG2  ARG  20           1HG      ARG  20  -7.692   6.875   4.124
  115    HG3  ARG  20           2HG      ARG  20  -6.205   6.595   5.031
  116    HD2  ARG  20           1HD      ARG  20  -6.239   8.693   5.991
  117    HD3  ARG  20           2HD      ARG  20  -7.224   9.381   4.700
  118    HE   ARG  20           HE       ARG  20  -8.600   7.391   6.242
  119   HH11  ARG  20          1HH1      ARG  20  -7.716  10.753   6.066
  120   HH12  ARG  20          2HH1      ARG  20  -9.037  11.287   7.052
  121   HH21  ARG  20          1HH2      ARG  20 -10.343   8.080   7.541
  122   HH22  ARG  20          2HH2      ARG  20 -10.531   9.765   7.891
  123    H    PHE  21           H        PHE  21  -5.429   7.160   0.299
  124    HA   PHE  21           HA       PHE  21  -2.767   8.334  -0.107
  125    HB2  PHE  21           1HB      PHE  21  -4.122   6.250  -1.816
  126    HB3  PHE  21           2HB      PHE  21  -2.812   7.260  -2.419
  127    HD1  PHE  21           HD2      PHE  21  -3.662   4.856   0.281
  128    HD2  PHE  21           HD1      PHE  21  -0.602   6.639  -2.080
  129    HE1  PHE  21           HE2      PHE  21  -2.022   3.282   1.223
  130    HE2  PHE  21           HE1      PHE  21   1.042   5.067  -1.143
  131    HZ   PHE  21           HZ       PHE  21   0.334   3.387   0.512
  132    H    ARG  22           H        ARG  22  -2.663  10.040  -1.541
  133    HA   ARG  22           HA       ARG  22  -4.763  11.769  -1.765
  134    HB2  ARG  22           1HB      ARG  22  -3.526  12.825  -3.649
  135    HB3  ARG  22           2HB      ARG  22  -2.515  12.483  -2.251
  136    HG2  ARG  22           1HG      ARG  22  -1.999  10.268  -3.548
  137    HG3  ARG  22           2HG      ARG  22  -2.523  11.215  -4.943
  138    HD2  ARG  22           1HD      ARG  22  -0.852  12.887  -4.500
  139    HD3  ARG  22           2HD      ARG  22  -0.402  12.095  -2.990
  140    HE   ARG  22           HE       ARG  22  -0.107  10.360  -5.232
  141   HH11  ARG  22          1HH1      ARG  22   1.393  12.987  -3.509
  142   HH12  ARG  22          2HH1      ARG  22   2.998  12.576  -4.016
  143   HH21  ARG  22          1HH2      ARG  22   2.001   9.809  -5.907
  144   HH22  ARG  22          2HH2      ARG  22   3.343  10.768  -5.381
  145    H    HIS  23           H        HIS  23  -3.672   9.539  -4.325
  146    HA   HIS  23           HA       HIS  23  -6.333   9.800  -5.560
  147    HB2  HIS  23           1HB      HIS  23  -3.598   9.495  -6.699
  148    HB3  HIS  23           2HB      HIS  23  -4.931   8.733  -7.560
  149    HD2  HIS  23           HD2      HIS  23  -5.366  12.257  -5.904
  150    HE1  HIS  23           HE1      HIS  23  -5.477  12.695 -10.123
  151    HE2  HIS  23           HE2      HIS  23  -5.689  13.866  -7.903
  152    H    LEU  24           H        LEU  24  -7.085   7.828  -6.731
  153    HA   LEU  24           HA       LEU  24  -6.939   5.567  -4.966
  154    HB2  LEU  24           1HB      LEU  24  -9.024   6.281  -6.088
  155    HB3  LEU  24           2HB      LEU  24  -8.312   5.831  -7.637
  156    HG   LEU  24           HG       LEU  24  -9.939   4.180  -6.716
  157   HD11  LEU  24          1HD1      LEU  24  -7.784   3.742  -8.192
  158   HD12  LEU  24          2HD1      LEU  24  -8.819   2.428  -7.637
  159   HD13  LEU  24          3HD1      LEU  24  -7.319   2.790  -6.782
  160   HD21  LEU  24          3HD2      LEU  24  -8.567   4.587  -4.347
  161   HD22  LEU  24          1HD2      LEU  24  -8.051   2.983  -4.870
  162   HD23  LEU  24          2HD2      LEU  24  -9.768   3.333  -4.663
  163    H    GLN  25           H        GLN  25  -6.389   5.876  -8.480
  164    HA   GLN  25           HA       GLN  25  -5.360   3.519  -9.166
  165    HB2  GLN  25           1HB      GLN  25  -3.817   4.668 -10.723
  166    HB3  GLN  25           2HB      GLN  25  -5.433   5.361 -10.734
  167    HG2  GLN  25           1HG      GLN  25  -4.698   7.212  -9.380
  168    HG3  GLN  25           2HG      GLN  25  -3.098   6.492  -9.211
  169   HE21  GLN  25          1HE2      GLN  25  -2.128   8.326 -10.099
  170   HE22  GLN  25          2HE2      GLN  25  -2.195   8.664 -11.791
  171    H    THR  26           H        THR  26  -3.675   5.910  -7.208
  172    HA   THR  26           HA       THR  26  -1.192   4.515  -7.126
  173    HB   THR  26           HB       THR  26  -2.265   6.596  -5.211
  174    HG1  THR  26           HG1      THR  26  -1.993   7.155  -7.535
  175   HG21  THR  26          3HG2      THR  26   0.582   6.593  -5.515
  176   HG22  THR  26          1HG2      THR  26   0.044   4.978  -5.057
  177   HG23  THR  26          2HG2      THR  26  -0.377   6.366  -4.052
  178    H    LEU  27           H        LEU  27  -3.879   4.832  -4.814
  179    HA   LEU  27           HA       LEU  27  -2.908   3.353  -2.718
  180    HB2  LEU  27           1HB      LEU  27  -4.983   4.454  -2.475
  181    HB3  LEU  27           2HB      LEU  27  -5.689   3.580  -3.832
  182    HG   LEU  27           HG       LEU  27  -5.801   1.555  -2.539
  183   HD11  LEU  27          1HD1      LEU  27  -4.456   3.114  -0.337
  184   HD12  LEU  27          2HD1      LEU  27  -3.738   1.802  -1.271
  185   HD13  LEU  27          3HD1      LEU  27  -5.100   1.478  -0.199
  186   HD21  LEU  27          3HD2      LEU  27  -7.763   2.419  -1.928
  187   HD22  LEU  27          1HD2      LEU  27  -7.074   4.027  -1.705
  188   HD23  LEU  27          2HD2      LEU  27  -6.987   2.843  -0.401
  189    H    LYS  28           H        LYS  28  -4.567   2.139  -5.612
  190    HA   LYS  28           HA       LYS  28  -4.673  -0.556  -4.944
  191    HB2  LYS  28           1HB      LYS  28  -4.497   0.895  -7.567
  192    HB3  LYS  28           2HB      LYS  28  -4.498  -0.863  -7.518
  193    HG2  LYS  28           1HG      LYS  28  -6.664  -0.957  -6.654
  194    HG3  LYS  28           2HG      LYS  28  -6.636   0.737  -6.158
  195    HD2  LYS  28           1HD      LYS  28  -6.851   1.498  -8.375
  196    HD3  LYS  28           2HD      LYS  28  -6.438  -0.083  -9.044
  197    HE2  LYS  28           1HE      LYS  28  -8.885   0.344  -7.354
  198    HE3  LYS  28           2HE      LYS  28  -8.895   0.621  -9.095
  199    HZ1  LYS  28           3HZ      LYS  28  -8.971  -1.553  -9.492
  200    HZ2  LYS  28           1HZ      LYS  28  -9.342  -1.758  -7.854
  201    HZ3  LYS  28           2HZ      LYS  28  -7.742  -1.902  -8.384
  202    H    SER  29           H        SER  29  -1.997   1.386  -6.035
  203    HA   SER  29           HA       SER  29  -0.310  -0.901  -6.588
  204    HB2  SER  29           1HB      SER  29   0.358   2.051  -6.473
  205    HB3  SER  29           2HB      SER  29   1.432   0.779  -7.056
  206    HG   SER  29           HG       SER  29   0.225   1.925  -8.713
  207    H    HIS  30           H        HIS  30  -1.188   0.946  -3.879
  208    HA   HIS  30           HA       HIS  30   1.253   0.647  -2.401
  209    HB2  HIS  30           1HB      HIS  30   0.061   2.459  -1.614
  210    HB3  HIS  30           2HB      HIS  30  -1.495   1.658  -1.814
  211    HD1  HIS  30           HD1      HIS  30   1.572   1.220   0.408
  212    HD2  HIS  30           HD2      HIS  30  -2.572   0.947   0.552
  213    HE1  HIS  30           HE1      HIS  30   1.018   0.652   2.794
  214    H    LEU  31           H        LEU  31  -1.554  -1.276  -2.969
  215    HA   LEU  31           HA       LEU  31  -1.348  -2.925  -0.651
  216    HB2  LEU  31           1HB      LEU  31  -2.574  -3.920  -3.173
  217    HB3  LEU  31           2HB      LEU  31  -3.110  -4.121  -1.506
  218    HG   LEU  31           HG       LEU  31  -3.496  -1.755  -3.319
  219   HD11  LEU  31          1HD1      LEU  31  -5.867  -2.113  -2.558
  220   HD12  LEU  31          2HD1      LEU  31  -5.323  -3.623  -1.828
  221   HD13  LEU  31          3HD1      LEU  31  -5.192  -3.389  -3.571
  222   HD21  LEU  31          3HD2      LEU  31  -2.874  -0.685  -1.340
  223   HD22  LEU  31          1HD2      LEU  31  -3.645  -1.905  -0.327
  224   HD23  LEU  31          2HD2      LEU  31  -4.634  -0.767  -1.242
  225    H    ARG  32           H        ARG  32   0.702  -2.573  -3.183
  226    HA   ARG  32           HA       ARG  32   1.331  -5.289  -3.786
  227    HB2  ARG  32           1HB      ARG  32   2.561  -2.632  -4.354
  228    HB3  ARG  32           2HB      ARG  32   3.560  -4.066  -4.543
  229    HG2  ARG  32           1HG      ARG  32   2.551  -3.428  -6.652
  230    HG3  ARG  32           2HG      ARG  32   1.938  -4.993  -6.115
  231    HD2  ARG  32           1HD      ARG  32  -0.127  -4.060  -5.442
  232    HD3  ARG  32           2HD      ARG  32   0.495  -2.415  -5.563
  233    HE   ARG  32           HE       ARG  32  -0.642  -3.962  -7.657
  234   HH11  ARG  32          1HH1      ARG  32   1.804  -1.577  -6.986
  235   HH12  ARG  32          2HH1      ARG  32   1.781  -0.913  -8.586
  236   HH21  ARG  32          1HH2      ARG  32  -0.682  -3.096  -9.767
  237   HH22  ARG  32          2HH2      ARG  32   0.366  -1.777 -10.167
  238    H    ILE  33           H        ILE  33   2.590  -2.891  -1.528
  239    HA   ILE  33           HA       ILE  33   4.779  -4.497  -0.642
  240    HB   ILE  33           HB       ILE  33   5.129  -2.855   1.062
  241   HG12  ILE  33          1HG1      ILE  33   2.543  -1.489   0.360
  242   HG13  ILE  33          2HG1      ILE  33   2.594  -2.754   1.583
  243   HG21  ILE  33          1HG2      ILE  33   4.497  -1.997  -1.680
  244   HG22  ILE  33          2HG2      ILE  33   4.621  -0.703  -0.489
  245   HG23  ILE  33          3HG2      ILE  33   5.976  -1.803  -0.740
  246   HD11  ILE  33          3HD1      ILE  33   4.674  -0.976   2.200
  247   HD12  ILE  33          1HD1      ILE  33   3.265   0.010   1.809
  248   HD13  ILE  33          2HD1      ILE  33   3.158  -1.221   3.068
  249    H    HIS  34           H        HIS  34   1.440  -4.525  -0.016
  250    HA   HIS  34           HA       HIS  34   1.607  -5.620   2.646
  251    HB2  HIS  34           1HB      HIS  34  -0.642  -5.165   0.701
  252    HB3  HIS  34           2HB      HIS  34  -0.890  -6.088   2.180
  253    HD1  HIS  34           HD1      HIS  34   0.667  -4.401   4.183
  254    HD2  HIS  34           HD2      HIS  34  -1.831  -2.795   1.278
  255    HE1  HIS  34           HE1      HIS  34   0.007  -2.133   5.044
  256    H    THR  35           H        THR  35   0.942  -6.850  -0.608
  257    HA   THR  35           HA       THR  35   1.234  -9.587   0.447
  258    HB   THR  35           HB       THR  35  -0.982  -9.261  -0.484
  259    HG1  THR  35           HG1      THR  35   0.743 -10.784  -2.168
  260   HG21  THR  35          3HG2      THR  35  -1.398  -8.547  -2.715
  261   HG22  THR  35          1HG2      THR  35   0.315  -8.608  -3.126
  262   HG23  THR  35          2HG2      THR  35  -0.282  -7.376  -2.014
  263    H    GLY  36           H        GLY  36   2.866 -10.803  -0.291
  264    HA2  GLY  36           1HA      GLY  36   4.020 -10.371  -2.902
  265    HA3  GLY  36           2HA      GLY  36   5.070  -9.890  -1.577
  266    H    SER  37           H        SER  37   5.646 -11.928  -3.466
  267    HA   SER  37           HA       SER  37   5.200 -14.461  -2.125
  268    HB2  SER  37           1HB      SER  37   6.258 -15.474  -4.030
  269    HB3  SER  37           2HB      SER  37   5.182 -14.214  -4.633
  270    HG   SER  37           HG       SER  37   7.217 -14.111  -5.644
  271    H    GLY  38           H        GLY  38   6.373 -14.812  -0.344
  272    HA2  GLY  38           1HA      GLY  38   8.536 -15.645   0.411
  273    HA3  GLY  38           2HA      GLY  38   9.286 -14.364  -0.530
  274    HA   PRO  39           HA       PRO  39   9.537 -12.011   3.174
  275    HB2  PRO  39           1HB      PRO  39   9.841  -9.541   2.090
  276    HB3  PRO  39           2HB      PRO  39  11.126 -10.755   2.090
  277    HG2  PRO  39           1HG      PRO  39   9.228 -10.006  -0.101
  278    HG3  PRO  39           2HG      PRO  39  10.969 -10.331  -0.191
  279    HD2  PRO  39           1HD      PRO  39   9.106 -12.164  -0.899
  280    HD3  PRO  39           2HD      PRO  39  10.670 -12.616  -0.191
  281    H    SER  40           H        SER  40   8.100 -11.125   4.537
  282    HA   SER  40           HA       SER  40   5.659  -9.939   3.388
  283    HB2  SER  40           1HB      SER  40   5.061 -12.007   4.443
  284    HB3  SER  40           2HB      SER  40   6.011 -11.617   5.877
  285    HG   SER  40           HG       SER  40   4.540 -10.017   6.389
  286    H    SER  41           H        SER  41   7.454  -9.999   6.472
  287    HA   SER  41           HA       SER  41   6.543  -7.384   7.198
  288    HB2  SER  41           1HB      SER  41   7.997  -7.640   9.150
  289    HB3  SER  41           2HB      SER  41   7.060  -9.112   8.889
  290    HG   SER  41           HG       SER  41   9.348  -9.429   9.321
  291    H    GLY  42           H        GLY  42   7.317  -5.535   6.443
  292    HA2  GLY  42           1HA      GLY  42  10.196  -5.282   5.961
  293    HA3  GLY  42           2HA      GLY  42   9.109  -4.932   4.625
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1  12.855  17.826   5.148
    2    HA2  GLY   1           1HA      GLY   1  13.210  15.546   4.243
    3    HA3  GLY   1           2HA      GLY   1  12.562  14.949   5.763
    4    H    SER   2           H        SER   2  10.992  13.764   4.570
    5    HA   SER   2           HA       SER   2   8.909  15.404   3.297
    6    HB2  SER   2           1HB      SER   2   9.839  13.642   1.867
    7    HB3  SER   2           2HB      SER   2   9.432  12.428   3.080
    8    HG   SER   2           HG       SER   2   7.373  14.078   2.194
    9    H    SER   3           H        SER   3   7.741  16.059   5.074
   10    HA   SER   3           HA       SER   3   5.926  14.121   6.169
   11    HB2  SER   3           1HB      SER   3   8.077  15.346   7.881
   12    HB3  SER   3           2HB      SER   3   6.532  14.856   8.576
   13    HG   SER   3           HG       SER   3   7.175  12.865   8.489
   14    H    GLY   4           H        GLY   4   4.122  15.069   7.195
   15    HA2  GLY   4           1HA      GLY   4   3.409  17.340   8.190
   16    HA3  GLY   4           2HA      GLY   4   3.846  17.937   6.596
   17    H    SER   5           H        SER   5   1.268  17.356   8.353
   18    HA   SER   5           HA       SER   5  -0.286  16.026   6.248
   19    HB2  SER   5           1HB      SER   5  -0.337  15.368   8.785
   20    HB3  SER   5           2HB      SER   5  -1.418  16.754   8.930
   21    HG   SER   5           HG       SER   5  -1.763  14.416   7.374
   22    H    SER   6           H        SER   6   0.547  18.599   5.666
   23    HA   SER   6           HA       SER   6  -1.963  20.129   5.884
   24    HB2  SER   6           1HB      SER   6  -0.600  22.186   5.715
   25    HB3  SER   6           2HB      SER   6  -0.172  21.231   7.134
   26    HG   SER   6           HG       SER   6   1.337  21.900   4.957
   27    H    GLY   7           H        GLY   7  -2.981  19.840   3.995
   28    HA2  GLY   7           1HA      GLY   7  -3.113  20.784   1.739
   29    HA3  GLY   7           2HA      GLY   7  -1.424  20.342   1.534
   30    H    GLY   8           H        GLY   8  -3.791  19.626  -0.071
   31    HA2  GLY   8           1HA      GLY   8  -4.424  17.781  -1.293
   32    HA3  GLY   8           2HA      GLY   8  -3.148  16.883  -0.484
   33    H    GLU   9           H        GLU   9  -5.083  15.303  -0.827
   34    HA   GLU   9           HA       GLU   9  -6.201  14.842   1.769
   35    HB2  GLU   9           1HB      GLU   9  -8.584  14.679   0.712
   36    HB3  GLU   9           2HB      GLU   9  -7.976  16.234   1.263
   37    HG2  GLU   9           1HG      GLU   9  -7.283  16.726  -1.068
   38    HG3  GLU   9           2HG      GLU   9  -8.061  15.225  -1.569
   39    H    LYS  10           H        LYS  10  -6.501  12.715   2.099
   40    HA   LYS  10           HA       LYS  10  -6.229  10.946  -0.236
   41    HB2  LYS  10           1HB      LYS  10  -5.704  10.327   2.677
   42    HB3  LYS  10           2HB      LYS  10  -5.394   9.259   1.315
   43    HG2  LYS  10           1HG      LYS  10  -3.557  10.456   0.617
   44    HG3  LYS  10           2HG      LYS  10  -4.096  11.943   1.402
   45    HD2  LYS  10           1HD      LYS  10  -3.481   9.592   3.118
   46    HD3  LYS  10           2HD      LYS  10  -2.131  10.472   2.397
   47    HE2  LYS  10           1HE      LYS  10  -2.356  11.657   4.331
   48    HE3  LYS  10           2HE      LYS  10  -3.480  12.557   3.313
   49    HZ1  LYS  10           3HZ      LYS  10  -5.145  12.015   4.648
   50    HZ2  LYS  10           1HZ      LYS  10  -4.033  11.320   5.716
   51    HZ3  LYS  10           2HZ      LYS  10  -4.787  10.365   4.542
   52    HA   PRO  11           HA       PRO  11 -10.604  10.418   1.246
   53    HB2  PRO  11           1HB      PRO  11 -11.700  10.460  -1.237
   54    HB3  PRO  11           2HB      PRO  11 -11.396  11.925  -0.296
   55    HG2  PRO  11           1HG      PRO  11  -9.771  10.720  -2.503
   56    HG3  PRO  11           2HG      PRO  11 -10.187  12.420  -2.220
   57    HD2  PRO  11           1HD      PRO  11  -7.776  11.380  -1.560
   58    HD3  PRO  11           2HD      PRO  11  -8.536  12.690  -0.634
   59    H    TYR  12           H        TYR  12  -8.281   8.656  -0.267
   60    HA   TYR  12           HA       TYR  12 -10.075   6.348  -0.650
   61    HB2  TYR  12           1HB      TYR  12  -7.475   6.989  -2.055
   62    HB3  TYR  12           2HB      TYR  12  -8.347   5.470  -2.224
   63    HD1  TYR  12           HD1      TYR  12  -8.517   9.104  -2.881
   64    HD2  TYR  12           HD2      TYR  12 -10.223   5.287  -3.669
   65    HE1  TYR  12           HE1      TYR  12  -9.856  10.084  -4.696
   66    HE2  TYR  12           HE2      TYR  12 -11.565   6.256  -5.488
   67    HH   TYR  12           HH       TYR  12 -11.175   9.626  -6.466
   68    HA   PRO  13           HA       PRO  13  -7.404   5.311   2.944
   69    HB2  PRO  13           1HB      PRO  13  -9.321   3.871   4.215
   70    HB3  PRO  13           2HB      PRO  13  -9.187   5.627   4.357
   71    HG2  PRO  13           1HG      PRO  13 -11.013   4.000   2.630
   72    HG3  PRO  13           2HG      PRO  13 -11.374   5.449   3.588
   73    HD2  PRO  13           1HD      PRO  13 -10.957   5.536   0.914
   74    HD3  PRO  13           2HD      PRO  13 -10.508   6.871   1.994
   75    H    CYS  14           H        CYS  14  -6.237   3.474   3.219
   76    HA   CYS  14           HA       CYS  14  -6.374   1.438   1.255
   77    HB2  CYS  14           1HB      CYS  14  -4.240   1.944   2.195
   78    HB3  CYS  14           2HB      CYS  14  -4.825   1.679   3.835
   79    H    GLU  15           H        GLU  15  -6.560  -0.895   1.728
   80    HA   GLU  15           HA       GLU  15  -8.815  -1.366   3.545
   81    HB2  GLU  15           1HB      GLU  15  -9.451  -2.122   1.444
   82    HB3  GLU  15           2HB      GLU  15  -7.839  -2.705   1.053
   83    HG2  GLU  15           1HG      GLU  15  -8.125  -4.679   2.185
   84    HG3  GLU  15           2HG      GLU  15  -9.353  -4.011   3.258
   85    H    ILE  16           H        ILE  16  -5.591  -2.533   2.726
   86    HA   ILE  16           HA       ILE  16  -5.553  -4.720   4.517
   87    HB   ILE  16           HB       ILE  16  -3.212  -3.114   3.487
   88   HG12  ILE  16          1HG1      ILE  16  -3.172  -5.338   2.001
   89   HG13  ILE  16          2HG1      ILE  16  -4.904  -5.256   2.301
   90   HG21  ILE  16          1HG2      ILE  16  -2.066  -5.387   3.842
   91   HG22  ILE  16          2HG2      ILE  16  -2.382  -4.381   5.255
   92   HG23  ILE  16          3HG2      ILE  16  -3.434  -5.749   4.895
   93   HD11  ILE  16          3HD1      ILE  16  -5.095  -3.790   0.665
   94   HD12  ILE  16          1HD1      ILE  16  -4.058  -2.671   1.549
   95   HD13  ILE  16          2HD1      ILE  16  -3.350  -3.820   0.412
   96    H    CYS  17           H        CYS  17  -3.577  -1.774   4.826
   97    HA   CYS  17           HA       CYS  17  -3.616  -2.080   7.720
   98    HB2  CYS  17           1HB      CYS  17  -1.928  -0.256   7.687
   99    HB3  CYS  17           2HB      CYS  17  -1.463  -1.639   6.701
  100    H    GLY  18           H        GLY  18  -4.399   0.416   5.306
  101    HA2  GLY  18           1HA      GLY  18  -6.680   1.438   5.844
  102    HA3  GLY  18           2HA      GLY  18  -5.937   1.829   7.388
  103    H    THR  19           H        THR  19  -3.339   2.275   5.848
  104    HA   THR  19           HA       THR  19  -3.235   4.987   5.810
  105    HB   THR  19           HB       THR  19  -1.789   3.052   4.000
  106    HG1  THR  19           HG1      THR  19  -0.487   2.898   5.661
  107   HG21  THR  19          3HG2      THR  19  -0.148   5.062   3.851
  108   HG22  THR  19          1HG2      THR  19  -1.570   6.031   4.234
  109   HG23  THR  19          2HG2      THR  19  -1.554   5.020   2.789
  110    H    ARG  20           H        ARG  20  -3.990   6.611   4.598
  111    HA   ARG  20           HA       ARG  20  -5.625   5.942   2.274
  112    HB2  ARG  20           1HB      ARG  20  -5.320   8.621   3.637
  113    HB3  ARG  20           2HB      ARG  20  -6.568   8.148   2.491
  114    HG2  ARG  20           1HG      ARG  20  -7.746   6.970   4.042
  115    HG3  ARG  20           2HG      ARG  20  -6.311   6.564   4.985
  116    HD2  ARG  20           1HD      ARG  20  -6.311   8.580   6.103
  117    HD3  ARG  20           2HD      ARG  20  -7.197   9.408   4.822
  118    HE   ARG  20           HE       ARG  20  -9.036   7.692   5.717
  119   HH11  ARG  20          1HH1      ARG  20  -6.884   9.839   7.413
  120   HH12  ARG  20          2HH1      ARG  20  -7.965  10.081   8.746
  121   HH21  ARG  20          1HH2      ARG  20 -10.468   8.002   7.466
  122   HH22  ARG  20          2HH2      ARG  20 -10.003   9.035   8.775
  123    H    PHE  21           H        PHE  21  -5.408   7.021   0.269
  124    HA   PHE  21           HA       PHE  21  -2.799   8.310  -0.171
  125    HB2  PHE  21           1HB      PHE  21  -4.137   6.175  -1.832
  126    HB3  PHE  21           2HB      PHE  21  -2.840   7.189  -2.457
  127    HD1  PHE  21           HD2      PHE  21  -3.654   4.823   0.288
  128    HD2  PHE  21           HD1      PHE  21  -0.623   6.600  -2.115
  129    HE1  PHE  21           HE2      PHE  21  -1.994   3.284   1.251
  130    HE2  PHE  21           HE1      PHE  21   1.043   5.063  -1.156
  131    HZ   PHE  21           HZ       PHE  21   0.358   3.403   0.530
  132    H    ARG  22           H        ARG  22  -2.786  10.091  -1.450
  133    HA   ARG  22           HA       ARG  22  -4.897  11.739  -1.741
  134    HB2  ARG  22           1HB      ARG  22  -2.411  12.091  -2.374
  135    HB3  ARG  22           2HB      ARG  22  -2.898  11.557  -3.977
  136    HG2  ARG  22           1HG      ARG  22  -4.571  13.375  -4.033
  137    HG3  ARG  22           2HG      ARG  22  -3.964  13.937  -2.474
  138    HD2  ARG  22           1HD      ARG  22  -2.977  15.229  -4.272
  139    HD3  ARG  22           2HD      ARG  22  -1.742  14.255  -3.474
  140    HE   ARG  22           HE       ARG  22  -2.539  12.705  -5.554
  141   HH11  ARG  22          1HH1      ARG  22  -1.402  15.984  -5.274
  142   HH12  ARG  22          2HH1      ARG  22  -0.674  16.003  -6.846
  143   HH21  ARG  22          1HH2      ARG  22  -1.584  12.719  -7.626
  144   HH22  ARG  22          2HH2      ARG  22  -0.779  14.146  -8.183
  145    H    HIS  23           H        HIS  23  -3.836   9.435  -4.242
  146    HA   HIS  23           HA       HIS  23  -6.548   9.582  -5.387
  147    HB2  HIS  23           1HB      HIS  23  -3.864   9.509  -6.708
  148    HB3  HIS  23           2HB      HIS  23  -5.240   8.775  -7.527
  149    HD2  HIS  23           HD2      HIS  23  -4.972  12.299  -5.721
  150    HE1  HIS  23           HE1      HIS  23  -6.559  12.791  -9.625
  151    HE2  HIS  23           HE2      HIS  23  -5.835  13.954  -7.512
  152    H    LEU  24           H        LEU  24  -7.297   7.617  -6.451
  153    HA   LEU  24           HA       LEU  24  -6.803   5.313  -4.846
  154    HB2  LEU  24           1HB      LEU  24  -8.992   5.927  -5.896
  155    HB3  LEU  24           2HB      LEU  24  -8.309   5.458  -7.451
  156    HG   LEU  24           HG       LEU  24  -8.272   3.187  -6.879
  157   HD11  LEU  24          1HD1      LEU  24  -9.072   2.658  -4.396
  158   HD12  LEU  24          2HD1      LEU  24  -8.285   4.208  -4.100
  159   HD13  LEU  24          3HD1      LEU  24  -7.374   2.880  -4.819
  160   HD21  LEU  24          3HD2      LEU  24 -10.749   4.456  -5.724
  161   HD22  LEU  24          1HD2      LEU  24 -10.578   2.729  -6.042
  162   HD23  LEU  24          2HD2      LEU  24 -10.505   3.883  -7.374
  163    H    GLN  25           H        GLN  25  -6.334   5.929  -8.330
  164    HA   GLN  25           HA       GLN  25  -5.193   3.665  -9.204
  165    HB2  GLN  25           1HB      GLN  25  -3.740   5.048 -10.689
  166    HB3  GLN  25           2HB      GLN  25  -5.426   5.548 -10.676
  167    HG2  GLN  25           1HG      GLN  25  -4.983   7.499  -9.547
  168    HG3  GLN  25           2HG      GLN  25  -3.496   6.875  -8.835
  169   HE21  GLN  25          1HE2      GLN  25  -1.928   8.161  -9.511
  170   HE22  GLN  25          2HE2      GLN  25  -1.631   8.616 -11.151
  171    H    THR  26           H        THR  26  -3.772   5.885  -6.932
  172    HA   THR  26           HA       THR  26  -1.156   4.656  -7.047
  173    HB   THR  26           HB       THR  26  -2.221   6.654  -5.042
  174    HG1  THR  26           HG1      THR  26  -0.607   7.151  -7.335
  175   HG21  THR  26          3HG2      THR  26  -0.209   6.622  -4.069
  176   HG22  THR  26          1HG2      THR  26   0.623   6.695  -5.622
  177   HG23  THR  26          2HG2      THR  26   0.103   5.140  -4.973
  178    H    LEU  27           H        LEU  27  -3.882   4.765  -4.780
  179    HA   LEU  27           HA       LEU  27  -2.789   3.307  -2.691
  180    HB2  LEU  27           1HB      LEU  27  -4.888   4.393  -2.412
  181    HB3  LEU  27           2HB      LEU  27  -5.612   3.460  -3.720
  182    HG   LEU  27           HG       LEU  27  -5.616   1.470  -2.376
  183   HD11  LEU  27          1HD1      LEU  27  -3.438   2.078  -1.214
  184   HD12  LEU  27          2HD1      LEU  27  -4.669   1.279  -0.237
  185   HD13  LEU  27          3HD1      LEU  27  -4.425   3.020  -0.096
  186   HD21  LEU  27          3HD2      LEU  27  -7.505   2.109  -1.398
  187   HD22  LEU  27          1HD2      LEU  27  -7.092   3.774  -1.807
  188   HD23  LEU  27          2HD2      LEU  27  -6.630   3.111  -0.239
  189    H    LYS  28           H        LYS  28  -4.561   2.116  -5.532
  190    HA   LYS  28           HA       LYS  28  -4.603  -0.585  -4.938
  191    HB2  LYS  28           1HB      LYS  28  -4.341   0.813  -7.602
  192    HB3  LYS  28           2HB      LYS  28  -4.610  -0.918  -7.443
  193    HG2  LYS  28           1HG      LYS  28  -6.753  -0.626  -6.570
  194    HG3  LYS  28           2HG      LYS  28  -6.457   1.067  -6.168
  195    HD2  LYS  28           1HD      LYS  28  -6.672   1.758  -8.376
  196    HD3  LYS  28           2HD      LYS  28  -6.354   0.144  -9.015
  197    HE2  LYS  28           1HE      LYS  28  -8.780   0.665  -7.341
  198    HE3  LYS  28           2HE      LYS  28  -8.774   1.080  -9.055
  199    HZ1  LYS  28           3HZ      LYS  28  -7.754  -1.507  -8.787
  200    HZ2  LYS  28           1HZ      LYS  28  -9.202  -1.026  -9.519
  201    HZ3  LYS  28           2HZ      LYS  28  -9.178  -1.429  -7.877
  202    H    SER  29           H        SER  29  -1.959   1.401  -6.031
  203    HA   SER  29           HA       SER  29  -0.262  -0.865  -6.646
  204    HB2  SER  29           1HB      SER  29   0.454   2.072  -6.464
  205    HB3  SER  29           2HB      SER  29   1.436   0.797  -7.186
  206    HG   SER  29           HG       SER  29   0.373   1.133  -8.953
  207    H    HIS  30           H        HIS  30  -1.092   0.974  -3.906
  208    HA   HIS  30           HA       HIS  30   1.373   0.632  -2.473
  209    HB2  HIS  30           1HB      HIS  30   0.260   2.456  -1.632
  210    HB3  HIS  30           2HB      HIS  30  -1.328   1.730  -1.865
  211    HD1  HIS  30           HD1      HIS  30   1.680   1.260   0.420
  212    HD2  HIS  30           HD2      HIS  30  -2.457   0.880   0.441
  213    HE1  HIS  30           HE1      HIS  30   1.074   0.638   2.780
  214    H    LEU  31           H        LEU  31  -1.485  -1.230  -2.988
  215    HA   LEU  31           HA       LEU  31  -1.297  -2.878  -0.675
  216    HB2  LEU  31           1HB      LEU  31  -2.524  -3.845  -3.214
  217    HB3  LEU  31           2HB      LEU  31  -3.055  -4.083  -1.550
  218    HG   LEU  31           HG       LEU  31  -3.455  -1.690  -3.321
  219   HD11  LEU  31          1HD1      LEU  31  -5.102  -3.490  -3.444
  220   HD12  LEU  31          2HD1      LEU  31  -5.793  -2.034  -2.730
  221   HD13  LEU  31          3HD1      LEU  31  -5.344  -3.393  -1.700
  222   HD21  LEU  31          3HD2      LEU  31  -4.545  -0.708  -1.219
  223   HD22  LEU  31          1HD2      LEU  31  -2.787  -0.640  -1.345
  224   HD23  LEU  31          2HD2      LEU  31  -3.551  -1.861  -0.327
  225    H    ARG  32           H        ARG  32   0.741  -2.578  -3.243
  226    HA   ARG  32           HA       ARG  32   1.349  -5.295  -3.822
  227    HB2  ARG  32           1HB      ARG  32   2.597  -2.653  -4.386
  228    HB3  ARG  32           2HB      ARG  32   3.616  -4.079  -4.527
  229    HG2  ARG  32           1HG      ARG  32   2.624  -3.437  -6.667
  230    HG3  ARG  32           2HG      ARG  32   2.100  -5.041  -6.151
  231    HD2  ARG  32           1HD      ARG  32  -0.011  -4.152  -5.392
  232    HD3  ARG  32           2HD      ARG  32   0.516  -2.507  -5.746
  233    HE   ARG  32           HE       ARG  32  -0.556  -4.398  -7.592
  234   HH11  ARG  32          1HH1      ARG  32   1.657  -1.728  -7.281
  235   HH12  ARG  32          2HH1      ARG  32   1.529  -1.259  -8.944
  236   HH21  ARG  32          1HH2      ARG  32  -0.732  -3.791  -9.784
  237   HH22  ARG  32          2HH2      ARG  32   0.170  -2.433 -10.367
  238    H    ILE  33           H        ILE  33   2.458  -2.995  -1.428
  239    HA   ILE  33           HA       ILE  33   4.660  -4.634  -0.553
  240    HB   ILE  33           HB       ILE  33   5.107  -2.984   1.067
  241   HG12  ILE  33          1HG1      ILE  33   2.336  -1.859   0.611
  242   HG13  ILE  33          2HG1      ILE  33   2.786  -2.881   1.971
  243   HG21  ILE  33          1HG2      ILE  33   5.800  -1.692  -0.604
  244   HG22  ILE  33          2HG2      ILE  33   4.450  -2.188  -1.624
  245   HG23  ILE  33          3HG2      ILE  33   4.258  -0.842  -0.501
  246   HD11  ILE  33          3HD1      ILE  33   2.866  -0.728   2.827
  247   HD12  ILE  33          1HD1      ILE  33   4.553  -1.097   2.470
  248   HD13  ILE  33          2HD1      ILE  33   3.623  -0.074   1.374
  249    H    HIS  34           H        HIS  34   1.335  -4.696  -0.082
  250    HA   HIS  34           HA       HIS  34   1.423  -5.758   2.617
  251    HB2  HIS  34           1HB      HIS  34  -0.792  -5.191   0.660
  252    HB3  HIS  34           2HB      HIS  34  -1.087  -6.114   2.130
  253    HD1  HIS  34           HD1      HIS  34   0.502  -4.518   4.169
  254    HD2  HIS  34           HD2      HIS  34  -1.862  -2.768   1.235
  255    HE1  HIS  34           HE1      HIS  34  -0.065  -2.228   5.040
  256    H    THR  35           H        THR  35   0.908  -6.909  -0.674
  257    HA   THR  35           HA       THR  35   0.938  -9.674   0.350
  258    HB   THR  35           HB       THR  35  -1.140  -9.397  -0.732
  259    HG1  THR  35           HG1      THR  35  -0.893 -10.757  -2.575
  260   HG21  THR  35          3HG2      THR  35  -1.358  -8.451  -3.006
  261   HG22  THR  35          1HG2      THR  35   0.361  -8.063  -2.988
  262   HG23  THR  35          2HG2      THR  35  -0.731  -7.280  -1.846
  263    H    GLY  36           H        GLY  36   2.762 -10.738  -0.026
  264    HA2  GLY  36           1HA      GLY  36   4.044 -10.627  -2.608
  265    HA3  GLY  36           2HA      GLY  36   4.989  -9.887  -1.324
  266    H    SER  37           H        SER  37   4.835 -11.429   0.778
  267    HA   SER  37           HA       SER  37   6.506 -13.571   0.289
  268    HB2  SER  37           1HB      SER  37   4.581 -13.153   2.586
  269    HB3  SER  37           2HB      SER  37   5.853 -14.374   2.568
  270    HG   SER  37           HG       SER  37   6.028 -11.625   2.875
  271    H    GLY  38           H        GLY  38   2.987 -13.668   0.856
  272    HA2  GLY  38           1HA      GLY  38   2.850 -16.080  -0.799
  273    HA3  GLY  38           2HA      GLY  38   2.257 -16.194   0.852
  274    HA   PRO  39           HA       PRO  39  -0.878 -14.278  -2.256
  275    HB2  PRO  39           1HB      PRO  39  -2.169 -16.505  -3.118
  276    HB3  PRO  39           2HB      PRO  39  -0.785 -15.808  -3.968
  277    HG2  PRO  39           1HG      PRO  39  -0.875 -18.126  -2.077
  278    HG3  PRO  39           2HG      PRO  39   0.005 -17.965  -3.608
  279    HD2  PRO  39           1HD      PRO  39   1.202 -17.648  -1.200
  280    HD3  PRO  39           2HD      PRO  39   1.711 -16.751  -2.644
  281    H    SER  40           H        SER  40  -0.889 -16.701   0.221
  282    HA   SER  40           HA       SER  40  -3.717 -16.303   0.810
  283    HB2  SER  40           1HB      SER  40  -2.595 -18.582   0.898
  284    HB3  SER  40           2HB      SER  40  -1.761 -18.018   2.346
  285    HG   SER  40           HG       SER  40  -4.062 -19.136   2.314
  286    H    SER  41           H        SER  41  -4.501 -15.322   2.638
  287    HA   SER  41           HA       SER  41  -2.618 -13.568   4.021
  288    HB2  SER  41           1HB      SER  41  -4.484 -12.228   4.622
  289    HB3  SER  41           2HB      SER  41  -4.783 -12.727   2.957
  290    HG   SER  41           HG       SER  41  -6.225 -13.240   5.194
  291    H    GLY  42           H        GLY  42  -2.400 -16.241   4.742
  292    HA2  GLY  42           1HA      GLY  42  -2.779 -16.051   7.572
  293    HA3  GLY  42           2HA      GLY  42  -3.889 -17.200   6.842
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1  -6.054  27.887   8.452
    2    HA2  GLY   1           1HA      GLY   1  -8.023  27.502   9.610
    3    HA3  GLY   1           2HA      GLY   1  -8.127  29.254   9.509
    4    H    SER   2           H        SER   2  -9.143  26.228   8.054
    5    HA   SER   2           HA       SER   2 -11.212  27.690   6.553
    6    HB2  SER   2           1HB      SER   2  -9.811  25.080   6.047
    7    HB3  SER   2           2HB      SER   2 -11.387  25.403   5.325
    8    HG   SER   2           HG       SER   2 -10.139  27.528   4.768
    9    H    SER   3           H        SER   3 -13.260  26.335   6.237
   10    HA   SER   3           HA       SER   3 -14.502  25.961   8.703
   11    HB2  SER   3           1HB      SER   3 -15.200  25.297   5.879
   12    HB3  SER   3           2HB      SER   3 -16.167  24.572   7.163
   13    HG   SER   3           HG       SER   3 -16.070  26.983   7.913
   14    H    GLY   4           H        GLY   4 -13.113  23.584   6.468
   15    HA2  GLY   4           1HA      GLY   4 -13.811  21.360   8.171
   16    HA3  GLY   4           2HA      GLY   4 -12.852  21.290   6.700
   17    H    SER   5           H        SER   5 -12.702  20.657   9.860
   18    HA   SER   5           HA       SER   5 -10.217  21.825  10.615
   19    HB2  SER   5           1HB      SER   5 -11.559  19.362  11.757
   20    HB3  SER   5           2HB      SER   5 -10.312  20.335  12.537
   21    HG   SER   5           HG       SER   5 -12.868  20.667  12.759
   22    H    SER   6           H        SER   6 -11.070  18.450   9.824
   23    HA   SER   6           HA       SER   6  -8.485  18.135   8.508
   24    HB2  SER   6           1HB      SER   6  -8.044  17.427  10.804
   25    HB3  SER   6           2HB      SER   6  -9.429  16.337  10.755
   26    HG   SER   6           HG       SER   6  -6.913  15.917   9.904
   27    H    GLY   7           H        GLY   7  -8.384  16.344   7.066
   28    HA2  GLY   7           1HA      GLY   7  -9.545  14.319   6.227
   29    HA3  GLY   7           2HA      GLY   7 -11.040  15.227   6.402
   30    H    GLY   8           H        GLY   8 -11.165  14.452   4.083
   31    HA2  GLY   8           1HA      GLY   8 -11.453  15.351   1.946
   32    HA3  GLY   8           2HA      GLY   8 -10.374  16.669   2.382
   33    H    GLU   9           H        GLU   9  -8.027  15.941   2.731
   34    HA   GLU   9           HA       GLU   9  -7.057  14.905   0.313
   35    HB2  GLU   9           1HB      GLU   9  -5.851  16.410   1.979
   36    HB3  GLU   9           2HB      GLU   9  -5.509  14.951   2.898
   37    HG2  GLU   9           1HG      GLU   9  -4.221  14.038   1.115
   38    HG3  GLU   9           2HG      GLU   9  -4.721  15.328   0.022
   39    H    LYS  10           H        LYS  10  -6.373  12.920  -0.323
   40    HA   LYS  10           HA       LYS  10  -6.206  10.653  -0.392
   41    HB2  LYS  10           1HB      LYS  10  -5.704  10.987   2.571
   42    HB3  LYS  10           2HB      LYS  10  -5.422   9.507   1.663
   43    HG2  LYS  10           1HG      LYS  10  -3.577  10.352   0.589
   44    HG3  LYS  10           2HG      LYS  10  -4.102  12.027   0.778
   45    HD2  LYS  10           1HD      LYS  10  -3.275  12.190   2.903
   46    HD3  LYS  10           2HD      LYS  10  -3.501  10.471   3.239
   47    HE2  LYS  10           1HE      LYS  10  -1.224  10.541   3.071
   48    HE3  LYS  10           2HE      LYS  10  -1.639  10.220   1.388
   49    HZ1  LYS  10           3HZ      LYS  10  -1.172  12.940   2.477
   50    HZ2  LYS  10           1HZ      LYS  10  -1.351  12.505   0.852
   51    HZ3  LYS  10           2HZ      LYS  10   0.021  12.017   1.712
   52    HA   PRO  11           HA       PRO  11 -10.568  10.418   1.406
   53    HB2  PRO  11           1HB      PRO  11 -11.891  10.448  -0.964
   54    HB3  PRO  11           2HB      PRO  11 -11.494  11.918  -0.067
   55    HG2  PRO  11           1HG      PRO  11 -10.088  10.689  -2.406
   56    HG3  PRO  11           2HG      PRO  11 -10.468  12.393  -2.099
   57    HD2  PRO  11           1HD      PRO  11  -8.010  11.346  -1.659
   58    HD3  PRO  11           2HD      PRO  11  -8.675  12.666  -0.675
   59    H    TYR  12           H        TYR  12  -8.406   8.635  -0.311
   60    HA   TYR  12           HA       TYR  12 -10.240   6.338  -0.529
   61    HB2  TYR  12           1HB      TYR  12  -7.731   6.929  -2.112
   62    HB3  TYR  12           2HB      TYR  12  -8.653   5.433  -2.220
   63    HD1  TYR  12           HD1      TYR  12  -8.804   9.082  -2.833
   64    HD2  TYR  12           HD2      TYR  12 -10.593   5.292  -3.568
   65    HE1  TYR  12           HE1      TYR  12 -10.236  10.099  -4.555
   66    HE2  TYR  12           HE2      TYR  12 -12.029   6.298  -5.293
   67    HH   TYR  12           HH       TYR  12 -11.576   9.583  -6.375
   68    HA   PRO  13           HA       PRO  13  -7.368   5.265   2.882
   69    HB2  PRO  13           1HB      PRO  13  -9.197   3.773   4.223
   70    HB3  PRO  13           2HB      PRO  13  -9.084   5.529   4.387
   71    HG2  PRO  13           1HG      PRO  13 -10.966   3.898   2.726
   72    HG3  PRO  13           2HG      PRO  13 -11.303   5.325   3.723
   73    HD2  PRO  13           1HD      PRO  13 -11.021   5.461   1.034
   74    HD3  PRO  13           2HD      PRO  13 -10.541   6.786   2.112
   75    H    CYS  14           H        CYS  14  -6.294   3.342   3.285
   76    HA   CYS  14           HA       CYS  14  -6.431   1.365   1.225
   77    HB2  CYS  14           1HB      CYS  14  -4.278   1.919   2.148
   78    HB3  CYS  14           2HB      CYS  14  -4.819   1.524   3.776
   79    H    GLU  15           H        GLU  15  -6.610  -0.969   1.661
   80    HA   GLU  15           HA       GLU  15  -8.821  -1.471   3.515
   81    HB2  GLU  15           1HB      GLU  15  -9.322  -2.171   1.294
   82    HB3  GLU  15           2HB      GLU  15  -7.771  -2.982   1.127
   83    HG2  GLU  15           1HG      GLU  15  -9.208  -4.744   1.452
   84    HG3  GLU  15           2HG      GLU  15  -8.606  -4.455   3.083
   85    H    ILE  16           H        ILE  16  -5.576  -2.577   2.706
   86    HA   ILE  16           HA       ILE  16  -5.488  -4.759   4.496
   87    HB   ILE  16           HB       ILE  16  -3.219  -3.077   3.426
   88   HG12  ILE  16          1HG1      ILE  16  -3.045  -5.390   2.084
   89   HG13  ILE  16          2HG1      ILE  16  -4.781  -5.380   2.376
   90   HG21  ILE  16          1HG2      ILE  16  -3.287  -5.272   5.325
   91   HG22  ILE  16          2HG2      ILE  16  -2.261  -5.614   3.933
   92   HG23  ILE  16          3HG2      ILE  16  -1.970  -4.176   4.910
   93   HD11  ILE  16          3HD1      ILE  16  -4.152  -2.811   1.476
   94   HD12  ILE  16          1HD1      ILE  16  -3.249  -3.922   0.446
   95   HD13  ILE  16          2HD1      ILE  16  -4.999  -4.086   0.599
   96    H    CYS  17           H        CYS  17  -3.599  -1.761   4.833
   97    HA   CYS  17           HA       CYS  17  -3.721  -2.061   7.734
   98    HB2  CYS  17           1HB      CYS  17  -1.964  -0.339   7.777
   99    HB3  CYS  17           2HB      CYS  17  -1.522  -1.687   6.734
  100    H    GLY  18           H        GLY  18  -4.364   0.403   5.249
  101    HA2  GLY  18           1HA      GLY  18  -6.640   1.485   5.712
  102    HA3  GLY  18           2HA      GLY  18  -5.910   1.913   7.252
  103    H    THR  19           H        THR  19  -3.273   2.339   5.930
  104    HA   THR  19           HA       THR  19  -3.118   5.008   5.739
  105    HB   THR  19           HB       THR  19  -1.674   3.010   3.994
  106    HG1  THR  19           HG1      THR  19  -0.227   3.002   5.597
  107   HG21  THR  19          3HG2      THR  19  -1.643   5.224   2.928
  108   HG22  THR  19          1HG2      THR  19  -0.048   4.770   3.527
  109   HG23  THR  19          2HG2      THR  19  -1.029   5.930   4.422
  110    H    ARG  20           H        ARG  20  -4.092   6.542   4.602
  111    HA   ARG  20           HA       ARG  20  -5.582   5.853   2.211
  112    HB2  ARG  20           1HB      ARG  20  -5.318   8.594   3.438
  113    HB3  ARG  20           2HB      ARG  20  -6.606   7.987   2.404
  114    HG2  ARG  20           1HG      ARG  20  -7.649   6.892   4.105
  115    HG3  ARG  20           2HG      ARG  20  -6.150   6.617   4.995
  116    HD2  ARG  20           1HD      ARG  20  -6.128   8.798   5.852
  117    HD3  ARG  20           2HD      ARG  20  -7.296   9.369   4.662
  118    HE   ARG  20           HE       ARG  20  -8.514   7.388   6.218
  119   HH11  ARG  20          1HH1      ARG  20  -7.275  10.626   6.535
  120   HH12  ARG  20          2HH1      ARG  20  -8.366  11.059   7.809
  121   HH21  ARG  20          1HH2      ARG  20  -9.956   7.946   7.895
  122   HH22  ARG  20          2HH2      ARG  20  -9.890   9.533   8.582
  123    H    PHE  21           H        PHE  21  -5.469   7.324   0.301
  124    HA   PHE  21           HA       PHE  21  -2.808   8.462  -0.148
  125    HB2  PHE  21           1HB      PHE  21  -4.125   6.343  -1.847
  126    HB3  PHE  21           2HB      PHE  21  -2.821   7.365  -2.443
  127    HD1  PHE  21           HD2      PHE  21  -3.641   5.056   0.360
  128    HD2  PHE  21           HD1      PHE  21  -0.635   6.681  -2.178
  129    HE1  PHE  21           HE2      PHE  21  -1.992   3.506   1.325
  130    HE2  PHE  21           HE1      PHE  21   1.018   5.133  -1.217
  131    HZ   PHE  21           HZ       PHE  21   0.341   3.543   0.538
  132    H    ARG  22           H        ARG  22  -2.800  10.269  -1.381
  133    HA   ARG  22           HA       ARG  22  -4.936  11.891  -1.687
  134    HB2  ARG  22           1HB      ARG  22  -3.712  13.038  -3.504
  135    HB3  ARG  22           2HB      ARG  22  -2.679  12.654  -2.133
  136    HG2  ARG  22           1HG      ARG  22  -1.651  10.862  -3.296
  137    HG3  ARG  22           2HG      ARG  22  -2.842  10.941  -4.596
  138    HD2  ARG  22           1HD      ARG  22  -1.968  12.952  -5.425
  139    HD3  ARG  22           2HD      ARG  22  -1.070  13.272  -3.942
  140    HE   ARG  22           HE       ARG  22   0.049  10.987  -4.835
  141   HH11  ARG  22          1HH1      ARG  22  -0.623  14.047  -6.354
  142   HH12  ARG  22          2HH1      ARG  22   0.717  13.947  -7.446
  143   HH21  ARG  22          1HH2      ARG  22   1.817  10.844  -6.268
  144   HH22  ARG  22          2HH2      ARG  22   2.104  12.124  -7.397
  145    H    HIS  23           H        HIS  23  -3.881   9.433  -4.005
  146    HA   HIS  23           HA       HIS  23  -6.476   9.730  -5.371
  147    HB2  HIS  23           1HB      HIS  23  -3.722   9.485  -6.469
  148    HB3  HIS  23           2HB      HIS  23  -5.011   8.648  -7.329
  149    HD2  HIS  23           HD2      HIS  23  -5.844  12.118  -5.791
  150    HE1  HIS  23           HE1      HIS  23  -5.496  12.574  -9.995
  151    HE2  HIS  23           HE2      HIS  23  -6.074  13.705  -7.820
  152    H    LEU  24           H        LEU  24  -7.126   7.711  -6.566
  153    HA   LEU  24           HA       LEU  24  -6.931   5.475  -4.750
  154    HB2  LEU  24           1HB      LEU  24  -9.051   6.179  -5.858
  155    HB3  LEU  24           2HB      LEU  24  -8.368   5.646  -7.393
  156    HG   LEU  24           HG       LEU  24  -9.967   4.038  -6.386
  157   HD11  LEU  24          1HD1      LEU  24  -7.486   2.504  -6.271
  158   HD12  LEU  24          2HD1      LEU  24  -7.610   3.553  -7.683
  159   HD13  LEU  24          3HD1      LEU  24  -8.865   2.357  -7.360
  160   HD21  LEU  24          3HD2      LEU  24  -8.596   4.600  -4.036
  161   HD22  LEU  24          1HD2      LEU  24  -8.117   2.954  -4.448
  162   HD23  LEU  24          2HD2      LEU  24  -9.825   3.357  -4.273
  163    H    GLN  25           H        GLN  25  -6.493   5.768  -8.282
  164    HA   GLN  25           HA       GLN  25  -5.430   3.428  -8.977
  165    HB2  GLN  25           1HB      GLN  25  -3.979   4.588 -10.602
  166    HB3  GLN  25           2HB      GLN  25  -5.601   5.266 -10.552
  167    HG2  GLN  25           1HG      GLN  25  -4.851   7.150  -9.292
  168    HG3  GLN  25           2HG      GLN  25  -3.252   6.437  -9.087
  169   HE21  GLN  25          1HE2      GLN  25  -4.212   8.976 -10.334
  170   HE22  GLN  25          2HE2      GLN  25  -3.512   8.982 -11.913
  171    H    THR  26           H        THR  26  -3.658   5.937  -7.224
  172    HA   THR  26           HA       THR  26  -1.166   4.608  -7.177
  173    HB   THR  26           HB       THR  26  -2.241   6.623  -5.194
  174    HG1  THR  26           HG1      THR  26  -1.543   8.143  -6.576
  175   HG21  THR  26          3HG2      THR  26   0.133   5.107  -5.162
  176   HG22  THR  26          1HG2      THR  26  -0.285   6.479  -4.137
  177   HG23  THR  26          2HG2      THR  26   0.588   6.740  -5.646
  178    H    LEU  27           H        LEU  27  -3.714   4.867  -4.697
  179    HA   LEU  27           HA       LEU  27  -2.616   3.379  -2.686
  180    HB2  LEU  27           1HB      LEU  27  -4.691   4.407  -2.290
  181    HB3  LEU  27           2HB      LEU  27  -5.449   3.586  -3.653
  182    HG   LEU  27           HG       LEU  27  -5.344   1.465  -2.411
  183   HD11  LEU  27          1HD1      LEU  27  -4.183   3.199  -0.242
  184   HD12  LEU  27          2HD1      LEU  27  -3.440   1.801  -1.017
  185   HD13  LEU  27          3HD1      LEU  27  -4.841   1.586   0.032
  186   HD21  LEU  27          3HD2      LEU  27  -7.423   2.287  -2.075
  187   HD22  LEU  27          1HD2      LEU  27  -6.833   3.841  -1.484
  188   HD23  LEU  27          2HD2      LEU  27  -6.846   2.439  -0.414
  189    H    LYS  28           H        LYS  28  -4.414   2.142  -5.487
  190    HA   LYS  28           HA       LYS  28  -4.483  -0.543  -4.881
  191    HB2  LYS  28           1HB      LYS  28  -4.311   0.970  -7.457
  192    HB3  LYS  28           2HB      LYS  28  -4.190  -0.785  -7.485
  193    HG2  LYS  28           1HG      LYS  28  -6.362  -1.080  -6.766
  194    HG3  LYS  28           2HG      LYS  28  -6.451   0.528  -6.044
  195    HD2  LYS  28           1HD      LYS  28  -6.661   1.569  -8.156
  196    HD3  LYS  28           2HD      LYS  28  -6.185   0.100  -9.010
  197    HE2  LYS  28           1HE      LYS  28  -8.688   0.360  -7.351
  198    HE3  LYS  28           2HE      LYS  28  -8.630   0.608  -9.096
  199    HZ1  LYS  28           3HZ      LYS  28  -7.812  -1.677  -9.325
  200    HZ2  LYS  28           1HZ      LYS  28  -9.341  -1.622  -8.601
  201    HZ3  LYS  28           2HZ      LYS  28  -7.967  -1.903  -7.656
  202    H    SER  29           H        SER  29  -1.793   1.370  -6.064
  203    HA   SER  29           HA       SER  29  -0.106  -0.912  -6.548
  204    HB2  SER  29           1HB      SER  29   0.290   2.064  -6.617
  205    HB3  SER  29           2HB      SER  29   1.681   0.982  -6.671
  206    HG   SER  29           HG       SER  29   1.259   0.811  -8.713
  207    H    HIS  30           H        HIS  30  -0.899   1.082  -3.865
  208    HA   HIS  30           HA       HIS  30   1.486   0.655  -2.354
  209    HB2  HIS  30           1HB      HIS  30   0.381   2.507  -1.562
  210    HB3  HIS  30           2HB      HIS  30  -1.212   1.803  -1.823
  211    HD1  HIS  30           HD1      HIS  30   1.725   1.422   0.558
  212    HD2  HIS  30           HD2      HIS  30  -2.394   0.886   0.441
  213    HE1  HIS  30           HE1      HIS  30   1.059   0.808   2.905
  214    H    LEU  31           H        LEU  31  -1.353  -1.188  -2.965
  215    HA   LEU  31           HA       LEU  31  -1.264  -2.811  -0.620
  216    HB2  LEU  31           1HB      LEU  31  -2.449  -3.755  -3.191
  217    HB3  LEU  31           2HB      LEU  31  -3.010  -4.010  -1.540
  218    HG   LEU  31           HG       LEU  31  -3.358  -1.589  -3.284
  219   HD11  LEU  31          1HD1      LEU  31  -5.729  -1.926  -2.589
  220   HD12  LEU  31          2HD1      LEU  31  -5.230  -3.423  -1.802
  221   HD13  LEU  31          3HD1      LEU  31  -5.057  -3.245  -3.547
  222   HD21  LEU  31          3HD2      LEU  31  -4.427  -0.557  -1.246
  223   HD22  LEU  31          1HD2      LEU  31  -2.666  -0.648  -1.223
  224   HD23  LEU  31          2HD2      LEU  31  -3.620  -1.803  -0.293
  225    H    ARG  32           H        ARG  32   0.709  -2.625  -3.320
  226    HA   ARG  32           HA       ARG  32   1.320  -5.305  -3.857
  227    HB2  ARG  32           1HB      ARG  32   2.679  -2.694  -4.273
  228    HB3  ARG  32           2HB      ARG  32   3.669  -4.142  -4.393
  229    HG2  ARG  32           1HG      ARG  32   2.841  -3.453  -6.572
  230    HG3  ARG  32           2HG      ARG  32   2.189  -5.027  -6.113
  231    HD2  ARG  32           1HD      ARG  32   0.065  -4.192  -5.760
  232    HD3  ARG  32           2HD      ARG  32   0.645  -2.550  -5.485
  233    HE   ARG  32           HE       ARG  32   0.619  -2.179  -7.763
  234   HH11  ARG  32          1HH1      ARG  32   0.070  -5.550  -7.088
  235   HH12  ARG  32          2HH1      ARG  32  -0.411  -5.930  -8.708
  236   HH21  ARG  32          1HH2      ARG  32  -0.013  -2.667  -9.899
  237   HH22  ARG  32          2HH2      ARG  32  -0.457  -4.290 -10.307
  238    H    ILE  33           H        ILE  33   2.733  -3.030  -1.534
  239    HA   ILE  33           HA       ILE  33   4.726  -4.789  -0.566
  240    HB   ILE  33           HB       ILE  33   5.098  -3.239   1.185
  241   HG12  ILE  33          1HG1      ILE  33   2.443  -1.929   0.580
  242   HG13  ILE  33          2HG1      ILE  33   2.657  -3.130   1.849
  243   HG21  ILE  33          1HG2      ILE  33   4.427  -2.157  -1.477
  244   HG22  ILE  33          2HG2      ILE  33   4.641  -0.976  -0.186
  245   HG23  ILE  33          3HG2      ILE  33   5.942  -2.102  -0.576
  246   HD11  ILE  33          3HD1      ILE  33   4.110  -1.707   3.063
  247   HD12  ILE  33          1HD1      ILE  33   4.221  -0.570   1.719
  248   HD13  ILE  33          2HD1      ILE  33   2.704  -0.748   2.601
  249    H    HIS  34           H        HIS  34   1.346  -4.429   0.121
  250    HA   HIS  34           HA       HIS  34   1.364  -5.778   2.638
  251    HB2  HIS  34           1HB      HIS  34  -0.809  -5.064   0.677
  252    HB3  HIS  34           2HB      HIS  34  -1.144  -6.004   2.128
  253    HD1  HIS  34           HD1      HIS  34   0.493  -4.507   4.203
  254    HD2  HIS  34           HD2      HIS  34  -1.790  -2.614   1.293
  255    HE1  HIS  34           HE1      HIS  34   0.009  -2.214   5.115
  256    H    THR  35           H        THR  35   0.657  -6.754  -0.696
  257    HA   THR  35           HA       THR  35   0.654  -9.562   0.194
  258    HB   THR  35           HB       THR  35  -1.433  -8.843  -0.909
  259    HG1  THR  35           HG1      THR  35  -0.065 -10.985  -1.378
  260   HG21  THR  35          3HG2      THR  35  -1.335  -8.442  -3.390
  261   HG22  THR  35          1HG2      THR  35   0.411  -8.267  -3.225
  262   HG23  THR  35          2HG2      THR  35  -0.669  -7.142  -2.402
  263    H    GLY  36           H        GLY  36   3.089  -8.164  -0.183
  264    HA2  GLY  36           1HA      GLY  36   4.098  -9.395  -2.673
  265    HA3  GLY  36           2HA      GLY  36   4.790  -7.959  -1.934
  266    H    SER  37           H        SER  37   6.578  -8.255  -0.793
  267    HA   SER  37           HA       SER  37   7.784 -10.742  -0.433
  268    HB2  SER  37           1HB      SER  37   9.479  -9.610   0.766
  269    HB3  SER  37           2HB      SER  37   8.857  -8.412  -0.368
  270    HG   SER  37           HG       SER  37   8.794  -8.432   2.366
  271    H    GLY  38           H        GLY  38   7.638 -12.292   1.071
  272    HA2  GLY  38           1HA      GLY  38   5.523 -12.382   2.901
  273    HA3  GLY  38           2HA      GLY  38   6.918 -13.451   2.915
  274    HA   PRO  39           HA       PRO  39   6.883 -10.212   6.462
  275    HB2  PRO  39           1HB      PRO  39   5.636 -11.633   8.411
  276    HB3  PRO  39           2HB      PRO  39   4.775 -10.549   7.312
  277    HG2  PRO  39           1HG      PRO  39   5.062 -13.527   7.196
  278    HG3  PRO  39           2HG      PRO  39   3.623 -12.529   6.913
  279    HD2  PRO  39           1HD      PRO  39   5.106 -13.555   4.893
  280    HD3  PRO  39           2HD      PRO  39   4.260 -12.000   4.761
  281    H    SER  40           H        SER  40   8.024 -13.194   5.649
  282    HA   SER  40           HA       SER  40   9.340 -13.873   8.122
  283    HB2  SER  40           1HB      SER  40  10.362 -15.688   6.848
  284    HB3  SER  40           2HB      SER  40   8.633 -15.615   6.508
  285    HG   SER  40           HG       SER  40   9.612 -15.787   4.552
  286    H    SER  41           H        SER  41   9.963 -11.278   7.466
  287    HA   SER  41           HA       SER  41  12.812 -11.368   7.453
  288    HB2  SER  41           1HB      SER  41  13.215 -10.084   5.416
  289    HB3  SER  41           2HB      SER  41  12.384 -11.589   5.021
  290    HG   SER  41           HG       SER  41  11.305  -8.976   5.154
  291    H    GLY  42           H        GLY  42  13.148 -10.002   9.080
  292    HA2  GLY  42           1HA      GLY  42  12.535  -7.233   8.831
  293    HA3  GLY  42           2HA      GLY  42  11.461  -8.007   9.987
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1 -20.469  25.629  -5.786
    2    HA2  GLY   1           1HA      GLY   1 -19.338  25.587  -3.738
    3    HA3  GLY   1           2HA      GLY   1 -20.379  24.272  -3.216
    4    H    SER   2           H        SER   2 -18.825  22.874  -2.514
    5    HA   SER   2           HA       SER   2 -17.239  21.593  -4.603
    6    HB2  SER   2           1HB      SER   2 -16.042  22.604  -2.012
    7    HB3  SER   2           2HB      SER   2 -15.206  21.607  -3.202
    8    HG   SER   2           HG       SER   2 -16.382  24.046  -3.967
    9    H    SER   3           H        SER   3 -17.315  19.447  -4.442
   10    HA   SER   3           HA       SER   3 -18.867  18.180  -2.447
   11    HB2  SER   3           1HB      SER   3 -18.770  17.178  -4.621
   12    HB3  SER   3           2HB      SER   3 -17.010  17.076  -4.562
   13    HG   SER   3           HG       SER   3 -18.724  15.725  -2.753
   14    H    GLY   4           H        GLY   4 -17.805  18.930  -0.504
   15    HA2  GLY   4           1HA      GLY   4 -15.817  17.022   0.401
   16    HA3  GLY   4           2HA      GLY   4 -15.272  18.692   0.359
   17    H    SER   5           H        SER   5 -16.887  16.327   2.151
   18    HA   SER   5           HA       SER   5 -18.472  18.067   3.785
   19    HB2  SER   5           1HB      SER   5 -19.036  15.679   3.473
   20    HB3  SER   5           2HB      SER   5 -17.557  15.229   4.321
   21    HG   SER   5           HG       SER   5 -18.426  15.806   6.182
   22    H    SER   6           H        SER   6 -15.512  16.178   4.421
   23    HA   SER   6           HA       SER   6 -14.732  18.236   6.376
   24    HB2  SER   6           1HB      SER   6 -15.450  16.410   7.726
   25    HB3  SER   6           2HB      SER   6 -14.633  15.235   6.695
   26    HG   SER   6           HG       SER   6 -12.647  16.109   7.395
   27    H    GLY   7           H        GLY   7 -13.419  19.139   4.709
   28    HA2  GLY   7           1HA      GLY   7 -11.286  19.514   3.895
   29    HA3  GLY   7           2HA      GLY   7 -10.772  18.019   4.661
   30    H    GLY   8           H        GLY   8  -9.561  17.392   2.851
   31    HA2  GLY   8           1HA      GLY   8 -10.882  15.752   1.002
   32    HA3  GLY   8           2HA      GLY   8 -10.550  17.289   0.218
   33    H    GLU   9           H        GLU   9  -8.959  14.713   2.081
   34    HA   GLU   9           HA       GLU   9  -6.728  14.795   0.213
   35    HB2  GLU   9           1HB      GLU   9  -6.532  15.487   3.120
   36    HB3  GLU   9           2HB      GLU   9  -5.190  14.665   2.336
   37    HG2  GLU   9           1HG      GLU   9  -6.385  17.245   1.358
   38    HG3  GLU   9           2HG      GLU   9  -4.983  17.140   2.421
   39    H    LYS  10           H        LYS  10  -6.368  12.776  -0.391
   40    HA   LYS  10           HA       LYS  10  -6.205  10.508  -0.394
   41    HB2  LYS  10           1HB      LYS  10  -5.926  10.698   2.605
   42    HB3  LYS  10           2HB      LYS  10  -5.317   9.431   1.548
   43    HG2  LYS  10           1HG      LYS  10  -3.673  10.888   0.623
   44    HG3  LYS  10           2HG      LYS  10  -4.375  12.286   1.441
   45    HD2  LYS  10           1HD      LYS  10  -3.550  11.662   3.501
   46    HD3  LYS  10           2HD      LYS  10  -3.460   9.954   3.065
   47    HE2  LYS  10           1HE      LYS  10  -1.228  10.712   3.167
   48    HE3  LYS  10           2HE      LYS  10  -1.620  10.603   1.451
   49    HZ1  LYS  10           3HZ      LYS  10  -1.779  13.120   3.013
   50    HZ2  LYS  10           1HZ      LYS  10  -1.897  12.945   1.334
   51    HZ3  LYS  10           2HZ      LYS  10  -0.423  12.661   2.113
   52    HA   PRO  11           HA       PRO  11 -10.630  10.337   1.251
   53    HB2  PRO  11           1HB      PRO  11 -11.866  10.310  -1.166
   54    HB3  PRO  11           2HB      PRO  11 -11.495  11.802  -0.294
   55    HG2  PRO  11           1HG      PRO  11 -10.011  10.506  -2.548
   56    HG3  PRO  11           2HG      PRO  11 -10.394  12.220  -2.299
   57    HD2  PRO  11           1HD      PRO  11  -7.959  11.175  -1.742
   58    HD3  PRO  11           2HD      PRO  11  -8.653  12.523  -0.819
   59    H    TYR  12           H        TYR  12  -8.413   8.498  -0.320
   60    HA   TYR  12           HA       TYR  12 -10.246   6.197  -0.517
   61    HB2  TYR  12           1HB      TYR  12  -7.726   6.735  -2.102
   62    HB3  TYR  12           2HB      TYR  12  -8.669   5.251  -2.184
   63    HD1  TYR  12           HD1      TYR  12  -8.727   8.876  -2.910
   64    HD2  TYR  12           HD2      TYR  12 -10.639   5.121  -3.506
   65    HE1  TYR  12           HE1      TYR  12 -10.135   9.877  -4.661
   66    HE2  TYR  12           HE2      TYR  12 -12.051   6.112  -5.259
   67    HH   TYR  12           HH       TYR  12 -11.997   8.024  -6.805
   68    HA   PRO  13           HA       PRO  13  -7.378   5.230   2.930
   69    HB2  PRO  13           1HB      PRO  13  -9.207   3.775   4.312
   70    HB3  PRO  13           2HB      PRO  13  -9.097   5.535   4.424
   71    HG2  PRO  13           1HG      PRO  13 -10.975   3.854   2.809
   72    HG3  PRO  13           2HG      PRO  13 -11.315   5.309   3.764
   73    HD2  PRO  13           1HD      PRO  13 -11.029   5.367   1.072
   74    HD3  PRO  13           2HD      PRO  13 -10.551   6.724   2.112
   75    H    CYS  14           H        CYS  14  -6.172   3.413   3.180
   76    HA   CYS  14           HA       CYS  14  -6.320   1.366   1.245
   77    HB2  CYS  14           1HB      CYS  14  -4.189   1.905   2.194
   78    HB3  CYS  14           2HB      CYS  14  -4.769   1.589   3.826
   79    H    GLU  15           H        GLU  15  -6.493  -0.969   1.713
   80    HA   GLU  15           HA       GLU  15  -8.756  -1.455   3.508
   81    HB2  GLU  15           1HB      GLU  15  -9.274  -2.223   1.352
   82    HB3  GLU  15           2HB      GLU  15  -7.668  -2.895   1.107
   83    HG2  GLU  15           1HG      GLU  15  -8.127  -4.796   2.297
   84    HG3  GLU  15           2HG      GLU  15  -9.379  -4.020   3.264
   85    H    ILE  16           H        ILE  16  -5.496  -2.585   2.780
   86    HA   ILE  16           HA       ILE  16  -5.464  -4.728   4.627
   87    HB   ILE  16           HB       ILE  16  -3.119  -3.125   3.599
   88   HG12  ILE  16          1HG1      ILE  16  -3.041  -5.376   2.154
   89   HG13  ILE  16          2HG1      ILE  16  -4.779  -5.297   2.422
   90   HG21  ILE  16          1HG2      ILE  16  -1.947  -5.357   4.022
   91   HG22  ILE  16          2HG2      ILE  16  -2.340  -4.363   5.424
   92   HG23  ILE  16          3HG2      ILE  16  -3.343  -5.757   5.021
   93   HD11  ILE  16          3HD1      ILE  16  -3.369  -4.039   0.423
   94   HD12  ILE  16          1HD1      ILE  16  -5.023  -3.682   0.921
   95   HD13  ILE  16          2HD1      ILE  16  -3.681  -2.751   1.586
   96    H    CYS  17           H        CYS  17  -3.498  -1.773   4.890
   97    HA   CYS  17           HA       CYS  17  -3.591  -1.993   7.789
   98    HB2  CYS  17           1HB      CYS  17  -1.891  -0.214   7.761
   99    HB3  CYS  17           2HB      CYS  17  -1.430  -1.566   6.731
  100    H    GLY  18           H        GLY  18  -4.371   0.411   5.285
  101    HA2  GLY  18           1HA      GLY  18  -6.654   1.444   5.751
  102    HA3  GLY  18           2HA      GLY  18  -5.950   1.874   7.303
  103    H    THR  19           H        THR  19  -3.314   2.378   5.983
  104    HA   THR  19           HA       THR  19  -3.272   5.072   5.818
  105    HB   THR  19           HB       THR  19  -1.664   3.116   4.175
  106    HG1  THR  19           HG1      THR  19  -1.485   3.266   6.566
  107   HG21  THR  19          3HG2      THR  19  -1.725   6.060   4.115
  108   HG22  THR  19          1HG2      THR  19  -1.141   4.913   2.910
  109   HG23  THR  19          2HG2      THR  19  -0.123   5.343   4.284
  110    H    ARG  20           H        ARG  20  -4.193   6.576   4.595
  111    HA   ARG  20           HA       ARG  20  -5.615   5.809   2.192
  112    HB2  ARG  20           1HB      ARG  20  -5.368   8.578   3.364
  113    HB3  ARG  20           2HB      ARG  20  -6.608   7.980   2.269
  114    HG2  ARG  20           1HG      ARG  20  -7.761   6.927   3.922
  115    HG3  ARG  20           2HG      ARG  20  -6.317   6.627   4.891
  116    HD2  ARG  20           1HD      ARG  20  -7.183   9.443   4.496
  117    HD3  ARG  20           2HD      ARG  20  -8.126   8.432   5.590
  118    HE   ARG  20           HE       ARG  20  -5.432   9.406   5.998
  119   HH11  ARG  20          1HH1      ARG  20  -7.896   7.145   6.968
  120   HH12  ARG  20          2HH1      ARG  20  -7.215   6.877   8.538
  121   HH21  ARG  20          1HH2      ARG  20  -4.526   9.061   8.063
  122   HH22  ARG  20          2HH2      ARG  20  -5.299   7.968   9.161
  123    H    PHE  21           H        PHE  21  -5.492   7.425   0.305
  124    HA   PHE  21           HA       PHE  21  -2.802   8.455  -0.144
  125    HB2  PHE  21           1HB      PHE  21  -4.098   6.297  -1.806
  126    HB3  PHE  21           2HB      PHE  21  -2.801   7.313  -2.428
  127    HD1  PHE  21           HD2      PHE  21  -3.608   5.067   0.428
  128    HD2  PHE  21           HD1      PHE  21  -0.609   6.662  -2.136
  129    HE1  PHE  21           HE2      PHE  21  -1.947   3.557   1.437
  130    HE2  PHE  21           HE1      PHE  21   1.056   5.153  -1.133
  131    HZ   PHE  21           HZ       PHE  21   0.388   3.599   0.657
  132    H    ARG  22           H        ARG  22  -2.789  10.279  -1.329
  133    HA   ARG  22           HA       ARG  22  -4.852  11.922  -1.720
  134    HB2  ARG  22           1HB      ARG  22  -3.634  13.009  -3.531
  135    HB3  ARG  22           2HB      ARG  22  -2.528  12.514  -2.257
  136    HG2  ARG  22           1HG      ARG  22  -2.185  10.400  -3.708
  137    HG3  ARG  22           2HG      ARG  22  -2.875  11.385  -5.000
  138    HD2  ARG  22           1HD      ARG  22  -0.525  12.220  -3.307
  139    HD3  ARG  22           2HD      ARG  22  -0.378  11.426  -4.874
  140    HE   ARG  22           HE       ARG  22  -1.944  13.545  -5.433
  141   HH11  ARG  22          1HH1      ARG  22   1.093  13.229  -3.760
  142   HH12  ARG  22          2HH1      ARG  22   1.655  14.805  -4.212
  143   HH21  ARG  22          1HH2      ARG  22  -1.215  15.621  -6.035
  144   HH22  ARG  22          2HH2      ARG  22   0.341  16.164  -5.506
  145    H    HIS  23           H        HIS  23  -3.862   9.470  -4.096
  146    HA   HIS  23           HA       HIS  23  -6.542   9.695  -5.301
  147    HB2  HIS  23           1HB      HIS  23  -3.849   9.551  -6.569
  148    HB3  HIS  23           2HB      HIS  23  -5.180   8.727  -7.375
  149    HD2  HIS  23           HD2      HIS  23  -4.627  12.412  -6.006
  150    HE1  HIS  23           HE1      HIS  23  -6.865  12.526  -9.608
  151    HE2  HIS  23           HE2      HIS  23  -5.720  13.889  -7.827
  152    H    LEU  24           H        LEU  24  -7.191   7.679  -6.496
  153    HA   LEU  24           HA       LEU  24  -6.840   5.422  -4.743
  154    HB2  LEU  24           1HB      LEU  24  -9.018   5.999  -5.741
  155    HB3  LEU  24           2HB      LEU  24  -8.362   5.643  -7.337
  156    HG   LEU  24           HG       LEU  24  -9.755   3.819  -6.578
  157   HD11  LEU  24          1HD1      LEU  24  -8.315   2.060  -7.081
  158   HD12  LEU  24          2HD1      LEU  24  -6.936   2.838  -6.304
  159   HD13  LEU  24          3HD1      LEU  24  -7.548   3.456  -7.838
  160   HD21  LEU  24          3HD2      LEU  24  -8.334   4.273  -4.080
  161   HD22  LEU  24          1HD2      LEU  24  -8.387   2.571  -4.539
  162   HD23  LEU  24          2HD2      LEU  24  -9.886   3.487  -4.376
  163    H    GLN  25           H        GLN  25  -6.492   5.780  -8.279
  164    HA   GLN  25           HA       GLN  25  -5.355   3.501  -9.041
  165    HB2  GLN  25           1HB      GLN  25  -3.919   4.778 -10.629
  166    HB3  GLN  25           2HB      GLN  25  -5.594   5.313 -10.604
  167    HG2  GLN  25           1HG      GLN  25  -5.086   7.306  -9.570
  168    HG3  GLN  25           2HG      GLN  25  -3.580   6.690  -8.891
  169   HE21  GLN  25          1HE2      GLN  25  -1.779   7.300  -9.847
  170   HE22  GLN  25          2HE2      GLN  25  -1.638   7.912 -11.456
  171    H    THR  26           H        THR  26  -3.758   5.929  -7.072
  172    HA   THR  26           HA       THR  26  -1.184   4.688  -7.140
  173    HB   THR  26           HB       THR  26  -2.277   6.675  -5.137
  174    HG1  THR  26           HG1      THR  26  -1.948   7.080  -7.637
  175   HG21  THR  26          3HG2      THR  26  -0.367   6.178  -4.061
  176   HG22  THR  26          1HG2      THR  26   0.420   7.094  -5.345
  177   HG23  THR  26          2HG2      THR  26   0.310   5.337  -5.455
  178    H    LEU  27           H        LEU  27  -3.708   4.908  -4.630
  179    HA   LEU  27           HA       LEU  27  -2.576   3.424  -2.639
  180    HB2  LEU  27           1HB      LEU  27  -4.668   4.430  -2.240
  181    HB3  LEU  27           2HB      LEU  27  -5.423   3.572  -3.582
  182    HG   LEU  27           HG       LEU  27  -5.256   1.472  -2.310
  183   HD11  LEU  27          1HD1      LEU  27  -4.216   3.235  -0.097
  184   HD12  LEU  27          2HD1      LEU  27  -3.300   2.004  -0.964
  185   HD13  LEU  27          3HD1      LEU  27  -4.657   1.535   0.059
  186   HD21  LEU  27          3HD2      LEU  27  -6.965   3.666  -1.819
  187   HD22  LEU  27          1HD2      LEU  27  -6.627   2.909  -0.262
  188   HD23  LEU  27          2HD2      LEU  27  -7.296   1.949  -1.582
  189    H    LYS  28           H        LYS  28  -4.336   2.183  -5.458
  190    HA   LYS  28           HA       LYS  28  -4.370  -0.511  -4.852
  191    HB2  LYS  28           1HB      LYS  28  -4.284   1.031  -7.409
  192    HB3  LYS  28           2HB      LYS  28  -4.082  -0.715  -7.472
  193    HG2  LYS  28           1HG      LYS  28  -6.225  -1.100  -6.578
  194    HG3  LYS  28           2HG      LYS  28  -6.401   0.583  -6.074
  195    HD2  LYS  28           1HD      LYS  28  -6.755   1.325  -8.255
  196    HD3  LYS  28           2HD      LYS  28  -6.040  -0.124  -8.965
  197    HE2  LYS  28           1HE      LYS  28  -7.990  -1.391  -7.921
  198    HE3  LYS  28           2HE      LYS  28  -8.726   0.188  -7.651
  199    HZ1  LYS  28           3HZ      LYS  28  -8.154  -1.176 -10.197
  200    HZ2  LYS  28           1HZ      LYS  28  -8.262   0.512 -10.152
  201    HZ3  LYS  28           2HZ      LYS  28  -9.583  -0.433  -9.681
  202    H    SER  29           H        SER  29  -1.743   1.442  -6.136
  203    HA   SER  29           HA       SER  29  -0.018  -0.785  -6.657
  204    HB2  SER  29           1HB      SER  29   0.710   2.138  -6.350
  205    HB3  SER  29           2HB      SER  29   1.690   0.885  -7.112
  206    HG   SER  29           HG       SER  29  -0.912   1.452  -8.036
  207    H    HIS  30           H        HIS  30  -0.815   1.101  -3.897
  208    HA   HIS  30           HA       HIS  30   1.593   0.618  -2.426
  209    HB2  HIS  30           1HB      HIS  30   0.546   2.461  -1.558
  210    HB3  HIS  30           2HB      HIS  30  -1.067   1.820  -1.857
  211    HD1  HIS  30           HD1      HIS  30   1.826   1.299   0.546
  212    HD2  HIS  30           HD2      HIS  30  -2.297   0.826   0.352
  213    HE1  HIS  30           HE1      HIS  30   1.119   0.617   2.861
  214    H    LEU  31           H        LEU  31  -1.446  -1.037  -2.857
  215    HA   LEU  31           HA       LEU  31  -1.297  -2.751  -0.617
  216    HB2  LEU  31           1HB      LEU  31  -2.572  -3.559  -3.200
  217    HB3  LEU  31           2HB      LEU  31  -3.077  -3.920  -1.551
  218    HG   LEU  31           HG       LEU  31  -3.474  -1.399  -3.130
  219   HD11  LEU  31          1HD1      LEU  31  -5.097  -3.614  -2.222
  220   HD12  LEU  31          2HD1      LEU  31  -5.464  -2.351  -3.397
  221   HD13  LEU  31          3HD1      LEU  31  -5.740  -2.064  -1.679
  222   HD21  LEU  31          3HD2      LEU  31  -2.606  -0.632  -1.031
  223   HD22  LEU  31          1HD2      LEU  31  -3.647  -1.742  -0.141
  224   HD23  LEU  31          2HD2      LEU  31  -4.354  -0.394  -1.031
  225    H    ARG  32           H        ARG  32   0.671  -2.557  -3.296
  226    HA   ARG  32           HA       ARG  32   1.171  -5.261  -3.900
  227    HB2  ARG  32           1HB      ARG  32   2.565  -2.679  -4.352
  228    HB3  ARG  32           2HB      ARG  32   3.538  -4.138  -4.481
  229    HG2  ARG  32           1HG      ARG  32   2.716  -3.517  -6.653
  230    HG3  ARG  32           2HG      ARG  32   1.949  -5.021  -6.142
  231    HD2  ARG  32           1HD      ARG  32  -0.101  -4.013  -5.798
  232    HD3  ARG  32           2HD      ARG  32   0.608  -2.414  -5.580
  233    HE   ARG  32           HE       ARG  32   0.590  -2.113  -7.868
  234   HH11  ARG  32          1HH1      ARG  32  -0.220  -5.406  -7.082
  235   HH12  ARG  32          2HH1      ARG  32  -0.747  -5.796  -8.685
  236   HH21  ARG  32          1HH2      ARG  32  -0.100  -2.615  -9.983
  237   HH22  ARG  32          2HH2      ARG  32  -0.678  -4.208 -10.335
  238    H    ILE  33           H        ILE  33   2.679  -3.042  -1.586
  239    HA   ILE  33           HA       ILE  33   4.673  -4.835  -0.692
  240    HB   ILE  33           HB       ILE  33   5.109  -3.317   1.064
  241   HG12  ILE  33          1HG1      ILE  33   2.403  -2.051   0.593
  242   HG13  ILE  33          2HG1      ILE  33   2.734  -3.219   1.868
  243   HG21  ILE  33          1HG2      ILE  33   4.384  -2.211  -1.559
  244   HG22  ILE  33          2HG2      ILE  33   4.542  -1.025  -0.264
  245   HG23  ILE  33          3HG2      ILE  33   5.891  -2.093  -0.652
  246   HD11  ILE  33          3HD1      ILE  33   2.827  -0.581   2.234
  247   HD12  ILE  33          1HD1      ILE  33   3.827  -1.715   3.142
  248   HD13  ILE  33          2HD1      ILE  33   4.501  -0.861   1.754
  249    H    HIS  34           H        HIS  34   1.326  -4.361   0.176
  250    HA   HIS  34           HA       HIS  34   1.375  -5.770   2.635
  251    HB2  HIS  34           1HB      HIS  34  -0.813  -5.024   0.709
  252    HB3  HIS  34           2HB      HIS  34  -1.146  -6.013   2.128
  253    HD1  HIS  34           HD1      HIS  34   0.336  -4.650   4.322
  254    HD2  HIS  34           HD2      HIS  34  -1.639  -2.535   1.341
  255    HE1  HIS  34           HE1      HIS  34  -0.109  -2.375   5.295
  256    H    THR  35           H        THR  35   0.254  -6.759  -0.604
  257    HA   THR  35           HA       THR  35   0.359  -9.557   0.255
  258    HB   THR  35           HB       THR  35  -1.703  -8.767  -0.868
  259    HG1  THR  35           HG1      THR  35  -0.093 -10.798  -1.982
  260   HG21  THR  35          3HG2      THR  35  -1.703  -8.228  -3.222
  261   HG22  THR  35          1HG2      THR  35   0.035  -8.503  -3.323
  262   HG23  THR  35          2HG2      THR  35  -0.590  -7.145  -2.388
  263    H    GLY  36           H        GLY  36   1.972 -10.860  -0.328
  264    HA2  GLY  36           1HA      GLY  36   3.276 -11.643  -2.326
  265    HA3  GLY  36           2HA      GLY  36   3.744  -9.960  -2.514
  266    H    SER  37           H        SER  37   4.217  -9.324   0.179
  267    HA   SER  37           HA       SER  37   6.265 -11.207   1.071
  268    HB2  SER  37           1HB      SER  37   7.997  -9.525   1.183
  269    HB3  SER  37           2HB      SER  37   7.369  -9.567  -0.464
  270    HG   SER  37           HG       SER  37   7.315  -7.548   1.377
  271    H    GLY  38           H        GLY  38   7.261 -10.379   3.200
  272    HA2  GLY  38           1HA      GLY  38   6.772  -8.800   5.084
  273    HA3  GLY  38           2HA      GLY  38   5.083  -9.204   4.816
  274    HA   PRO  39           HA       PRO  39   6.470 -11.942   8.216
  275    HB2  PRO  39           1HB      PRO  39   4.075 -11.915   9.493
  276    HB3  PRO  39           2HB      PRO  39   5.296 -10.656   9.715
  277    HG2  PRO  39           1HG      PRO  39   2.851 -10.641   7.987
  278    HG3  PRO  39           2HG      PRO  39   3.494  -9.357   9.027
  279    HD2  PRO  39           1HD      PRO  39   3.870  -9.385   6.346
  280    HD3  PRO  39           2HD      PRO  39   5.066  -8.710   7.471
  281    H    SER  40           H        SER  40   4.545 -12.242   5.562
  282    HA   SER  40           HA       SER  40   3.167 -14.675   6.270
  283    HB2  SER  40           1HB      SER  40   2.453 -14.697   3.916
  284    HB3  SER  40           2HB      SER  40   2.180 -13.115   4.647
  285    HG   SER  40           HG       SER  40   3.141 -12.874   2.619
  286    H    SER  41           H        SER  41   5.872 -14.948   6.775
  287    HA   SER  41           HA       SER  41   7.539 -15.951   4.855
  288    HB2  SER  41           1HB      SER  41   7.171 -17.041   7.657
  289    HB3  SER  41           2HB      SER  41   8.579 -17.312   6.630
  290    HG   SER  41           HG       SER  41   9.000 -15.096   6.701
  291    H    GLY  42           H        GLY  42   7.157 -17.396   3.317
  292    HA2  GLY  42           1HA      GLY  42   5.938 -19.956   4.071
  293    HA3  GLY  42           2HA      GLY  42   5.217 -19.049   2.750
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1  -3.572  23.182  19.808
    2    HA2  GLY   1           1HA      GLY   1  -4.466  24.353  17.605
    3    HA3  GLY   1           2HA      GLY   1  -3.514  25.668  18.278
    4    H    SER   2           H        SER   2  -2.949  22.158  18.093
    5    HA   SER   2           HA       SER   2  -0.445  22.747  16.653
    6    HB2  SER   2           1HB      SER   2   0.483  20.695  17.772
    7    HB3  SER   2           2HB      SER   2   0.129  22.023  18.877
    8    HG   SER   2           HG       SER   2  -1.941  20.241  18.456
    9    H    SER   3           H        SER   3  -1.190  22.355  14.602
   10    HA   SER   3           HA       SER   3  -1.417  19.604  13.831
   11    HB2  SER   3           1HB      SER   3  -3.645  19.822  12.756
   12    HB3  SER   3           2HB      SER   3  -3.729  19.962  14.512
   13    HG   SER   3           HG       SER   3  -4.891  21.580  13.124
   14    H    GLY   4           H        GLY   4  -0.213  19.501  12.062
   15    HA2  GLY   4           1HA      GLY   4  -0.162  21.842  10.265
   16    HA3  GLY   4           2HA      GLY   4   1.165  20.708  10.464
   17    H    SER   5           H        SER   5  -0.373  21.602   8.064
   18    HA   SER   5           HA       SER   5  -0.604  19.014   6.841
   19    HB2  SER   5           1HB      SER   5  -2.902  19.028   6.283
   20    HB3  SER   5           2HB      SER   5  -2.855  19.452   7.994
   21    HG   SER   5           HG       SER   5  -2.702  21.729   6.854
   22    H    SER   6           H        SER   6  -0.050  19.137   4.753
   23    HA   SER   6           HA       SER   6  -0.581  21.482   3.165
   24    HB2  SER   6           1HB      SER   6   1.681  22.116   2.714
   25    HB3  SER   6           2HB      SER   6   1.517  22.040   4.469
   26    HG   SER   6           HG       SER   6   2.887  20.439   4.524
   27    H    GLY   7           H        GLY   7  -1.143  20.738   1.235
   28    HA2  GLY   7           1HA      GLY   7   0.037  19.485  -0.701
   29    HA3  GLY   7           2HA      GLY   7  -0.121  18.114   0.388
   30    H    GLY   8           H        GLY   8  -2.040  17.045   0.529
   31    HA2  GLY   8           1HA      GLY   8  -4.430  18.225  -0.656
   32    HA3  GLY   8           2HA      GLY   8  -3.795  16.790  -1.448
   33    H    GLU   9           H        GLU   9  -5.814  15.760  -0.955
   34    HA   GLU   9           HA       GLU   9  -5.941  14.829   1.837
   35    HB2  GLU   9           1HB      GLU   9  -8.427  14.586   1.459
   36    HB3  GLU   9           2HB      GLU   9  -7.832  16.238   1.559
   37    HG2  GLU   9           1HG      GLU   9  -8.100  14.943  -1.110
   38    HG3  GLU   9           2HG      GLU   9  -9.537  15.546  -0.286
   39    H    LYS  10           H        LYS  10  -6.528  12.669   2.173
   40    HA   LYS  10           HA       LYS  10  -6.229  10.962  -0.207
   41    HB2  LYS  10           1HB      LYS  10  -5.591  10.425   2.697
   42    HB3  LYS  10           2HB      LYS  10  -5.534   9.197   1.440
   43    HG2  LYS  10           1HG      LYS  10  -3.348   9.799   1.462
   44    HG3  LYS  10           2HG      LYS  10  -3.946  10.972   0.286
   45    HD2  LYS  10           1HD      LYS  10  -4.305  12.517   2.303
   46    HD3  LYS  10           2HD      LYS  10  -3.272  11.388   3.183
   47    HE2  LYS  10           1HE      LYS  10  -1.974  13.252   2.303
   48    HE3  LYS  10           2HE      LYS  10  -1.493  11.736   1.542
   49    HZ1  LYS  10           3HZ      LYS  10  -2.743  12.300  -0.400
   50    HZ2  LYS  10           1HZ      LYS  10  -1.729  13.604  -0.031
   51    HZ3  LYS  10           2HZ      LYS  10  -3.379  13.685   0.334
   52    HA   PRO  11           HA       PRO  11 -10.606  10.410   1.243
   53    HB2  PRO  11           1HB      PRO  11 -11.685  10.477  -1.247
   54    HB3  PRO  11           2HB      PRO  11 -11.385  11.933  -0.291
   55    HG2  PRO  11           1HG      PRO  11  -9.748  10.745  -2.498
   56    HG3  PRO  11           2HG      PRO  11 -10.162  12.443  -2.202
   57    HD2  PRO  11           1HD      PRO  11  -7.757  11.393  -1.535
   58    HD3  PRO  11           2HD      PRO  11  -8.522  12.695  -0.602
   59    H    TYR  12           H        TYR  12  -8.278   8.662  -0.289
   60    HA   TYR  12           HA       TYR  12 -10.071   6.355  -0.682
   61    HB2  TYR  12           1HB      TYR  12  -7.477   6.993  -2.100
   62    HB3  TYR  12           2HB      TYR  12  -8.382   5.496  -2.292
   63    HD1  TYR  12           HD1      TYR  12  -8.470   9.143  -2.887
   64    HD2  TYR  12           HD2      TYR  12 -10.282   5.384  -3.716
   65    HE1  TYR  12           HE1      TYR  12  -9.802  10.186  -4.672
   66    HE2  TYR  12           HE2      TYR  12 -11.618   6.416  -5.505
   67    HH   TYR  12           HH       TYR  12 -12.461   8.960  -5.936
   68    HA   PRO  13           HA       PRO  13  -7.388   5.265   2.876
   69    HB2  PRO  13           1HB      PRO  13  -9.276   3.743   4.095
   70    HB3  PRO  13           2HB      PRO  13  -9.187   5.498   4.286
   71    HG2  PRO  13           1HG      PRO  13 -10.961   3.873   2.503
   72    HG3  PRO  13           2HG      PRO  13 -11.364   5.286   3.497
   73    HD2  PRO  13           1HD      PRO  13 -10.933   5.457   0.829
   74    HD3  PRO  13           2HD      PRO  13 -10.524   6.772   1.949
   75    H    CYS  14           H        CYS  14  -6.360   3.320   3.360
   76    HA   CYS  14           HA       CYS  14  -6.392   1.359   1.260
   77    HB2  CYS  14           1HB      CYS  14  -4.264   1.938   2.214
   78    HB3  CYS  14           2HB      CYS  14  -4.830   1.562   3.838
   79    H    GLU  15           H        GLU  15  -6.534  -0.979   1.708
   80    HA   GLU  15           HA       GLU  15  -8.771  -1.509   3.526
   81    HB2  GLU  15           1HB      GLU  15  -9.230  -2.203   1.291
   82    HB3  GLU  15           2HB      GLU  15  -7.674  -3.010   1.152
   83    HG2  GLU  15           1HG      GLU  15  -9.065  -4.793   1.471
   84    HG3  GLU  15           2HG      GLU  15  -8.569  -4.456   3.129
   85    H    ILE  16           H        ILE  16  -5.505  -2.577   2.749
   86    HA   ILE  16           HA       ILE  16  -5.422  -4.754   4.554
   87    HB   ILE  16           HB       ILE  16  -3.127  -3.090   3.509
   88   HG12  ILE  16          1HG1      ILE  16  -2.999  -5.349   2.081
   89   HG13  ILE  16          2HG1      ILE  16  -4.735  -5.323   2.373
   90   HG21  ILE  16          1HG2      ILE  16  -2.060  -5.505   3.905
   91   HG22  ILE  16          2HG2      ILE  16  -2.072  -4.251   5.144
   92   HG23  ILE  16          3HG2      ILE  16  -3.285  -5.531   5.173
   93   HD11  ILE  16          3HD1      ILE  16  -3.301  -3.961   0.396
   94   HD12  ILE  16          1HD1      ILE  16  -5.017  -3.824   0.777
   95   HD13  ILE  16          2HD1      ILE  16  -3.856  -2.734   1.535
   96    H    CYS  17           H        CYS  17  -3.518  -1.761   4.854
   97    HA   CYS  17           HA       CYS  17  -3.602  -2.035   7.754
   98    HB2  CYS  17           1HB      CYS  17  -1.912  -0.221   7.736
   99    HB3  CYS  17           2HB      CYS  17  -1.431  -1.604   6.758
  100    H    GLY  18           H        GLY  18  -4.343   0.419   5.284
  101    HA2  GLY  18           1HA      GLY  18  -6.635   1.446   5.757
  102    HA3  GLY  18           2HA      GLY  18  -5.927   1.861   7.311
  103    H    THR  19           H        THR  19  -3.293   2.312   5.874
  104    HA   THR  19           HA       THR  19  -3.185   5.010   5.788
  105    HB   THR  19           HB       THR  19  -1.711   3.028   4.061
  106    HG1  THR  19           HG1      THR  19  -1.341   4.259   6.531
  107   HG21  THR  19          3HG2      THR  19  -1.552   4.958   2.745
  108   HG22  THR  19          1HG2      THR  19  -0.096   5.005   3.737
  109   HG23  THR  19          2HG2      THR  19  -1.477   6.021   4.150
  110    H    ARG  20           H        ARG  20  -4.094   6.583   4.643
  111    HA   ARG  20           HA       ARG  20  -5.608   5.906   2.250
  112    HB2  ARG  20           1HB      ARG  20  -5.434   8.622   3.542
  113    HB3  ARG  20           2HB      ARG  20  -6.709   7.987   2.510
  114    HG2  ARG  20           1HG      ARG  20  -7.694   6.823   4.200
  115    HG3  ARG  20           2HG      ARG  20  -6.177   6.589   5.071
  116    HD2  ARG  20           1HD      ARG  20  -6.306   8.614   6.120
  117    HD3  ARG  20           2HD      ARG  20  -7.213   9.359   4.804
  118    HE   ARG  20           HE       ARG  20  -8.288   7.900   7.060
  119   HH11  ARG  20          1HH1      ARG  20  -8.865   9.190   3.879
  120   HH12  ARG  20          2HH1      ARG  20 -10.587   9.227   4.063
  121   HH21  ARG  20          1HH2      ARG  20 -10.554   7.943   7.315
  122   HH22  ARG  20          2HH2      ARG  20 -11.547   8.518   6.019
  123    H    PHE  21           H        PHE  21  -5.395   7.050   0.272
  124    HA   PHE  21           HA       PHE  21  -2.809   8.409  -0.092
  125    HB2  PHE  21           1HB      PHE  21  -4.066   6.284  -1.827
  126    HB3  PHE  21           2HB      PHE  21  -2.781   7.341  -2.401
  127    HD1  PHE  21           HD2      PHE  21  -3.584   4.930   0.312
  128    HD2  PHE  21           HD1      PHE  21  -0.568   6.755  -2.072
  129    HE1  PHE  21           HE2      PHE  21  -1.908   3.405   1.271
  130    HE2  PHE  21           HE1      PHE  21   1.113   5.233  -1.117
  131    HZ   PHE  21           HZ       PHE  21   0.444   3.556   0.558
  132    H    ARG  22           H        ARG  22  -2.750  10.085  -1.588
  133    HA   ARG  22           HA       ARG  22  -4.859  11.787  -1.790
  134    HB2  ARG  22           1HB      ARG  22  -2.559  12.378  -2.421
  135    HB3  ARG  22           2HB      ARG  22  -2.702  11.396  -3.872
  136    HG2  ARG  22           1HG      ARG  22  -3.112  13.470  -4.729
  137    HG3  ARG  22           2HG      ARG  22  -4.756  12.957  -4.344
  138    HD2  ARG  22           1HD      ARG  22  -4.363  15.239  -3.596
  139    HD3  ARG  22           2HD      ARG  22  -4.637  14.167  -2.223
  140    HE   ARG  22           HE       ARG  22  -2.488  14.564  -1.520
  141   HH11  ARG  22          1HH1      ARG  22  -2.874  15.714  -4.783
  142   HH12  ARG  22          2HH1      ARG  22  -1.342  16.523  -4.817
  143   HH21  ARG  22          1HH2      ARG  22  -0.470  15.626  -1.552
  144   HH22  ARG  22          2HH2      ARG  22   0.025  16.472  -2.980
  145    H    HIS  23           H        HIS  23  -3.879   9.516  -4.362
  146    HA   HIS  23           HA       HIS  23  -6.630   9.670  -5.408
  147    HB2  HIS  23           1HB      HIS  23  -3.977   9.505  -6.763
  148    HB3  HIS  23           2HB      HIS  23  -5.350   8.711  -7.529
  149    HD2  HIS  23           HD2      HIS  23  -6.269  12.010  -5.793
  150    HE1  HIS  23           HE1      HIS  23  -5.869  12.828  -9.937
  151    HE2  HIS  23           HE2      HIS  23  -6.547  13.745  -7.691
  152    H    LEU  24           H        LEU  24  -7.264   7.645  -6.652
  153    HA   LEU  24           HA       LEU  24  -6.943   5.394  -4.890
  154    HB2  LEU  24           1HB      LEU  24  -9.088   6.023  -6.005
  155    HB3  LEU  24           2HB      LEU  24  -8.377   5.519  -7.537
  156    HG   LEU  24           HG       LEU  24  -9.871   3.813  -6.651
  157   HD11  LEU  24          1HD1      LEU  24  -8.488   1.976  -7.027
  158   HD12  LEU  24          2HD1      LEU  24  -7.083   2.766  -6.312
  159   HD13  LEU  24          3HD1      LEU  24  -7.684   3.291  -7.885
  160   HD21  LEU  24          3HD2      LEU  24  -8.409   2.740  -4.508
  161   HD22  LEU  24          1HD2      LEU  24 -10.006   3.488  -4.460
  162   HD23  LEU  24          2HD2      LEU  24  -8.565   4.467  -4.184
  163    H    GLN  25           H        GLN  25  -6.477   5.778  -8.410
  164    HA   GLN  25           HA       GLN  25  -5.333   3.493  -9.153
  165    HB2  GLN  25           1HB      GLN  25  -3.840   4.776 -10.684
  166    HB3  GLN  25           2HB      GLN  25  -5.514   5.314 -10.711
  167    HG2  GLN  25           1HG      GLN  25  -5.014   7.254  -9.466
  168    HG3  GLN  25           2HG      GLN  25  -3.411   6.656  -9.043
  169   HE21  GLN  25          1HE2      GLN  25  -1.762   7.287 -10.249
  170   HE22  GLN  25          2HE2      GLN  25  -1.875   8.039 -11.801
  171    H    THR  26           H        THR  26  -3.768   5.919  -7.146
  172    HA   THR  26           HA       THR  26  -1.210   4.646  -7.130
  173    HB   THR  26           HB       THR  26  -2.343   6.668  -5.186
  174    HG1  THR  26           HG1      THR  26  -1.946   7.068  -7.652
  175   HG21  THR  26          3HG2      THR  26   0.475   6.847  -5.496
  176   HG22  THR  26          1HG2      THR  26   0.074   5.168  -5.139
  177   HG23  THR  26          2HG2      THR  26  -0.444   6.451  -4.045
  178    H    LEU  27           H        LEU  27  -3.873   4.837  -4.775
  179    HA   LEU  27           HA       LEU  27  -2.814   3.397  -2.699
  180    HB2  LEU  27           1HB      LEU  27  -4.940   4.397  -2.437
  181    HB3  LEU  27           2HB      LEU  27  -5.614   3.483  -3.785
  182    HG   LEU  27           HG       LEU  27  -5.570   1.449  -2.474
  183   HD11  LEU  27          1HD1      LEU  27  -4.342   3.157  -0.316
  184   HD12  LEU  27          2HD1      LEU  27  -3.571   1.823  -1.174
  185   HD13  LEU  27          3HD1      LEU  27  -4.930   1.509  -0.095
  186   HD21  LEU  27          3HD2      LEU  27  -6.868   2.737  -0.375
  187   HD22  LEU  27          1HD2      LEU  27  -7.595   2.130  -1.863
  188   HD23  LEU  27          2HD2      LEU  27  -7.068   3.810  -1.761
  189    H    LYS  28           H        LYS  28  -4.411   2.119  -5.596
  190    HA   LYS  28           HA       LYS  28  -4.413  -0.579  -4.947
  191    HB2  LYS  28           1HB      LYS  28  -4.227   0.879  -7.569
  192    HB3  LYS  28           2HB      LYS  28  -4.197  -0.879  -7.510
  193    HG2  LYS  28           1HG      LYS  28  -6.379  -1.017  -6.731
  194    HG3  LYS  28           2HG      LYS  28  -6.388   0.656  -6.170
  195    HD2  LYS  28           1HD      LYS  28  -6.640   1.504  -8.328
  196    HD3  LYS  28           2HD      LYS  28  -6.079   0.009  -9.082
  197    HE2  LYS  28           1HE      LYS  28  -8.578   0.021  -7.438
  198    HE3  LYS  28           2HE      LYS  28  -8.614   0.601  -9.102
  199    HZ1  LYS  28           3HZ      LYS  28  -7.896  -1.499  -9.889
  200    HZ2  LYS  28           1HZ      LYS  28  -9.159  -1.800  -8.804
  201    HZ3  LYS  28           2HZ      LYS  28  -7.556  -2.059  -8.329
  202    H    SER  29           H        SER  29  -1.794   1.476  -5.953
  203    HA   SER  29           HA       SER  29  -0.006  -0.719  -6.533
  204    HB2  SER  29           1HB      SER  29   0.600   2.233  -6.230
  205    HB3  SER  29           2HB      SER  29   1.674   1.014  -6.918
  206    HG   SER  29           HG       SER  29   0.227   2.402  -8.352
  207    H    HIS  30           H        HIS  30  -0.966   1.080  -3.786
  208    HA   HIS  30           HA       HIS  30   1.430   0.693  -2.255
  209    HB2  HIS  30           1HB      HIS  30   0.277   2.511  -1.444
  210    HB3  HIS  30           2HB      HIS  30  -1.298   1.776  -1.730
  211    HD1  HIS  30           HD1      HIS  30   1.642   1.344   0.645
  212    HD2  HIS  30           HD2      HIS  30  -2.482   0.853   0.523
  213    HE1  HIS  30           HE1      HIS  30   0.974   0.682   2.978
  214    H    LEU  31           H        LEU  31  -1.362  -1.178  -2.974
  215    HA   LEU  31           HA       LEU  31  -1.249  -2.873  -0.668
  216    HB2  LEU  31           1HB      LEU  31  -2.488  -3.738  -3.238
  217    HB3  LEU  31           2HB      LEU  31  -3.024  -4.021  -1.583
  218    HG   LEU  31           HG       LEU  31  -3.371  -1.552  -3.261
  219   HD11  LEU  31          1HD1      LEU  31  -5.120  -3.654  -2.103
  220   HD12  LEU  31          2HD1      LEU  31  -5.200  -2.848  -3.669
  221   HD13  LEU  31          3HD1      LEU  31  -5.753  -2.011  -2.218
  222   HD21  LEU  31          3HD2      LEU  31  -3.657  -1.861  -0.280
  223   HD22  LEU  31          1HD2      LEU  31  -4.418  -0.565  -1.203
  224   HD23  LEU  31          2HD2      LEU  31  -2.660  -0.701  -1.159
  225    H    ARG  32           H        ARG  32   0.820  -2.517  -3.188
  226    HA   ARG  32           HA       ARG  32   1.379  -5.231  -3.856
  227    HB2  ARG  32           1HB      ARG  32   2.672  -2.594  -4.352
  228    HB3  ARG  32           2HB      ARG  32   3.655  -4.038  -4.548
  229    HG2  ARG  32           1HG      ARG  32   2.696  -3.359  -6.664
  230    HG3  ARG  32           2HG      ARG  32   2.039  -4.917  -6.160
  231    HD2  ARG  32           1HD      ARG  32  -0.029  -3.990  -5.586
  232    HD3  ARG  32           2HD      ARG  32   0.622  -2.352  -5.525
  233    HE   ARG  32           HE       ARG  32  -0.476  -3.636  -7.786
  234   HH11  ARG  32          1HH1      ARG  32   2.133  -1.529  -6.851
  235   HH12  ARG  32          2HH1      ARG  32   2.239  -0.758  -8.399
  236   HH21  ARG  32          1HH2      ARG  32  -0.347  -2.628  -9.828
  237   HH22  ARG  32          2HH2      ARG  32   0.827  -1.383 -10.091
  238    H    ILE  33           H        ILE  33   2.414  -3.061  -1.342
  239    HA   ILE  33           HA       ILE  33   4.633  -4.733  -0.531
  240    HB   ILE  33           HB       ILE  33   5.093  -3.133   1.142
  241   HG12  ILE  33          1HG1      ILE  33   2.375  -1.900   0.654
  242   HG13  ILE  33          2HG1      ILE  33   2.738  -2.995   1.983
  243   HG21  ILE  33          1HG2      ILE  33   4.363  -0.932  -0.374
  244   HG22  ILE  33          2HG2      ILE  33   5.852  -1.864  -0.521
  245   HG23  ILE  33          3HG2      ILE  33   4.467  -2.249  -1.542
  246   HD11  ILE  33          3HD1      ILE  33   4.146  -0.378   1.533
  247   HD12  ILE  33          1HD1      ILE  33   2.750  -0.587   2.590
  248   HD13  ILE  33          2HD1      ILE  33   4.259  -1.431   2.943
  249    H    HIS  34           H        HIS  34   1.295  -4.681  -0.024
  250    HA   HIS  34           HA       HIS  34   1.368  -5.837   2.631
  251    HB2  HIS  34           1HB      HIS  34  -0.836  -5.152   0.701
  252    HB3  HIS  34           2HB      HIS  34  -1.153  -6.115   2.141
  253    HD1  HIS  34           HD1      HIS  34   0.296  -4.705   4.312
  254    HD2  HIS  34           HD2      HIS  34  -1.652  -2.648   1.273
  255    HE1  HIS  34           HE1      HIS  34  -0.159  -2.412   5.238
  256    H    THR  35           H        THR  35   0.487  -6.892  -0.646
  257    HA   THR  35           HA       THR  35   0.587  -9.680   0.292
  258    HB   THR  35           HB       THR  35  -1.544  -9.153  -0.710
  259    HG1  THR  35           HG1      THR  35   0.118 -11.022  -1.643
  260   HG21  THR  35          3HG2      THR  35  -0.848  -7.226  -2.055
  261   HG22  THR  35          1HG2      THR  35  -1.740  -8.394  -3.028
  262   HG23  THR  35          2HG2      THR  35   0.017  -8.302  -3.153
  263    H    GLY  36           H        GLY  36   2.073 -11.061  -0.496
  264    HA2  GLY  36           1HA      GLY  36   3.433 -11.862  -2.337
  265    HA3  GLY  36           2HA      GLY  36   3.673 -10.188  -2.815
  266    H    SER  37           H        SER  37   5.680 -12.224  -2.307
  267    HA   SER  37           HA       SER  37   6.909 -11.559   0.217
  268    HB2  SER  37           1HB      SER  37   7.097 -13.828  -0.786
  269    HB3  SER  37           2HB      SER  37   8.044 -13.138  -2.104
  270    HG   SER  37           HG       SER  37   9.472 -12.353  -0.352
  271    H    GLY  38           H        GLY  38   7.608 -10.970  -3.218
  272    HA2  GLY  38           1HA      GLY  38   8.468  -8.904  -4.019
  273    HA3  GLY  38           2HA      GLY  38   9.122  -8.587  -2.419
  274    HA   PRO  39           HA       PRO  39  12.672  -9.853  -5.058
  275    HB2  PRO  39           1HB      PRO  39  14.401  -8.072  -3.958
  276    HB3  PRO  39           2HB      PRO  39  13.309  -7.657  -5.285
  277    HG2  PRO  39           1HG      PRO  39  13.013  -7.131  -2.353
  278    HG3  PRO  39           2HG      PRO  39  12.675  -6.056  -3.722
  279    HD2  PRO  39           1HD      PRO  39  10.725  -7.403  -2.411
  280    HD3  PRO  39           2HD      PRO  39  10.629  -7.031  -4.145
  281    H    SER  40           H        SER  40  14.258 -11.271  -4.510
  282    HA   SER  40           HA       SER  40  14.199 -12.551  -2.020
  283    HB2  SER  40           1HB      SER  40  16.244 -13.720  -2.792
  284    HB3  SER  40           2HB      SER  40  14.991 -13.684  -4.032
  285    HG   SER  40           HG       SER  40  16.100 -11.960  -5.013
  286    H    SER  41           H        SER  41  14.564 -11.291  -0.260
  287    HA   SER  41           HA       SER  41  16.152  -9.179   0.182
  288    HB2  SER  41           1HB      SER  41  15.636 -11.549   1.969
  289    HB3  SER  41           2HB      SER  41  16.576 -10.165   2.525
  290    HG   SER  41           HG       SER  41  13.859 -10.313   1.828
  291    H    GLY  42           H        GLY  42  18.296  -8.787   0.908
  292    HA2  GLY  42           1HA      GLY  42  20.377 -10.425   1.371
  293    HA3  GLY  42           2HA      GLY  42  20.235 -10.517  -0.378
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1 -16.434  22.809  16.674
    2    HA2  GLY   1           1HA      GLY   1 -13.781  22.740  16.622
    3    HA3  GLY   1           2HA      GLY   1 -14.139  21.077  16.180
    4    H    SER   2           H        SER   2 -12.750  22.226  14.345
    5    HA   SER   2           HA       SER   2 -14.644  23.257  12.337
    6    HB2  SER   2           1HB      SER   2 -12.627  24.690  13.106
    7    HB3  SER   2           2HB      SER   2 -11.656  23.572  12.147
    8    HG   SER   2           HG       SER   2 -13.914  24.620  10.918
    9    H    SER   3           H        SER   3 -14.739  22.325  10.333
   10    HA   SER   3           HA       SER   3 -12.848  20.360   9.454
   11    HB2  SER   3           1HB      SER   3 -14.269  18.419   9.494
   12    HB3  SER   3           2HB      SER   3 -14.231  19.086  11.126
   13    HG   SER   3           HG       SER   3 -16.323  19.066  10.944
   14    H    GLY   4           H        GLY   4 -13.527  19.374   7.351
   15    HA2  GLY   4           1HA      GLY   4 -14.979  19.436   5.429
   16    HA3  GLY   4           2HA      GLY   4 -15.501  21.037   5.931
   17    H    SER   5           H        SER   5 -12.324  19.523   5.355
   18    HA   SER   5           HA       SER   5 -11.695  21.793   3.583
   19    HB2  SER   5           1HB      SER   5 -10.020  20.312   5.586
   20    HB3  SER   5           2HB      SER   5  -9.252  21.106   4.211
   21    HG   SER   5           HG       SER   5 -10.289  22.190   6.475
   22    H    SER   6           H        SER   6 -13.011  19.597   2.551
   23    HA   SER   6           HA       SER   6 -11.519  17.489   1.581
   24    HB2  SER   6           1HB      SER   6 -14.029  17.911   1.331
   25    HB3  SER   6           2HB      SER   6 -13.617  18.890  -0.077
   26    HG   SER   6           HG       SER   6 -13.915  16.279   0.027
   27    H    GLY   7           H        GLY   7 -10.421  17.091  -0.381
   28    HA2  GLY   7           1HA      GLY   7  -9.586  17.895  -2.515
   29    HA3  GLY   7           2HA      GLY   7  -9.527  19.508  -1.819
   30    H    GLY   8           H        GLY   8  -7.636  17.059  -2.815
   31    HA2  GLY   8           1HA      GLY   8  -5.310  16.946  -2.658
   32    HA3  GLY   8           2HA      GLY   8  -5.372  18.055  -1.297
   33    H    GLU   9           H        GLU   9  -7.209  16.625   0.309
   34    HA   GLU   9           HA       GLU   9  -5.515  14.972   1.755
   35    HB2  GLU   9           1HB      GLU   9  -7.487  14.243   2.978
   36    HB3  GLU   9           2HB      GLU   9  -7.572  15.971   2.666
   37    HG2  GLU   9           1HG      GLU   9  -9.153  15.633   0.896
   38    HG3  GLU   9           2HG      GLU   9  -8.978  13.883   1.018
   39    H    LYS  10           H        LYS  10  -6.491  12.594   2.323
   40    HA   LYS  10           HA       LYS  10  -6.348  11.131  -0.226
   41    HB2  LYS  10           1HB      LYS  10  -5.602  10.244   2.567
   42    HB3  LYS  10           2HB      LYS  10  -5.520   9.228   1.134
   43    HG2  LYS  10           1HG      LYS  10  -3.358   9.901   1.225
   44    HG3  LYS  10           2HG      LYS  10  -4.016  11.222   0.257
   45    HD2  LYS  10           1HD      LYS  10  -4.435  12.314   2.608
   46    HD3  LYS  10           2HD      LYS  10  -3.165  11.198   3.117
   47    HE2  LYS  10           1HE      LYS  10  -2.005  13.141   2.558
   48    HE3  LYS  10           2HE      LYS  10  -1.834  12.126   1.127
   49    HZ1  LYS  10           3HZ      LYS  10  -2.858  14.699   1.261
   50    HZ2  LYS  10           1HZ      LYS  10  -4.172  13.691   0.916
   51    HZ3  LYS  10           2HZ      LYS  10  -2.812  13.679  -0.088
   52    HA   PRO  11           HA       PRO  11 -10.652  10.417   1.283
   53    HB2  PRO  11           1HB      PRO  11 -11.762  10.476  -1.194
   54    HB3  PRO  11           2HB      PRO  11 -11.470  11.933  -0.237
   55    HG2  PRO  11           1HG      PRO  11  -9.843  10.774  -2.466
   56    HG3  PRO  11           2HG      PRO  11 -10.277  12.466  -2.160
   57    HD2  PRO  11           1HD      PRO  11  -7.850  11.447  -1.524
   58    HD3  PRO  11           2HD      PRO  11  -8.622  12.736  -0.579
   59    H    TYR  12           H        TYR  12  -8.318   8.704  -0.276
   60    HA   TYR  12           HA       TYR  12 -10.086   6.380  -0.676
   61    HB2  TYR  12           1HB      TYR  12  -7.492   7.058  -2.076
   62    HB3  TYR  12           2HB      TYR  12  -8.364   5.541  -2.271
   63    HD1  TYR  12           HD1      TYR  12  -8.542   9.189  -2.858
   64    HD2  TYR  12           HD2      TYR  12 -10.236   5.382  -3.721
   65    HE1  TYR  12           HE1      TYR  12  -9.885  10.200  -4.654
   66    HE2  TYR  12           HE2      TYR  12 -11.582   6.382  -5.520
   67    HH   TYR  12           HH       TYR  12 -11.877   9.779  -5.923
   68    HA   PRO  13           HA       PRO  13  -7.414   5.308   2.899
   69    HB2  PRO  13           1HB      PRO  13  -9.301   3.780   4.113
   70    HB3  PRO  13           2HB      PRO  13  -9.219   5.536   4.302
   71    HG2  PRO  13           1HG      PRO  13 -10.980   3.904   2.514
   72    HG3  PRO  13           2HG      PRO  13 -11.392   5.316   3.505
   73    HD2  PRO  13           1HD      PRO  13 -10.952   5.486   0.839
   74    HD3  PRO  13           2HD      PRO  13 -10.552   6.804   1.959
   75    H    CYS  14           H        CYS  14  -6.389   3.362   3.396
   76    HA   CYS  14           HA       CYS  14  -6.407   1.399   1.296
   77    HB2  CYS  14           1HB      CYS  14  -4.277   1.959   2.222
   78    HB3  CYS  14           2HB      CYS  14  -4.839   1.651   3.862
   79    H    GLU  15           H        GLU  15  -6.536  -0.940   1.755
   80    HA   GLU  15           HA       GLU  15  -8.765  -1.473   3.583
   81    HB2  GLU  15           1HB      GLU  15  -9.387  -2.256   1.491
   82    HB3  GLU  15           2HB      GLU  15  -7.758  -2.781   1.089
   83    HG2  GLU  15           1HG      GLU  15  -7.972  -4.771   2.193
   84    HG3  GLU  15           2HG      GLU  15  -9.186  -4.147   3.309
   85    H    ILE  16           H        ILE  16  -5.512  -2.555   2.761
   86    HA   ILE  16           HA       ILE  16  -5.407  -4.739   4.548
   87    HB   ILE  16           HB       ILE  16  -3.129  -3.049   3.509
   88   HG12  ILE  16          1HG1      ILE  16  -2.989  -5.304   2.072
   89   HG13  ILE  16          2HG1      ILE  16  -4.724  -5.286   2.366
   90   HG21  ILE  16          1HG2      ILE  16  -2.110  -5.529   3.893
   91   HG22  ILE  16          2HG2      ILE  16  -1.986  -4.211   5.057
   92   HG23  ILE  16          3HG2      ILE  16  -3.253  -5.425   5.231
   93   HD11  ILE  16          3HD1      ILE  16  -4.941  -3.903   0.660
   94   HD12  ILE  16          1HD1      ILE  16  -4.042  -2.688   1.569
   95   HD13  ILE  16          2HD1      ILE  16  -3.191  -3.786   0.482
   96    H    CYS  17           H        CYS  17  -3.529  -1.732   4.877
   97    HA   CYS  17           HA       CYS  17  -3.594  -2.044   7.774
   98    HB2  CYS  17           1HB      CYS  17  -1.930  -0.196   7.761
   99    HB3  CYS  17           2HB      CYS  17  -1.431  -1.580   6.793
  100    H    GLY  18           H        GLY  18  -4.364   0.441   5.343
  101    HA2  GLY  18           1HA      GLY  18  -6.670   1.432   5.849
  102    HA3  GLY  18           2HA      GLY  18  -5.945   1.845   7.396
  103    H    THR  19           H        THR  19  -3.340   2.309   5.871
  104    HA   THR  19           HA       THR  19  -3.252   5.016   5.818
  105    HB   THR  19           HB       THR  19  -1.799   3.054   4.051
  106    HG1  THR  19           HG1      THR  19  -1.518   3.572   6.523
  107   HG21  THR  19          3HG2      THR  19  -1.690   6.040   4.072
  108   HG22  THR  19          1HG2      THR  19  -1.586   4.923   2.712
  109   HG23  THR  19          2HG2      THR  19  -0.209   5.123   3.796
  110    H    ARG  20           H        ARG  20  -3.994   6.642   4.594
  111    HA   ARG  20           HA       ARG  20  -5.636   5.958   2.273
  112    HB2  ARG  20           1HB      ARG  20  -5.388   8.612   3.696
  113    HB3  ARG  20           2HB      ARG  20  -6.599   8.167   2.501
  114    HG2  ARG  20           1HG      ARG  20  -7.813   6.938   3.980
  115    HG3  ARG  20           2HG      ARG  20  -6.402   6.505   4.948
  116    HD2  ARG  20           1HD      ARG  20  -6.448   8.475   6.138
  117    HD3  ARG  20           2HD      ARG  20  -7.287   9.351   4.858
  118    HE   ARG  20           HE       ARG  20  -9.298   8.636   5.717
  119   HH11  ARG  20          1HH1      ARG  20  -6.686   6.897   7.224
  120   HH12  ARG  20          2HH1      ARG  20  -7.689   6.187   8.445
  121   HH21  ARG  20          1HH2      ARG  20 -10.630   7.707   7.319
  122   HH22  ARG  20          2HH2      ARG  20  -9.933   6.648   8.497
  123    H    PHE  21           H        PHE  21  -5.360   6.898   0.252
  124    HA   PHE  21           HA       PHE  21  -2.799   8.297  -0.158
  125    HB2  PHE  21           1HB      PHE  21  -4.090   6.133  -1.816
  126    HB3  PHE  21           2HB      PHE  21  -2.827   7.182  -2.455
  127    HD1  PHE  21           HD2      PHE  21  -3.546   4.823   0.325
  128    HD2  PHE  21           HD1      PHE  21  -0.597   6.634  -2.152
  129    HE1  PHE  21           HE2      PHE  21  -1.836   3.334   1.279
  130    HE2  PHE  21           HE1      PHE  21   1.118   5.148  -1.202
  131    HZ   PHE  21           HZ       PHE  21   0.500   3.496   0.516
  132    H    ARG  22           H        ARG  22  -2.839  10.126  -1.337
  133    HA   ARG  22           HA       ARG  22  -4.959  11.726  -1.664
  134    HB2  ARG  22           1HB      ARG  22  -2.610  12.333  -2.211
  135    HB3  ARG  22           2HB      ARG  22  -2.775  11.475  -3.738
  136    HG2  ARG  22           1HG      ARG  22  -4.751  13.047  -4.182
  137    HG3  ARG  22           2HG      ARG  22  -4.095  14.014  -2.860
  138    HD2  ARG  22           1HD      ARG  22  -1.854  13.693  -4.239
  139    HD3  ARG  22           2HD      ARG  22  -2.994  13.491  -5.569
  140    HE   ARG  22           HE       ARG  22  -3.843  15.758  -4.359
  141   HH11  ARG  22          1HH1      ARG  22  -0.755  14.695  -5.566
  142   HH12  ARG  22          2HH1      ARG  22  -0.216  16.292  -5.966
  143   HH21  ARG  22          1HH2      ARG  22  -3.144  17.865  -4.881
  144   HH22  ARG  22          2HH2      ARG  22  -1.575  18.095  -5.575
  145    H    HIS  23           H        HIS  23  -3.815   9.592  -4.287
  146    HA   HIS  23           HA       HIS  23  -6.505   9.749  -5.470
  147    HB2  HIS  23           1HB      HIS  23  -3.774   9.464  -6.632
  148    HB3  HIS  23           2HB      HIS  23  -5.116   8.700  -7.478
  149    HD2  HIS  23           HD2      HIS  23  -5.585  12.211  -5.819
  150    HE1  HIS  23           HE1      HIS  23  -5.659  12.670 -10.036
  151    HE2  HIS  23           HE2      HIS  23  -5.906  13.828  -7.813
  152    H    LEU  24           H        LEU  24  -7.045   7.701  -6.788
  153    HA   LEU  24           HA       LEU  24  -6.885   5.465  -4.949
  154    HB2  LEU  24           1HB      LEU  24  -9.017   6.115  -6.004
  155    HB3  LEU  24           2HB      LEU  24  -8.336   5.714  -7.580
  156    HG   LEU  24           HG       LEU  24  -9.826   3.959  -6.806
  157   HD11  LEU  24          1HD1      LEU  24  -8.467   2.153  -7.333
  158   HD12  LEU  24          2HD1      LEU  24  -7.060   2.849  -6.529
  159   HD13  LEU  24          3HD1      LEU  24  -7.619   3.517  -8.062
  160   HD21  LEU  24          3HD2      LEU  24  -8.463   4.415  -4.308
  161   HD22  LEU  24          1HD2      LEU  24  -8.414   2.709  -4.752
  162   HD23  LEU  24          2HD2      LEU  24  -9.963   3.543  -4.628
  163    H    GLN  25           H        GLN  25  -6.430   5.799  -8.475
  164    HA   GLN  25           HA       GLN  25  -5.344   3.457  -9.167
  165    HB2  GLN  25           1HB      GLN  25  -3.890   4.664 -10.787
  166    HB3  GLN  25           2HB      GLN  25  -5.554   5.233 -10.779
  167    HG2  GLN  25           1HG      GLN  25  -4.999   7.230  -9.731
  168    HG3  GLN  25           2HG      GLN  25  -3.458   6.605  -9.147
  169   HE21  GLN  25          1HE2      GLN  25  -2.446   8.456 -10.030
  170   HE22  GLN  25          2HE2      GLN  25  -2.123   8.569 -11.723
  171    H    THR  26           H        THR  26  -3.815   5.840  -7.134
  172    HA   THR  26           HA       THR  26  -1.224   4.592  -7.187
  173    HB   THR  26           HB       THR  26  -2.319   6.662  -5.272
  174    HG1  THR  26           HG1      THR  26  -1.472   6.807  -7.854
  175   HG21  THR  26          3HG2      THR  26   0.489   6.834  -5.604
  176   HG22  THR  26          1HG2      THR  26   0.102   5.153  -5.242
  177   HG23  THR  26          2HG2      THR  26  -0.413   6.433  -4.144
  178    H    LEU  27           H        LEU  27  -3.894   4.790  -4.850
  179    HA   LEU  27           HA       LEU  27  -2.796   3.404  -2.739
  180    HB2  LEU  27           1HB      LEU  27  -4.900   4.393  -2.421
  181    HB3  LEU  27           2HB      LEU  27  -5.601   3.539  -3.795
  182    HG   LEU  27           HG       LEU  27  -5.573   1.456  -2.543
  183   HD11  LEU  27          1HD1      LEU  27  -3.553   1.927  -1.210
  184   HD12  LEU  27          2HD1      LEU  27  -4.902   1.361  -0.227
  185   HD13  LEU  27          3HD1      LEU  27  -4.483   3.073  -0.245
  186   HD21  LEU  27          3HD2      LEU  27  -7.603   2.129  -1.940
  187   HD22  LEU  27          1HD2      LEU  27  -7.074   3.806  -1.811
  188   HD23  LEU  27          2HD2      LEU  27  -6.894   2.717  -0.435
  189    H    LYS  28           H        LYS  28  -4.381   2.097  -5.624
  190    HA   LYS  28           HA       LYS  28  -4.410  -0.595  -4.922
  191    HB2  LYS  28           1HB      LYS  28  -4.247   0.831  -7.561
  192    HB3  LYS  28           2HB      LYS  28  -4.193  -0.926  -7.489
  193    HG2  LYS  28           1HG      LYS  28  -6.366  -1.058  -6.591
  194    HG3  LYS  28           2HG      LYS  28  -6.401   0.668  -6.223
  195    HD2  LYS  28           1HD      LYS  28  -6.718   1.264  -8.442
  196    HD3  LYS  28           2HD      LYS  28  -6.062  -0.258  -9.049
  197    HE2  LYS  28           1HE      LYS  28  -8.072  -1.392  -8.034
  198    HE3  LYS  28           2HE      LYS  28  -8.737   0.216  -7.748
  199    HZ1  LYS  28           3HZ      LYS  28  -9.601  -0.624  -9.793
  200    HZ2  LYS  28           1HZ      LYS  28  -8.054  -0.986 -10.375
  201    HZ3  LYS  28           2HZ      LYS  28  -8.522   0.625 -10.163
  202    H    SER  29           H        SER  29  -1.805   1.407  -6.135
  203    HA   SER  29           HA       SER  29  -0.030  -0.802  -6.627
  204    HB2  SER  29           1HB      SER  29   0.028   1.470  -7.799
  205    HB3  SER  29           2HB      SER  29   0.775   2.092  -6.327
  206    HG   SER  29           HG       SER  29   2.298   1.406  -7.936
  207    H    HIS  30           H        HIS  30  -0.971   1.017  -3.903
  208    HA   HIS  30           HA       HIS  30   1.453   0.695  -2.398
  209    HB2  HIS  30           1HB      HIS  30   0.292   2.506  -1.590
  210    HB3  HIS  30           2HB      HIS  30  -1.278   1.758  -1.863
  211    HD1  HIS  30           HD1      HIS  30   1.685   1.249   0.477
  212    HD2  HIS  30           HD2      HIS  30  -2.460   0.971   0.433
  213    HE1  HIS  30           HE1      HIS  30   1.028   0.638   2.826
  214    H    LEU  31           H        LEU  31  -1.394  -1.179  -2.977
  215    HA   LEU  31           HA       LEU  31  -1.182  -2.853  -0.672
  216    HB2  LEU  31           1HB      LEU  31  -2.496  -3.785  -3.174
  217    HB3  LEU  31           2HB      LEU  31  -2.994  -3.996  -1.497
  218    HG   LEU  31           HG       LEU  31  -3.344  -1.573  -3.247
  219   HD11  LEU  31          1HD1      LEU  31  -5.332  -2.495  -3.590
  220   HD12  LEU  31          2HD1      LEU  31  -5.683  -2.255  -1.878
  221   HD13  LEU  31          3HD1      LEU  31  -4.996  -3.782  -2.432
  222   HD21  LEU  31          3HD2      LEU  31  -3.520  -1.835  -0.262
  223   HD22  LEU  31          1HD2      LEU  31  -4.460  -0.632  -1.145
  224   HD23  LEU  31          2HD2      LEU  31  -2.698  -0.603  -1.220
  225    H    ARG  32           H        ARG  32   0.847  -2.513  -3.200
  226    HA   ARG  32           HA       ARG  32   1.379  -5.227  -3.897
  227    HB2  ARG  32           1HB      ARG  32   2.803  -2.621  -4.317
  228    HB3  ARG  32           2HB      ARG  32   3.609  -4.137  -4.694
  229    HG2  ARG  32           1HG      ARG  32   2.480  -3.020  -6.624
  230    HG3  ARG  32           2HG      ARG  32   1.989  -4.691  -6.336
  231    HD2  ARG  32           1HD      ARG  32   0.427  -2.507  -5.052
  232    HD3  ARG  32           2HD      ARG  32   0.217  -2.785  -6.781
  233    HE   ARG  32           HE       ARG  32  -0.706  -4.452  -4.635
  234   HH11  ARG  32          1HH1      ARG  32   0.242  -4.376  -7.983
  235   HH12  ARG  32          2HH1      ARG  32  -0.676  -5.781  -8.411
  236   HH21  ARG  32          1HH2      ARG  32  -1.920  -6.303  -5.185
  237   HH22  ARG  32          2HH2      ARG  32  -1.907  -6.876  -6.818
  238    H    ILE  33           H        ILE  33   2.402  -3.111  -1.346
  239    HA   ILE  33           HA       ILE  33   4.632  -4.800  -0.577
  240    HB   ILE  33           HB       ILE  33   5.097  -3.219   1.134
  241   HG12  ILE  33          1HG1      ILE  33   2.467  -1.850   0.554
  242   HG13  ILE  33          2HG1      ILE  33   2.682  -3.013   1.858
  243   HG21  ILE  33          1HG2      ILE  33   4.634  -0.988  -0.319
  244   HG22  ILE  33          2HG2      ILE  33   5.937  -2.130  -0.647
  245   HG23  ILE  33          3HG2      ILE  33   4.428  -2.231  -1.553
  246   HD11  ILE  33          3HD1      ILE  33   3.164  -1.238   3.107
  247   HD12  ILE  33          1HD1      ILE  33   4.729  -1.257   2.295
  248   HD13  ILE  33          2HD1      ILE  33   3.440  -0.209   1.702
  249    H    HIS  34           H        HIS  34   1.293  -4.657  -0.006
  250    HA   HIS  34           HA       HIS  34   1.365  -5.827   2.635
  251    HB2  HIS  34           1HB      HIS  34  -0.842  -5.164   0.698
  252    HB3  HIS  34           2HB      HIS  34  -1.154  -6.092   2.162
  253    HD1  HIS  34           HD1      HIS  34   0.379  -4.613   4.262
  254    HD2  HIS  34           HD2      HIS  34  -1.714  -2.668   1.245
  255    HE1  HIS  34           HE1      HIS  34  -0.080  -2.302   5.144
  256    H    THR  35           H        THR  35   0.592  -6.899  -0.655
  257    HA   THR  35           HA       THR  35   0.508  -9.675   0.304
  258    HB   THR  35           HB       THR  35  -1.431  -9.347  -0.935
  259    HG1  THR  35           HG1      THR  35  -1.009 -10.440  -2.972
  260   HG21  THR  35          3HG2      THR  35  -1.411  -8.208  -3.183
  261   HG22  THR  35          1HG2      THR  35   0.248  -7.720  -2.839
  262   HG23  THR  35          2HG2      THR  35  -1.068  -7.159  -1.808
  263    H    GLY  36           H        GLY  36   2.003 -11.144  -0.295
  264    HA2  GLY  36           1HA      GLY  36   3.547 -12.022  -1.947
  265    HA3  GLY  36           2HA      GLY  36   3.937 -10.364  -2.382
  266    H    SER  37           H        SER  37   6.077 -11.754  -2.007
  267    HA   SER  37           HA       SER  37   7.958 -12.119  -0.764
  268    HB2  SER  37           1HB      SER  37   6.974  -9.507   0.398
  269    HB3  SER  37           2HB      SER  37   8.558 -10.194   0.755
  270    HG   SER  37           HG       SER  37   7.750  -9.850  -1.914
  271    H    GLY  38           H        GLY  38   5.778 -13.595   0.159
  272    HA2  GLY  38           1HA      GLY  38   5.952 -15.084   2.067
  273    HA3  GLY  38           2HA      GLY  38   6.389 -13.691   3.044
  274    HA   PRO  39           HA       PRO  39   1.644 -14.542   2.765
  275    HB2  PRO  39           1HB      PRO  39   1.294 -16.415   4.699
  276    HB3  PRO  39           2HB      PRO  39   1.549 -16.826   2.999
  277    HG2  PRO  39           1HG      PRO  39   3.513 -16.808   5.258
  278    HG3  PRO  39           2HG      PRO  39   3.302 -18.006   3.968
  279    HD2  PRO  39           1HD      PRO  39   5.249 -16.125   3.905
  280    HD3  PRO  39           2HD      PRO  39   4.473 -16.746   2.434
  281    H    SER  40           H        SER  40   1.722 -12.420   3.660
  282    HA   SER  40           HA       SER  40   1.863 -12.302   6.596
  283    HB2  SER  40           1HB      SER  40   2.155  -9.847   6.276
  284    HB3  SER  40           2HB      SER  40   3.430 -10.796   5.513
  285    HG   SER  40           HG       SER  40   2.273 -10.555   3.529
  286    H    SER  41           H        SER  41   0.144 -11.670   7.782
  287    HA   SER  41           HA       SER  41  -2.386 -11.327   6.357
  288    HB2  SER  41           1HB      SER  41  -2.002 -13.018   8.279
  289    HB3  SER  41           2HB      SER  41  -2.108 -11.614   9.340
  290    HG   SER  41           HG       SER  41  -4.096 -12.056   7.406
  291    H    GLY  42           H        GLY  42  -2.410  -9.196   5.735
  292    HA2  GLY  42           1HA      GLY  42  -3.428  -7.108   6.452
  293    HA3  GLY  42           2HA      GLY  42  -2.517  -7.247   7.948
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1  -1.896  31.357   8.495
    2    HA2  GLY   1           1HA      GLY   1  -4.477  32.031   7.222
    3    HA3  GLY   1           2HA      GLY   1  -3.608  30.549   6.854
    4    H    SER   2           H        SER   2  -6.295  31.323   8.178
    5    HA   SER   2           HA       SER   2  -6.087  30.193  10.815
    6    HB2  SER   2           1HB      SER   2  -8.439  30.578  10.994
    7    HB3  SER   2           2HB      SER   2  -7.771  31.953  10.114
    8    HG   SER   2           HG       SER   2  -8.959  31.428   8.471
    9    H    SER   3           H        SER   3  -6.433  28.144  11.442
   10    HA   SER   3           HA       SER   3  -6.383  25.859  11.146
   11    HB2  SER   3           1HB      SER   3  -9.043  26.717   9.998
   12    HB3  SER   3           2HB      SER   3  -8.625  25.029  10.290
   13    HG   SER   3           HG       SER   3  -8.430  25.481  12.472
   14    H    GLY   4           H        GLY   4  -4.850  27.034   9.158
   15    HA2  GLY   4           1HA      GLY   4  -5.566  26.267   6.533
   16    HA3  GLY   4           2HA      GLY   4  -3.940  26.634   7.088
   17    H    SER   5           H        SER   5  -2.516  25.023   7.125
   18    HA   SER   5           HA       SER   5  -1.637  22.943   6.803
   19    HB2  SER   5           1HB      SER   5  -2.598  22.848   9.174
   20    HB3  SER   5           2HB      SER   5  -3.934  21.932   8.478
   21    HG   SER   5           HG       SER   5  -1.925  20.705   7.541
   22    H    SER   6           H        SER   6  -3.229  23.731   4.697
   23    HA   SER   6           HA       SER   6  -4.592  21.232   3.934
   24    HB2  SER   6           1HB      SER   6  -5.243  24.100   3.386
   25    HB3  SER   6           2HB      SER   6  -5.689  22.884   2.189
   26    HG   SER   6           HG       SER   6  -7.038  21.950   3.615
   27    H    GLY   7           H        GLY   7  -4.340  20.494   1.774
   28    HA2  GLY   7           1HA      GLY   7  -3.131  21.399  -0.390
   29    HA3  GLY   7           2HA      GLY   7  -1.733  21.209   0.659
   30    H    GLY   8           H        GLY   8  -4.640  19.250  -0.024
   31    HA2  GLY   8           1HA      GLY   8  -4.236  17.253  -1.482
   32    HA3  GLY   8           2HA      GLY   8  -2.822  16.965  -0.479
   33    H    GLU   9           H        GLU   9  -5.757  15.805  -1.052
   34    HA   GLU   9           HA       GLU   9  -6.184  15.024   1.757
   35    HB2  GLU   9           1HB      GLU   9  -8.122  15.854  -0.351
   36    HB3  GLU   9           2HB      GLU   9  -8.623  14.614   0.790
   37    HG2  GLU   9           1HG      GLU   9  -7.557  17.307   1.597
   38    HG3  GLU   9           2HG      GLU   9  -9.270  16.932   1.419
   39    H    LYS  10           H        LYS  10  -6.661  12.883   2.182
   40    HA   LYS  10           HA       LYS  10  -6.192  11.035  -0.062
   41    HB2  LYS  10           1HB      LYS  10  -5.902  10.261   2.823
   42    HB3  LYS  10           2HB      LYS  10  -5.144   9.548   1.405
   43    HG2  LYS  10           1HG      LYS  10  -4.508  12.317   2.383
   44    HG3  LYS  10           2HG      LYS  10  -3.634  10.877   2.910
   45    HD2  LYS  10           1HD      LYS  10  -3.152  10.393   0.501
   46    HD3  LYS  10           2HD      LYS  10  -3.855  11.962   0.105
   47    HE2  LYS  10           1HE      LYS  10  -2.141  13.133   1.144
   48    HE3  LYS  10           2HE      LYS  10  -1.668  11.755   2.137
   49    HZ1  LYS  10           3HZ      LYS  10  -1.368  11.058  -0.562
   50    HZ2  LYS  10           1HZ      LYS  10  -0.169  11.216   0.622
   51    HZ3  LYS  10           2HZ      LYS  10  -0.608  12.550  -0.321
   52    HA   PRO  11           HA       PRO  11 -10.607  10.454   1.344
   53    HB2  PRO  11           1HB      PRO  11 -11.682  10.561  -1.146
   54    HB3  PRO  11           2HB      PRO  11 -11.411  11.999  -0.154
   55    HG2  PRO  11           1HG      PRO  11  -9.747  10.897  -2.385
   56    HG3  PRO  11           2HG      PRO  11 -10.194  12.579  -2.049
   57    HD2  PRO  11           1HD      PRO  11  -7.771  11.559  -1.401
   58    HD3  PRO  11           2HD      PRO  11  -8.563  12.824  -0.439
   59    H    TYR  12           H        TYR  12  -8.241   8.785  -0.206
   60    HA   TYR  12           HA       TYR  12  -9.991   6.466  -0.704
   61    HB2  TYR  12           1HB      TYR  12  -7.358   7.183  -2.006
   62    HB3  TYR  12           2HB      TYR  12  -8.210   5.664  -2.256
   63    HD1  TYR  12           HD1      TYR  12  -8.424   9.324  -2.761
   64    HD2  TYR  12           HD2      TYR  12 -10.009   5.512  -3.789
   65    HE1  TYR  12           HE1      TYR  12  -9.717  10.359  -4.580
   66    HE2  TYR  12           HE2      TYR  12 -11.305   6.535  -5.611
   67    HH   TYR  12           HH       TYR  12 -11.188  10.036  -6.208
   68    HA   PRO  13           HA       PRO  13  -7.426   5.326   2.931
   69    HB2  PRO  13           1HB      PRO  13  -9.357   3.796   4.072
   70    HB3  PRO  13           2HB      PRO  13  -9.266   5.548   4.290
   71    HG2  PRO  13           1HG      PRO  13 -10.993   3.958   2.432
   72    HG3  PRO  13           2HG      PRO  13 -11.419   5.357   3.434
   73    HD2  PRO  13           1HD      PRO  13 -10.908   5.565   0.783
   74    HD3  PRO  13           2HD      PRO  13 -10.527   6.862   1.933
   75    H    CYS  14           H        CYS  14  -6.458   3.347   3.455
   76    HA   CYS  14           HA       CYS  14  -6.444   1.415   1.315
   77    HB2  CYS  14           1HB      CYS  14  -4.333   2.021   2.330
   78    HB3  CYS  14           2HB      CYS  14  -4.919   1.551   3.922
   79    H    GLU  15           H        GLU  15  -6.586  -0.928   1.757
   80    HA   GLU  15           HA       GLU  15  -8.826  -1.464   3.576
   81    HB2  GLU  15           1HB      GLU  15  -9.241  -3.453   2.239
   82    HB3  GLU  15           2HB      GLU  15  -9.158  -2.035   1.204
   83    HG2  GLU  15           1HG      GLU  15  -6.753  -2.656   0.758
   84    HG3  GLU  15           2HG      GLU  15  -7.098  -4.189   1.557
   85    H    ILE  16           H        ILE  16  -5.570  -2.504   2.756
   86    HA   ILE  16           HA       ILE  16  -5.492  -4.743   4.496
   87    HB   ILE  16           HB       ILE  16  -3.200  -3.081   3.444
   88   HG12  ILE  16          1HG1      ILE  16  -3.107  -5.318   1.983
   89   HG13  ILE  16          2HG1      ILE  16  -4.837  -5.292   2.307
   90   HG21  ILE  16          1HG2      ILE  16  -3.346  -5.543   5.077
   91   HG22  ILE  16          2HG2      ILE  16  -2.141  -5.506   3.790
   92   HG23  ILE  16          3HG2      ILE  16  -2.126  -4.270   5.048
   93   HD11  ILE  16          3HD1      ILE  16  -4.073  -2.689   1.512
   94   HD12  ILE  16          1HD1      ILE  16  -3.367  -3.835   0.373
   95   HD13  ILE  16          2HD1      ILE  16  -5.107  -3.841   0.667
   96    H    CYS  17           H        CYS  17  -3.559  -1.773   4.832
   97    HA   CYS  17           HA       CYS  17  -3.589  -2.115   7.725
   98    HB2  CYS  17           1HB      CYS  17  -1.904  -0.286   7.710
   99    HB3  CYS  17           2HB      CYS  17  -1.436  -1.661   6.715
  100    H    GLY  18           H        GLY  18  -4.384   0.395   5.330
  101    HA2  GLY  18           1HA      GLY  18  -6.668   1.406   5.889
  102    HA3  GLY  18           2HA      GLY  18  -5.911   1.798   7.426
  103    H    THR  19           H        THR  19  -3.330   2.252   5.855
  104    HA   THR  19           HA       THR  19  -3.164   4.937   5.840
  105    HB   THR  19           HB       THR  19  -1.912   3.059   3.833
  106    HG1  THR  19           HG1      THR  19  -0.982   4.253   6.250
  107   HG21  THR  19          3HG2      THR  19  -1.786   5.988   4.074
  108   HG22  THR  19          1HG2      THR  19  -1.418   4.947   2.699
  109   HG23  THR  19          2HG2      THR  19  -0.222   5.180   3.974
  110    H    ARG  20           H        ARG  20  -3.824   6.643   4.651
  111    HA   ARG  20           HA       ARG  20  -5.652   6.081   2.427
  112    HB2  ARG  20           1HB      ARG  20  -5.294   8.697   3.889
  113    HB3  ARG  20           2HB      ARG  20  -6.613   8.241   2.819
  114    HG2  ARG  20           1HG      ARG  20  -7.455   6.672   4.408
  115    HG3  ARG  20           2HG      ARG  20  -6.034   6.875   5.436
  116    HD2  ARG  20           1HD      ARG  20  -7.555   8.220   6.513
  117    HD3  ARG  20           2HD      ARG  20  -6.768   9.383   5.447
  118    HE   ARG  20           HE       ARG  20  -8.874   8.504   3.983
  119   HH11  ARG  20          1HH1      ARG  20  -8.548   9.825   7.187
  120   HH12  ARG  20          2HH1      ARG  20 -10.120  10.555   7.187
  121   HH21  ARG  20          1HH2      ARG  20 -10.944   9.460   3.971
  122   HH22  ARG  20          2HH2      ARG  20 -11.482  10.346   5.357
  123    H    PHE  21           H        PHE  21  -5.404   7.000   0.420
  124    HA   PHE  21           HA       PHE  21  -2.867   8.426  -0.045
  125    HB2  PHE  21           1HB      PHE  21  -4.255   6.366  -1.763
  126    HB3  PHE  21           2HB      PHE  21  -2.944   7.384  -2.349
  127    HD1  PHE  21           HD2      PHE  21  -3.781   4.921   0.303
  128    HD2  PHE  21           HD1      PHE  21  -0.740   6.729  -2.063
  129    HE1  PHE  21           HE2      PHE  21  -2.143   3.310   1.183
  130    HE2  PHE  21           HE1      PHE  21   0.903   5.120  -1.187
  131    HZ   PHE  21           HZ       PHE  21   0.202   3.408   0.439
  132    H    ARG  22           H        ARG  22  -2.852   9.908  -1.863
  133    HA   ARG  22           HA       ARG  22  -5.060  11.650  -1.856
  134    HB2  ARG  22           1HB      ARG  22  -3.877  12.824  -3.689
  135    HB3  ARG  22           2HB      ARG  22  -2.831  12.470  -2.320
  136    HG2  ARG  22           1HG      ARG  22  -1.912  10.547  -3.524
  137    HG3  ARG  22           2HG      ARG  22  -2.950  10.924  -4.901
  138    HD2  ARG  22           1HD      ARG  22  -0.854  11.850  -5.430
  139    HD3  ARG  22           2HD      ARG  22  -1.850  13.211  -4.914
  140    HE   ARG  22           HE       ARG  22  -0.249  12.018  -2.827
  141   HH11  ARG  22          1HH1      ARG  22  -0.424  14.436  -5.326
  142   HH12  ARG  22          2HH1      ARG  22   0.799  15.440  -4.620
  143   HH21  ARG  22          1HH2      ARG  22   1.362  13.332  -1.889
  144   HH22  ARG  22          2HH2      ARG  22   1.814  14.811  -2.666
  145    H    HIS  23           H        HIS  23  -3.912   9.342  -4.302
  146    HA   HIS  23           HA       HIS  23  -6.573   9.496  -5.560
  147    HB2  HIS  23           1HB      HIS  23  -3.847   9.484  -6.768
  148    HB3  HIS  23           2HB      HIS  23  -5.136   8.649  -7.630
  149    HD2  HIS  23           HD2      HIS  23  -5.470  12.159  -5.846
  150    HE1  HIS  23           HE1      HIS  23  -6.333  12.575  -9.979
  151    HE2  HIS  23           HE2      HIS  23  -6.162  13.755  -7.760
  152    H    LEU  24           H        LEU  24  -7.336   7.536  -6.563
  153    HA   LEU  24           HA       LEU  24  -6.849   5.237  -4.957
  154    HB2  LEU  24           1HB      LEU  24  -9.018   5.902  -6.092
  155    HB3  LEU  24           2HB      LEU  24  -8.309   5.293  -7.586
  156    HG   LEU  24           HG       LEU  24  -8.420   3.085  -6.891
  157   HD11  LEU  24          1HD1      LEU  24  -7.377   2.956  -4.848
  158   HD12  LEU  24          2HD1      LEU  24  -9.049   2.623  -4.398
  159   HD13  LEU  24          3HD1      LEU  24  -8.369   4.230  -4.137
  160   HD21  LEU  24          3HD2      LEU  24 -10.771   4.621  -5.840
  161   HD22  LEU  24          1HD2      LEU  24 -10.712   2.861  -5.757
  162   HD23  LEU  24          2HD2      LEU  24 -10.636   3.672  -7.321
  163    H    GLN  25           H        GLN  25  -6.269   5.915  -8.408
  164    HA   GLN  25           HA       GLN  25  -5.140   3.610  -9.262
  165    HB2  GLN  25           1HB      GLN  25  -3.695   4.991 -10.758
  166    HB3  GLN  25           2HB      GLN  25  -5.387   5.469 -10.762
  167    HG2  GLN  25           1HG      GLN  25  -4.978   7.449  -9.692
  168    HG3  GLN  25           2HG      GLN  25  -3.516   6.851  -8.910
  169   HE21  GLN  25          1HE2      GLN  25  -3.929   9.302 -10.411
  170   HE22  GLN  25          2HE2      GLN  25  -2.800   9.267 -11.718
  171    H    THR  26           H        THR  26  -3.757   5.878  -7.014
  172    HA   THR  26           HA       THR  26  -1.126   4.680  -7.100
  173    HB   THR  26           HB       THR  26  -2.282   6.751  -5.224
  174    HG1  THR  26           HG1      THR  26  -0.316   7.202  -7.203
  175   HG21  THR  26          3HG2      THR  26   0.639   6.468  -5.555
  176   HG22  THR  26          1HG2      THR  26  -0.162   5.191  -4.640
  177   HG23  THR  26          2HG2      THR  26  -0.307   6.871  -4.121
  178    H    LEU  27           H        LEU  27  -3.859   4.793  -4.839
  179    HA   LEU  27           HA       LEU  27  -2.740   3.351  -2.743
  180    HB2  LEU  27           1HB      LEU  27  -4.805   4.438  -2.389
  181    HB3  LEU  27           2HB      LEU  27  -5.567   3.589  -3.733
  182    HG   LEU  27           HG       LEU  27  -5.600   1.531  -2.471
  183   HD11  LEU  27          1HD1      LEU  27  -4.339   3.047  -0.194
  184   HD12  LEU  27          2HD1      LEU  27  -3.462   1.950  -1.260
  185   HD13  LEU  27          3HD1      LEU  27  -4.764   1.335  -0.242
  186   HD21  LEU  27          3HD2      LEU  27  -6.780   4.004  -1.348
  187   HD22  LEU  27          1HD2      LEU  27  -6.856   2.551  -0.351
  188   HD23  LEU  27          2HD2      LEU  27  -7.563   2.549  -1.967
  189    H    LYS  28           H        LYS  28  -4.395   2.202  -5.650
  190    HA   LYS  28           HA       LYS  28  -4.552  -0.506  -5.027
  191    HB2  LYS  28           1HB      LYS  28  -4.252   0.931  -7.659
  192    HB3  LYS  28           2HB      LYS  28  -4.436  -0.815  -7.563
  193    HG2  LYS  28           1HG      LYS  28  -6.611  -0.663  -6.738
  194    HG3  LYS  28           2HG      LYS  28  -6.411   1.027  -6.268
  195    HD2  LYS  28           1HD      LYS  28  -6.565   1.780  -8.476
  196    HD3  LYS  28           2HD      LYS  28  -6.228   0.180  -9.141
  197    HE2  LYS  28           1HE      LYS  28  -8.379  -0.618  -8.531
  198    HE3  LYS  28           2HE      LYS  28  -8.700   0.805  -7.541
  199    HZ1  LYS  28           3HZ      LYS  28  -9.527   1.840  -9.298
  200    HZ2  LYS  28           1HZ      LYS  28  -9.341   0.427 -10.210
  201    HZ3  LYS  28           2HZ      LYS  28  -8.111   1.588 -10.189
  202    H    SER  29           H        SER  29  -1.843   1.423  -6.062
  203    HA   SER  29           HA       SER  29  -0.177  -0.879  -6.623
  204    HB2  SER  29           1HB      SER  29   0.017   1.284  -7.888
  205    HB3  SER  29           2HB      SER  29   0.651   2.024  -6.418
  206    HG   SER  29           HG       SER  29   1.787  -0.236  -7.706
  207    H    HIS  30           H        HIS  30  -1.075   0.927  -3.905
  208    HA   HIS  30           HA       HIS  30   1.361   0.596  -2.412
  209    HB2  HIS  30           1HB      HIS  30   0.223   2.415  -1.595
  210    HB3  HIS  30           2HB      HIS  30  -1.357   1.687  -1.870
  211    HD1  HIS  30           HD1      HIS  30   1.602   1.115   0.463
  212    HD2  HIS  30           HD2      HIS  30  -2.549   0.928   0.429
  213    HE1  HIS  30           HE1      HIS  30   0.936   0.510   2.812
  214    H    LEU  31           H        LEU  31  -1.464  -1.279  -3.026
  215    HA   LEU  31           HA       LEU  31  -1.312  -2.939  -0.707
  216    HB2  LEU  31           1HB      LEU  31  -2.540  -3.883  -3.252
  217    HB3  LEU  31           2HB      LEU  31  -3.082  -4.112  -1.591
  218    HG   LEU  31           HG       LEU  31  -3.438  -1.708  -3.359
  219   HD11  LEU  31          1HD1      LEU  31  -5.036  -3.921  -2.700
  220   HD12  LEU  31          2HD1      LEU  31  -5.507  -2.469  -3.582
  221   HD13  LEU  31          3HD1      LEU  31  -5.712  -2.542  -1.832
  222   HD21  LEU  31          3HD2      LEU  31  -4.564  -0.753  -1.250
  223   HD22  LEU  31          1HD2      LEU  31  -2.807  -0.663  -1.378
  224   HD23  LEU  31          2HD2      LEU  31  -3.554  -1.902  -0.370
  225    H    ARG  32           H        ARG  32   0.739  -2.623  -3.258
  226    HA   ARG  32           HA       ARG  32   1.329  -5.352  -3.841
  227    HB2  ARG  32           1HB      ARG  32   2.571  -2.713  -4.448
  228    HB3  ARG  32           2HB      ARG  32   3.578  -4.146  -4.603
  229    HG2  ARG  32           1HG      ARG  32   2.568  -3.541  -6.729
  230    HG3  ARG  32           2HG      ARG  32   1.986  -5.111  -6.173
  231    HD2  ARG  32           1HD      ARG  32  -0.107  -4.242  -5.564
  232    HD3  ARG  32           2HD      ARG  32   0.477  -2.579  -5.610
  233    HE   ARG  32           HE       ARG  32   0.067  -2.533  -7.862
  234   HH11  ARG  32          1HH1      ARG  32   0.042  -5.836  -6.762
  235   HH12  ARG  32          2HH1      ARG  32  -0.533  -6.471  -8.268
  236   HH21  ARG  32          1HH2      ARG  32  -0.690  -3.356  -9.850
  237   HH22  ARG  32          2HH2      ARG  32  -0.948  -5.059 -10.024
  238    H    ILE  33           H        ILE  33   2.357  -3.081  -1.415
  239    HA   ILE  33           HA       ILE  33   4.618  -4.679  -0.579
  240    HB   ILE  33           HB       ILE  33   5.086  -3.014   1.009
  241   HG12  ILE  33          1HG1      ILE  33   2.277  -1.950   0.635
  242   HG13  ILE  33          2HG1      ILE  33   2.807  -2.935   1.994
  243   HG21  ILE  33          1HG2      ILE  33   4.571  -2.324  -1.662
  244   HG22  ILE  33          2HG2      ILE  33   3.987  -0.979  -0.684
  245   HG23  ILE  33          3HG2      ILE  33   5.658  -1.519  -0.530
  246   HD11  ILE  33          3HD1      ILE  33   4.541  -1.095   2.393
  247   HD12  ILE  33          1HD1      ILE  33   3.544  -0.118   1.316
  248   HD13  ILE  33          2HD1      ILE  33   2.860  -0.764   2.808
  249    H    HIS  34           H        HIS  34   1.294  -4.732  -0.064
  250    HA   HIS  34           HA       HIS  34   1.415  -5.788   2.635
  251    HB2  HIS  34           1HB      HIS  34  -0.821  -5.224   0.702
  252    HB3  HIS  34           2HB      HIS  34  -1.101  -6.150   2.174
  253    HD1  HIS  34           HD1      HIS  34   0.378  -4.612   4.265
  254    HD2  HIS  34           HD2      HIS  34  -1.756  -2.748   1.227
  255    HE1  HIS  34           HE1      HIS  34  -0.147  -2.310   5.128
  256    H    THR  35           H        THR  35   1.013  -6.952  -0.648
  257    HA   THR  35           HA       THR  35   1.005  -9.713   0.389
  258    HB   THR  35           HB       THR  35  -1.093  -9.380  -0.690
  259    HG1  THR  35           HG1      THR  35   0.484 -11.210  -1.409
  260   HG21  THR  35          3HG2      THR  35   0.478  -8.222  -2.993
  261   HG22  THR  35          1HG2      THR  35  -0.633  -7.358  -1.931
  262   HG23  THR  35          2HG2      THR  35  -1.247  -8.586  -3.038
  263    H    GLY  36           H        GLY  36   3.401  -9.306   0.361
  264    HA2  GLY  36           1HA      GLY  36   4.451 -10.160  -2.245
  265    HA3  GLY  36           2HA      GLY  36   5.176  -8.764  -1.462
  266    H    SER  37           H        SER  37   5.978  -9.147   0.799
  267    HA   SER  37           HA       SER  37   6.569 -11.800   1.645
  268    HB2  SER  37           1HB      SER  37   8.187 -11.858  -0.104
  269    HB3  SER  37           2HB      SER  37   8.738 -10.222   0.256
  270    HG   SER  37           HG       SER  37  10.218 -11.417   1.257
  271    H    GLY  38           H        GLY  38   6.492 -11.609   3.777
  272    HA2  GLY  38           1HA      GLY  38   8.217 -10.145   5.356
  273    HA3  GLY  38           2HA      GLY  38   6.823  -9.105   5.105
  274    HA   PRO  39           HA       PRO  39   6.137 -12.662   8.316
  275    HB2  PRO  39           1HB      PRO  39   7.327 -11.689  10.553
  276    HB3  PRO  39           2HB      PRO  39   8.152 -12.760   9.414
  277    HG2  PRO  39           1HG      PRO  39   8.309  -9.781   9.666
  278    HG3  PRO  39           2HG      PRO  39   9.614 -10.952   9.402
  279    HD2  PRO  39           1HD      PRO  39   8.550  -9.479   7.395
  280    HD3  PRO  39           2HD      PRO  39   9.175 -11.122   7.146
  281    H    SER  40           H        SER  40   4.007 -12.105   8.421
  282    HA   SER  40           HA       SER  40   2.922  -9.640   9.075
  283    HB2  SER  40           1HB      SER  40   1.861 -12.446   9.315
  284    HB3  SER  40           2HB      SER  40   0.892 -11.062   9.820
  285    HG   SER  40           HG       SER  40   1.834 -11.727   7.249
  286    H    SER  41           H        SER  41   3.545 -12.407  11.221
  287    HA   SER  41           HA       SER  41   3.267 -10.580  13.516
  288    HB2  SER  41           1HB      SER  41   1.628 -12.492  13.382
  289    HB3  SER  41           2HB      SER  41   2.994 -13.592  13.571
  290    HG   SER  41           HG       SER  41   1.833 -12.970  15.547
  291    H    GLY  42           H        GLY  42   4.797 -10.655  15.173
  292    HA2  GLY  42           1HA      GLY  42   6.737 -11.969  16.088
  293    HA3  GLY  42           2HA      GLY  42   7.316 -12.010  14.429
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1  10.151  30.331  -6.251
    2    HA2  GLY   1           1HA      GLY   1   9.460  28.569  -7.671
    3    HA3  GLY   1           2HA      GLY   1  10.114  27.416  -6.517
    4    H    SER   2           H        SER   2   7.474  27.517  -7.809
    5    HA   SER   2           HA       SER   2   5.572  28.290  -5.811
    6    HB2  SER   2           1HB      SER   2   3.939  27.101  -7.312
    7    HB3  SER   2           2HB      SER   2   4.877  28.361  -8.113
    8    HG   SER   2           HG       SER   2   4.834  26.485  -9.377
    9    H    SER   3           H        SER   3   6.115  27.180  -3.932
   10    HA   SER   3           HA       SER   3   6.790  24.590  -3.519
   11    HB2  SER   3           1HB      SER   3   6.468  26.333  -1.743
   12    HB3  SER   3           2HB      SER   3   4.732  26.036  -1.836
   13    HG   SER   3           HG       SER   3   6.781  24.322  -0.938
   14    H    GLY   4           H        GLY   4   3.501  25.806  -4.048
   15    HA2  GLY   4           1HA      GLY   4   2.543  23.647  -5.458
   16    HA3  GLY   4           2HA      GLY   4   2.268  23.241  -3.770
   17    H    SER   5           H        SER   5   1.415  25.414  -2.570
   18    HA   SER   5           HA       SER   5  -0.483  26.614  -2.180
   19    HB2  SER   5           1HB      SER   5   0.091  27.341  -5.055
   20    HB3  SER   5           2HB      SER   5  -1.192  28.106  -4.117
   21    HG   SER   5           HG       SER   5   0.412  29.399  -3.606
   22    H    SER   6           H        SER   6  -0.957  23.926  -2.711
   23    HA   SER   6           HA       SER   6  -3.656  24.086  -3.831
   24    HB2  SER   6           1HB      SER   6  -3.371  22.067  -5.146
   25    HB3  SER   6           2HB      SER   6  -2.144  23.239  -5.624
   26    HG   SER   6           HG       SER   6  -1.741  21.111  -3.789
   27    H    GLY   7           H        GLY   7  -5.021  22.250  -3.207
   28    HA2  GLY   7           1HA      GLY   7  -4.223  21.247  -0.553
   29    HA3  GLY   7           2HA      GLY   7  -5.880  21.477  -1.093
   30    H    GLY   8           H        GLY   8  -4.059  19.128  -0.131
   31    HA2  GLY   8           1HA      GLY   8  -5.088  17.240  -2.152
   32    HA3  GLY   8           2HA      GLY   8  -3.449  17.093  -1.535
   33    H    GLU   9           H        GLU   9  -6.212  15.582  -1.363
   34    HA   GLU   9           HA       GLU   9  -5.855  14.866   1.467
   35    HB2  GLU   9           1HB      GLU   9  -8.415  15.457   0.006
   36    HB3  GLU   9           2HB      GLU   9  -8.399  14.411   1.419
   37    HG2  GLU   9           1HG      GLU   9  -8.982  16.625   2.100
   38    HG3  GLU   9           2HG      GLU   9  -7.375  16.248   2.717
   39    H    LYS  10           H        LYS  10  -6.513  12.696   2.010
   40    HA   LYS  10           HA       LYS  10  -6.261  10.873  -0.284
   41    HB2  LYS  10           1HB      LYS  10  -5.734  10.306   2.638
   42    HB3  LYS  10           2HB      LYS  10  -5.416   9.221   1.291
   43    HG2  LYS  10           1HG      LYS  10  -3.546  10.344   0.643
   44    HG3  LYS  10           2HG      LYS  10  -4.132  11.896   1.248
   45    HD2  LYS  10           1HD      LYS  10  -3.641  11.288   3.502
   46    HD3  LYS  10           2HD      LYS  10  -3.311   9.616   3.040
   47    HE2  LYS  10           1HE      LYS  10  -1.376  10.360   1.742
   48    HE3  LYS  10           2HE      LYS  10  -1.711  12.031   2.193
   49    HZ1  LYS  10           3HZ      LYS  10  -1.505  10.261   4.447
   50    HZ2  LYS  10           1HZ      LYS  10  -0.757  11.753   4.172
   51    HZ3  LYS  10           2HZ      LYS  10  -0.081  10.339   3.537
   52    HA   PRO  11           HA       PRO  11 -10.631  10.400   1.237
   53    HB2  PRO  11           1HB      PRO  11 -11.747  10.413  -1.238
   54    HB3  PRO  11           2HB      PRO  11 -11.427  11.890  -0.320
   55    HG2  PRO  11           1HG      PRO  11  -9.827  10.644  -2.522
   56    HG3  PRO  11           2HG      PRO  11 -10.230  12.350  -2.261
   57    HD2  PRO  11           1HD      PRO  11  -7.820  11.306  -1.604
   58    HD3  PRO  11           2HD      PRO  11  -8.566  12.633  -0.691
   59    H    TYR  12           H        TYR  12  -8.332   8.605  -0.279
   60    HA   TYR  12           HA       TYR  12 -10.141   6.303  -0.615
   61    HB2  TYR  12           1HB      TYR  12  -7.539   6.899  -2.036
   62    HB3  TYR  12           2HB      TYR  12  -8.436   5.392  -2.188
   63    HD1  TYR  12           HD1      TYR  12  -8.557   9.024  -2.873
   64    HD2  TYR  12           HD2      TYR  12 -10.311   5.222  -3.632
   65    HE1  TYR  12           HE1      TYR  12  -9.886  10.007  -4.695
   66    HE2  TYR  12           HE2      TYR  12 -11.643   6.195  -5.456
   67    HH   TYR  12           HH       TYR  12 -12.389   8.190  -6.330
   68    HA   PRO  13           HA       PRO  13  -7.473   5.289   2.983
   69    HB2  PRO  13           1HB      PRO  13  -9.391   3.854   4.262
   70    HB3  PRO  13           2HB      PRO  13  -9.260   5.612   4.391
   71    HG2  PRO  13           1HG      PRO  13 -11.079   3.970   2.672
   72    HG3  PRO  13           2HG      PRO  13 -11.445   5.424   3.618
   73    HD2  PRO  13           1HD      PRO  13 -11.023   5.493   0.944
   74    HD3  PRO  13           2HD      PRO  13 -10.578   6.837   2.016
   75    H    CYS  14           H        CYS  14  -6.226   3.515   3.127
   76    HA   CYS  14           HA       CYS  14  -6.377   1.455   1.226
   77    HB2  CYS  14           1HB      CYS  14  -4.254   1.984   2.193
   78    HB3  CYS  14           2HB      CYS  14  -4.850   1.680   3.821
   79    H    GLU  15           H        GLU  15  -6.557  -0.880   1.692
   80    HA   GLU  15           HA       GLU  15  -8.825  -1.363   3.487
   81    HB2  GLU  15           1HB      GLU  15  -9.240  -3.368   2.185
   82    HB3  GLU  15           2HB      GLU  15  -9.098  -1.982   1.113
   83    HG2  GLU  15           1HG      GLU  15  -7.815  -3.444  -0.037
   84    HG3  GLU  15           2HG      GLU  15  -6.575  -2.779   1.025
   85    H    ILE  16           H        ILE  16  -5.581  -2.504   2.719
   86    HA   ILE  16           HA       ILE  16  -5.549  -4.685   4.519
   87    HB   ILE  16           HB       ILE  16  -3.234  -3.057   3.463
   88   HG12  ILE  16          1HG1      ILE  16  -3.111  -5.360   2.103
   89   HG13  ILE  16          2HG1      ILE  16  -4.847  -5.313   2.387
   90   HG21  ILE  16          1HG2      ILE  16  -2.380  -4.201   5.309
   91   HG22  ILE  16          2HG2      ILE  16  -3.368  -5.627   4.999
   92   HG23  ILE  16          3HG2      ILE  16  -2.003  -5.255   3.947
   93   HD11  ILE  16          3HD1      ILE  16  -4.140  -2.751   1.509
   94   HD12  ILE  16          1HD1      ILE  16  -3.281  -3.886   0.468
   95   HD13  ILE  16          2HD1      ILE  16  -5.035  -3.990   0.629
   96    H    CYS  17           H        CYS  17  -3.590  -1.731   4.846
   97    HA   CYS  17           HA       CYS  17  -3.698  -2.016   7.744
   98    HB2  CYS  17           1HB      CYS  17  -1.983  -0.219   7.738
   99    HB3  CYS  17           2HB      CYS  17  -1.513  -1.616   6.776
  100    H    GLY  18           H        GLY  18  -4.376   0.469   5.286
  101    HA2  GLY  18           1HA      GLY  18  -6.652   1.533   5.741
  102    HA3  GLY  18           2HA      GLY  18  -5.959   1.917   7.309
  103    H    THR  19           H        THR  19  -3.300   2.316   5.860
  104    HA   THR  19           HA       THR  19  -3.159   5.029   5.817
  105    HB   THR  19           HB       THR  19  -1.647   2.991   4.207
  106    HG1  THR  19           HG1      THR  19  -1.421   3.570   6.611
  107   HG21  THR  19          3HG2      THR  19  -0.049   4.919   3.713
  108   HG22  THR  19          1HG2      THR  19  -1.398   5.987   4.095
  109   HG23  THR  19          2HG2      THR  19  -1.529   4.846   2.757
  110    H    ARG  20           H        ARG  20  -4.291   6.509   4.759
  111    HA   ARG  20           HA       ARG  20  -5.688   5.886   2.323
  112    HB2  ARG  20           1HB      ARG  20  -5.397   8.599   3.612
  113    HB3  ARG  20           2HB      ARG  20  -6.659   8.063   2.511
  114    HG2  ARG  20           1HG      ARG  20  -7.793   6.939   4.132
  115    HG3  ARG  20           2HG      ARG  20  -6.336   6.591   5.065
  116    HD2  ARG  20           1HD      ARG  20  -6.361   8.629   6.121
  117    HD3  ARG  20           2HD      ARG  20  -7.223   9.421   4.802
  118    HE   ARG  20           HE       ARG  20  -8.968   7.573   5.907
  119   HH11  ARG  20          1HH1      ARG  20  -7.269  10.441   6.912
  120   HH12  ARG  20          2HH1      ARG  20  -8.471  10.905   8.071
  121   HH21  ARG  20          1HH2      ARG  20 -10.557   8.173   7.430
  122   HH22  ARG  20          2HH2      ARG  20 -10.340   9.613   8.365
  123    H    PHE  21           H        PHE  21  -5.412   6.905   0.304
  124    HA   PHE  21           HA       PHE  21  -2.781   8.167  -0.098
  125    HB2  PHE  21           1HB      PHE  21  -4.136   6.025  -1.726
  126    HB3  PHE  21           2HB      PHE  21  -2.877   7.047  -2.410
  127    HD1  PHE  21           HD2      PHE  21  -3.574   4.681   0.360
  128    HD2  PHE  21           HD1      PHE  21  -0.630   6.533  -2.093
  129    HE1  PHE  21           HE2      PHE  21  -1.859   3.183   1.293
  130    HE2  PHE  21           HE1      PHE  21   1.089   5.038  -1.165
  131    HZ   PHE  21           HZ       PHE  21   0.476   3.361   0.532
  132    H    ARG  22           H        ARG  22  -2.758  10.011  -1.242
  133    HA   ARG  22           HA       ARG  22  -4.831  11.667  -1.604
  134    HB2  ARG  22           1HB      ARG  22  -2.388  11.315  -3.326
  135    HB3  ARG  22           2HB      ARG  22  -3.554  12.594  -3.638
  136    HG2  ARG  22           1HG      ARG  22  -2.431  12.308  -0.896
  137    HG3  ARG  22           2HG      ARG  22  -1.437  13.028  -2.165
  138    HD2  ARG  22           1HD      ARG  22  -4.208  13.949  -1.412
  139    HD3  ARG  22           2HD      ARG  22  -2.713  14.695  -0.850
  140    HE   ARG  22           HE       ARG  22  -3.922  14.966  -3.449
  141   HH11  ARG  22          1HH1      ARG  22  -0.978  15.205  -1.606
  142   HH12  ARG  22          2HH1      ARG  22  -0.223  16.307  -2.708
  143   HH21  ARG  22          1HH2      ARG  22  -2.938  16.417  -4.909
  144   HH22  ARG  22          2HH2      ARG  22  -1.339  16.997  -4.587
  145    H    HIS  23           H        HIS  23  -3.680   9.500  -4.195
  146    HA   HIS  23           HA       HIS  23  -6.355   9.698  -5.415
  147    HB2  HIS  23           1HB      HIS  23  -3.619   9.413  -6.614
  148    HB3  HIS  23           2HB      HIS  23  -5.034   8.848  -7.498
  149    HD2  HIS  23           HD2      HIS  23  -4.633  12.274  -5.550
  150    HE1  HIS  23           HE1      HIS  23  -5.699  13.033  -9.586
  151    HE2  HIS  23           HE2      HIS  23  -5.148  14.057  -7.352
  152    H    LEU  24           H        LEU  24  -7.137   7.762  -6.520
  153    HA   LEU  24           HA       LEU  24  -6.812   5.443  -4.878
  154    HB2  LEU  24           1HB      LEU  24  -8.967   6.075  -5.864
  155    HB3  LEU  24           2HB      LEU  24  -8.307   5.792  -7.474
  156    HG   LEU  24           HG       LEU  24  -8.409   3.505  -7.262
  157   HD11  LEU  24          1HD1      LEU  24  -8.369   2.269  -5.215
  158   HD12  LEU  24          2HD1      LEU  24  -8.564   3.740  -4.263
  159   HD13  LEU  24          3HD1      LEU  24  -7.073   3.465  -5.164
  160   HD21  LEU  24          3HD2      LEU  24 -10.577   2.923  -6.296
  161   HD22  LEU  24          1HD2      LEU  24 -10.669   4.423  -7.220
  162   HD23  LEU  24          2HD2      LEU  24 -10.624   4.475  -5.457
  163    H    GLN  25           H        GLN  25  -6.311   5.985  -8.371
  164    HA   GLN  25           HA       GLN  25  -5.246   3.660  -9.188
  165    HB2  GLN  25           1HB      GLN  25  -3.828   4.917 -10.763
  166    HB3  GLN  25           2HB      GLN  25  -5.456   5.576 -10.669
  167    HG2  GLN  25           1HG      GLN  25  -4.751   7.450  -9.461
  168    HG3  GLN  25           2HG      GLN  25  -3.204   6.711  -9.052
  169   HE21  GLN  25          1HE2      GLN  25  -5.012   8.449 -11.413
  170   HE22  GLN  25          2HE2      GLN  25  -3.710   8.744 -12.509
  171    H    THR  26           H        THR  26  -3.773   5.872  -6.955
  172    HA   THR  26           HA       THR  26  -1.173   4.616  -7.072
  173    HB   THR  26           HB       THR  26  -2.259   6.650  -5.115
  174    HG1  THR  26           HG1      THR  26  -2.081   7.403  -7.295
  175   HG21  THR  26          3HG2      THR  26   0.486   5.496  -5.538
  176   HG22  THR  26          1HG2      THR  26  -0.439   5.609  -4.041
  177   HG23  THR  26          2HG2      THR  26   0.238   7.065  -4.771
  178    H    LEU  27           H        LEU  27  -3.896   4.733  -4.801
  179    HA   LEU  27           HA       LEU  27  -2.824   3.265  -2.715
  180    HB2  LEU  27           1HB      LEU  27  -4.929   4.340  -2.453
  181    HB3  LEU  27           2HB      LEU  27  -5.637   3.409  -3.772
  182    HG   LEU  27           HG       LEU  27  -5.633   1.411  -2.432
  183   HD11  LEU  27          1HD1      LEU  27  -3.485   2.059  -1.228
  184   HD12  LEU  27          2HD1      LEU  27  -4.719   1.228  -0.282
  185   HD13  LEU  27          3HD1      LEU  27  -4.514   2.973  -0.126
  186   HD21  LEU  27          3HD2      LEU  27  -6.759   3.854  -1.091
  187   HD22  LEU  27          1HD2      LEU  27  -7.063   2.222  -0.496
  188   HD23  LEU  27          2HD2      LEU  27  -7.589   2.682  -2.116
  189    H    LYS  28           H        LYS  28  -4.598   2.065  -5.555
  190    HA   LYS  28           HA       LYS  28  -4.627  -0.632  -4.979
  191    HB2  LYS  28           1HB      LYS  28  -4.304   0.742  -7.650
  192    HB3  LYS  28           2HB      LYS  28  -4.640  -0.975  -7.465
  193    HG2  LYS  28           1HG      LYS  28  -6.795  -0.624  -6.784
  194    HG3  LYS  28           2HG      LYS  28  -6.445   0.981  -6.137
  195    HD2  LYS  28           1HD      LYS  28  -6.646   1.998  -8.181
  196    HD3  LYS  28           2HD      LYS  28  -6.171   0.549  -9.069
  197    HE2  LYS  28           1HE      LYS  28  -8.593   1.238  -9.281
  198    HE3  LYS  28           2HE      LYS  28  -8.302  -0.433  -8.799
  199    HZ1  LYS  28           3HZ      LYS  28  -8.536   0.483  -6.430
  200    HZ2  LYS  28           1HZ      LYS  28  -9.941   0.274  -7.349
  201    HZ3  LYS  28           2HZ      LYS  28  -9.276   1.817  -7.161
  202    H    SER  29           H        SER  29  -1.976   1.356  -6.072
  203    HA   SER  29           HA       SER  29  -0.269  -0.906  -6.657
  204    HB2  SER  29           1HB      SER  29  -0.123   1.256  -7.915
  205    HB3  SER  29           2HB      SER  29   0.483   2.019  -6.445
  206    HG   SER  29           HG       SER  29   2.316   0.835  -6.572
  207    H    HIS  30           H        HIS  30  -1.102   0.976  -3.933
  208    HA   HIS  30           HA       HIS  30   1.340   0.623  -2.474
  209    HB2  HIS  30           1HB      HIS  30   0.203   2.446  -1.654
  210    HB3  HIS  30           2HB      HIS  30  -1.376   1.700  -1.881
  211    HD1  HIS  30           HD1      HIS  30   1.647   1.210   0.386
  212    HD2  HIS  30           HD2      HIS  30  -2.497   0.921   0.448
  213    HE1  HIS  30           HE1      HIS  30   1.050   0.613   2.755
  214    H    LEU  31           H        LEU  31  -1.507  -1.251  -3.013
  215    HA   LEU  31           HA       LEU  31  -1.315  -2.902  -0.697
  216    HB2  LEU  31           1HB      LEU  31  -2.564  -3.844  -3.237
  217    HB3  LEU  31           2HB      LEU  31  -3.075  -4.110  -1.572
  218    HG   LEU  31           HG       LEU  31  -3.482  -1.670  -3.280
  219   HD11  LEU  31          1HD1      LEU  31  -5.742  -2.573  -1.781
  220   HD12  LEU  31          2HD1      LEU  31  -5.045  -3.927  -2.669
  221   HD13  LEU  31          3HD1      LEU  31  -5.534  -2.467  -3.529
  222   HD21  LEU  31          3HD2      LEU  31  -2.901  -0.633  -1.300
  223   HD22  LEU  31          1HD2      LEU  31  -3.524  -1.949  -0.305
  224   HD23  LEU  31          2HD2      LEU  31  -4.641  -0.843  -1.104
  225    H    ARG  32           H        ARG  32   0.726  -2.588  -3.249
  226    HA   ARG  32           HA       ARG  32   1.321  -5.324  -3.816
  227    HB2  ARG  32           1HB      ARG  32   2.532  -2.684  -4.477
  228    HB3  ARG  32           2HB      ARG  32   3.549  -4.111  -4.625
  229    HG2  ARG  32           1HG      ARG  32   2.563  -3.632  -6.752
  230    HG3  ARG  32           2HG      ARG  32   1.847  -5.114  -6.116
  231    HD2  ARG  32           1HD      ARG  32  -0.170  -4.053  -5.596
  232    HD3  ARG  32           2HD      ARG  32   0.551  -2.447  -5.679
  233    HE   ARG  32           HE       ARG  32   0.108  -2.423  -7.916
  234   HH11  ARG  32          1HH1      ARG  32   0.054  -5.721  -6.804
  235   HH12  ARG  32          2HH1      ARG  32  -0.488  -6.361  -8.320
  236   HH21  ARG  32          1HH2      ARG  32  -0.606  -3.252  -9.917
  237   HH22  ARG  32          2HH2      ARG  32  -0.862  -4.956 -10.090
  238    H    ILE  33           H        ILE  33   2.450  -2.964  -1.498
  239    HA   ILE  33           HA       ILE  33   4.707  -4.544  -0.654
  240    HB   ILE  33           HB       ILE  33   5.088  -2.868   1.014
  241   HG12  ILE  33          1HG1      ILE  33   2.605  -1.366   0.297
  242   HG13  ILE  33          2HG1      ILE  33   2.481  -2.716   1.420
  243   HG21  ILE  33          1HG2      ILE  33   5.956  -1.843  -0.783
  244   HG22  ILE  33          2HG2      ILE  33   4.508  -2.104  -1.754
  245   HG23  ILE  33          3HG2      ILE  33   4.578  -0.755  -0.619
  246   HD11  ILE  33          3HD1      ILE  33   3.272  -0.052   1.936
  247   HD12  ILE  33          1HD1      ILE  33   3.136  -1.400   3.065
  248   HD13  ILE  33          2HD1      ILE  33   4.661  -1.098   2.231
  249    H    HIS  34           H        HIS  34   1.393  -4.629  -0.078
  250    HA   HIS  34           HA       HIS  34   1.562  -5.630   2.636
  251    HB2  HIS  34           1HB      HIS  34  -0.691  -5.150   0.706
  252    HB3  HIS  34           2HB      HIS  34  -0.950  -6.085   2.175
  253    HD1  HIS  34           HD1      HIS  34   0.516  -4.496   4.256
  254    HD2  HIS  34           HD2      HIS  34  -1.728  -2.714   1.246
  255    HE1  HIS  34           HE1      HIS  34  -0.082  -2.212   5.124
  256    H    THR  35           H        THR  35   0.695  -6.914  -0.563
  257    HA   THR  35           HA       THR  35   1.069  -9.631   0.518
  258    HB   THR  35           HB       THR  35  -1.222  -9.146  -0.334
  259    HG1  THR  35           HG1      THR  35  -1.021 -11.006  -1.990
  260   HG21  THR  35          3HG2      THR  35  -0.003  -9.108  -3.083
  261   HG22  THR  35          1HG2      THR  35  -0.345  -7.626  -2.191
  262   HG23  THR  35          2HG2      THR  35  -1.658  -8.725  -2.611
  263    H    GLY  36           H        GLY  36   2.887 -10.589  -0.099
  264    HA2  GLY  36           1HA      GLY  36   4.162 -11.533  -1.939
  265    HA3  GLY  36           2HA      GLY  36   3.911 -10.027  -2.809
  266    H    SER  37           H        SER  37   5.658 -11.576  -0.193
  267    HA   SER  37           HA       SER  37   7.641  -9.402  -0.333
  268    HB2  SER  37           1HB      SER  37   6.339  -9.350   1.798
  269    HB3  SER  37           2HB      SER  37   6.926 -10.974   2.154
  270    HG   SER  37           HG       SER  37   8.139  -8.630   2.575
  271    H    GLY  38           H        GLY  38   7.036 -12.829   0.263
  272    HA2  GLY  38           1HA      GLY  38   9.833 -13.356  -0.525
  273    HA3  GLY  38           2HA      GLY  38   9.087 -14.213   0.816
  274    HA   PRO  39           HA       PRO  39   8.571 -16.841  -2.942
  275    HB2  PRO  39           1HB      PRO  39   9.147 -19.166  -1.665
  276    HB3  PRO  39           2HB      PRO  39  10.390 -18.113  -2.350
  277    HG2  PRO  39           1HG      PRO  39   9.465 -18.354   0.487
  278    HG3  PRO  39           2HG      PRO  39  11.116 -18.215  -0.143
  279    HD2  PRO  39           1HD      PRO  39   9.776 -16.110   0.907
  280    HD3  PRO  39           2HD      PRO  39  10.960 -15.930  -0.404
  281    H    SER  40           H        SER  40   7.044 -16.423   0.025
  282    HA   SER  40           HA       SER  40   4.760 -18.024  -0.880
  283    HB2  SER  40           1HB      SER  40   5.725 -17.995   1.988
  284    HB3  SER  40           2HB      SER  40   4.375 -18.922   1.335
  285    HG   SER  40           HG       SER  40   7.007 -19.529   1.374
  286    H    SER  41           H        SER  41   3.140 -16.652  -1.156
  287    HA   SER  41           HA       SER  41   3.005 -14.038  -0.276
  288    HB2  SER  41           1HB      SER  41   0.542 -14.206  -0.750
  289    HB3  SER  41           2HB      SER  41   1.570 -14.794  -2.057
  290    HG   SER  41           HG       SER  41  -0.280 -16.156  -1.407
  291    H    GLY  42           H        GLY  42   1.610 -13.010   1.297
  292    HA2  GLY  42           1HA      GLY  42   0.534 -12.830   3.342
  293    HA3  GLY  42           2HA      GLY  42   0.497 -14.584   3.440
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1  13.838  20.528  -3.817
    2    HA2  GLY   1           1HA      GLY   1  15.137  21.307  -1.956
    3    HA3  GLY   1           2HA      GLY   1  13.491  21.840  -1.651
    4    H    SER   2           H        SER   2  12.730  21.401   0.299
    5    HA   SER   2           HA       SER   2  13.764  19.026   1.704
    6    HB2  SER   2           1HB      SER   2  13.799  20.239   3.779
    7    HB3  SER   2           2HB      SER   2  14.677  21.201   2.590
    8    HG   SER   2           HG       SER   2  12.127  21.632   3.697
    9    H    SER   3           H        SER   3  12.321  17.899   3.012
   10    HA   SER   3           HA       SER   3   9.672  17.760   2.149
   11    HB2  SER   3           1HB      SER   3   9.304  16.240   4.020
   12    HB3  SER   3           2HB      SER   3  10.874  15.912   3.287
   13    HG   SER   3           HG       SER   3  11.747  16.334   5.139
   14    H    GLY   4           H        GLY   4   7.787  18.656   2.810
   15    HA2  GLY   4           1HA      GLY   4   7.764  20.285   5.245
   16    HA3  GLY   4           2HA      GLY   4   7.388  21.081   3.724
   17    H    SER   5           H        SER   5   5.273  21.513   3.832
   18    HA   SER   5           HA       SER   5   3.458  19.251   4.341
   19    HB2  SER   5           1HB      SER   5   3.385  22.030   5.464
   20    HB3  SER   5           2HB      SER   5   1.875  21.155   5.210
   21    HG   SER   5           HG       SER   5   2.477  19.661   6.675
   22    H    SER   6           H        SER   6   3.026  18.835   2.207
   23    HA   SER   6           HA       SER   6   1.212  20.665   0.902
   24    HB2  SER   6           1HB      SER   6   3.946  20.073  -0.209
   25    HB3  SER   6           2HB      SER   6   2.600  20.480  -1.272
   26    HG   SER   6           HG       SER   6   4.142  22.125   0.128
   27    H    GLY   7           H        GLY   7  -0.122  19.664  -0.592
   28    HA2  GLY   7           1HA      GLY   7  -0.043  17.530  -2.107
   29    HA3  GLY   7           2HA      GLY   7  -0.005  16.736  -0.540
   30    H    GLY   8           H        GLY   8  -2.016  15.931  -1.957
   31    HA2  GLY   8           1HA      GLY   8  -4.335  17.622  -1.294
   32    HA3  GLY   8           2HA      GLY   8  -4.320  16.353  -2.509
   33    H    GLU   9           H        GLU   9  -6.338  16.463  -0.657
   34    HA   GLU   9           HA       GLU   9  -5.894  14.938   1.671
   35    HB2  GLU   9           1HB      GLU   9  -8.392  15.458   0.059
   36    HB3  GLU   9           2HB      GLU   9  -8.396  14.573   1.579
   37    HG2  GLU   9           1HG      GLU   9  -7.378  16.577   2.660
   38    HG3  GLU   9           2HG      GLU   9  -7.613  17.443   1.142
   39    H    LYS  10           H        LYS  10  -6.488  12.766   2.135
   40    HA   LYS  10           HA       LYS  10  -6.224  10.990  -0.196
   41    HB2  LYS  10           1HB      LYS  10  -5.594  10.504   2.721
   42    HB3  LYS  10           2HB      LYS  10  -5.467   9.286   1.458
   43    HG2  LYS  10           1HG      LYS  10  -3.301   9.983   1.575
   44    HG3  LYS  10           2HG      LYS  10  -3.911  11.078   0.333
   45    HD2  LYS  10           1HD      LYS  10  -3.989  12.889   1.792
   46    HD3  LYS  10           2HD      LYS  10  -3.993  11.857   3.225
   47    HE2  LYS  10           1HE      LYS  10  -1.632  11.144   2.282
   48    HE3  LYS  10           2HE      LYS  10  -1.724  12.722   1.502
   49    HZ1  LYS  10           3HZ      LYS  10  -1.643  13.813   3.489
   50    HZ2  LYS  10           1HZ      LYS  10  -0.710  12.457   3.880
   51    HZ3  LYS  10           2HZ      LYS  10  -2.328  12.538   4.365
   52    HA   PRO  11           HA       PRO  11 -10.582  10.455   1.349
   53    HB2  PRO  11           1HB      PRO  11 -11.722  10.543  -1.114
   54    HB3  PRO  11           2HB      PRO  11 -11.401  11.990  -0.152
   55    HG2  PRO  11           1HG      PRO  11  -9.816  10.826  -2.409
   56    HG3  PRO  11           2HG      PRO  11 -10.226  12.521  -2.087
   57    HD2  PRO  11           1HD      PRO  11  -7.804  11.469  -1.489
   58    HD3  PRO  11           2HD      PRO  11  -8.548  12.762  -0.526
   59    H    TYR  12           H        TYR  12  -8.284   8.715  -0.210
   60    HA   TYR  12           HA       TYR  12 -10.085   6.416  -0.609
   61    HB2  TYR  12           1HB      TYR  12  -7.510   7.076  -2.052
   62    HB3  TYR  12           2HB      TYR  12  -8.395   5.566  -2.234
   63    HD1  TYR  12           HD1      TYR  12  -8.546   9.212  -2.823
   64    HD2  TYR  12           HD2      TYR  12 -10.307   5.426  -3.640
   65    HE1  TYR  12           HE1      TYR  12  -9.912  10.236  -4.594
   66    HE2  TYR  12           HE2      TYR  12 -11.677   6.439  -5.413
   67    HH   TYR  12           HH       TYR  12 -12.137   9.708  -5.738
   68    HA   PRO  13           HA       PRO  13  -7.355   5.310   2.915
   69    HB2  PRO  13           1HB      PRO  13  -9.242   3.819   4.174
   70    HB3  PRO  13           2HB      PRO  13  -9.124   5.573   4.357
   71    HG2  PRO  13           1HG      PRO  13 -10.954   3.969   2.613
   72    HG3  PRO  13           2HG      PRO  13 -11.319   5.390   3.610
   73    HD2  PRO  13           1HD      PRO  13 -10.936   5.547   0.934
   74    HD3  PRO  13           2HD      PRO  13 -10.487   6.860   2.042
   75    H    CYS  14           H        CYS  14  -6.252   3.415   3.263
   76    HA   CYS  14           HA       CYS  14  -6.333   1.452   1.207
   77    HB2  CYS  14           1HB      CYS  14  -4.221   1.962   2.230
   78    HB3  CYS  14           2HB      CYS  14  -4.841   1.574   3.831
   79    H    GLU  15           H        GLU  15  -6.533  -0.893   1.608
   80    HA   GLU  15           HA       GLU  15  -8.828  -1.409   3.358
   81    HB2  GLU  15           1HB      GLU  15  -9.294  -2.054   1.128
   82    HB3  GLU  15           2HB      GLU  15  -7.729  -2.833   0.944
   83    HG2  GLU  15           1HG      GLU  15  -9.207  -4.604   1.161
   84    HG3  GLU  15           2HG      GLU  15  -8.520  -4.434   2.775
   85    H    ILE  16           H        ILE  16  -5.573  -2.536   2.623
   86    HA   ILE  16           HA       ILE  16  -5.589  -4.754   4.387
   87    HB   ILE  16           HB       ILE  16  -3.217  -3.159   3.410
   88   HG12  ILE  16          1HG1      ILE  16  -3.176  -5.383   1.914
   89   HG13  ILE  16          2HG1      ILE  16  -4.913  -5.266   2.173
   90   HG21  ILE  16          1HG2      ILE  16  -1.880  -4.607   4.453
   91   HG22  ILE  16          2HG2      ILE  16  -3.304  -5.098   5.368
   92   HG23  ILE  16          3HG2      ILE  16  -2.833  -5.993   3.924
   93   HD11  ILE  16          3HD1      ILE  16  -3.305  -3.874   0.313
   94   HD12  ILE  16          1HD1      ILE  16  -5.047  -3.764   0.563
   95   HD13  ILE  16          2HD1      ILE  16  -3.959  -2.698   1.452
   96    H    CYS  17           H        CYS  17  -3.578  -1.840   4.751
   97    HA   CYS  17           HA       CYS  17  -3.658  -2.161   7.639
   98    HB2  CYS  17           1HB      CYS  17  -1.985  -0.320   7.636
   99    HB3  CYS  17           2HB      CYS  17  -1.500  -1.695   6.648
  100    H    GLY  18           H        GLY  18  -4.435   0.358   5.246
  101    HA2  GLY  18           1HA      GLY  18  -6.729   1.358   5.775
  102    HA3  GLY  18           2HA      GLY  18  -6.002   1.737   7.329
  103    H    THR  19           H        THR  19  -3.397   2.204   5.784
  104    HA   THR  19           HA       THR  19  -3.273   4.908   5.798
  105    HB   THR  19           HB       THR  19  -1.886   3.011   3.904
  106    HG1  THR  19           HG1      THR  19  -0.427   2.905   5.464
  107   HG21  THR  19          3HG2      THR  19  -1.635   4.988   2.730
  108   HG22  THR  19          1HG2      THR  19  -0.232   5.032   3.797
  109   HG23  THR  19          2HG2      THR  19  -1.666   5.980   4.188
  110    H    ARG  20           H        ARG  20  -3.863   6.600   4.541
  111    HA   ARG  20           HA       ARG  20  -5.605   5.995   2.261
  112    HB2  ARG  20           1HB      ARG  20  -5.313   8.704   3.525
  113    HB3  ARG  20           2HB      ARG  20  -6.674   8.050   2.624
  114    HG2  ARG  20           1HG      ARG  20  -7.293   6.636   4.444
  115    HG3  ARG  20           2HG      ARG  20  -5.819   7.042   5.325
  116    HD2  ARG  20           1HD      ARG  20  -7.267   8.460   6.365
  117    HD3  ARG  20           2HD      ARG  20  -6.764   9.498   5.032
  118    HE   ARG  20           HE       ARG  20  -8.874   9.325   4.129
  119   HH11  ARG  20          1HH1      ARG  20  -8.497   7.014   6.705
  120   HH12  ARG  20          2HH1      ARG  20 -10.179   6.600   6.755
  121   HH21  ARG  20          1HH2      ARG  20 -11.091   8.789   4.186
  122   HH22  ARG  20          2HH2      ARG  20 -11.653   7.610   5.322
  123    H    PHE  21           H        PHE  21  -5.379   7.080   0.278
  124    HA   PHE  21           HA       PHE  21  -2.783   8.407  -0.134
  125    HB2  PHE  21           1HB      PHE  21  -4.126   6.318  -1.849
  126    HB3  PHE  21           2HB      PHE  21  -2.832   7.350  -2.449
  127    HD1  PHE  21           HD2      PHE  21  -3.631   4.917   0.242
  128    HD2  PHE  21           HD1      PHE  21  -0.616   6.742  -2.144
  129    HE1  PHE  21           HE2      PHE  21  -1.967   3.352   1.155
  130    HE2  PHE  21           HE1      PHE  21   1.053   5.179  -1.236
  131    HZ   PHE  21           HZ       PHE  21   0.379   3.482   0.417
  132    H    ARG  22           H        ARG  22  -2.736  10.136  -1.537
  133    HA   ARG  22           HA       ARG  22  -4.889  11.809  -1.726
  134    HB2  ARG  22           1HB      ARG  22  -3.683  12.975  -3.529
  135    HB3  ARG  22           2HB      ARG  22  -2.618  12.544  -2.198
  136    HG2  ARG  22           1HG      ARG  22  -1.664  10.751  -3.435
  137    HG3  ARG  22           2HG      ARG  22  -2.875  10.911  -4.708
  138    HD2  ARG  22           1HD      ARG  22  -0.938  11.937  -5.560
  139    HD3  ARG  22           2HD      ARG  22  -1.985  13.263  -5.054
  140    HE   ARG  22           HE       ARG  22  -0.080  12.414  -3.062
  141   HH11  ARG  22          1HH1      ARG  22  -0.694  14.522  -5.764
  142   HH12  ARG  22          2HH1      ARG  22   0.517  15.674  -5.308
  143   HH21  ARG  22          1HH2      ARG  22   1.517  13.924  -2.451
  144   HH22  ARG  22          2HH2      ARG  22   1.775  15.333  -3.423
  145    H    HIS  23           H        HIS  23  -3.870   9.369  -4.079
  146    HA   HIS  23           HA       HIS  23  -6.484   9.677  -5.404
  147    HB2  HIS  23           1HB      HIS  23  -3.746   9.430  -6.547
  148    HB3  HIS  23           2HB      HIS  23  -5.059   8.622  -7.399
  149    HD2  HIS  23           HD2      HIS  23  -4.782  12.304  -5.932
  150    HE1  HIS  23           HE1      HIS  23  -6.317  12.428  -9.885
  151    HE2  HIS  23           HE2      HIS  23  -5.584  13.786  -7.895
  152    H    LEU  24           H        LEU  24  -7.183   7.679  -6.576
  153    HA   LEU  24           HA       LEU  24  -6.980   5.431  -4.793
  154    HB2  LEU  24           1HB      LEU  24  -9.092   6.097  -5.892
  155    HB3  LEU  24           2HB      LEU  24  -8.391   5.656  -7.447
  156    HG   LEU  24           HG       LEU  24  -9.896   3.924  -6.693
  157   HD11  LEU  24          1HD1      LEU  24  -7.634   3.424  -7.820
  158   HD12  LEU  24          2HD1      LEU  24  -8.527   2.092  -7.089
  159   HD13  LEU  24          3HD1      LEU  24  -7.157   2.806  -6.239
  160   HD21  LEU  24          3HD2      LEU  24  -8.623   2.722  -4.534
  161   HD22  LEU  24          1HD2      LEU  24 -10.146   3.610  -4.506
  162   HD23  LEU  24          2HD2      LEU  24  -8.634   4.443  -4.146
  163    H    GLN  25           H        GLN  25  -6.533   5.683  -8.326
  164    HA   GLN  25           HA       GLN  25  -5.428   3.344  -8.970
  165    HB2  GLN  25           1HB      GLN  25  -4.022   4.490 -10.638
  166    HB3  GLN  25           2HB      GLN  25  -5.652   5.146 -10.585
  167    HG2  GLN  25           1HG      GLN  25  -4.888   7.050  -9.315
  168    HG3  GLN  25           2HG      GLN  25  -3.261   6.376  -9.235
  169   HE21  GLN  25          1HE2      GLN  25  -1.877   7.118 -10.665
  170   HE22  GLN  25          2HE2      GLN  25  -2.268   7.833 -12.189
  171    H    THR  26           H        THR  26  -3.722   5.923  -7.260
  172    HA   THR  26           HA       THR  26  -1.194   4.649  -7.206
  173    HB   THR  26           HB       THR  26  -2.316   6.721  -5.309
  174    HG1  THR  26           HG1      THR  26  -1.905   8.083  -6.869
  175   HG21  THR  26          3HG2      THR  26   0.560   6.698  -5.755
  176   HG22  THR  26          1HG2      THR  26  -0.020   5.210  -5.008
  177   HG23  THR  26          2HG2      THR  26  -0.347   6.766  -4.244
  178    H    LEU  27           H        LEU  27  -3.865   4.774  -4.872
  179    HA   LEU  27           HA       LEU  27  -2.671   3.391  -2.779
  180    HB2  LEU  27           1HB      LEU  27  -4.725   4.423  -2.339
  181    HB3  LEU  27           2HB      LEU  27  -5.514   3.630  -3.701
  182    HG   LEU  27           HG       LEU  27  -5.496   1.512  -2.499
  183   HD11  LEU  27          1HD1      LEU  27  -4.780   1.399  -0.170
  184   HD12  LEU  27          2HD1      LEU  27  -4.222   3.070  -0.253
  185   HD13  LEU  27          3HD1      LEU  27  -3.438   1.829  -1.230
  186   HD21  LEU  27          3HD2      LEU  27  -7.479   2.204  -1.779
  187   HD22  LEU  27          1HD2      LEU  27  -6.920   3.875  -1.699
  188   HD23  LEU  27          2HD2      LEU  27  -6.692   2.802  -0.317
  189    H    LYS  28           H        LYS  28  -4.568   2.114  -5.501
  190    HA   LYS  28           HA       LYS  28  -4.598  -0.563  -4.845
  191    HB2  LYS  28           1HB      LYS  28  -4.556   0.900  -7.458
  192    HB3  LYS  28           2HB      LYS  28  -4.457  -0.856  -7.448
  193    HG2  LYS  28           1HG      LYS  28  -6.578  -1.063  -6.423
  194    HG3  LYS  28           2HG      LYS  28  -6.642   0.661  -6.051
  195    HD2  LYS  28           1HD      LYS  28  -7.063   1.249  -8.258
  196    HD3  LYS  28           2HD      LYS  28  -6.417  -0.267  -8.889
  197    HE2  LYS  28           1HE      LYS  28  -8.355  -1.429  -7.792
  198    HE3  LYS  28           2HE      LYS  28  -9.026   0.164  -7.444
  199    HZ1  LYS  28           3HZ      LYS  28  -8.974   0.615  -9.853
  200    HZ2  LYS  28           1HZ      LYS  28  -9.989  -0.677  -9.451
  201    HZ3  LYS  28           2HZ      LYS  28  -8.468  -0.975 -10.129
  202    H    SER  29           H        SER  29  -1.959   1.369  -6.047
  203    HA   SER  29           HA       SER  29  -0.291  -0.911  -6.656
  204    HB2  SER  29           1HB      SER  29  -0.254   1.455  -7.760
  205    HB3  SER  29           2HB      SER  29   0.746   1.894  -6.375
  206    HG   SER  29           HG       SER  29   1.504   0.679  -8.585
  207    H    HIS  30           H        HIS  30  -0.992   1.054  -3.929
  208    HA   HIS  30           HA       HIS  30   1.457   0.624  -2.519
  209    HB2  HIS  30           1HB      HIS  30   0.414   2.466  -1.648
  210    HB3  HIS  30           2HB      HIS  30  -1.199   1.806  -1.902
  211    HD1  HIS  30           HD1      HIS  30   1.757   1.297   0.432
  212    HD2  HIS  30           HD2      HIS  30  -2.378   0.891   0.363
  213    HE1  HIS  30           HE1      HIS  30   1.104   0.660   2.776
  214    H    LEU  31           H        LEU  31  -1.347  -1.250  -3.087
  215    HA   LEU  31           HA       LEU  31  -1.243  -2.857  -0.732
  216    HB2  LEU  31           1HB      LEU  31  -2.395  -3.838  -3.303
  217    HB3  LEU  31           2HB      LEU  31  -2.962  -4.092  -1.654
  218    HG   LEU  31           HG       LEU  31  -3.348  -1.696  -3.423
  219   HD11  LEU  31          1HD1      LEU  31  -5.722  -2.119  -2.450
  220   HD12  LEU  31          2HD1      LEU  31  -5.085  -3.722  -2.085
  221   HD13  LEU  31          3HD1      LEU  31  -5.111  -3.142  -3.750
  222   HD21  LEU  31          3HD2      LEU  31  -4.462  -0.696  -1.362
  223   HD22  LEU  31          1HD2      LEU  31  -2.699  -0.669  -1.415
  224   HD23  LEU  31          2HD2      LEU  31  -3.533  -1.871  -0.430
  225    H    ARG  32           H        ARG  32   0.852  -2.594  -3.269
  226    HA   ARG  32           HA       ARG  32   1.485  -5.315  -3.784
  227    HB2  ARG  32           1HB      ARG  32   2.732  -2.678  -4.362
  228    HB3  ARG  32           2HB      ARG  32   3.772  -4.093  -4.436
  229    HG2  ARG  32           1HG      ARG  32   2.968  -3.706  -6.626
  230    HG3  ARG  32           2HG      ARG  32   2.106  -5.116  -6.007
  231    HD2  ARG  32           1HD      ARG  32   0.263  -3.509  -5.328
  232    HD3  ARG  32           2HD      ARG  32   1.097  -2.298  -6.301
  233    HE   ARG  32           HE       ARG  32  -0.465  -4.516  -7.255
  234   HH11  ARG  32          1HH1      ARG  32   2.067  -2.251  -8.019
  235   HH12  ARG  32          2HH1      ARG  32   1.835  -2.370  -9.732
  236   HH21  ARG  32          1HH2      ARG  32  -0.779  -4.681  -9.509
  237   HH22  ARG  32          2HH2      ARG  32   0.215  -3.752 -10.578
  238    H    ILE  33           H        ILE  33   2.766  -2.890  -1.552
  239    HA   ILE  33           HA       ILE  33   4.873  -4.523  -0.556
  240    HB   ILE  33           HB       ILE  33   5.193  -2.868   1.135
  241   HG12  ILE  33          1HG1      ILE  33   2.636  -1.487   0.361
  242   HG13  ILE  33          2HG1      ILE  33   2.647  -2.744   1.594
  243   HG21  ILE  33          1HG2      ILE  33   6.071  -1.950  -0.764
  244   HG22  ILE  33          2HG2      ILE  33   4.519  -1.916  -1.598
  245   HG23  ILE  33          3HG2      ILE  33   4.879  -0.715  -0.358
  246   HD11  ILE  33          3HD1      ILE  33   4.010  -0.075   1.641
  247   HD12  ILE  33          1HD1      ILE  33   2.798  -0.715   2.751
  248   HD13  ILE  33          2HD1      ILE  33   4.435  -1.374   2.756
  249    H    HIS  34           H        HIS  34   1.541  -4.639  -0.132
  250    HA   HIS  34           HA       HIS  34   1.609  -5.688   2.573
  251    HB2  HIS  34           1HB      HIS  34  -0.583  -5.159   0.582
  252    HB3  HIS  34           2HB      HIS  34  -0.888  -6.096   2.041
  253    HD1  HIS  34           HD1      HIS  34   0.683  -4.461   4.092
  254    HD2  HIS  34           HD2      HIS  34  -1.755  -2.782   1.177
  255    HE1  HIS  34           HE1      HIS  34   0.048  -2.193   4.972
  256    H    THR  35           H        THR  35   0.063  -6.989  -0.358
  257    HA   THR  35           HA       THR  35   0.186  -9.665   0.527
  258    HB   THR  35           HB       THR  35  -1.469  -9.049  -1.107
  259    HG1  THR  35           HG1      THR  35  -0.801 -10.631  -2.828
  260   HG21  THR  35          3HG2      THR  35  -0.892  -8.393  -3.384
  261   HG22  THR  35          1HG2      THR  35   0.824  -8.470  -2.986
  262   HG23  THR  35          2HG2      THR  35  -0.205  -7.258  -2.222
  263    H    GLY  36           H        GLY  36   2.279  -7.749  -1.577
  264    HA2  GLY  36           1HA      GLY  36   4.374  -8.156  -2.422
  265    HA3  GLY  36           2HA      GLY  36   4.602  -9.170  -1.006
  266    H    SER  37           H        SER  37   3.205  -9.179  -4.267
  267    HA   SER  37           HA       SER  37   3.797 -12.063  -4.409
  268    HB2  SER  37           1HB      SER  37   1.595 -10.432  -5.663
  269    HB3  SER  37           2HB      SER  37   2.049 -12.013  -6.299
  270    HG   SER  37           HG       SER  37   0.800 -12.778  -4.802
  271    H    GLY  38           H        GLY  38   3.440  -9.213  -6.533
  272    HA2  GLY  38           1HA      GLY  38   5.580 -10.334  -8.225
  273    HA3  GLY  38           2HA      GLY  38   4.343  -9.215  -8.779
  274    HA   PRO  39           HA       PRO  39   7.317  -6.008  -8.302
  275    HB2  PRO  39           1HB      PRO  39   5.626  -3.883  -8.317
  276    HB3  PRO  39           2HB      PRO  39   6.025  -4.804  -9.772
  277    HG2  PRO  39           1HG      PRO  39   3.611  -4.995  -8.012
  278    HG3  PRO  39           2HG      PRO  39   3.709  -5.012  -9.783
  279    HD2  PRO  39           1HD      PRO  39   3.418  -7.271  -8.319
  280    HD3  PRO  39           2HD      PRO  39   4.308  -7.237  -9.854
  281    H    SER  40           H        SER  40   8.251  -4.864  -6.675
  282    HA   SER  40           HA       SER  40   8.689  -4.147  -4.561
  283    HB2  SER  40           1HB      SER  40   5.710  -3.605  -4.504
  284    HB3  SER  40           2HB      SER  40   6.901  -2.935  -3.389
  285    HG   SER  40           HG       SER  40   7.926  -2.103  -5.408
  286    H    SER  41           H        SER  41   8.522  -6.850  -4.756
  287    HA   SER  41           HA       SER  41   6.727  -7.973  -2.827
  288    HB2  SER  41           1HB      SER  41   8.949  -8.990  -4.535
  289    HB3  SER  41           2HB      SER  41   8.502  -9.941  -3.120
  290    HG   SER  41           HG       SER  41   6.680  -9.062  -5.111
  291    H    GLY  42           H        GLY  42   7.615  -9.324  -0.984
  292    HA2  GLY  42           1HA      GLY  42   9.422  -7.620   0.566
  293    HA3  GLY  42           2HA      GLY  42   8.364  -8.865   1.213
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1 -20.076  24.999  -7.690
    2    HA2  GLY   1           1HA      GLY   1 -22.763  24.233  -6.731
    3    HA3  GLY   1           2HA      GLY   1 -21.507  23.082  -7.165
    4    H    SER   2           H        SER   2 -23.018  23.418  -4.654
    5    HA   SER   2           HA       SER   2 -20.787  24.021  -2.827
    6    HB2  SER   2           1HB      SER   2 -23.774  24.095  -2.349
    7    HB3  SER   2           2HB      SER   2 -22.565  24.302  -1.082
    8    HG   SER   2           HG       SER   2 -22.309  25.905  -3.339
    9    H    SER   3           H        SER   3 -23.592  21.858  -3.203
   10    HA   SER   3           HA       SER   3 -23.128  20.047  -1.218
   11    HB2  SER   3           1HB      SER   3 -24.289  18.388  -2.584
   12    HB3  SER   3           2HB      SER   3 -25.060  19.964  -2.766
   13    HG   SER   3           HG       SER   3 -24.124  18.417  -4.670
   14    H    GLY   4           H        GLY   4 -21.642  20.052  -4.445
   15    HA2  GLY   4           1HA      GLY   4 -20.193  17.706  -4.317
   16    HA3  GLY   4           2HA      GLY   4 -19.665  19.142  -5.183
   17    H    SER   5           H        SER   5 -17.846  17.412  -4.036
   18    HA   SER   5           HA       SER   5 -16.969  18.752  -1.577
   19    HB2  SER   5           1HB      SER   5 -15.354  16.823  -1.426
   20    HB3  SER   5           2HB      SER   5 -17.054  16.362  -1.347
   21    HG   SER   5           HG       SER   5 -15.443  16.278  -3.684
   22    H    SER   6           H        SER   6 -16.011  20.608  -2.313
   23    HA   SER   6           HA       SER   6 -14.323  20.795  -4.556
   24    HB2  SER   6           1HB      SER   6 -15.470  22.701  -3.313
   25    HB3  SER   6           2HB      SER   6 -14.170  22.584  -2.128
   26    HG   SER   6           HG       SER   6 -14.026  24.068  -4.121
   27    H    GLY   7           H        GLY   7 -13.452  20.799  -1.091
   28    HA2  GLY   7           1HA      GLY   7 -10.665  20.453  -1.644
   29    HA3  GLY   7           2HA      GLY   7 -11.433  20.363  -0.065
   30    H    GLY   8           H        GLY   8  -9.697  18.612   0.031
   31    HA2  GLY   8           1HA      GLY   8 -10.744  16.139   0.345
   32    HA3  GLY   8           2HA      GLY   8 -10.313  16.154  -1.359
   33    H    GLU   9           H        GLU   9  -9.241  14.499   0.791
   34    HA   GLU   9           HA       GLU   9  -6.464  14.802   0.167
   35    HB2  GLU   9           1HB      GLU   9  -5.732  14.969   2.565
   36    HB3  GLU   9           2HB      GLU   9  -6.469  16.427   1.916
   37    HG2  GLU   9           1HG      GLU   9  -8.615  15.710   2.982
   38    HG3  GLU   9           2HG      GLU   9  -7.714  14.418   3.772
   39    H    LYS  10           H        LYS  10  -6.049  12.756  -0.334
   40    HA   LYS  10           HA       LYS  10  -6.022  10.474  -0.289
   41    HB2  LYS  10           1HB      LYS  10  -5.972  10.742   2.710
   42    HB3  LYS  10           2HB      LYS  10  -5.200   9.516   1.713
   43    HG2  LYS  10           1HG      LYS  10  -3.434  10.850   1.188
   44    HG3  LYS  10           2HG      LYS  10  -4.376  12.338   1.316
   45    HD2  LYS  10           1HD      LYS  10  -3.121  12.533   3.211
   46    HD3  LYS  10           2HD      LYS  10  -4.477  11.611   3.865
   47    HE2  LYS  10           1HE      LYS  10  -2.195  10.105   2.700
   48    HE3  LYS  10           2HE      LYS  10  -1.956  10.886   4.262
   49    HZ1  LYS  10           3HZ      LYS  10  -3.498   8.553   3.600
   50    HZ2  LYS  10           1HZ      LYS  10  -4.348   9.661   4.555
   51    HZ3  LYS  10           2HZ      LYS  10  -2.867   9.044   5.091
   52    HA   PRO  11           HA       PRO  11 -10.542  10.362   1.123
   53    HB2  PRO  11           1HB      PRO  11 -11.665  10.333  -1.348
   54    HB3  PRO  11           2HB      PRO  11 -11.330  11.826  -0.463
   55    HG2  PRO  11           1HG      PRO  11  -9.748  10.520  -2.643
   56    HG3  PRO  11           2HG      PRO  11 -10.136  12.236  -2.416
   57    HD2  PRO  11           1HD      PRO  11  -7.732  11.184  -1.745
   58    HD3  PRO  11           2HD      PRO  11  -8.463  12.536  -0.858
   59    H    TYR  12           H        TYR  12  -8.262   8.514  -0.350
   60    HA   TYR  12           HA       TYR  12 -10.094   6.224  -0.650
   61    HB2  TYR  12           1HB      TYR  12  -7.468   6.756  -2.054
   62    HB3  TYR  12           2HB      TYR  12  -8.388   5.261  -2.188
   63    HD1  TYR  12           HD1      TYR  12  -8.457   8.886  -2.931
   64    HD2  TYR  12           HD2      TYR  12 -10.234   5.090  -3.663
   65    HE1  TYR  12           HE1      TYR  12  -9.750   9.855  -4.785
   66    HE2  TYR  12           HE2      TYR  12 -11.531   6.049  -5.520
   67    HH   TYR  12           HH       TYR  12 -11.337   9.504  -6.305
   68    HA   PRO  13           HA       PRO  13  -7.481   5.249   2.997
   69    HB2  PRO  13           1HB      PRO  13  -9.425   3.846   4.270
   70    HB3  PRO  13           2HB      PRO  13  -9.287   5.605   4.372
   71    HG2  PRO  13           1HG      PRO  13 -11.090   3.943   2.654
   72    HG3  PRO  13           2HG      PRO  13 -11.462   5.415   3.570
   73    HD2  PRO  13           1HD      PRO  13 -11.000   5.438   0.903
   74    HD3  PRO  13           2HD      PRO  13 -10.564   6.797   1.959
   75    H    CYS  14           H        CYS  14  -6.250   3.470   3.195
   76    HA   CYS  14           HA       CYS  14  -6.431   1.362   1.328
   77    HB2  CYS  14           1HB      CYS  14  -4.277   1.903   2.185
   78    HB3  CYS  14           2HB      CYS  14  -4.815   1.713   3.851
   79    H    GLU  15           H        GLU  15  -6.580  -0.958   1.878
   80    HA   GLU  15           HA       GLU  15  -8.767  -1.392   3.788
   81    HB2  GLU  15           1HB      GLU  15  -9.171  -3.489   2.542
   82    HB3  GLU  15           2HB      GLU  15  -9.282  -2.064   1.518
   83    HG2  GLU  15           1HG      GLU  15  -7.266  -2.527   0.445
   84    HG3  GLU  15           2HG      GLU  15  -6.747  -3.643   1.707
   85    H    ILE  16           H        ILE  16  -5.579  -2.564   2.851
   86    HA   ILE  16           HA       ILE  16  -5.443  -4.739   4.637
   87    HB   ILE  16           HB       ILE  16  -3.180  -3.067   3.539
   88   HG12  ILE  16          1HG1      ILE  16  -3.098  -5.340   2.114
   89   HG13  ILE  16          2HG1      ILE  16  -4.826  -5.287   2.443
   90   HG21  ILE  16          1HG2      ILE  16  -2.006  -5.379   3.899
   91   HG22  ILE  16          2HG2      ILE  16  -2.162  -4.237   5.232
   92   HG23  ILE  16          3HG2      ILE  16  -3.273  -5.601   5.105
   93   HD11  ILE  16          3HD1      ILE  16  -5.036  -3.931   0.712
   94   HD12  ILE  16          1HD1      ILE  16  -4.146  -2.709   1.619
   95   HD13  ILE  16          2HD1      ILE  16  -3.286  -3.804   0.536
   96    H    CYS  17           H        CYS  17  -3.559  -1.729   4.925
   97    HA   CYS  17           HA       CYS  17  -3.560  -2.055   7.826
   98    HB2  CYS  17           1HB      CYS  17  -1.829  -0.308   7.813
   99    HB3  CYS  17           2HB      CYS  17  -1.410  -1.636   6.737
  100    H    GLY  18           H        GLY  18  -4.346   0.418   5.392
  101    HA2  GLY  18           1HA      GLY  18  -6.616   1.461   5.958
  102    HA3  GLY  18           2HA      GLY  18  -5.833   1.884   7.474
  103    H    THR  19           H        THR  19  -3.256   2.368   6.059
  104    HA   THR  19           HA       THR  19  -3.214   5.064   5.869
  105    HB   THR  19           HB       THR  19  -1.648   3.061   4.248
  106    HG1  THR  19           HG1      THR  19  -0.347   3.137   5.924
  107   HG21  THR  19          3HG2      THR  19  -0.076   5.150   4.020
  108   HG22  THR  19          1HG2      THR  19  -1.586   6.047   4.183
  109   HG23  THR  19          2HG2      THR  19  -1.385   4.890   2.867
  110    H    ARG  20           H        ARG  20  -4.205   6.542   4.672
  111    HA   ARG  20           HA       ARG  20  -5.677   5.754   2.311
  112    HB2  ARG  20           1HB      ARG  20  -5.397   8.538   3.439
  113    HB3  ARG  20           2HB      ARG  20  -6.670   7.923   2.392
  114    HG2  ARG  20           1HG      ARG  20  -7.768   6.891   4.096
  115    HG3  ARG  20           2HG      ARG  20  -6.293   6.610   5.024
  116    HD2  ARG  20           1HD      ARG  20  -7.359   9.380   4.604
  117    HD3  ARG  20           2HD      ARG  20  -7.987   8.350   5.889
  118    HE   ARG  20           HE       ARG  20  -5.109   8.634   5.831
  119   HH11  ARG  20          1HH1      ARG  20  -8.130   9.814   7.098
  120   HH12  ARG  20          2HH1      ARG  20  -7.406  10.566   8.481
  121   HH21  ARG  20          1HH2      ARG  20  -4.144   9.620   7.647
  122   HH22  ARG  20          2HH2      ARG  20  -5.139  10.455   8.792
  123    H    PHE  21           H        PHE  21  -5.606   7.341   0.400
  124    HA   PHE  21           HA       PHE  21  -2.937   8.383  -0.134
  125    HB2  PHE  21           1HB      PHE  21  -4.254   6.221  -1.784
  126    HB3  PHE  21           2HB      PHE  21  -2.901   7.191  -2.357
  127    HD1  PHE  21           HD2      PHE  21  -3.894   4.956   0.447
  128    HD2  PHE  21           HD1      PHE  21  -0.739   6.481  -1.970
  129    HE1  PHE  21           HE2      PHE  21  -2.325   3.388   1.512
  130    HE2  PHE  21           HE1      PHE  21   0.835   4.915  -0.909
  131    HZ   PHE  21           HZ       PHE  21   0.043   3.367   0.835
  132    H    ARG  22           H        ARG  22  -2.953  10.153  -1.412
  133    HA   ARG  22           HA       ARG  22  -5.093  11.745  -1.785
  134    HB2  ARG  22           1HB      ARG  22  -2.569  11.425  -3.351
  135    HB3  ARG  22           2HB      ARG  22  -3.808  12.511  -3.963
  136    HG2  ARG  22           1HG      ARG  22  -3.766  13.683  -1.763
  137    HG3  ARG  22           2HG      ARG  22  -2.387  12.676  -1.318
  138    HD2  ARG  22           1HD      ARG  22  -0.983  13.696  -2.831
  139    HD3  ARG  22           2HD      ARG  22  -2.308  14.197  -3.881
  140    HE   ARG  22           HE       ARG  22  -2.642  15.592  -1.530
  141   HH11  ARG  22          1HH1      ARG  22  -0.176  15.296  -3.969
  142   HH12  ARG  22          2HH1      ARG  22   0.417  16.909  -3.751
  143   HH21  ARG  22          1HH2      ARG  22  -1.871  17.718  -1.233
  144   HH22  ARG  22          2HH2      ARG  22  -0.547  18.286  -2.194
  145    H    HIS  23           H        HIS  23  -3.888   9.517  -4.298
  146    HA   HIS  23           HA       HIS  23  -6.594   9.536  -5.467
  147    HB2  HIS  23           1HB      HIS  23  -3.885   9.487  -6.760
  148    HB3  HIS  23           2HB      HIS  23  -5.280   8.813  -7.599
  149    HD2  HIS  23           HD2      HIS  23  -5.280  12.214  -5.594
  150    HE1  HIS  23           HE1      HIS  23  -6.217  12.966  -9.663
  151    HE2  HIS  23           HE2      HIS  23  -5.900  13.980  -7.380
  152    H    LEU  24           H        LEU  24  -7.312   7.553  -6.454
  153    HA   LEU  24           HA       LEU  24  -6.738   5.272  -4.863
  154    HB2  LEU  24           1HB      LEU  24  -8.925   5.862  -6.005
  155    HB3  LEU  24           2HB      LEU  24  -8.191   5.272  -7.495
  156    HG   LEU  24           HG       LEU  24  -8.046   3.046  -6.616
  157   HD11  LEU  24          1HD1      LEU  24  -8.353   4.413  -4.074
  158   HD12  LEU  24          2HD1      LEU  24  -7.672   2.826  -4.433
  159   HD13  LEU  24          3HD1      LEU  24  -9.413   3.012  -4.223
  160   HD21  LEU  24          3HD2      LEU  24 -10.679   4.437  -6.318
  161   HD22  LEU  24          1HD2      LEU  24 -10.531   2.713  -5.980
  162   HD23  LEU  24          2HD2      LEU  24 -10.134   3.334  -7.582
  163    H    GLN  25           H        GLN  25  -6.185   5.954  -8.318
  164    HA   GLN  25           HA       GLN  25  -4.980   3.702  -9.181
  165    HB2  GLN  25           1HB      GLN  25  -3.567   5.121 -10.657
  166    HB3  GLN  25           2HB      GLN  25  -5.261   5.593 -10.648
  167    HG2  GLN  25           1HG      GLN  25  -4.855   7.562  -9.567
  168    HG3  GLN  25           2HG      GLN  25  -3.405   6.953  -8.770
  169   HE21  GLN  25          1HE2      GLN  25  -2.425   8.949  -9.437
  170   HE22  GLN  25          2HE2      GLN  25  -1.805   9.110 -11.041
  171    H    THR  26           H        THR  26  -3.717   5.909  -6.830
  172    HA   THR  26           HA       THR  26  -1.042   4.789  -6.921
  173    HB   THR  26           HB       THR  26  -2.226   6.772  -4.968
  174    HG1  THR  26           HG1      THR  26  -1.881   7.236  -7.406
  175   HG21  THR  26          3HG2      THR  26  -0.267   6.784  -3.890
  176   HG22  THR  26          1HG2      THR  26   0.645   6.850  -5.397
  177   HG23  THR  26          2HG2      THR  26   0.113   5.296  -4.756
  178    H    LEU  27           H        LEU  27  -3.849   4.757  -4.764
  179    HA   LEU  27           HA       LEU  27  -2.725   3.334  -2.642
  180    HB2  LEU  27           1HB      LEU  27  -4.840   4.392  -2.369
  181    HB3  LEU  27           2HB      LEU  27  -5.544   3.457  -3.686
  182    HG   LEU  27           HG       LEU  27  -5.517   1.456  -2.350
  183   HD11  LEU  27          1HD1      LEU  27  -3.393   1.965  -1.164
  184   HD12  LEU  27          2HD1      LEU  27  -4.674   1.366  -0.111
  185   HD13  LEU  27          3HD1      LEU  27  -4.286   3.086  -0.136
  186   HD21  LEU  27          3HD2      LEU  27  -6.708   2.702  -0.205
  187   HD22  LEU  27          1HD2      LEU  27  -7.501   2.258  -1.717
  188   HD23  LEU  27          2HD2      LEU  27  -6.869   3.890  -1.500
  189    H    LYS  28           H        LYS  28  -4.456   2.146  -5.509
  190    HA   LYS  28           HA       LYS  28  -4.480  -0.559  -4.941
  191    HB2  LYS  28           1HB      LYS  28  -4.242   0.913  -7.560
  192    HB3  LYS  28           2HB      LYS  28  -4.376  -0.839  -7.481
  193    HG2  LYS  28           1HG      LYS  28  -6.531  -0.675  -6.420
  194    HG3  LYS  28           2HG      LYS  28  -6.389   1.083  -6.332
  195    HD2  LYS  28           1HD      LYS  28  -6.368  -0.474  -8.913
  196    HD3  LYS  28           2HD      LYS  28  -7.823   0.232  -8.205
  197    HE2  LYS  28           1HE      LYS  28  -6.801   2.450  -8.317
  198    HE3  LYS  28           2HE      LYS  28  -5.340   1.747  -9.009
  199    HZ1  LYS  28           3HZ      LYS  28  -6.718   2.676 -10.735
  200    HZ2  LYS  28           1HZ      LYS  28  -8.040   1.739 -10.246
  201    HZ3  LYS  28           2HZ      LYS  28  -6.670   0.993 -10.902
  202    H    SER  29           H        SER  29  -1.852   1.442  -6.105
  203    HA   SER  29           HA       SER  29  -0.124  -0.794  -6.673
  204    HB2  SER  29           1HB      SER  29   0.009   1.393  -7.893
  205    HB3  SER  29           2HB      SER  29   0.616   2.129  -6.410
  206    HG   SER  29           HG       SER  29   2.385   0.700  -6.505
  207    H    HIS  30           H        HIS  30  -0.969   1.048  -3.923
  208    HA   HIS  30           HA       HIS  30   1.470   0.676  -2.464
  209    HB2  HIS  30           1HB      HIS  30   0.356   2.477  -1.592
  210    HB3  HIS  30           2HB      HIS  30  -1.232   1.776  -1.888
  211    HD1  HIS  30           HD1      HIS  30   1.703   1.212   0.470
  212    HD2  HIS  30           HD2      HIS  30  -2.438   0.891   0.364
  213    HE1  HIS  30           HE1      HIS  30   1.020   0.544   2.796
  214    H    LEU  31           H        LEU  31  -1.563  -1.049  -2.788
  215    HA   LEU  31           HA       LEU  31  -1.301  -2.765  -0.576
  216    HB2  LEU  31           1HB      LEU  31  -2.590  -3.661  -3.117
  217    HB3  LEU  31           2HB      LEU  31  -3.078  -3.962  -1.450
  218    HG   LEU  31           HG       LEU  31  -3.512  -1.499  -3.114
  219   HD11  LEU  31          1HD1      LEU  31  -5.774  -2.219  -1.643
  220   HD12  LEU  31          2HD1      LEU  31  -5.096  -3.734  -2.238
  221   HD13  LEU  31          3HD1      LEU  31  -5.502  -2.445  -3.371
  222   HD21  LEU  31          3HD2      LEU  31  -4.485  -0.515  -1.011
  223   HD22  LEU  31          1HD2      LEU  31  -2.724  -0.613  -1.060
  224   HD23  LEU  31          2HD2      LEU  31  -3.646  -1.787  -0.120
  225    H    ARG  32           H        ARG  32   0.620  -2.515  -3.280
  226    HA   ARG  32           HA       ARG  32   1.191  -5.194  -3.910
  227    HB2  ARG  32           1HB      ARG  32   2.627  -2.595  -4.262
  228    HB3  ARG  32           2HB      ARG  32   3.494  -4.095  -4.567
  229    HG2  ARG  32           1HG      ARG  32   2.497  -3.084  -6.593
  230    HG3  ARG  32           2HG      ARG  32   1.932  -4.725  -6.269
  231    HD2  ARG  32           1HD      ARG  32   0.363  -2.456  -5.162
  232    HD3  ARG  32           2HD      ARG  32   0.266  -2.763  -6.896
  233    HE   ARG  32           HE       ARG  32  -0.799  -4.406  -4.771
  234   HH11  ARG  32          1HH1      ARG  32   0.144  -4.235  -8.118
  235   HH12  ARG  32          2HH1      ARG  32  -0.847  -5.571  -8.600
  236   HH21  ARG  32          1HH2      ARG  32  -2.109  -6.166  -5.394
  237   HH22  ARG  32          2HH2      ARG  32  -2.129  -6.668  -7.051
  238    H    ILE  33           H        ILE  33   2.614  -2.980  -1.544
  239    HA   ILE  33           HA       ILE  33   4.637  -4.788  -0.679
  240    HB   ILE  33           HB       ILE  33   5.107  -3.248   1.066
  241   HG12  ILE  33          1HG1      ILE  33   2.482  -1.860   0.505
  242   HG13  ILE  33          2HG1      ILE  33   2.703  -3.034   1.798
  243   HG21  ILE  33          1HG2      ILE  33   5.958  -2.161  -0.724
  244   HG22  ILE  33          2HG2      ILE  33   4.423  -2.161  -1.590
  245   HG23  ILE  33          3HG2      ILE  33   4.714  -0.980  -0.314
  246   HD11  ILE  33          3HD1      ILE  33   3.488  -0.228   1.647
  247   HD12  ILE  33          1HD1      ILE  33   3.163  -1.247   3.049
  248   HD13  ILE  33          2HD1      ILE  33   4.744  -1.298   2.269
  249    H    HIS  34           H        HIS  34   1.287  -4.469  -0.007
  250    HA   HIS  34           HA       HIS  34   1.335  -5.744   2.565
  251    HB2  HIS  34           1HB      HIS  34  -0.836  -4.970   0.637
  252    HB3  HIS  34           2HB      HIS  34  -1.196  -5.978   2.035
  253    HD1  HIS  34           HD1      HIS  34   0.404  -4.621   4.214
  254    HD2  HIS  34           HD2      HIS  34  -1.763  -2.529   1.352
  255    HE1  HIS  34           HE1      HIS  34  -0.056  -2.368   5.233
  256    H    THR  35           H        THR  35   0.612  -6.753  -0.751
  257    HA   THR  35           HA       THR  35   0.851  -9.550   0.141
  258    HB   THR  35           HB       THR  35  -1.510  -8.982  -0.401
  259    HG1  THR  35           HG1      THR  35  -0.048 -10.874  -1.906
  260   HG21  THR  35          3HG2      THR  35  -0.598  -8.726  -3.258
  261   HG22  THR  35          1HG2      THR  35  -0.853  -7.327  -2.217
  262   HG23  THR  35          2HG2      THR  35  -2.198  -8.406  -2.590
  263    H    GLY  36           H        GLY  36   2.576 -10.477  -0.738
  264    HA2  GLY  36           1HA      GLY  36   3.086 -10.665  -3.467
  265    HA3  GLY  36           2HA      GLY  36   4.050  -9.325  -2.865
  266    H    SER  37           H        SER  37   3.556 -12.776  -2.787
  267    HA   SER  37           HA       SER  37   5.978 -13.124  -1.170
  268    HB2  SER  37           1HB      SER  37   3.775 -14.354  -0.663
  269    HB3  SER  37           2HB      SER  37   4.146 -15.339  -2.078
  270    HG   SER  37           HG       SER  37   5.489 -15.168   0.380
  271    H    GLY  38           H        GLY  38   7.850 -13.629  -2.096
  272    HA2  GLY  38           1HA      GLY  38   9.124 -15.059  -3.572
  273    HA3  GLY  38           2HA      GLY  38   7.803 -14.960  -4.727
  274    HA   PRO  39           HA       PRO  39  11.177 -11.572  -5.272
  275    HB2  PRO  39           1HB      PRO  39  12.890 -12.820  -6.969
  276    HB3  PRO  39           2HB      PRO  39  13.089 -12.843  -5.213
  277    HG2  PRO  39           1HG      PRO  39  11.916 -14.927  -7.014
  278    HG3  PRO  39           2HG      PRO  39  13.025 -15.128  -5.644
  279    HD2  PRO  39           1HD      PRO  39  10.364 -15.585  -5.444
  280    HD3  PRO  39           2HD      PRO  39  11.331 -14.970  -4.089
  281    H    SER  40           H        SER  40   9.546 -10.532  -6.441
  282    HA   SER  40           HA       SER  40   9.048 -11.425  -9.182
  283    HB2  SER  40           1HB      SER  40   7.700  -9.243  -7.573
  284    HB3  SER  40           2HB      SER  40   7.207  -9.796  -9.173
  285    HG   SER  40           HG       SER  40   6.239 -10.710  -7.048
  286    H    SER  41           H        SER  41   9.744  -8.351  -7.509
  287    HA   SER  41           HA       SER  41  11.542  -7.616  -9.692
  288    HB2  SER  41           1HB      SER  41   9.211  -6.693 -10.139
  289    HB3  SER  41           2HB      SER  41   9.442  -5.677  -8.717
  290    HG   SER  41           HG       SER  41  10.358  -4.379 -10.096
  291    H    GLY  42           H        GLY  42  13.395  -7.380  -8.608
  292    HA2  GLY  42           1HA      GLY  42  14.257  -5.322  -7.189
  293    HA3  GLY  42           2HA      GLY  42  13.380  -6.192  -5.939
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1   3.548  14.933  16.656
    2    HA2  GLY   1           1HA      GLY   1   2.234  16.801  15.521
    3    HA3  GLY   1           2HA      GLY   1   3.842  16.517  14.871
    4    H    SER   2           H        SER   2   3.132  17.386  12.863
    5    HA   SER   2           HA       SER   2   1.843  15.377  11.188
    6    HB2  SER   2           1HB      SER   2   0.910  18.257  11.242
    7    HB3  SER   2           2HB      SER   2   0.307  16.986  10.179
    8    HG   SER   2           HG       SER   2  -0.283  17.509  12.809
    9    H    SER   3           H        SER   3   3.316  15.007   9.674
   10    HA   SER   3           HA       SER   3   4.656  17.320   8.434
   11    HB2  SER   3           1HB      SER   3   5.789  14.693   9.336
   12    HB3  SER   3           2HB      SER   3   6.529  15.546   7.982
   13    HG   SER   3           HG       SER   3   6.309  17.404   9.677
   14    H    GLY   4           H        GLY   4   4.016  17.560   6.403
   15    HA2  GLY   4           1HA      GLY   4   4.304  15.765   4.354
   16    HA3  GLY   4           2HA      GLY   4   2.687  15.461   4.970
   17    H    SER   5           H        SER   5   4.746  18.209   4.011
   18    HA   SER   5           HA       SER   5   2.772  20.077   3.554
   19    HB2  SER   5           1HB      SER   5   5.384  19.656   2.089
   20    HB3  SER   5           2HB      SER   5   4.371  21.085   1.890
   21    HG   SER   5           HG       SER   5   4.576  21.044   4.378
   22    H    SER   6           H        SER   6   4.270  18.043   1.032
   23    HA   SER   6           HA       SER   6   2.492  18.708  -1.011
   24    HB2  SER   6           1HB      SER   6   4.305  16.367  -0.523
   25    HB3  SER   6           2HB      SER   6   3.205  16.351  -1.901
   26    HG   SER   6           HG       SER   6   4.453  17.726  -2.877
   27    H    GLY   7           H        GLY   7   2.425  15.943   1.231
   28    HA2  GLY   7           1HA      GLY   7   0.220  14.595   0.291
   29    HA3  GLY   7           2HA      GLY   7   0.657  14.684   1.991
   30    H    GLY   8           H        GLY   8  -1.696  15.402  -0.273
   31    HA2  GLY   8           1HA      GLY   8  -2.840  17.594   1.304
   32    HA3  GLY   8           2HA      GLY   8  -3.371  17.085  -0.292
   33    H    GLU   9           H        GLU   9  -5.206  15.978  -0.383
   34    HA   GLU   9           HA       GLU   9  -6.211  14.764   2.099
   35    HB2  GLU   9           1HB      GLU   9  -7.563  16.000  -0.272
   36    HB3  GLU   9           2HB      GLU   9  -8.425  14.821   0.707
   37    HG2  GLU   9           1HG      GLU   9  -9.039  16.900   1.574
   38    HG3  GLU   9           2HG      GLU   9  -7.841  16.270   2.704
   39    H    LYS  10           H        LYS  10  -6.660  12.639   2.207
   40    HA   LYS  10           HA       LYS  10  -6.324  11.057  -0.258
   41    HB2  LYS  10           1HB      LYS  10  -5.633  10.318   2.591
   42    HB3  LYS  10           2HB      LYS  10  -5.545   9.214   1.225
   43    HG2  LYS  10           1HG      LYS  10  -3.375   9.874   1.316
   44    HG3  LYS  10           2HG      LYS  10  -4.007  11.120   0.237
   45    HD2  LYS  10           1HD      LYS  10  -4.324  12.592   2.213
   46    HD3  LYS  10           2HD      LYS  10  -3.551  11.358   3.211
   47    HE2  LYS  10           1HE      LYS  10  -2.181  12.450   0.781
   48    HE3  LYS  10           2HE      LYS  10  -2.129  13.322   2.312
   49    HZ1  LYS  10           3HZ      LYS  10  -0.689  10.993   1.508
   50    HZ2  LYS  10           1HZ      LYS  10  -1.501  10.747   2.971
   51    HZ3  LYS  10           2HZ      LYS  10  -0.411  12.030   2.815
   52    HA   PRO  11           HA       PRO  11 -10.663  10.413   1.210
   53    HB2  PRO  11           1HB      PRO  11 -11.742  10.433  -1.281
   54    HB3  PRO  11           2HB      PRO  11 -11.456  11.906  -0.346
   55    HG2  PRO  11           1HG      PRO  11  -9.807  10.702  -2.535
   56    HG3  PRO  11           2HG      PRO  11 -10.238  12.400  -2.264
   57    HD2  PRO  11           1HD      PRO  11  -7.823  11.384  -1.582
   58    HD3  PRO  11           2HD      PRO  11  -8.601  12.692  -0.668
   59    H    TYR  12           H        TYR  12  -8.316   8.664  -0.287
   60    HA   TYR  12           HA       TYR  12 -10.088   6.339  -0.668
   61    HB2  TYR  12           1HB      TYR  12  -7.488   7.007  -2.060
   62    HB3  TYR  12           2HB      TYR  12  -8.328   5.468  -2.218
   63    HD1  TYR  12           HD1      TYR  12  -8.593   9.097  -2.893
   64    HD2  TYR  12           HD2      TYR  12 -10.167   5.226  -3.693
   65    HE1  TYR  12           HE1      TYR  12  -9.942  10.031  -4.727
   66    HE2  TYR  12           HE2      TYR  12 -11.518   6.148  -5.529
   67    HH   TYR  12           HH       TYR  12 -11.464   8.117  -7.047
   68    HA   PRO  13           HA       PRO  13  -7.453   5.326   2.953
   69    HB2  PRO  13           1HB      PRO  13  -9.361   3.836   4.182
   70    HB3  PRO  13           2HB      PRO  13  -9.268   5.594   4.336
   71    HG2  PRO  13           1HG      PRO  13 -11.026   3.938   2.568
   72    HG3  PRO  13           2HG      PRO  13 -11.437   5.372   3.527
   73    HD2  PRO  13           1HD      PRO  13 -10.974   5.485   0.861
   74    HD3  PRO  13           2HD      PRO  13 -10.574   6.823   1.957
   75    H    CYS  14           H        CYS  14  -6.285   3.489   3.291
   76    HA   CYS  14           HA       CYS  14  -6.341   1.464   1.297
   77    HB2  CYS  14           1HB      CYS  14  -4.225   2.008   2.244
   78    HB3  CYS  14           2HB      CYS  14  -4.815   1.754   3.884
   79    H    GLU  15           H        GLU  15  -6.478  -0.873   1.769
   80    HA   GLU  15           HA       GLU  15  -8.724  -1.394   3.586
   81    HB2  GLU  15           1HB      GLU  15  -9.344  -2.124   1.461
   82    HB3  GLU  15           2HB      GLU  15  -7.733  -2.719   1.087
   83    HG2  GLU  15           1HG      GLU  15  -8.053  -4.697   2.179
   84    HG3  GLU  15           2HG      GLU  15  -9.239  -4.018   3.292
   85    H    ILE  16           H        ILE  16  -5.486  -2.495   2.738
   86    HA   ILE  16           HA       ILE  16  -5.398  -4.704   4.499
   87    HB   ILE  16           HB       ILE  16  -3.110  -3.032   3.453
   88   HG12  ILE  16          1HG1      ILE  16  -2.994  -5.271   2.000
   89   HG13  ILE  16          2HG1      ILE  16  -4.725  -5.265   2.322
   90   HG21  ILE  16          1HG2      ILE  16  -2.060  -5.473   3.816
   91   HG22  ILE  16          2HG2      ILE  16  -2.012  -4.206   5.042
   92   HG23  ILE  16          3HG2      ILE  16  -3.246  -5.464   5.121
   93   HD11  ILE  16          3HD1      ILE  16  -5.020  -3.812   0.690
   94   HD12  ILE  16          1HD1      ILE  16  -3.975  -2.655   1.515
   95   HD13  ILE  16          2HD1      ILE  16  -3.285  -3.810   0.375
   96    H    CYS  17           H        CYS  17  -3.494  -1.714   4.843
   97    HA   CYS  17           HA       CYS  17  -3.508  -2.066   7.733
   98    HB2  CYS  17           1HB      CYS  17  -1.871  -0.192   7.715
   99    HB3  CYS  17           2HB      CYS  17  -1.372  -1.555   6.718
  100    H    GLY  18           H        GLY  18  -4.384   0.432   5.354
  101    HA2  GLY  18           1HA      GLY  18  -6.682   1.391   5.921
  102    HA3  GLY  18           2HA      GLY  18  -5.941   1.779   7.467
  103    H    THR  19           H        THR  19  -3.366   2.305   5.894
  104    HA   THR  19           HA       THR  19  -3.338   5.025   5.902
  105    HB   THR  19           HB       THR  19  -1.832   3.130   4.103
  106    HG1  THR  19           HG1      THR  19  -1.589   3.918   6.647
  107   HG21  THR  19          3HG2      THR  19  -1.608   5.029   2.825
  108   HG22  THR  19          1HG2      THR  19  -0.278   5.252   3.960
  109   HG23  THR  19          2HG2      THR  19  -1.798   6.111   4.204
  110    H    ARG  20           H        ARG  20  -4.007   6.668   4.633
  111    HA   ARG  20           HA       ARG  20  -5.669   5.971   2.325
  112    HB2  ARG  20           1HB      ARG  20  -5.436   8.658   3.681
  113    HB3  ARG  20           2HB      ARG  20  -6.688   8.126   2.567
  114    HG2  ARG  20           1HG      ARG  20  -7.792   6.926   4.154
  115    HG3  ARG  20           2HG      ARG  20  -6.325   6.585   5.074
  116    HD2  ARG  20           1HD      ARG  20  -6.341   8.674   6.106
  117    HD3  ARG  20           2HD      ARG  20  -7.409   9.371   4.888
  118    HE   ARG  20           HE       ARG  20  -8.574   7.249   6.465
  119   HH11  ARG  20          1HH1      ARG  20  -8.050  10.675   6.139
  120   HH12  ARG  20          2HH1      ARG  20  -9.397  11.109   7.137
  121   HH21  ARG  20          1HH2      ARG  20 -10.352   7.807   7.782
  122   HH22  ARG  20          2HH2      ARG  20 -10.706   9.477   8.072
  123    H    PHE  21           H        PHE  21  -5.392   6.909   0.304
  124    HA   PHE  21           HA       PHE  21  -2.835   8.315  -0.103
  125    HB2  PHE  21           1HB      PHE  21  -4.128   6.176  -1.795
  126    HB3  PHE  21           2HB      PHE  21  -2.824   7.202  -2.384
  127    HD1  PHE  21           HD2      PHE  21  -3.660   4.885   0.406
  128    HD2  PHE  21           HD1      PHE  21  -0.634   6.542  -2.086
  129    HE1  PHE  21           HE2      PHE  21  -2.012   3.346   1.390
  130    HE2  PHE  21           HE1      PHE  21   1.019   5.004  -1.107
  131    HZ   PHE  21           HZ       PHE  21   0.331   3.404   0.634
  132    H    ARG  22           H        ARG  22  -2.813  10.047  -1.479
  133    HA   ARG  22           HA       ARG  22  -4.949  11.692  -1.745
  134    HB2  ARG  22           1HB      ARG  22  -2.640  12.337  -2.298
  135    HB3  ARG  22           2HB      ARG  22  -2.726  11.380  -3.771
  136    HG2  ARG  22           1HG      ARG  22  -3.177  13.433  -4.629
  137    HG3  ARG  22           2HG      ARG  22  -4.819  12.924  -4.228
  138    HD2  ARG  22           1HD      ARG  22  -4.701  15.074  -3.354
  139    HD3  ARG  22           2HD      ARG  22  -4.378  14.051  -1.954
  140    HE   ARG  22           HE       ARG  22  -2.210  14.837  -1.902
  141   HH11  ARG  22          1HH1      ARG  22  -3.800  15.894  -4.813
  142   HH12  ARG  22          2HH1      ARG  22  -2.555  17.022  -5.238
  143   HH21  ARG  22          1HH2      ARG  22  -0.565  16.319  -2.451
  144   HH22  ARG  22          2HH2      ARG  22  -0.716  17.262  -3.894
  145    H    HIS  23           H        HIS  23  -3.859   9.422  -4.269
  146    HA   HIS  23           HA       HIS  23  -6.582   9.523  -5.393
  147    HB2  HIS  23           1HB      HIS  23  -3.903   9.516  -6.704
  148    HB3  HIS  23           2HB      HIS  23  -5.223   8.680  -7.516
  149    HD2  HIS  23           HD2      HIS  23  -6.381  11.860  -5.724
  150    HE1  HIS  23           HE1      HIS  23  -5.854  12.851  -9.815
  151    HE2  HIS  23           HE2      HIS  23  -6.679  13.644  -7.572
  152    H    LEU  24           H        LEU  24  -7.267   7.535  -6.514
  153    HA   LEU  24           HA       LEU  24  -6.779   5.247  -4.871
  154    HB2  LEU  24           1HB      LEU  24  -8.970   5.820  -5.918
  155    HB3  LEU  24           2HB      LEU  24  -8.279   5.388  -7.481
  156    HG   LEU  24           HG       LEU  24  -8.248   3.117  -6.979
  157   HD11  LEU  24          1HD1      LEU  24  -8.192   4.035  -4.152
  158   HD12  LEU  24          2HD1      LEU  24  -7.212   2.817  -4.967
  159   HD13  LEU  24          3HD1      LEU  24  -8.874   2.448  -4.510
  160   HD21  LEU  24          3HD2      LEU  24 -10.672   4.342  -5.676
  161   HD22  LEU  24          1HD2      LEU  24 -10.506   2.619  -6.013
  162   HD23  LEU  24          2HD2      LEU  24 -10.507   3.781  -7.341
  163    H    GLN  25           H        GLN  25  -6.306   5.842  -8.358
  164    HA   GLN  25           HA       GLN  25  -5.136   3.589  -9.213
  165    HB2  GLN  25           1HB      GLN  25  -3.703   4.967 -10.709
  166    HB3  GLN  25           2HB      GLN  25  -5.385   5.478 -10.685
  167    HG2  GLN  25           1HG      GLN  25  -4.917   7.407  -9.485
  168    HG3  GLN  25           2HG      GLN  25  -3.369   6.788  -8.909
  169   HE21  GLN  25          1HE2      GLN  25  -3.664   9.300 -10.055
  170   HE22  GLN  25          2HE2      GLN  25  -2.815   9.330 -11.559
  171    H    THR  26           H        THR  26  -3.663   5.930  -7.061
  172    HA   THR  26           HA       THR  26  -1.069   4.686  -7.122
  173    HB   THR  26           HB       THR  26  -2.166   6.725  -5.176
  174    HG1  THR  26           HG1      THR  26  -0.366   7.297  -7.270
  175   HG21  THR  26          3HG2      THR  26   0.593   7.011  -5.427
  176   HG22  THR  26          1HG2      THR  26   0.334   5.272  -5.304
  177   HG23  THR  26          2HG2      THR  26  -0.278   6.345  -4.046
  178    H    LEU  27           H        LEU  27  -3.818   4.763  -4.891
  179    HA   LEU  27           HA       LEU  27  -2.698   3.358  -2.767
  180    HB2  LEU  27           1HB      LEU  27  -4.797   4.414  -2.470
  181    HB3  LEU  27           2HB      LEU  27  -5.518   3.509  -3.799
  182    HG   LEU  27           HG       LEU  27  -5.486   1.479  -2.479
  183   HD11  LEU  27          1HD1      LEU  27  -4.669   1.362  -0.254
  184   HD12  LEU  27          2HD1      LEU  27  -4.376   3.100  -0.200
  185   HD13  LEU  27          3HD1      LEU  27  -3.387   2.071  -1.236
  186   HD21  LEU  27          3HD2      LEU  27  -6.919   2.348  -0.508
  187   HD22  LEU  27          1HD2      LEU  27  -7.486   2.607  -2.158
  188   HD23  LEU  27          2HD2      LEU  27  -6.719   3.926  -1.272
  189    H    LYS  28           H        LYS  28  -4.544   2.094  -5.537
  190    HA   LYS  28           HA       LYS  28  -4.562  -0.582  -4.941
  191    HB2  LYS  28           1HB      LYS  28  -4.243   0.792  -7.609
  192    HB3  LYS  28           2HB      LYS  28  -4.486  -0.943  -7.451
  193    HG2  LYS  28           1HG      LYS  28  -6.624  -0.541  -6.334
  194    HG3  LYS  28           2HG      LYS  28  -6.380   1.199  -6.504
  195    HD2  LYS  28           1HD      LYS  28  -6.368  -0.646  -8.876
  196    HD3  LYS  28           2HD      LYS  28  -7.863   0.039  -8.235
  197    HE2  LYS  28           1HE      LYS  28  -7.360   1.637  -9.778
  198    HE3  LYS  28           2HE      LYS  28  -6.469   2.285  -8.402
  199    HZ1  LYS  28           3HZ      LYS  28  -5.316   2.048 -10.696
  200    HZ2  LYS  28           1HZ      LYS  28  -5.128   0.428 -10.245
  201    HZ3  LYS  28           2HZ      LYS  28  -4.464   1.655  -9.288
  202    H    SER  29           H        SER  29  -1.893   1.355  -6.113
  203    HA   SER  29           HA       SER  29  -0.194  -0.908  -6.642
  204    HB2  SER  29           1HB      SER  29   0.060   1.194  -7.906
  205    HB3  SER  29           2HB      SER  29   0.495   2.033  -6.417
  206    HG   SER  29           HG       SER  29   2.242   1.175  -7.876
  207    H    HIS  30           H        HIS  30  -0.940   1.103  -3.937
  208    HA   HIS  30           HA       HIS  30   1.434   0.638  -2.438
  209    HB2  HIS  30           1HB      HIS  30   0.321   2.473  -1.616
  210    HB3  HIS  30           2HB      HIS  30  -1.269   1.760  -1.875
  211    HD1  HIS  30           HD1      HIS  30   1.706   1.173   0.433
  212    HD2  HIS  30           HD2      HIS  30  -2.445   1.002   0.433
  213    HE1  HIS  30           HE1      HIS  30   1.058   0.572   2.787
  214    H    LEU  31           H        LEU  31  -1.425  -1.193  -3.033
  215    HA   LEU  31           HA       LEU  31  -1.304  -2.856  -0.722
  216    HB2  LEU  31           1HB      LEU  31  -2.502  -3.775  -3.295
  217    HB3  LEU  31           2HB      LEU  31  -3.056  -4.042  -1.643
  218    HG   LEU  31           HG       LEU  31  -3.418  -1.614  -3.373
  219   HD11  LEU  31          1HD1      LEU  31  -5.474  -2.405  -3.605
  220   HD12  LEU  31          2HD1      LEU  31  -5.690  -2.431  -1.856
  221   HD13  LEU  31          3HD1      LEU  31  -5.013  -3.835  -2.681
  222   HD21  LEU  31          3HD2      LEU  31  -2.726  -0.643  -1.344
  223   HD22  LEU  31          1HD2      LEU  31  -3.602  -1.834  -0.381
  224   HD23  LEU  31          2HD2      LEU  31  -4.490  -0.616  -1.297
  225    H    ARG  32           H        ARG  32   0.785  -2.562  -3.246
  226    HA   ARG  32           HA       ARG  32   1.365  -5.278  -3.849
  227    HB2  ARG  32           1HB      ARG  32   2.741  -2.661  -4.295
  228    HB3  ARG  32           2HB      ARG  32   3.646  -4.149  -4.534
  229    HG2  ARG  32           1HG      ARG  32   2.560  -3.152  -6.580
  230    HG3  ARG  32           2HG      ARG  32   2.225  -4.857  -6.270
  231    HD2  ARG  32           1HD      ARG  32   0.058  -4.371  -5.439
  232    HD3  ARG  32           2HD      ARG  32   0.401  -2.643  -5.368
  233    HE   ARG  32           HE       ARG  32   0.678  -3.128  -7.976
  234   HH11  ARG  32          1HH1      ARG  32  -1.799  -4.078  -5.722
  235   HH12  ARG  32          2HH1      ARG  32  -3.056  -4.102  -6.913
  236   HH21  ARG  32          1HH2      ARG  32  -0.969  -3.156  -9.554
  237   HH22  ARG  32          2HH2      ARG  32  -2.584  -3.578  -9.092
  238    H    ILE  33           H        ILE  33   2.590  -2.979  -1.479
  239    HA   ILE  33           HA       ILE  33   4.691  -4.693  -0.552
  240    HB   ILE  33           HB       ILE  33   5.101  -3.077   1.143
  241   HG12  ILE  33          1HG1      ILE  33   2.510  -1.688   0.462
  242   HG13  ILE  33          2HG1      ILE  33   2.631  -2.879   1.752
  243   HG21  ILE  33          1HG2      ILE  33   4.458  -2.113  -1.573
  244   HG22  ILE  33          2HG2      ILE  33   4.714  -0.878  -0.342
  245   HG23  ILE  33          3HG2      ILE  33   5.977  -2.062  -0.678
  246   HD11  ILE  33          3HD1      ILE  33   2.849  -0.329   2.254
  247   HD12  ILE  33          1HD1      ILE  33   3.866  -1.500   3.092
  248   HD13  ILE  33          2HD1      ILE  33   4.516  -0.579   1.735
  249    H    HIS  34           H        HIS  34   1.348  -4.630  -0.095
  250    HA   HIS  34           HA       HIS  34   1.386  -5.751   2.579
  251    HB2  HIS  34           1HB      HIS  34  -0.786  -5.046   0.624
  252    HB3  HIS  34           2HB      HIS  34  -1.137  -6.022   2.048
  253    HD1  HIS  34           HD1      HIS  34   0.335  -4.630   4.240
  254    HD2  HIS  34           HD2      HIS  34  -1.638  -2.558   1.228
  255    HE1  HIS  34           HE1      HIS  34  -0.127  -2.347   5.187
  256    H    THR  35           H        THR  35   0.503  -6.832  -0.690
  257    HA   THR  35           HA       THR  35   0.627  -9.612   0.274
  258    HB   THR  35           HB       THR  35  -1.546  -8.989  -0.688
  259    HG1  THR  35           HG1      THR  35   0.110 -10.922  -1.843
  260   HG21  THR  35          3HG2      THR  35  -0.663  -7.270  -2.261
  261   HG22  THR  35          1HG2      THR  35  -1.789  -8.400  -3.011
  262   HG23  THR  35          2HG2      THR  35  -0.055  -8.574  -3.280
  263    H    GLY  36           H        GLY  36   2.961  -8.043  -0.414
  264    HA2  GLY  36           1HA      GLY  36   3.848  -9.472  -2.844
  265    HA3  GLY  36           2HA      GLY  36   4.474  -7.908  -2.345
  266    H    SER  37           H        SER  37   4.274 -11.307  -1.363
  267    HA   SER  37           HA       SER  37   6.110 -11.236   0.728
  268    HB2  SER  37           1HB      SER  37   5.108 -13.358  -1.113
  269    HB3  SER  37           2HB      SER  37   6.534 -13.717  -0.140
  270    HG   SER  37           HG       SER  37   4.748 -12.556   1.436
  271    H    GLY  38           H        GLY  38   8.328 -11.732   0.858
  272    HA2  GLY  38           1HA      GLY  38   9.866 -10.713  -1.364
  273    HA3  GLY  38           2HA      GLY  38  10.491 -11.201   0.205
  274    HA   PRO  39           HA       PRO  39  11.122 -14.466  -3.252
  275    HB2  PRO  39           1HB      PRO  39  13.636 -13.824  -4.050
  276    HB3  PRO  39           2HB      PRO  39  12.187 -13.174  -4.825
  277    HG2  PRO  39           1HG      PRO  39  13.967 -11.912  -2.775
  278    HG3  PRO  39           2HG      PRO  39  13.252 -11.194  -4.231
  279    HD2  PRO  39           1HD      PRO  39  12.218 -10.810  -1.758
  280    HD3  PRO  39           2HD      PRO  39  11.208 -10.865  -3.217
  281    H    SER  40           H        SER  40  12.510 -13.343  -0.403
  282    HA   SER  40           HA       SER  40  14.763 -14.722   0.130
  283    HB2  SER  40           1HB      SER  40  13.120 -13.348   1.694
  284    HB3  SER  40           2HB      SER  40  12.599 -14.962   2.177
  285    HG   SER  40           HG       SER  40  15.114 -15.195   2.281
  286    H    SER  41           H        SER  41  15.096 -16.668  -0.841
  287    HA   SER  41           HA       SER  41  13.568 -18.924   0.236
  288    HB2  SER  41           1HB      SER  41  12.584 -18.484  -1.952
  289    HB3  SER  41           2HB      SER  41  14.181 -18.505  -2.700
  290    HG   SER  41           HG       SER  41  13.393 -20.517  -3.014
  291    H    GLY  42           H        GLY  42  14.696 -20.930   0.232
  292    HA2  GLY  42           1HA      GLY  42  16.668 -22.226  -0.291
  293    HA3  GLY  42           2HA      GLY  42  17.581 -20.725  -0.340
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1  15.145  28.021  -3.098
    2    HA2  GLY   1           1HA      GLY   1  12.216  28.065  -2.721
    3    HA3  GLY   1           2HA      GLY   1  13.023  27.431  -4.148
    4    H    SER   2           H        SER   2  11.112  25.999  -2.667
    5    HA   SER   2           HA       SER   2  12.706  23.669  -1.973
    6    HB2  SER   2           1HB      SER   2  10.802  24.994  -0.034
    7    HB3  SER   2           2HB      SER   2  11.361  23.330   0.143
    8    HG   SER   2           HG       SER   2  13.021  24.176   1.097
    9    H    SER   3           H        SER   3  11.720  21.781  -2.483
   10    HA   SER   3           HA       SER   3   9.365  21.890  -4.090
   11    HB2  SER   3           1HB      SER   3  11.372  20.269  -4.284
   12    HB3  SER   3           2HB      SER   3  10.565  19.346  -3.017
   13    HG   SER   3           HG       SER   3   9.470  18.519  -4.603
   14    H    GLY   4           H        GLY   4   7.449  22.258  -3.159
   15    HA2  GLY   4           1HA      GLY   4   6.709  20.555  -0.864
   16    HA3  GLY   4           2HA      GLY   4   6.305  22.265  -0.898
   17    H    SER   5           H        SER   5   5.245  19.165  -1.619
   18    HA   SER   5           HA       SER   5   3.563  19.667  -3.838
   19    HB2  SER   5           1HB      SER   5   2.420  17.563  -3.155
   20    HB3  SER   5           2HB      SER   5   4.173  17.393  -3.235
   21    HG   SER   5           HG       SER   5   2.497  17.522  -0.979
   22    H    SER   6           H        SER   6   1.272  19.881  -3.892
   23    HA   SER   6           HA       SER   6   0.255  21.816  -2.117
   24    HB2  SER   6           1HB      SER   6  -1.303  20.019  -3.991
   25    HB3  SER   6           2HB      SER   6  -1.858  21.545  -3.304
   26    HG   SER   6           HG       SER   6   0.500  21.913  -4.522
   27    H    GLY   7           H        GLY   7  -1.121  21.702  -0.391
   28    HA2  GLY   7           1HA      GLY   7  -1.223  19.162   0.989
   29    HA3  GLY   7           2HA      GLY   7  -1.772  20.712   1.609
   30    H    GLY   8           H        GLY   8  -2.640  17.868  -0.211
   31    HA2  GLY   8           1HA      GLY   8  -5.410  18.826  -0.443
   32    HA3  GLY   8           2HA      GLY   8  -4.723  17.458  -1.307
   33    H    GLU   9           H        GLU   9  -5.858  15.726  -0.709
   34    HA   GLU   9           HA       GLU   9  -5.807  14.930   2.075
   35    HB2  GLU   9           1HB      GLU   9  -8.318  15.688   0.639
   36    HB3  GLU   9           2HB      GLU   9  -8.365  14.372   1.804
   37    HG2  GLU   9           1HG      GLU   9  -7.463  15.887   3.518
   38    HG3  GLU   9           2HG      GLU   9  -7.499  17.203   2.346
   39    H    LYS  10           H        LYS  10  -6.792  12.703   2.336
   40    HA   LYS  10           HA       LYS  10  -6.345  11.120  -0.111
   41    HB2  LYS  10           1HB      LYS  10  -5.618  10.454   2.746
   42    HB3  LYS  10           2HB      LYS  10  -5.549   9.299   1.421
   43    HG2  LYS  10           1HG      LYS  10  -3.690  10.237   0.512
   44    HG3  LYS  10           2HG      LYS  10  -4.093  11.858   1.082
   45    HD2  LYS  10           1HD      LYS  10  -3.407  11.307   3.315
   46    HD3  LYS  10           2HD      LYS  10  -3.192   9.610   2.879
   47    HE2  LYS  10           1HE      LYS  10  -1.668  11.684   1.378
   48    HE3  LYS  10           2HE      LYS  10  -1.143  11.262   3.007
   49    HZ1  LYS  10           3HZ      LYS  10  -1.480   8.844   1.936
   50    HZ2  LYS  10           1HZ      LYS  10  -0.007   9.677   1.923
   51    HZ3  LYS  10           2HZ      LYS  10  -1.011   9.712   0.562
   52    HA   PRO  11           HA       PRO  11 -10.666  10.361   1.390
   53    HB2  PRO  11           1HB      PRO  11 -11.783  10.448  -1.082
   54    HB3  PRO  11           2HB      PRO  11 -11.517  11.891  -0.097
   55    HG2  PRO  11           1HG      PRO  11  -9.874  10.809  -2.353
   56    HG3  PRO  11           2HG      PRO  11 -10.340  12.485  -2.013
   57    HD2  PRO  11           1HD      PRO  11  -7.892  11.502  -1.403
   58    HD3  PRO  11           2HD      PRO  11  -8.686  12.756  -0.430
   59    H    TYR  12           H        TYR  12  -8.298   8.715  -0.166
   60    HA   TYR  12           HA       TYR  12 -10.024   6.373  -0.640
   61    HB2  TYR  12           1HB      TYR  12  -7.428   7.133  -1.992
   62    HB3  TYR  12           2HB      TYR  12  -8.247   5.592  -2.215
   63    HD1  TYR  12           HD1      TYR  12  -8.544   9.239  -2.759
   64    HD2  TYR  12           HD2      TYR  12 -10.086   5.386  -3.699
   65    HE1  TYR  12           HE1      TYR  12  -9.895  10.226  -4.562
   66    HE2  TYR  12           HE2      TYR  12 -11.440   6.363  -5.506
   67    HH   TYR  12           HH       TYR  12 -11.613   8.260  -6.857
   68    HA   PRO  13           HA       PRO  13  -7.347   5.314   2.952
   69    HB2  PRO  13           1HB      PRO  13  -9.251   3.835   4.200
   70    HB3  PRO  13           2HB      PRO  13  -9.132   5.590   4.373
   71    HG2  PRO  13           1HG      PRO  13 -10.945   3.978   2.619
   72    HG3  PRO  13           2HG      PRO  13 -11.318   5.406   3.602
   73    HD2  PRO  13           1HD      PRO  13 -10.905   5.544   0.930
   74    HD3  PRO  13           2HD      PRO  13 -10.466   6.864   2.033
   75    H    CYS  14           H        CYS  14  -6.234   3.432   3.302
   76    HA   CYS  14           HA       CYS  14  -6.348   1.436   1.269
   77    HB2  CYS  14           1HB      CYS  14  -4.200   1.924   2.157
   78    HB3  CYS  14           2HB      CYS  14  -4.754   1.705   3.814
   79    H    GLU  15           H        GLU  15  -6.539  -0.893   1.699
   80    HA   GLU  15           HA       GLU  15  -8.765  -1.397   3.536
   81    HB2  GLU  15           1HB      GLU  15  -9.073  -3.486   2.247
   82    HB3  GLU  15           2HB      GLU  15  -9.164  -2.049   1.239
   83    HG2  GLU  15           1HG      GLU  15  -6.869  -2.424   0.493
   84    HG3  GLU  15           2HG      GLU  15  -6.779  -3.866   1.502
   85    H    ILE  16           H        ILE  16  -5.532  -2.548   2.716
   86    HA   ILE  16           HA       ILE  16  -5.455  -4.723   4.505
   87    HB   ILE  16           HB       ILE  16  -3.155  -3.043   3.498
   88   HG12  ILE  16          1HG1      ILE  16  -3.009  -5.292   2.054
   89   HG13  ILE  16          2HG1      ILE  16  -4.747  -5.272   2.334
   90   HG21  ILE  16          1HG2      ILE  16  -3.315  -5.481   5.158
   91   HG22  ILE  16          2HG2      ILE  16  -2.099  -5.475   3.882
   92   HG23  ILE  16          3HG2      ILE  16  -2.089  -4.214   5.115
   93   HD11  ILE  16          3HD1      ILE  16  -3.216  -3.797   0.446
   94   HD12  ILE  16          1HD1      ILE  16  -4.966  -3.858   0.654
   95   HD13  ILE  16          2HD1      ILE  16  -4.012  -2.671   1.545
   96    H    CYS  17           H        CYS  17  -3.541  -1.745   4.875
   97    HA   CYS  17           HA       CYS  17  -3.659  -2.066   7.769
   98    HB2  CYS  17           1HB      CYS  17  -1.971  -0.229   7.780
   99    HB3  CYS  17           2HB      CYS  17  -1.471  -1.637   6.847
  100    H    GLY  18           H        GLY  18  -4.357   0.431   5.330
  101    HA2  GLY  18           1HA      GLY  18  -6.657   1.454   5.822
  102    HA3  GLY  18           2HA      GLY  18  -5.927   1.873   7.365
  103    H    THR  19           H        THR  19  -3.327   2.241   5.737
  104    HA   THR  19           HA       THR  19  -3.167   4.953   5.695
  105    HB   THR  19           HB       THR  19  -1.834   3.066   3.743
  106    HG1  THR  19           HG1      THR  19  -1.121   4.073   6.306
  107   HG21  THR  19          3HG2      THR  19  -1.912   5.649   3.277
  108   HG22  THR  19          1HG2      THR  19  -0.405   4.754   3.090
  109   HG23  THR  19          2HG2      THR  19  -0.690   5.705   4.547
  110    H    ARG  20           H        ARG  20  -3.923   6.590   4.501
  111    HA   ARG  20           HA       ARG  20  -5.610   5.940   2.201
  112    HB2  ARG  20           1HB      ARG  20  -5.336   8.641   3.509
  113    HB3  ARG  20           2HB      ARG  20  -6.654   8.045   2.509
  114    HG2  ARG  20           1HG      ARG  20  -7.608   6.871   4.215
  115    HG3  ARG  20           2HG      ARG  20  -6.072   6.620   5.047
  116    HD2  ARG  20           1HD      ARG  20  -6.137   8.672   6.074
  117    HD3  ARG  20           2HD      ARG  20  -7.132   9.392   4.810
  118    HE   ARG  20           HE       ARG  20  -8.437   7.358   6.400
  119   HH11  ARG  20          1HH1      ARG  20  -7.773  10.750   5.981
  120   HH12  ARG  20          2HH1      ARG  20  -9.137  11.266   6.917
  121   HH21  ARG  20          1HH2      ARG  20 -10.236   8.025   7.633
  122   HH22  ARG  20          2HH2      ARG  20 -10.537   9.715   7.856
  123    H    PHE  21           H        PHE  21  -5.481   7.195   0.249
  124    HA   PHE  21           HA       PHE  21  -2.901   8.525  -0.198
  125    HB2  PHE  21           1HB      PHE  21  -4.129   6.367  -1.920
  126    HB3  PHE  21           2HB      PHE  21  -2.810   7.405  -2.452
  127    HD1  PHE  21           HD2      PHE  21  -3.711   5.122   0.353
  128    HD2  PHE  21           HD1      PHE  21  -0.649   6.681  -2.158
  129    HE1  PHE  21           HE2      PHE  21  -2.092   3.578   1.376
  130    HE2  PHE  21           HE1      PHE  21   0.976   5.138  -1.140
  131    HZ   PHE  21           HZ       PHE  21   0.255   3.585   0.630
  132    H    ARG  22           H        ARG  22  -2.935  10.239  -1.604
  133    HA   ARG  22           HA       ARG  22  -5.112  11.826  -1.864
  134    HB2  ARG  22           1HB      ARG  22  -2.642  12.228  -2.561
  135    HB3  ARG  22           2HB      ARG  22  -3.165  11.668  -4.143
  136    HG2  ARG  22           1HG      ARG  22  -4.917  13.444  -4.110
  137    HG3  ARG  22           2HG      ARG  22  -4.184  14.056  -2.626
  138    HD2  ARG  22           1HD      ARG  22  -2.493  13.632  -5.052
  139    HD3  ARG  22           2HD      ARG  22  -3.513  15.066  -4.938
  140    HE   ARG  22           HE       ARG  22  -2.113  14.929  -2.565
  141   HH11  ARG  22          1HH1      ARG  22  -1.364  15.212  -5.953
  142   HH12  ARG  22          2HH1      ARG  22   0.096  16.106  -5.689
  143   HH21  ARG  22          1HH2      ARG  22  -0.192  16.105  -2.205
  144   HH22  ARG  22          2HH2      ARG  22   0.762  16.613  -3.557
  145    H    HIS  23           H        HIS  23  -4.041   9.456  -4.294
  146    HA   HIS  23           HA       HIS  23  -6.754   9.550  -5.442
  147    HB2  HIS  23           1HB      HIS  23  -4.070   9.452  -6.728
  148    HB3  HIS  23           2HB      HIS  23  -5.378   8.561  -7.501
  149    HD2  HIS  23           HD2      HIS  23  -6.114  12.036  -5.878
  150    HE1  HIS  23           HE1      HIS  23  -6.332  12.433 -10.096
  151    HE2  HIS  23           HE2      HIS  23  -6.633  13.590  -7.879
  152    H    LEU  24           H        LEU  24  -7.196   7.455  -6.746
  153    HA   LEU  24           HA       LEU  24  -6.821   5.250  -4.896
  154    HB2  LEU  24           1HB      LEU  24  -9.032   5.797  -5.904
  155    HB3  LEU  24           2HB      LEU  24  -8.382   5.326  -7.473
  156    HG   LEU  24           HG       LEU  24  -8.469   3.092  -6.994
  157   HD11  LEU  24          1HD1      LEU  24  -7.026   3.079  -5.081
  158   HD12  LEU  24          2HD1      LEU  24  -8.487   2.175  -4.685
  159   HD13  LEU  24          3HD1      LEU  24  -8.274   3.816  -4.076
  160   HD21  LEU  24          3HD2      LEU  24 -10.651   4.513  -5.544
  161   HD22  LEU  24          1HD2      LEU  24 -10.541   2.757  -5.424
  162   HD23  LEU  24          2HD2      LEU  24 -10.723   3.523  -7.002
  163    H    GLN  25           H        GLN  25  -6.363   5.784  -8.393
  164    HA   GLN  25           HA       GLN  25  -5.226   3.455  -9.172
  165    HB2  GLN  25           1HB      GLN  25  -3.851   4.791 -10.782
  166    HB3  GLN  25           2HB      GLN  25  -5.559   5.213 -10.763
  167    HG2  GLN  25           1HG      GLN  25  -5.189   7.260  -9.809
  168    HG3  GLN  25           2HG      GLN  25  -3.684   6.753  -9.045
  169   HE21  GLN  25          1HE2      GLN  25  -5.039   8.465 -11.560
  170   HE22  GLN  25          2HE2      GLN  25  -3.635   8.646 -12.549
  171    H    THR  26           H        THR  26  -3.808   5.849  -7.087
  172    HA   THR  26           HA       THR  26  -1.152   4.724  -7.225
  173    HB   THR  26           HB       THR  26  -2.305   6.802  -5.354
  174    HG1  THR  26           HG1      THR  26  -0.777   8.088  -6.789
  175   HG21  THR  26          3HG2      THR  26  -0.187   5.383  -4.697
  176   HG22  THR  26          1HG2      THR  26  -0.219   7.127  -4.440
  177   HG23  THR  26          2HG2      THR  26   0.617   6.457  -5.841
  178    H    LEU  27           H        LEU  27  -3.796   4.822  -4.857
  179    HA   LEU  27           HA       LEU  27  -2.558   3.468  -2.773
  180    HB2  LEU  27           1HB      LEU  27  -4.631   4.477  -2.333
  181    HB3  LEU  27           2HB      LEU  27  -5.417   3.635  -3.666
  182    HG   LEU  27           HG       LEU  27  -5.296   1.536  -2.411
  183   HD11  LEU  27          1HD1      LEU  27  -4.064   3.245  -0.255
  184   HD12  LEU  27          2HD1      LEU  27  -3.295   1.916  -1.122
  185   HD13  LEU  27          3HD1      LEU  27  -4.642   1.593  -0.030
  186   HD21  LEU  27          3HD2      LEU  27  -6.513   3.764  -0.782
  187   HD22  LEU  27          1HD2      LEU  27  -6.968   2.060  -0.750
  188   HD23  LEU  27          2HD2      LEU  27  -7.256   3.022  -2.200
  189    H    LYS  28           H        LYS  28  -4.348   2.173  -5.544
  190    HA   LYS  28           HA       LYS  28  -4.393  -0.508  -4.870
  191    HB2  LYS  28           1HB      LYS  28  -4.133   0.833  -7.560
  192    HB3  LYS  28           2HB      LYS  28  -4.343  -0.904  -7.380
  193    HG2  LYS  28           1HG      LYS  28  -6.507  -0.694  -6.594
  194    HG3  LYS  28           2HG      LYS  28  -6.272   0.984  -6.099
  195    HD2  LYS  28           1HD      LYS  28  -6.587   1.796  -8.218
  196    HD3  LYS  28           2HD      LYS  28  -6.012   0.315  -8.987
  197    HE2  LYS  28           1HE      LYS  28  -8.128  -0.777  -8.072
  198    HE3  LYS  28           2HE      LYS  28  -8.693   0.861  -7.745
  199    HZ1  LYS  28           3HZ      LYS  28  -8.421  -0.531 -10.270
  200    HZ2  LYS  28           1HZ      LYS  28  -7.907   1.081 -10.285
  201    HZ3  LYS  28           2HZ      LYS  28  -9.488   0.702  -9.822
  202    H    SER  29           H        SER  29  -1.731   1.453  -5.928
  203    HA   SER  29           HA       SER  29  -0.025  -0.802  -6.535
  204    HB2  SER  29           1HB      SER  29   0.591   2.154  -6.314
  205    HB3  SER  29           2HB      SER  29   1.725   0.925  -6.873
  206    HG   SER  29           HG       SER  29   0.390   0.532  -8.628
  207    H    HIS  30           H        HIS  30  -0.849   1.084  -3.790
  208    HA   HIS  30           HA       HIS  30   1.552   0.623  -2.300
  209    HB2  HIS  30           1HB      HIS  30   0.488   2.461  -1.443
  210    HB3  HIS  30           2HB      HIS  30  -1.119   1.811  -1.756
  211    HD1  HIS  30           HD1      HIS  30   1.773   1.090   0.617
  212    HD2  HIS  30           HD2      HIS  30  -2.380   1.036   0.502
  213    HE1  HIS  30           HE1      HIS  30   1.044   0.465   2.941
  214    H    LEU  31           H        LEU  31  -1.275  -1.196  -2.977
  215    HA   LEU  31           HA       LEU  31  -1.185  -2.871  -0.654
  216    HB2  LEU  31           1HB      LEU  31  -2.452  -3.760  -3.196
  217    HB3  LEU  31           2HB      LEU  31  -2.999  -3.969  -1.534
  218    HG   LEU  31           HG       LEU  31  -3.270  -1.551  -3.299
  219   HD11  LEU  31          1HD1      LEU  31  -4.926  -3.685  -2.860
  220   HD12  LEU  31          2HD1      LEU  31  -5.433  -2.092  -3.420
  221   HD13  LEU  31          3HD1      LEU  31  -5.525  -2.494  -1.706
  222   HD21  LEU  31          3HD2      LEU  31  -2.628  -0.522  -1.320
  223   HD22  LEU  31          1HD2      LEU  31  -3.390  -1.755  -0.314
  224   HD23  LEU  31          2HD2      LEU  31  -4.386  -0.584  -1.180
  225    H    ARG  32           H        ARG  32   0.862  -2.583  -3.210
  226    HA   ARG  32           HA       ARG  32   1.367  -5.302  -3.867
  227    HB2  ARG  32           1HB      ARG  32   2.705  -2.693  -4.360
  228    HB3  ARG  32           2HB      ARG  32   3.688  -4.143  -4.519
  229    HG2  ARG  32           1HG      ARG  32   2.800  -3.528  -6.666
  230    HG3  ARG  32           2HG      ARG  32   2.057  -5.038  -6.134
  231    HD2  ARG  32           1HD      ARG  32   0.015  -4.026  -5.697
  232    HD3  ARG  32           2HD      ARG  32   0.728  -2.419  -5.566
  233    HE   ARG  32           HE       ARG  32   0.499  -2.171  -7.829
  234   HH11  ARG  32          1HH1      ARG  32   0.142  -5.535  -7.008
  235   HH12  ARG  32          2HH1      ARG  32  -0.357  -6.005  -8.599
  236   HH21  ARG  32          1HH2      ARG  32  -0.156  -2.778  -9.928
  237   HH22  ARG  32          2HH2      ARG  32  -0.525  -4.436 -10.260
  238    H    ILE  33           H        ILE  33   2.444  -3.176  -1.334
  239    HA   ILE  33           HA       ILE  33   4.629  -4.883  -0.526
  240    HB   ILE  33           HB       ILE  33   5.105  -3.316   1.153
  241   HG12  ILE  33          1HG1      ILE  33   2.289  -2.265   0.807
  242   HG13  ILE  33          2HG1      ILE  33   2.885  -3.203   2.171
  243   HG21  ILE  33          1HG2      ILE  33   4.080  -1.166  -0.443
  244   HG22  ILE  33          2HG2      ILE  33   5.736  -1.749  -0.287
  245   HG23  ILE  33          3HG2      ILE  33   4.657  -2.468  -1.482
  246   HD11  ILE  33          3HD1      ILE  33   4.575  -1.277   2.456
  247   HD12  ILE  33          1HD1      ILE  33   3.459  -0.368   1.437
  248   HD13  ILE  33          2HD1      ILE  33   2.905  -1.040   2.971
  249    H    HIS  34           H        HIS  34   1.266  -4.634   0.099
  250    HA   HIS  34           HA       HIS  34   1.317  -5.916   2.672
  251    HB2  HIS  34           1HB      HIS  34  -0.886  -5.217   0.739
  252    HB3  HIS  34           2HB      HIS  34  -1.195  -6.135   2.209
  253    HD1  HIS  34           HD1      HIS  34   0.330  -4.668   4.307
  254    HD2  HIS  34           HD2      HIS  34  -1.701  -2.700   1.264
  255    HE1  HIS  34           HE1      HIS  34  -0.098  -2.347   5.175
  256    H    THR  35           H        THR  35   0.580  -6.902  -0.650
  257    HA   THR  35           HA       THR  35   0.799  -9.708   0.227
  258    HB   THR  35           HB       THR  35  -1.528  -9.093  -0.426
  259    HG1  THR  35           HG1      THR  35  -0.806 -11.244  -0.701
  260   HG21  THR  35          3HG2      THR  35  -0.563  -8.941  -3.261
  261   HG22  THR  35          1HG2      THR  35  -0.648  -7.493  -2.260
  262   HG23  THR  35          2HG2      THR  35  -2.108  -8.428  -2.584
  263    H    GLY  36           H        GLY  36   2.575 -10.621  -0.558
  264    HA2  GLY  36           1HA      GLY  36   3.219 -10.910  -3.222
  265    HA3  GLY  36           2HA      GLY  36   4.079  -9.471  -2.695
  266    H    SER  37           H        SER  37   5.347 -11.801  -3.628
  267    HA   SER  37           HA       SER  37   6.475 -12.988  -1.189
  268    HB2  SER  37           1HB      SER  37   7.164 -14.839  -2.492
  269    HB3  SER  37           2HB      SER  37   5.550 -14.446  -3.085
  270    HG   SER  37           HG       SER  37   7.282 -14.804  -4.700
  271    H    GLY  38           H        GLY  38   8.387 -12.308  -0.496
  272    HA2  GLY  38           1HA      GLY  38  10.273 -11.184  -2.470
  273    HA3  GLY  38           2HA      GLY  38   9.968 -10.376  -0.940
  274    HA   PRO  39           HA       PRO  39  13.694 -13.033  -0.357
  275    HB2  PRO  39           1HB      PRO  39  15.056 -11.186   1.093
  276    HB3  PRO  39           2HB      PRO  39  15.078 -11.227  -0.674
  277    HG2  PRO  39           1HG      PRO  39  13.461  -9.500   1.161
  278    HG3  PRO  39           2HG      PRO  39  14.316  -9.057  -0.327
  279    HD2  PRO  39           1HD      PRO  39  11.643  -9.486  -0.255
  280    HD3  PRO  39           2HD      PRO  39  12.632  -9.857  -1.682
  281    H    SER  40           H        SER  40  12.698 -14.476   1.035
  282    HA   SER  40           HA       SER  40  12.066 -13.597   3.748
  283    HB2  SER  40           1HB      SER  40  11.508 -16.137   2.218
  284    HB3  SER  40           2HB      SER  40  11.219 -16.004   3.952
  285    HG   SER  40           HG       SER  40   9.860 -14.182   3.449
  286    H    SER  41           H        SER  41  14.773 -13.522   3.155
  287    HA   SER  41           HA       SER  41  16.449 -15.569   3.519
  288    HB2  SER  41           1HB      SER  41  16.485 -12.859   4.831
  289    HB3  SER  41           2HB      SER  41  17.790 -14.016   5.091
  290    HG   SER  41           HG       SER  41  18.512 -13.602   3.163
  291    H    GLY  42           H        GLY  42  14.554 -14.094   6.134
  292    HA2  GLY  42           1HA      GLY  42  13.577 -15.602   7.791
  293    HA3  GLY  42           2HA      GLY  42  15.070 -16.527   7.727
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1  10.268  18.676  12.859
    2    HA2  GLY   1           1HA      GLY   1  10.907  17.007  11.104
    3    HA3  GLY   1           2HA      GLY   1  10.778  15.804  12.379
    4    H    SER   2           H        SER   2   9.032  17.897  10.211
    5    HA   SER   2           HA       SER   2   6.650  16.248  10.606
    6    HB2  SER   2           1HB      SER   2   5.174  18.179  10.742
    7    HB3  SER   2           2HB      SER   2   6.369  18.261  12.036
    8    HG   SER   2           HG       SER   2   6.093  20.269  10.941
    9    H    SER   3           H        SER   3   5.168  16.306   8.832
   10    HA   SER   3           HA       SER   3   6.451  17.160   6.323
   11    HB2  SER   3           1HB      SER   3   4.369  15.001   6.746
   12    HB3  SER   3           2HB      SER   3   5.148  15.404   5.216
   13    HG   SER   3           HG       SER   3   6.754  14.191   5.786
   14    H    GLY   4           H        GLY   4   5.374  18.433   4.890
   15    HA2  GLY   4           1HA      GLY   4   3.075  19.862   5.886
   16    HA3  GLY   4           2HA      GLY   4   3.923  20.167   4.377
   17    H    SER   5           H        SER   5   1.677  20.467   3.602
   18    HA   SER   5           HA       SER   5   0.797  18.100   2.249
   19    HB2  SER   5           1HB      SER   5  -0.698  19.121   4.618
   20    HB3  SER   5           2HB      SER   5  -1.636  18.576   3.228
   21    HG   SER   5           HG       SER   5  -1.093  16.580   3.644
   22    H    SER   6           H        SER   6   0.717  18.996   0.288
   23    HA   SER   6           HA       SER   6  -0.381  21.674  -0.059
   24    HB2  SER   6           1HB      SER   6   1.764  20.852  -1.188
   25    HB3  SER   6           2HB      SER   6   0.718  19.895  -2.235
   26    HG   SER   6           HG       SER   6  -0.288  21.833  -2.885
   27    H    GLY   7           H        GLY   7  -2.575  21.093   0.459
   28    HA2  GLY   7           1HA      GLY   7  -4.675  20.191   0.023
   29    HA3  GLY   7           2HA      GLY   7  -4.362  20.962  -1.525
   30    H    GLY   8           H        GLY   8  -3.543  17.949   0.206
   31    HA2  GLY   8           1HA      GLY   8  -4.255  16.482  -2.246
   32    HA3  GLY   8           2HA      GLY   8  -2.716  16.167  -1.459
   33    H    GLU   9           H        GLU   9  -6.091  16.546  -0.363
   34    HA   GLU   9           HA       GLU   9  -5.942  14.851   1.817
   35    HB2  GLU   9           1HB      GLU   9  -8.327  15.316   0.017
   36    HB3  GLU   9           2HB      GLU   9  -8.389  14.650   1.643
   37    HG2  GLU   9           1HG      GLU   9  -7.744  16.695   2.616
   38    HG3  GLU   9           2HG      GLU   9  -7.258  17.368   1.061
   39    H    LYS  10           H        LYS  10  -6.569  12.683   2.165
   40    HA   LYS  10           HA       LYS  10  -6.249  10.975  -0.211
   41    HB2  LYS  10           1HB      LYS  10  -5.722  10.278   2.683
   42    HB3  LYS  10           2HB      LYS  10  -5.408   9.249   1.292
   43    HG2  LYS  10           1HG      LYS  10  -3.317  10.075   1.700
   44    HG3  LYS  10           2HG      LYS  10  -3.911  11.252   0.525
   45    HD2  LYS  10           1HD      LYS  10  -4.577  12.728   2.392
   46    HD3  LYS  10           2HD      LYS  10  -3.889  11.565   3.528
   47    HE2  LYS  10           1HE      LYS  10  -1.734  12.076   2.957
   48    HE3  LYS  10           2HE      LYS  10  -2.166  12.548   1.314
   49    HZ1  LYS  10           3HZ      LYS  10  -3.412  14.435   2.699
   50    HZ2  LYS  10           1HZ      LYS  10  -1.820  14.595   2.149
   51    HZ3  LYS  10           2HZ      LYS  10  -2.120  14.134   3.748
   52    HA   PRO  11           HA       PRO  11 -10.623  10.401   1.235
   53    HB2  PRO  11           1HB      PRO  11 -11.699  10.450  -1.257
   54    HB3  PRO  11           2HB      PRO  11 -11.408  11.912  -0.307
   55    HG2  PRO  11           1HG      PRO  11  -9.761  10.723  -2.506
   56    HG3  PRO  11           2HG      PRO  11 -10.185  12.420  -2.219
   57    HD2  PRO  11           1HD      PRO  11  -7.775  11.387  -1.543
   58    HD3  PRO  11           2HD      PRO  11  -8.549  12.689  -0.617
   59    H    TYR  12           H        TYR  12  -8.282   8.655  -0.270
   60    HA   TYR  12           HA       TYR  12 -10.062   6.341  -0.674
   61    HB2  TYR  12           1HB      TYR  12  -7.453   6.992  -2.058
   62    HB3  TYR  12           2HB      TYR  12  -8.331   5.478  -2.246
   63    HD1  TYR  12           HD1      TYR  12  -8.478   9.119  -2.875
   64    HD2  TYR  12           HD2      TYR  12 -10.200   5.317  -3.704
   65    HE1  TYR  12           HE1      TYR  12  -9.799  10.120  -4.691
   66    HE2  TYR  12           HE2      TYR  12 -11.525   6.308  -5.523
   67    HH   TYR  12           HH       TYR  12 -11.898   9.639  -5.921
   68    HA   PRO  13           HA       PRO  13  -7.414   5.295   2.931
   69    HB2  PRO  13           1HB      PRO  13  -9.330   3.824   4.171
   70    HB3  PRO  13           2HB      PRO  13  -9.215   5.580   4.330
   71    HG2  PRO  13           1HG      PRO  13 -11.006   3.950   2.571
   72    HG3  PRO  13           2HG      PRO  13 -11.392   5.386   3.537
   73    HD2  PRO  13           1HD      PRO  13 -10.949   5.502   0.868
   74    HD3  PRO  13           2HD      PRO  13 -10.525   6.832   1.965
   75    H    CYS  14           H        CYS  14  -6.279   3.433   3.275
   76    HA   CYS  14           HA       CYS  14  -6.362   1.420   1.269
   77    HB2  CYS  14           1HB      CYS  14  -4.240   1.941   2.230
   78    HB3  CYS  14           2HB      CYS  14  -4.837   1.660   3.862
   79    H    GLU  15           H        GLU  15  -6.532  -0.917   1.731
   80    HA   GLU  15           HA       GLU  15  -8.797  -1.414   3.527
   81    HB2  GLU  15           1HB      GLU  15  -9.382  -2.144   1.387
   82    HB3  GLU  15           2HB      GLU  15  -7.774  -2.774   1.058
   83    HG2  GLU  15           1HG      GLU  15  -8.156  -4.731   2.171
   84    HG3  GLU  15           2HG      GLU  15  -9.362  -4.017   3.239
   85    H    ILE  16           H        ILE  16  -5.557  -2.549   2.731
   86    HA   ILE  16           HA       ILE  16  -5.518  -4.742   4.518
   87    HB   ILE  16           HB       ILE  16  -3.185  -3.120   3.492
   88   HG12  ILE  16          1HG1      ILE  16  -3.116  -5.354   2.023
   89   HG13  ILE  16          2HG1      ILE  16  -4.850  -5.290   2.317
   90   HG21  ILE  16          1HG2      ILE  16  -3.325  -5.863   4.733
   91   HG22  ILE  16          2HG2      ILE  16  -1.901  -5.199   3.934
   92   HG23  ILE  16          3HG2      ILE  16  -2.529  -4.435   5.394
   93   HD11  ILE  16          3HD1      ILE  16  -4.049  -2.701   1.553
   94   HD12  ILE  16          1HD1      ILE  16  -3.294  -3.835   0.434
   95   HD13  ILE  16          2HD1      ILE  16  -5.044  -3.849   0.657
   96    H    CYS  17           H        CYS  17  -3.555  -1.789   4.840
   97    HA   CYS  17           HA       CYS  17  -3.601  -2.098   7.733
   98    HB2  CYS  17           1HB      CYS  17  -1.937  -0.250   7.704
   99    HB3  CYS  17           2HB      CYS  17  -1.452  -1.629   6.723
  100    H    GLY  18           H        GLY  18  -4.406   0.399   5.325
  101    HA2  GLY  18           1HA      GLY  18  -6.700   1.394   5.859
  102    HA3  GLY  18           2HA      GLY  18  -5.967   1.785   7.408
  103    H    THR  19           H        THR  19  -3.370   2.258   5.857
  104    HA   THR  19           HA       THR  19  -3.290   4.973   5.841
  105    HB   THR  19           HB       THR  19  -1.807   2.993   4.131
  106    HG1  THR  19           HG1      THR  19  -1.053   3.013   6.190
  107   HG21  THR  19          3HG2      THR  19  -1.741   5.981   3.997
  108   HG22  THR  19          1HG2      THR  19  -1.668   4.801   2.689
  109   HG23  THR  19          2HG2      THR  19  -0.264   5.058   3.725
  110    H    ARG  20           H        ARG  20  -3.986   6.613   4.598
  111    HA   ARG  20           HA       ARG  20  -5.639   5.939   2.281
  112    HB2  ARG  20           1HB      ARG  20  -5.360   8.595   3.695
  113    HB3  ARG  20           2HB      ARG  20  -6.577   8.160   2.502
  114    HG2  ARG  20           1HG      ARG  20  -7.802   6.946   3.986
  115    HG3  ARG  20           2HG      ARG  20  -6.396   6.508   4.958
  116    HD2  ARG  20           1HD      ARG  20  -6.465   8.438   6.178
  117    HD3  ARG  20           2HD      ARG  20  -7.183   9.369   4.864
  118    HE   ARG  20           HE       ARG  20  -9.156   7.652   5.560
  119   HH11  ARG  20          1HH1      ARG  20  -7.173   9.881   7.354
  120   HH12  ARG  20          2HH1      ARG  20  -8.385  10.199   8.551
  121   HH21  ARG  20          1HH2      ARG  20 -10.759   8.062   7.129
  122   HH22  ARG  20          2HH2      ARG  20 -10.424   9.162   8.423
  123    H    PHE  21           H        PHE  21  -5.374   6.917   0.264
  124    HA   PHE  21           HA       PHE  21  -2.783   8.257  -0.153
  125    HB2  PHE  21           1HB      PHE  21  -4.128   6.134  -1.822
  126    HB3  PHE  21           2HB      PHE  21  -2.841   7.157  -2.454
  127    HD1  PHE  21           HD2      PHE  21  -3.627   4.746   0.255
  128    HD2  PHE  21           HD1      PHE  21  -0.611   6.601  -2.106
  129    HE1  PHE  21           HE2      PHE  21  -1.952   3.209   1.195
  130    HE2  PHE  21           HE1      PHE  21   1.070   5.066  -1.170
  131    HZ   PHE  21           HZ       PHE  21   0.400   3.368   0.483
  132    H    ARG  22           H        ARG  22  -2.769  10.061  -1.389
  133    HA   ARG  22           HA       ARG  22  -4.862  11.722  -1.673
  134    HB2  ARG  22           1HB      ARG  22  -2.509  12.282  -2.236
  135    HB3  ARG  22           2HB      ARG  22  -2.694  11.421  -3.758
  136    HG2  ARG  22           1HG      ARG  22  -4.311  12.997  -4.534
  137    HG3  ARG  22           2HG      ARG  22  -4.374  13.783  -2.955
  138    HD2  ARG  22           1HD      ARG  22  -2.301  14.774  -3.221
  139    HD3  ARG  22           2HD      ARG  22  -1.776  13.589  -4.417
  140    HE   ARG  22           HE       ARG  22  -3.870  14.932  -5.584
  141   HH11  ARG  22          1HH1      ARG  22  -0.769  15.783  -4.251
  142   HH12  ARG  22          2HH1      ARG  22  -0.544  17.142  -5.302
  143   HH21  ARG  22          1HH2      ARG  22  -3.585  16.718  -6.974
  144   HH22  ARG  22          2HH2      ARG  22  -2.147  17.673  -6.850
  145    H    HIS  23           H        HIS  23  -3.862   9.374  -4.154
  146    HA   HIS  23           HA       HIS  23  -6.576   9.563  -5.287
  147    HB2  HIS  23           1HB      HIS  23  -3.914   9.584  -6.619
  148    HB3  HIS  23           2HB      HIS  23  -5.220   8.724  -7.428
  149    HD2  HIS  23           HD2      HIS  23  -6.421  11.883  -5.622
  150    HE1  HIS  23           HE1      HIS  23  -5.948  12.882  -9.718
  151    HE2  HIS  23           HE2      HIS  23  -6.766  13.662  -7.468
  152    H    LEU  24           H        LEU  24  -7.274   7.595  -6.452
  153    HA   LEU  24           HA       LEU  24  -6.810   5.281  -4.839
  154    HB2  LEU  24           1HB      LEU  24  -8.985   5.924  -5.932
  155    HB3  LEU  24           2HB      LEU  24  -8.279   5.415  -7.464
  156    HG   LEU  24           HG       LEU  24  -8.262   3.154  -6.830
  157   HD11  LEU  24          1HD1      LEU  24  -9.160   2.713  -4.356
  158   HD12  LEU  24          2HD1      LEU  24  -8.344   4.253  -4.086
  159   HD13  LEU  24          3HD1      LEU  24  -7.446   2.881  -4.736
  160   HD21  LEU  24          3HD2      LEU  24 -10.765   4.496  -5.828
  161   HD22  LEU  24          1HD2      LEU  24 -10.606   2.750  -6.023
  162   HD23  LEU  24          2HD2      LEU  24 -10.467   3.810  -7.427
  163    H    GLN  25           H        GLN  25  -6.330   5.906  -8.320
  164    HA   GLN  25           HA       GLN  25  -5.165   3.656  -9.192
  165    HB2  GLN  25           1HB      GLN  25  -3.721   5.046 -10.672
  166    HB3  GLN  25           2HB      GLN  25  -5.405   5.551 -10.654
  167    HG2  GLN  25           1HG      GLN  25  -4.955   7.496  -9.517
  168    HG3  GLN  25           2HG      GLN  25  -3.468   6.864  -8.811
  169   HE21  GLN  25          1HE2      GLN  25  -4.929   7.925 -11.838
  170   HE22  GLN  25          2HE2      GLN  25  -3.461   8.474 -12.565
  171    H    THR  26           H        THR  26  -3.701   5.961  -7.000
  172    HA   THR  26           HA       THR  26  -1.103   4.722  -7.077
  173    HB   THR  26           HB       THR  26  -2.205   6.730  -5.102
  174    HG1  THR  26           HG1      THR  26  -0.973   8.205  -6.442
  175   HG21  THR  26          3HG2      THR  26  -0.221   6.714  -4.068
  176   HG22  THR  26          1HG2      THR  26   0.661   6.730  -5.594
  177   HG23  THR  26          2HG2      THR  26   0.095   5.202  -4.919
  178    H    LEU  27           H        LEU  27  -3.871   4.746  -4.871
  179    HA   LEU  27           HA       LEU  27  -2.749   3.313  -2.760
  180    HB2  LEU  27           1HB      LEU  27  -4.840   4.366  -2.435
  181    HB3  LEU  27           2HB      LEU  27  -5.566   3.503  -3.790
  182    HG   LEU  27           HG       LEU  27  -5.544   1.435  -2.524
  183   HD11  LEU  27          1HD1      LEU  27  -3.446   2.057  -1.242
  184   HD12  LEU  27          2HD1      LEU  27  -4.710   1.227  -0.335
  185   HD13  LEU  27          3HD1      LEU  27  -4.500   2.970  -0.161
  186   HD21  LEU  27          3HD2      LEU  27  -6.946   2.343  -0.493
  187   HD22  LEU  27          1HD2      LEU  27  -7.555   2.460  -2.145
  188   HD23  LEU  27          2HD2      LEU  27  -6.821   3.866  -1.374
  189    H    LYS  28           H        LYS  28  -4.530   2.122  -5.597
  190    HA   LYS  28           HA       LYS  28  -4.566  -0.577  -5.024
  191    HB2  LYS  28           1HB      LYS  28  -4.297   0.855  -7.666
  192    HB3  LYS  28           2HB      LYS  28  -4.512  -0.886  -7.546
  193    HG2  LYS  28           1HG      LYS  28  -6.672  -0.679  -6.682
  194    HG3  LYS  28           2HG      LYS  28  -6.435   1.019  -6.259
  195    HD2  LYS  28           1HD      LYS  28  -6.607   1.716  -8.485
  196    HD3  LYS  28           2HD      LYS  28  -6.311   0.092  -9.111
  197    HE2  LYS  28           1HE      LYS  28  -8.465  -0.623  -8.621
  198    HE3  LYS  28           2HE      LYS  28  -8.722   0.649  -7.428
  199    HZ1  LYS  28           3HZ      LYS  28  -8.260   1.908  -9.854
  200    HZ2  LYS  28           1HZ      LYS  28  -9.720   1.814  -9.004
  201    HZ3  LYS  28           2HZ      LYS  28  -9.349   0.655 -10.178
  202    H    SER  29           H        SER  29  -1.917   1.403  -6.153
  203    HA   SER  29           HA       SER  29  -0.214  -0.856  -6.737
  204    HB2  SER  29           1HB      SER  29   0.099   2.123  -6.823
  205    HB3  SER  29           2HB      SER  29   1.537   1.103  -6.836
  206    HG   SER  29           HG       SER  29   0.338  -0.036  -8.620
  207    H    HIS  30           H        HIS  30  -1.047   0.993  -3.995
  208    HA   HIS  30           HA       HIS  30   1.399   0.616  -2.542
  209    HB2  HIS  30           1HB      HIS  30   0.292   2.445  -1.704
  210    HB3  HIS  30           2HB      HIS  30  -1.299   1.730  -1.948
  211    HD1  HIS  30           HD1      HIS  30   1.696   1.193   0.342
  212    HD2  HIS  30           HD2      HIS  30  -2.450   0.918   0.357
  213    HE1  HIS  30           HE1      HIS  30   1.071   0.576   2.699
  214    H    LEU  31           H        LEU  31  -1.523  -1.184  -3.027
  215    HA   LEU  31           HA       LEU  31  -1.349  -2.853  -0.742
  216    HB2  LEU  31           1HB      LEU  31  -2.567  -3.767  -3.311
  217    HB3  LEU  31           2HB      LEU  31  -3.093  -4.070  -1.656
  218    HG   LEU  31           HG       LEU  31  -3.513  -1.620  -3.340
  219   HD11  LEU  31          1HD1      LEU  31  -5.847  -2.145  -2.139
  220   HD12  LEU  31          2HD1      LEU  31  -5.166  -3.771  -2.174
  221   HD13  LEU  31          3HD1      LEU  31  -5.366  -2.868  -3.675
  222   HD21  LEU  31          3HD2      LEU  31  -3.628  -1.883  -0.349
  223   HD22  LEU  31          1HD2      LEU  31  -4.560  -0.669  -1.226
  224   HD23  LEU  31          2HD2      LEU  31  -2.798  -0.662  -1.315
  225    H    ARG  32           H        ARG  32   0.706  -2.574  -3.304
  226    HA   ARG  32           HA       ARG  32   1.296  -5.313  -3.836
  227    HB2  ARG  32           1HB      ARG  32   2.560  -2.689  -4.482
  228    HB3  ARG  32           2HB      ARG  32   3.534  -4.144  -4.645
  229    HG2  ARG  32           1HG      ARG  32   2.482  -3.495  -6.754
  230    HG3  ARG  32           2HG      ARG  32   1.932  -5.079  -6.202
  231    HD2  ARG  32           1HD      ARG  32  -0.165  -4.273  -5.593
  232    HD3  ARG  32           2HD      ARG  32   0.392  -2.602  -5.526
  233    HE   ARG  32           HE       ARG  32   0.038  -2.418  -7.791
  234   HH11  ARG  32          1HH1      ARG  32  -0.167  -5.759  -6.836
  235   HH12  ARG  32          2HH1      ARG  32  -0.792  -6.292  -8.362
  236   HH21  ARG  32          1HH2      ARG  32  -0.784  -3.107  -9.804
  237   HH22  ARG  32          2HH2      ARG  32  -1.142  -4.783 -10.049
  238    H    ILE  33           H        ILE  33   2.604  -2.872  -1.652
  239    HA   ILE  33           HA       ILE  33   4.781  -4.478  -0.741
  240    HB   ILE  33           HB       ILE  33   5.162  -2.798   0.916
  241   HG12  ILE  33          1HG1      ILE  33   2.647  -1.330   0.228
  242   HG13  ILE  33          2HG1      ILE  33   2.567  -2.673   1.364
  243   HG21  ILE  33          1HG2      ILE  33   4.490  -1.985  -1.835
  244   HG22  ILE  33          2HG2      ILE  33   4.671  -0.676  -0.668
  245   HG23  ILE  33          3HG2      ILE  33   5.995  -1.810  -0.932
  246   HD11  ILE  33          3HD1      ILE  33   3.834  -0.009   1.653
  247   HD12  ILE  33          1HD1      ILE  33   2.884  -0.947   2.806
  248   HD13  ILE  33          2HD1      ILE  33   4.565  -1.378   2.491
  249    H    HIS  34           H        HIS  34   1.468  -4.586  -0.175
  250    HA   HIS  34           HA       HIS  34   1.638  -5.582   2.541
  251    HB2  HIS  34           1HB      HIS  34  -0.608  -5.087   0.610
  252    HB3  HIS  34           2HB      HIS  34  -0.876  -6.055   2.057
  253    HD1  HIS  34           HD1      HIS  34   0.610  -4.489   4.164
  254    HD2  HIS  34           HD2      HIS  34  -1.699  -2.688   1.217
  255    HE1  HIS  34           HE1      HIS  34  -0.013  -2.232   5.083
  256    H    THR  35           H        THR  35  -0.023  -6.984  -0.274
  257    HA   THR  35           HA       THR  35   0.145  -9.627   0.652
  258    HB   THR  35           HB       THR  35  -1.514  -9.080  -0.991
  259    HG1  THR  35           HG1      THR  35  -1.066 -10.749  -2.520
  260   HG21  THR  35          3HG2      THR  35  -0.310  -7.281  -2.139
  261   HG22  THR  35          1HG2      THR  35  -0.940  -8.459  -3.289
  262   HG23  THR  35          2HG2      THR  35   0.773  -8.467  -2.868
  263    H    GLY  36           H        GLY  36   2.239  -7.761  -1.492
  264    HA2  GLY  36           1HA      GLY  36   3.888  -9.962  -2.248
  265    HA3  GLY  36           2HA      GLY  36   4.272  -8.260  -2.452
  266    H    SER  37           H        SER  37   4.911  -7.104  -0.397
  267    HA   SER  37           HA       SER  37   7.108  -8.478   0.764
  268    HB2  SER  37           1HB      SER  37   6.763  -5.926   0.355
  269    HB3  SER  37           2HB      SER  37   5.966  -5.955   1.928
  270    HG   SER  37           HG       SER  37   7.967  -7.037   2.662
  271    H    GLY  38           H        GLY  38   7.241  -9.658   2.568
  272    HA2  GLY  38           1HA      GLY  38   6.712 -10.105   4.856
  273    HA3  GLY  38           2HA      GLY  38   5.124  -9.400   4.591
  274    HA   PRO  39           HA       PRO  39   4.997 -14.110   4.375
  275    HB2  PRO  39           1HB      PRO  39   3.408 -14.487   6.544
  276    HB3  PRO  39           2HB      PRO  39   5.172 -14.439   6.642
  277    HG2  PRO  39           1HG      PRO  39   3.183 -12.284   7.241
  278    HG3  PRO  39           2HG      PRO  39   4.637 -12.747   8.145
  279    HD2  PRO  39           1HD      PRO  39   4.577 -10.616   6.475
  280    HD3  PRO  39           2HD      PRO  39   6.039 -11.591   6.728
  281    H    SER  40           H        SER  40   3.561 -14.739   2.902
  282    HA   SER  40           HA       SER  40   0.797 -13.738   3.109
  283    HB2  SER  40           1HB      SER  40   0.659 -13.723   0.668
  284    HB3  SER  40           2HB      SER  40   1.990 -12.699   1.206
  285    HG   SER  40           HG       SER  40   2.232 -14.455  -0.574
  286    H    SER  41           H        SER  41  -0.861 -15.170   2.573
  287    HA   SER  41           HA       SER  41  -0.366 -17.814   1.626
  288    HB2  SER  41           1HB      SER  41  -0.594 -17.331   4.561
  289    HB3  SER  41           2HB      SER  41  -1.394 -18.754   3.894
  290    HG   SER  41           HG       SER  41   0.548 -19.565   4.154
  291    H    GLY  42           H        GLY  42  -2.084 -18.109   0.377
  292    HA2  GLY  42           1HA      GLY  42  -4.500 -16.682   0.621
  293    HA3  GLY  42           2HA      GLY  42  -4.248 -18.099  -0.387
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1 -11.748  29.971   4.544
    2    HA2  GLY   1           1HA      GLY   1 -13.376  31.715   4.298
    3    HA3  GLY   1           2HA      GLY   1 -13.587  30.662   2.907
    4    H    SER   2           H        SER   2 -15.764  31.120   2.655
    5    HA   SER   2           HA       SER   2 -17.655  31.005   4.759
    6    HB2  SER   2           1HB      SER   2 -19.327  31.213   3.064
    7    HB3  SER   2           2HB      SER   2 -17.947  32.169   2.524
    8    HG   SER   2           HG       SER   2 -18.709  30.892   0.829
    9    H    SER   3           H        SER   3 -16.639  28.661   2.305
   10    HA   SER   3           HA       SER   3 -18.299  26.614   3.593
   11    HB2  SER   3           1HB      SER   3 -18.626  26.738   1.210
   12    HB3  SER   3           2HB      SER   3 -16.888  26.667   0.918
   13    HG   SER   3           HG       SER   3 -17.181  24.595   0.810
   14    H    GLY   4           H        GLY   4 -14.980  27.084   2.386
   15    HA2  GLY   4           1HA      GLY   4 -13.515  26.262   4.479
   16    HA3  GLY   4           2HA      GLY   4 -14.061  24.730   3.812
   17    H    SER   5           H        SER   5 -11.820  24.237   3.449
   18    HA   SER   5           HA       SER   5 -10.968  25.023   0.811
   19    HB2  SER   5           1HB      SER   5  -8.864  25.981   1.385
   20    HB3  SER   5           2HB      SER   5 -10.062  26.807   2.381
   21    HG   SER   5           HG       SER   5  -8.461  24.618   3.223
   22    H    SER   6           H        SER   6 -10.003  23.358  -0.170
   23    HA   SER   6           HA       SER   6  -8.748  21.276   1.480
   24    HB2  SER   6           1HB      SER   6 -11.075  20.604   0.828
   25    HB3  SER   6           2HB      SER   6 -10.575  20.696  -0.861
   26    HG   SER   6           HG       SER   6  -8.784  19.224   0.386
   27    H    GLY   7           H        GLY   7  -7.092  20.086   0.467
   28    HA2  GLY   7           1HA      GLY   7  -6.270  20.983  -2.205
   29    HA3  GLY   7           2HA      GLY   7  -5.138  21.167  -0.874
   30    H    GLY   8           H        GLY   8  -4.163  19.338   0.034
   31    HA2  GLY   8           1HA      GLY   8  -4.251  16.987  -1.730
   32    HA3  GLY   8           2HA      GLY   8  -2.920  17.418  -0.666
   33    H    GLU   9           H        GLU   9  -6.141  16.040  -0.824
   34    HA   GLU   9           HA       GLU   9  -5.784  14.997   1.906
   35    HB2  GLU   9           1HB      GLU   9  -8.220  15.704   0.310
   36    HB3  GLU   9           2HB      GLU   9  -8.335  14.516   1.601
   37    HG2  GLU   9           1HG      GLU   9  -7.249  16.290   3.084
   38    HG3  GLU   9           2HG      GLU   9  -7.636  17.422   1.790
   39    H    LYS  10           H        LYS  10  -6.557  12.807   2.312
   40    HA   LYS  10           HA       LYS  10  -6.179  11.076  -0.042
   41    HB2  LYS  10           1HB      LYS  10  -5.705  10.294   2.833
   42    HB3  LYS  10           2HB      LYS  10  -5.217   9.420   1.387
   43    HG2  LYS  10           1HG      LYS  10  -3.680  11.269   0.829
   44    HG3  LYS  10           2HG      LYS  10  -4.124  12.057   2.345
   45    HD2  LYS  10           1HD      LYS  10  -3.194  10.282   3.631
   46    HD3  LYS  10           2HD      LYS  10  -2.990   9.269   2.199
   47    HE2  LYS  10           1HE      LYS  10  -0.847  10.121   2.708
   48    HE3  LYS  10           2HE      LYS  10  -1.422  11.049   1.324
   49    HZ1  LYS  10           3HZ      LYS  10  -2.167  12.268   3.789
   50    HZ2  LYS  10           1HZ      LYS  10  -1.306  12.919   2.486
   51    HZ3  LYS  10           2HZ      LYS  10  -0.491  12.061   3.693
   52    HA   PRO  11           HA       PRO  11 -10.540  10.482   1.480
   53    HB2  PRO  11           1HB      PRO  11 -11.676  10.619  -0.982
   54    HB3  PRO  11           2HB      PRO  11 -11.366  12.046   0.014
   55    HG2  PRO  11           1HG      PRO  11  -9.769  10.945  -2.266
   56    HG3  PRO  11           2HG      PRO  11 -10.191  12.630  -1.906
   57    HD2  PRO  11           1HD      PRO  11  -7.763  11.580  -1.327
   58    HD3  PRO  11           2HD      PRO  11  -8.517  12.845  -0.336
   59    H    TYR  12           H        TYR  12  -8.228   8.796  -0.125
   60    HA   TYR  12           HA       TYR  12 -10.016   6.505  -0.618
   61    HB2  TYR  12           1HB      TYR  12  -7.380   7.183  -1.936
   62    HB3  TYR  12           2HB      TYR  12  -8.274   5.690  -2.199
   63    HD1  TYR  12           HD1      TYR  12  -8.410   9.364  -2.642
   64    HD2  TYR  12           HD2      TYR  12 -10.075   5.602  -3.729
   65    HE1  TYR  12           HE1      TYR  12  -9.691  10.456  -4.436
   66    HE2  TYR  12           HE2      TYR  12 -11.359   6.684  -5.526
   67    HH   TYR  12           HH       TYR  12 -11.294  10.195  -5.975
   68    HA   PRO  13           HA       PRO  13  -7.440   5.294   2.984
   69    HB2  PRO  13           1HB      PRO  13  -9.378   3.767   4.116
   70    HB3  PRO  13           2HB      PRO  13  -9.270   5.515   4.355
   71    HG2  PRO  13           1HG      PRO  13 -11.020   3.962   2.487
   72    HG3  PRO  13           2HG      PRO  13 -11.430   5.354   3.508
   73    HD2  PRO  13           1HD      PRO  13 -10.930   5.588   0.857
   74    HD3  PRO  13           2HD      PRO  13 -10.532   6.868   2.020
   75    H    CYS  14           H        CYS  14  -6.447   3.326   3.438
   76    HA   CYS  14           HA       CYS  14  -6.509   1.400   1.291
   77    HB2  CYS  14           1HB      CYS  14  -4.343   1.873   2.106
   78    HB3  CYS  14           2HB      CYS  14  -4.847   1.703   3.785
   79    H    GLU  15           H        GLU  15  -6.669  -0.932   1.700
   80    HA   GLU  15           HA       GLU  15  -8.845  -1.480   3.580
   81    HB2  GLU  15           1HB      GLU  15  -9.361  -2.165   1.357
   82    HB3  GLU  15           2HB      GLU  15  -7.805  -2.960   1.169
   83    HG2  GLU  15           1HG      GLU  15  -9.180  -4.753   1.509
   84    HG3  GLU  15           2HG      GLU  15  -8.632  -4.432   3.153
   85    H    ILE  16           H        ILE  16  -5.618  -2.598   2.685
   86    HA   ILE  16           HA       ILE  16  -5.471  -4.778   4.454
   87    HB   ILE  16           HB       ILE  16  -3.217  -3.039   3.442
   88   HG12  ILE  16          1HG1      ILE  16  -3.041  -5.262   1.967
   89   HG13  ILE  16          2HG1      ILE  16  -4.774  -5.290   2.270
   90   HG21  ILE  16          1HG2      ILE  16  -2.108  -4.207   5.031
   91   HG22  ILE  16          2HG2      ILE  16  -3.308  -5.497   5.076
   92   HG23  ILE  16          3HG2      ILE  16  -2.108  -5.454   3.785
   93   HD11  ILE  16          3HD1      ILE  16  -5.067  -3.839   0.635
   94   HD12  ILE  16          1HD1      ILE  16  -4.085  -2.659   1.503
   95   HD13  ILE  16          2HD1      ILE  16  -3.325  -3.773   0.366
   96    H    CYS  17           H        CYS  17  -3.614  -1.766   4.841
   97    HA   CYS  17           HA       CYS  17  -3.723  -2.120   7.736
   98    HB2  CYS  17           1HB      CYS  17  -2.019  -0.304   7.770
   99    HB3  CYS  17           2HB      CYS  17  -1.529  -1.699   6.814
  100    H    GLY  18           H        GLY  18  -4.374   0.413   5.319
  101    HA2  GLY  18           1HA      GLY  18  -6.676   1.444   5.804
  102    HA3  GLY  18           2HA      GLY  18  -5.951   1.845   7.353
  103    H    THR  19           H        THR  19  -3.334   2.222   5.780
  104    HA   THR  19           HA       THR  19  -3.204   4.945   5.731
  105    HB   THR  19           HB       THR  19  -1.739   2.952   4.004
  106    HG1  THR  19           HG1      THR  19  -0.030   3.774   5.532
  107   HG21  THR  19          3HG2      THR  19  -1.437   5.939   4.168
  108   HG22  THR  19          1HG2      THR  19  -1.571   4.925   2.732
  109   HG23  THR  19          2HG2      THR  19  -0.098   4.892   3.701
  110    H    ARG  20           H        ARG  20  -4.102   6.511   4.568
  111    HA   ARG  20           HA       ARG  20  -5.685   5.842   2.237
  112    HB2  ARG  20           1HB      ARG  20  -5.241   8.513   3.582
  113    HB3  ARG  20           2HB      ARG  20  -6.441   8.169   2.343
  114    HG2  ARG  20           1HG      ARG  20  -7.821   7.078   3.781
  115    HG3  ARG  20           2HG      ARG  20  -6.496   6.515   4.802
  116    HD2  ARG  20           1HD      ARG  20  -7.310   9.406   4.650
  117    HD3  ARG  20           2HD      ARG  20  -8.039   8.275   5.791
  118    HE   ARG  20           HE       ARG  20  -5.184   8.272   5.922
  119   HH11  ARG  20          1HH1      ARG  20  -8.052   9.949   6.961
  120   HH12  ARG  20          2HH1      ARG  20  -7.309  10.612   8.379
  121   HH21  ARG  20          1HH2      ARG  20  -4.194   9.139   7.785
  122   HH22  ARG  20          2HH2      ARG  20  -5.114  10.151   8.846
  123    H    PHE  21           H        PHE  21  -5.582   7.423   0.343
  124    HA   PHE  21           HA       PHE  21  -2.898   8.396  -0.232
  125    HB2  PHE  21           1HB      PHE  21  -4.277   6.236  -1.827
  126    HB3  PHE  21           2HB      PHE  21  -2.958   7.205  -2.474
  127    HD1  PHE  21           HD2      PHE  21  -3.838   4.903   0.299
  128    HD2  PHE  21           HD1      PHE  21  -0.746   6.607  -2.077
  129    HE1  PHE  21           HE2      PHE  21  -2.214   3.356   1.310
  130    HE2  PHE  21           HE1      PHE  21   0.884   5.062  -1.071
  131    HZ   PHE  21           HZ       PHE  21   0.151   3.435   0.625
  132    H    ARG  22           H        ARG  22  -2.887  10.155  -1.531
  133    HA   ARG  22           HA       ARG  22  -5.021  11.780  -1.876
  134    HB2  ARG  22           1HB      ARG  22  -2.739  12.494  -2.347
  135    HB3  ARG  22           2HB      ARG  22  -2.690  11.470  -3.776
  136    HG2  ARG  22           1HG      ARG  22  -3.144  13.464  -4.760
  137    HG3  ARG  22           2HG      ARG  22  -4.794  12.920  -4.448
  138    HD2  ARG  22           1HD      ARG  22  -4.892  15.051  -3.611
  139    HD3  ARG  22           2HD      ARG  22  -4.429  14.157  -2.163
  140    HE   ARG  22           HE       ARG  22  -2.534  15.409  -2.127
  141   HH11  ARG  22          1HH1      ARG  22  -3.624  15.185  -5.425
  142   HH12  ARG  22          2HH1      ARG  22  -2.353  16.184  -6.050
  143   HH21  ARG  22          1HH2      ARG  22  -0.857  16.725  -2.937
  144   HH22  ARG  22          2HH2      ARG  22  -0.779  17.058  -4.634
  145    H    HIS  23           H        HIS  23  -3.823   9.539  -4.379
  146    HA   HIS  23           HA       HIS  23  -6.483   9.676  -5.639
  147    HB2  HIS  23           1HB      HIS  23  -3.729   9.481  -6.763
  148    HB3  HIS  23           2HB      HIS  23  -5.029   8.665  -7.626
  149    HD2  HIS  23           HD2      HIS  23  -4.364  12.360  -6.353
  150    HE1  HIS  23           HE1      HIS  23  -6.636  12.458  -9.934
  151    HE2  HIS  23           HE2      HIS  23  -5.410  13.825  -8.210
  152    H    LEU  24           H        LEU  24  -7.221   7.686  -6.703
  153    HA   LEU  24           HA       LEU  24  -6.922   5.440  -4.950
  154    HB2  LEU  24           1HB      LEU  24  -9.049   6.107  -6.081
  155    HB3  LEU  24           2HB      LEU  24  -8.346   5.559  -7.602
  156    HG   LEU  24           HG       LEU  24  -9.967   3.991  -6.401
  157   HD11  LEU  24          1HD1      LEU  24  -7.565   3.510  -7.871
  158   HD12  LEU  24          2HD1      LEU  24  -9.077   2.602  -7.878
  159   HD13  LEU  24          3HD1      LEU  24  -7.815   2.204  -6.712
  160   HD21  LEU  24          3HD2      LEU  24  -9.399   2.955  -4.468
  161   HD22  LEU  24          1HD2      LEU  24  -8.501   4.452  -4.215
  162   HD23  LEU  24          2HD2      LEU  24  -7.670   3.015  -4.812
  163    H    GLN  25           H        GLN  25  -6.428   5.784  -8.469
  164    HA   GLN  25           HA       GLN  25  -5.322   3.445  -9.154
  165    HB2  GLN  25           1HB      GLN  25  -3.849   4.673 -10.750
  166    HB3  GLN  25           2HB      GLN  25  -5.524   5.209 -10.773
  167    HG2  GLN  25           1HG      GLN  25  -5.033   7.223  -9.743
  168    HG3  GLN  25           2HG      GLN  25  -3.507   6.629  -9.089
  169   HE21  GLN  25          1HE2      GLN  25  -1.721   7.184 -10.115
  170   HE22  GLN  25          2HE2      GLN  25  -1.627   7.793 -11.729
  171    H    THR  26           H        THR  26  -3.832   5.841  -7.105
  172    HA   THR  26           HA       THR  26  -1.228   4.627  -7.133
  173    HB   THR  26           HB       THR  26  -2.398   6.676  -5.240
  174    HG1  THR  26           HG1      THR  26  -2.223   7.650  -7.193
  175   HG21  THR  26          3HG2      THR  26   0.476   6.701  -5.530
  176   HG22  THR  26          1HG2      THR  26  -0.085   5.138  -4.936
  177   HG23  THR  26          2HG2      THR  26  -0.501   6.614  -4.065
  178    H    LEU  27           H        LEU  27  -3.890   4.803  -4.777
  179    HA   LEU  27           HA       LEU  27  -2.774   3.356  -2.712
  180    HB2  LEU  27           1HB      LEU  27  -4.840   4.382  -2.311
  181    HB3  LEU  27           2HB      LEU  27  -5.594   3.600  -3.699
  182    HG   LEU  27           HG       LEU  27  -5.596   1.470  -2.518
  183   HD11  LEU  27          1HD1      LEU  27  -4.323   3.028  -0.275
  184   HD12  LEU  27          2HD1      LEU  27  -3.601   1.705  -1.189
  185   HD13  LEU  27          3HD1      LEU  27  -4.976   1.396  -0.128
  186   HD21  LEU  27          3HD2      LEU  27  -7.566   2.031  -1.663
  187   HD22  LEU  27          1HD2      LEU  27  -7.144   3.726  -1.905
  188   HD23  LEU  27          2HD2      LEU  27  -6.794   2.942  -0.364
  189    H    LYS  28           H        LYS  28  -4.362   2.166  -5.632
  190    HA   LYS  28           HA       LYS  28  -4.494  -0.544  -4.979
  191    HB2  LYS  28           1HB      LYS  28  -4.282   0.931  -7.588
  192    HB3  LYS  28           2HB      LYS  28  -4.294  -0.828  -7.549
  193    HG2  LYS  28           1HG      LYS  28  -6.470  -0.902  -6.671
  194    HG3  LYS  28           2HG      LYS  28  -6.441   0.809  -6.239
  195    HD2  LYS  28           1HD      LYS  28  -6.603   1.482  -8.497
  196    HD3  LYS  28           2HD      LYS  28  -6.226  -0.138  -9.087
  197    HE2  LYS  28           1HE      LYS  28  -8.675   0.445  -7.446
  198    HE3  LYS  28           2HE      LYS  28  -8.661   0.608  -9.201
  199    HZ1  LYS  28           3HZ      LYS  28  -9.291  -1.536  -9.095
  200    HZ2  LYS  28           1HZ      LYS  28  -8.624  -1.790  -7.561
  201    HZ3  LYS  28           2HZ      LYS  28  -7.632  -1.824  -8.931
  202    H    SER  29           H        SER  29  -1.819   1.423  -6.042
  203    HA   SER  29           HA       SER  29  -0.112  -0.851  -6.583
  204    HB2  SER  29           1HB      SER  29  -0.035   1.455  -7.752
  205    HB3  SER  29           2HB      SER  29   0.834   1.995  -6.315
  206    HG   SER  29           HG       SER  29   2.329   1.304  -7.820
  207    H    HIS  30           H        HIS  30  -1.043   0.950  -3.870
  208    HA   HIS  30           HA       HIS  30   1.394   0.645  -2.371
  209    HB2  HIS  30           1HB      HIS  30   0.245   2.462  -1.565
  210    HB3  HIS  30           2HB      HIS  30  -1.331   1.724  -1.840
  211    HD1  HIS  30           HD1      HIS  30   1.620   1.244   0.519
  212    HD2  HIS  30           HD2      HIS  30  -2.520   0.905   0.443
  213    HE1  HIS  30           HE1      HIS  30   0.953   0.630   2.865
  214    H    LEU  31           H        LEU  31  -1.383  -1.271  -3.017
  215    HA   LEU  31           HA       LEU  31  -1.264  -2.908  -0.679
  216    HB2  LEU  31           1HB      LEU  31  -2.418  -3.862  -3.259
  217    HB3  LEU  31           2HB      LEU  31  -2.979  -4.141  -1.612
  218    HG   LEU  31           HG       LEU  31  -3.409  -1.750  -3.369
  219   HD11  LEU  31          1HD1      LEU  31  -5.326  -2.858  -3.630
  220   HD12  LEU  31          2HD1      LEU  31  -5.706  -2.341  -1.988
  221   HD13  LEU  31          3HD1      LEU  31  -4.996  -3.930  -2.269
  222   HD21  LEU  31          3HD2      LEU  31  -3.454  -1.883  -0.373
  223   HD22  LEU  31          1HD2      LEU  31  -4.482  -0.757  -1.261
  224   HD23  LEU  31          2HD2      LEU  31  -2.728  -0.663  -1.420
  225    H    ARG  32           H        ARG  32   0.809  -2.597  -3.234
  226    HA   ARG  32           HA       ARG  32   1.463  -5.293  -3.807
  227    HB2  ARG  32           1HB      ARG  32   2.712  -2.639  -4.290
  228    HB3  ARG  32           2HB      ARG  32   3.756  -4.050  -4.397
  229    HG2  ARG  32           1HG      ARG  32   2.950  -3.550  -6.581
  230    HG3  ARG  32           2HG      ARG  32   2.159  -5.029  -6.033
  231    HD2  ARG  32           1HD      ARG  32   0.115  -3.987  -5.751
  232    HD3  ARG  32           2HD      ARG  32   0.839  -2.389  -5.579
  233    HE   ARG  32           HE       ARG  32   0.674  -2.131  -7.839
  234   HH11  ARG  32          1HH1      ARG  32   0.493  -5.526  -7.089
  235   HH12  ARG  32          2HH1      ARG  32   0.144  -6.001  -8.718
  236   HH21  ARG  32          1HH2      ARG  32   0.216  -2.744  -9.988
  237   HH22  ARG  32          2HH2      ARG  32  -0.012  -4.418 -10.367
  238    H    ILE  33           H        ILE  33   2.555  -3.002  -1.379
  239    HA   ILE  33           HA       ILE  33   4.699  -4.668  -0.442
  240    HB   ILE  33           HB       ILE  33   5.082  -3.045   1.231
  241   HG12  ILE  33          1HG1      ILE  33   2.364  -1.858   0.640
  242   HG13  ILE  33          2HG1      ILE  33   2.700  -2.930   1.995
  243   HG21  ILE  33          1HG2      ILE  33   4.476  -2.166  -1.478
  244   HG22  ILE  33          2HG2      ILE  33   4.423  -0.859  -0.297
  245   HG23  ILE  33          3HG2      ILE  33   5.882  -1.834  -0.467
  246   HD11  ILE  33          3HD1      ILE  33   4.467  -1.220   2.673
  247   HD12  ILE  33          1HD1      ILE  33   3.671  -0.137   1.531
  248   HD13  ILE  33          2HD1      ILE  33   2.773  -0.789   2.902
  249    H    HIS  34           H        HIS  34   1.350  -4.678  -0.040
  250    HA   HIS  34           HA       HIS  34   1.368  -5.810   2.630
  251    HB2  HIS  34           1HB      HIS  34  -0.802  -5.173   0.643
  252    HB3  HIS  34           2HB      HIS  34  -1.135  -6.109   2.097
  253    HD1  HIS  34           HD1      HIS  34   0.427  -4.572   4.190
  254    HD2  HIS  34           HD2      HIS  34  -1.822  -2.732   1.220
  255    HE1  HIS  34           HE1      HIS  34  -0.111  -2.281   5.076
  256    H    THR  35           H        THR  35   0.892  -6.878  -0.695
  257    HA   THR  35           HA       THR  35   0.751  -9.661   0.256
  258    HB   THR  35           HB       THR  35  -1.165  -9.255  -1.057
  259    HG1  THR  35           HG1      THR  35   0.700 -10.336  -2.917
  260   HG21  THR  35          3HG2      THR  35  -0.583  -8.426  -3.553
  261   HG22  THR  35          1HG2      THR  35   0.676  -7.581  -2.653
  262   HG23  THR  35          2HG2      THR  35  -1.022  -7.329  -2.244
  263    H    GLY  36           H        GLY  36   3.112  -9.555   0.548
  264    HA2  GLY  36           1HA      GLY  36   4.449 -10.307  -1.953
  265    HA3  GLY  36           2HA      GLY  36   5.170  -9.039  -0.974
  266    H    SER  37           H        SER  37   7.034 -10.476  -0.909
  267    HA   SER  37           HA       SER  37   6.702 -12.749   0.926
  268    HB2  SER  37           1HB      SER  37   8.643 -12.133  -1.262
  269    HB3  SER  37           2HB      SER  37   9.181 -13.145   0.079
  270    HG   SER  37           HG       SER  37   6.777 -13.667  -1.311
  271    H    GLY  38           H        GLY  38   6.689 -11.607   2.870
  272    HA2  GLY  38           1HA      GLY  38   9.238 -11.084   4.002
  273    HA3  GLY  38           2HA      GLY  38   8.419  -9.572   3.639
  274    HA   PRO  39           HA       PRO  39   7.150 -10.700   7.902
  275    HB2  PRO  39           1HB      PRO  39   7.102  -8.136   8.792
  276    HB3  PRO  39           2HB      PRO  39   8.576  -9.110   8.748
  277    HG2  PRO  39           1HG      PRO  39   7.620  -7.035   6.814
  278    HG3  PRO  39           2HG      PRO  39   9.251  -7.296   7.459
  279    HD2  PRO  39           1HD      PRO  39   8.504  -8.144   4.998
  280    HD3  PRO  39           2HD      PRO  39   9.693  -9.015   5.988
  281    H    SER  40           H        SER  40   5.727  -9.319   5.267
  282    HA   SER  40           HA       SER  40   3.616  -7.810   5.869
  283    HB2  SER  40           1HB      SER  40   3.497 -10.343   4.215
  284    HB3  SER  40           2HB      SER  40   2.274  -9.072   4.193
  285    HG   SER  40           HG       SER  40   4.902  -8.277   3.779
  286    H    SER  41           H        SER  41   1.762  -7.865   7.015
  287    HA   SER  41           HA       SER  41   1.345 -10.187   8.744
  288    HB2  SER  41           1HB      SER  41  -0.037  -8.707  10.106
  289    HB3  SER  41           2HB      SER  41   1.522  -7.946   9.791
  290    HG   SER  41           HG       SER  41  -0.728  -6.830   9.404
  291    H    GLY  42           H        GLY  42  -0.448 -11.440   8.692
  292    HA2  GLY  42           1HA      GLY  42  -2.132 -11.251   6.359
  293    HA3  GLY  42           2HA      GLY  42  -2.193 -12.500   7.594
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1   1.825  17.036   6.687
    2    HA2  GLY   1           1HA      GLY   1   0.909  14.643   6.968
    3    HA3  GLY   1           2HA      GLY   1   2.053  14.585   8.301
    4    H    SER   2           H        SER   2  -1.097  14.942   7.644
    5    HA   SER   2           HA       SER   2  -2.887  16.007   8.618
    6    HB2  SER   2           1HB      SER   2  -1.165  14.936  10.815
    7    HB3  SER   2           2HB      SER   2  -2.583  15.894  11.244
    8    HG   SER   2           HG       SER   2  -3.685  14.375   9.687
    9    H    SER   3           H        SER   3  -1.120  17.906   7.662
   10    HA   SER   3           HA       SER   3  -1.188  19.968   9.767
   11    HB2  SER   3           1HB      SER   3   0.681  19.779   7.392
   12    HB3  SER   3           2HB      SER   3   0.673  21.073   8.590
   13    HG   SER   3           HG       SER   3   1.587  18.454   8.797
   14    H    GLY   4           H        GLY   4  -1.242  19.634   6.211
   15    HA2  GLY   4           1HA      GLY   4  -2.275  22.102   5.555
   16    HA3  GLY   4           2HA      GLY   4  -2.581  20.636   4.635
   17    H    SER   5           H        SER   5  -4.402  22.793   4.936
   18    HA   SER   5           HA       SER   5  -6.579  21.391   6.333
   19    HB2  SER   5           1HB      SER   5  -7.398  23.374   7.308
   20    HB3  SER   5           2HB      SER   5  -5.654  23.464   7.554
   21    HG   SER   5           HG       SER   5  -5.497  24.960   5.961
   22    H    SER   6           H        SER   6  -8.138  20.871   4.964
   23    HA   SER   6           HA       SER   6  -9.435  20.792   3.091
   24    HB2  SER   6           1HB      SER   6  -9.328  23.728   3.731
   25    HB3  SER   6           2HB      SER   6 -10.234  23.145   2.335
   26    HG   SER   6           HG       SER   6 -11.757  22.645   3.675
   27    H    GLY   7           H        GLY   7  -6.662  20.606   2.596
   28    HA2  GLY   7           1HA      GLY   7  -6.647  21.325  -0.205
   29    HA3  GLY   7           2HA      GLY   7  -5.446  22.171   0.761
   30    H    GLY   8           H        GLY   8  -6.502  19.031  -0.407
   31    HA2  GLY   8           1HA      GLY   8  -4.969  17.395  -1.191
   32    HA3  GLY   8           2HA      GLY   8  -3.735  18.094  -0.154
   33    H    GLU   9           H        GLU   9  -6.677  16.146  -0.173
   34    HA   GLU   9           HA       GLU   9  -5.819  14.979   2.395
   35    HB2  GLU   9           1HB      GLU   9  -8.099  16.303   2.125
   36    HB3  GLU   9           2HB      GLU   9  -8.651  14.764   1.478
   37    HG2  GLU   9           1HG      GLU   9  -9.147  14.954   3.845
   38    HG3  GLU   9           2HG      GLU   9  -8.006  13.646   3.537
   39    H    LYS  10           H        LYS  10  -6.584  12.698   2.704
   40    HA   LYS  10           HA       LYS  10  -6.236  11.211   0.189
   41    HB2  LYS  10           1HB      LYS  10  -5.591  10.484   3.046
   42    HB3  LYS  10           2HB      LYS  10  -5.559   9.317   1.730
   43    HG2  LYS  10           1HG      LYS  10  -3.682  10.222   0.785
   44    HG3  LYS  10           2HG      LYS  10  -3.989  11.829   1.449
   45    HD2  LYS  10           1HD      LYS  10  -3.304  11.125   3.635
   46    HD3  LYS  10           2HD      LYS  10  -3.200   9.441   3.114
   47    HE2  LYS  10           1HE      LYS  10  -1.548  11.589   1.825
   48    HE3  LYS  10           2HE      LYS  10  -1.023  10.793   3.307
   49    HZ1  LYS  10           3HZ      LYS  10  -1.334   8.646   2.065
   50    HZ2  LYS  10           1HZ      LYS  10  -0.050   9.614   1.541
   51    HZ3  LYS  10           2HZ      LYS  10  -1.488   9.565   0.653
   52    HA   PRO  11           HA       PRO  11 -10.620  10.436   1.484
   53    HB2  PRO  11           1HB      PRO  11 -11.635  10.628  -1.026
   54    HB3  PRO  11           2HB      PRO  11 -11.399  12.030   0.024
   55    HG2  PRO  11           1HG      PRO  11  -9.674  11.020  -2.204
   56    HG3  PRO  11           2HG      PRO  11 -10.140  12.687  -1.818
   57    HD2  PRO  11           1HD      PRO  11  -7.727  11.658  -1.149
   58    HD3  PRO  11           2HD      PRO  11  -8.550  12.881  -0.161
   59    H    TYR  12           H        TYR  12  -8.205   8.831  -0.046
   60    HA   TYR  12           HA       TYR  12  -9.928   6.530  -0.695
   61    HB2  TYR  12           1HB      TYR  12  -7.240   7.287  -1.857
   62    HB3  TYR  12           2HB      TYR  12  -8.091   5.786  -2.205
   63    HD1  TYR  12           HD1      TYR  12  -8.256   9.466  -2.570
   64    HD2  TYR  12           HD2      TYR  12  -9.827   5.713  -3.815
   65    HE1  TYR  12           HE1      TYR  12  -9.464  10.585  -4.397
   66    HE2  TYR  12           HE2      TYR  12 -11.038   6.821  -5.646
   67    HH   TYR  12           HH       TYR  12 -11.295  10.259  -5.864
   68    HA   PRO  13           HA       PRO  13  -7.499   5.272   2.999
   69    HB2  PRO  13           1HB      PRO  13  -9.480   3.731   4.033
   70    HB3  PRO  13           2HB      PRO  13  -9.380   5.475   4.304
   71    HG2  PRO  13           1HG      PRO  13 -11.060   3.956   2.346
   72    HG3  PRO  13           2HG      PRO  13 -11.506   5.331   3.373
   73    HD2  PRO  13           1HD      PRO  13 -10.906   5.607   0.747
   74    HD3  PRO  13           2HD      PRO  13 -10.551   6.868   1.945
   75    H    CYS  14           H        CYS  14  -6.525   3.296   3.457
   76    HA   CYS  14           HA       CYS  14  -6.524   1.399   1.281
   77    HB2  CYS  14           1HB      CYS  14  -4.402   2.016   2.287
   78    HB3  CYS  14           2HB      CYS  14  -4.964   1.487   3.870
   79    H    GLU  15           H        GLU  15  -6.640  -0.953   1.701
   80    HA   GLU  15           HA       GLU  15  -8.868  -1.522   3.519
   81    HB2  GLU  15           1HB      GLU  15  -9.405  -2.203   1.325
   82    HB3  GLU  15           2HB      GLU  15  -7.813  -2.901   1.062
   83    HG2  GLU  15           1HG      GLU  15  -9.236  -4.729   1.326
   84    HG3  GLU  15           2HG      GLU  15  -8.412  -4.572   2.876
   85    H    ILE  16           H        ILE  16  -5.591  -2.514   2.724
   86    HA   ILE  16           HA       ILE  16  -5.490  -4.748   4.469
   87    HB   ILE  16           HB       ILE  16  -3.224  -3.051   3.416
   88   HG12  ILE  16          1HG1      ILE  16  -3.084  -5.323   1.998
   89   HG13  ILE  16          2HG1      ILE  16  -4.818  -5.298   2.297
   90   HG21  ILE  16          1HG2      ILE  16  -2.030  -5.350   3.805
   91   HG22  ILE  16          2HG2      ILE  16  -2.221  -4.202   5.130
   92   HG23  ILE  16          3HG2      ILE  16  -3.314  -5.579   4.992
   93   HD11  ILE  16          3HD1      ILE  16  -3.969  -2.709   1.451
   94   HD12  ILE  16          1HD1      ILE  16  -3.381  -3.926   0.319
   95   HD13  ILE  16          2HD1      ILE  16  -5.103  -3.819   0.684
   96    H    CYS  17           H        CYS  17  -3.572  -1.772   4.817
   97    HA   CYS  17           HA       CYS  17  -3.682  -2.088   7.716
   98    HB2  CYS  17           1HB      CYS  17  -1.930  -0.340   7.742
   99    HB3  CYS  17           2HB      CYS  17  -1.486  -1.717   6.739
  100    H    GLY  18           H        GLY  18  -4.301   0.423   5.268
  101    HA2  GLY  18           1HA      GLY  18  -6.580   1.505   5.751
  102    HA3  GLY  18           2HA      GLY  18  -5.841   1.910   7.293
  103    H    THR  19           H        THR  19  -3.209   2.285   5.854
  104    HA   THR  19           HA       THR  19  -2.995   4.960   5.742
  105    HB   THR  19           HB       THR  19  -1.678   2.985   3.874
  106    HG1  THR  19           HG1      THR  19  -0.317   4.316   5.915
  107   HG21  THR  19          3HG2      THR  19  -0.107   4.662   3.259
  108   HG22  THR  19          1HG2      THR  19  -0.767   5.805   4.427
  109   HG23  THR  19          2HG2      THR  19  -1.707   5.356   3.004
  110    H    ARG  20           H        ARG  20  -4.192   6.462   4.787
  111    HA   ARG  20           HA       ARG  20  -5.707   5.896   2.403
  112    HB2  ARG  20           1HB      ARG  20  -5.393   8.598   3.696
  113    HB3  ARG  20           2HB      ARG  20  -6.736   8.001   2.730
  114    HG2  ARG  20           1HG      ARG  20  -7.565   6.692   4.466
  115    HG3  ARG  20           2HG      ARG  20  -6.038   6.733   5.349
  116    HD2  ARG  20           1HD      ARG  20  -6.374   8.937   6.057
  117    HD3  ARG  20           2HD      ARG  20  -7.612   9.233   4.837
  118    HE   ARG  20           HE       ARG  20  -8.350   7.190   6.703
  119   HH11  ARG  20          1HH1      ARG  20  -8.233  10.626   6.158
  120   HH12  ARG  20          2HH1      ARG  20  -9.526  10.976   7.257
  121   HH21  ARG  20          1HH2      ARG  20 -10.054   7.637   8.152
  122   HH22  ARG  20          2HH2      ARG  20 -10.561   9.275   8.391
  123    H    PHE  21           H        PHE  21  -5.643   7.321   0.503
  124    HA   PHE  21           HA       PHE  21  -3.009   8.512   0.001
  125    HB2  PHE  21           1HB      PHE  21  -4.413   6.471  -1.724
  126    HB3  PHE  21           2HB      PHE  21  -3.113   7.496  -2.323
  127    HD1  PHE  21           HD2      PHE  21  -3.907   5.017   0.328
  128    HD2  PHE  21           HD1      PHE  21  -0.903   6.846  -2.070
  129    HE1  PHE  21           HE2      PHE  21  -2.253   3.407   1.178
  130    HE2  PHE  21           HE1      PHE  21   0.756   5.237  -1.224
  131    HZ   PHE  21           HZ       PHE  21   0.082   3.515   0.403
  132    H    ARG  22           H        ARG  22  -3.015   9.840  -2.039
  133    HA   ARG  22           HA       ARG  22  -5.257  11.623  -1.966
  134    HB2  ARG  22           1HB      ARG  22  -4.007  12.911  -3.647
  135    HB3  ARG  22           2HB      ARG  22  -2.999  12.488  -2.269
  136    HG2  ARG  22           1HG      ARG  22  -1.835  10.848  -3.493
  137    HG3  ARG  22           2HG      ARG  22  -3.019  10.876  -4.800
  138    HD2  ARG  22           1HD      ARG  22  -1.352  12.140  -5.730
  139    HD3  ARG  22           2HD      ARG  22  -2.309  13.401  -4.952
  140    HE   ARG  22           HE       ARG  22  -0.218  12.349  -3.286
  141   HH11  ARG  22          1HH1      ARG  22  -1.013  14.670  -5.755
  142   HH12  ARG  22          2HH1      ARG  22   0.288  15.741  -5.351
  143   HH21  ARG  22          1HH2      ARG  22   1.499  13.749  -2.745
  144   HH22  ARG  22          2HH2      ARG  22   1.717  15.215  -3.639
  145    H    HIS  23           H        HIS  23  -3.985   9.261  -4.264
  146    HA   HIS  23           HA       HIS  23  -6.501   9.500  -5.779
  147    HB2  HIS  23           1HB      HIS  23  -3.680   9.366  -6.721
  148    HB3  HIS  23           2HB      HIS  23  -4.897   8.521  -7.674
  149    HD2  HIS  23           HD2      HIS  23  -5.381  12.092  -6.063
  150    HE1  HIS  23           HE1      HIS  23  -5.728  12.381 -10.281
  151    HE2  HIS  23           HE2      HIS  23  -5.816  13.631  -8.096
  152    H    LEU  24           H        LEU  24  -7.138   7.516  -6.927
  153    HA   LEU  24           HA       LEU  24  -6.940   5.249  -5.186
  154    HB2  LEU  24           1HB      LEU  24  -9.002   5.860  -6.404
  155    HB3  LEU  24           2HB      LEU  24  -8.195   5.461  -7.919
  156    HG   LEU  24           HG       LEU  24  -9.715   3.687  -7.227
  157   HD11  LEU  24          1HD1      LEU  24  -6.924   2.670  -6.811
  158   HD12  LEU  24          2HD1      LEU  24  -7.474   3.259  -8.379
  159   HD13  LEU  24          3HD1      LEU  24  -8.280   1.886  -7.621
  160   HD21  LEU  24          3HD2      LEU  24  -9.935   3.073  -5.108
  161   HD22  LEU  24          1HD2      LEU  24  -8.700   4.250  -4.658
  162   HD23  LEU  24          2HD2      LEU  24  -8.239   2.590  -5.040
  163    H    GLN  25           H        GLN  25  -6.250   5.594  -8.672
  164    HA   GLN  25           HA       GLN  25  -5.033   3.269  -9.243
  165    HB2  GLN  25           1HB      GLN  25  -3.570   4.499 -10.833
  166    HB3  GLN  25           2HB      GLN  25  -5.257   4.989 -10.916
  167    HG2  GLN  25           1HG      GLN  25  -4.846   7.046  -9.947
  168    HG3  GLN  25           2HG      GLN  25  -3.336   6.510  -9.210
  169   HE21  GLN  25          1HE2      GLN  25  -2.570   8.548 -10.158
  170   HE22  GLN  25          2HE2      GLN  25  -2.014   8.536 -11.793
  171    H    THR  26           H        THR  26  -3.727   5.792  -7.222
  172    HA   THR  26           HA       THR  26  -1.072   4.708  -7.116
  173    HB   THR  26           HB       THR  26  -2.440   6.757  -5.364
  174    HG1  THR  26           HG1      THR  26  -0.673   6.920  -7.587
  175   HG21  THR  26          3HG2      THR  26  -0.630   6.865  -4.051
  176   HG22  THR  26          1HG2      THR  26   0.470   6.787  -5.427
  177   HG23  THR  26          2HG2      THR  26  -0.178   5.302  -4.730
  178    H    LEU  27           H        LEU  27  -3.771   4.870  -4.792
  179    HA   LEU  27           HA       LEU  27  -2.620   3.432  -2.725
  180    HB2  LEU  27           1HB      LEU  27  -4.654   4.521  -2.295
  181    HB3  LEU  27           2HB      LEU  27  -5.462   3.719  -3.640
  182    HG   LEU  27           HG       LEU  27  -5.511   1.633  -2.418
  183   HD11  LEU  27          1HD1      LEU  27  -3.364   1.948  -1.229
  184   HD12  LEU  27          2HD1      LEU  27  -4.673   1.416  -0.174
  185   HD13  LEU  27          3HD1      LEU  27  -4.160   3.103  -0.160
  186   HD21  LEU  27          3HD2      LEU  27  -6.722   2.640  -0.265
  187   HD22  LEU  27          1HD2      LEU  27  -7.449   2.677  -1.872
  188   HD23  LEU  27          2HD2      LEU  27  -6.633   4.108  -1.240
  189    H    LYS  28           H        LYS  28  -4.401   2.243  -5.544
  190    HA   LYS  28           HA       LYS  28  -4.587  -0.440  -4.901
  191    HB2  LYS  28           1HB      LYS  28  -4.453   1.095  -7.446
  192    HB3  LYS  28           2HB      LYS  28  -4.220  -0.646  -7.541
  193    HG2  LYS  28           1HG      LYS  28  -6.372  -0.998  -6.443
  194    HG3  LYS  28           2HG      LYS  28  -6.606   0.748  -6.340
  195    HD2  LYS  28           1HD      LYS  28  -6.679   0.941  -8.729
  196    HD3  LYS  28           2HD      LYS  28  -6.215  -0.751  -8.928
  197    HE2  LYS  28           1HE      LYS  28  -8.666  -0.109  -7.360
  198    HE3  LYS  28           2HE      LYS  28  -8.730   0.016  -9.117
  199    HZ1  LYS  28           3HZ      LYS  28  -7.869  -2.403  -7.624
  200    HZ2  LYS  28           1HZ      LYS  28  -8.049  -2.269  -9.301
  201    HZ3  LYS  28           2HZ      LYS  28  -9.406  -2.178  -8.296
  202    H    SER  29           H        SER  29  -1.834   1.383  -6.070
  203    HA   SER  29           HA       SER  29  -0.220  -0.956  -6.546
  204    HB2  SER  29           1HB      SER  29   0.212   2.001  -6.693
  205    HB3  SER  29           2HB      SER  29   1.618   0.939  -6.612
  206    HG   SER  29           HG       SER  29   0.478  -0.220  -8.413
  207    H    HIS  30           H        HIS  30  -0.926   1.114  -3.885
  208    HA   HIS  30           HA       HIS  30   1.425   0.646  -2.361
  209    HB2  HIS  30           1HB      HIS  30   0.333   2.477  -1.528
  210    HB3  HIS  30           2HB      HIS  30  -1.263   1.808  -1.855
  211    HD1  HIS  30           HD1      HIS  30   1.603   1.149   0.566
  212    HD2  HIS  30           HD2      HIS  30  -2.546   1.034   0.391
  213    HE1  HIS  30           HE1      HIS  30   0.849   0.538   2.886
  214    H    LEU  31           H        LEU  31  -1.356  -1.235  -3.037
  215    HA   LEU  31           HA       LEU  31  -1.308  -2.859  -0.688
  216    HB2  LEU  31           1HB      LEU  31  -2.410  -3.835  -3.280
  217    HB3  LEU  31           2HB      LEU  31  -3.022  -4.065  -1.643
  218    HG   LEU  31           HG       LEU  31  -3.340  -1.689  -3.450
  219   HD11  LEU  31          1HD1      LEU  31  -5.682  -2.376  -2.055
  220   HD12  LEU  31          2HD1      LEU  31  -4.967  -3.887  -2.614
  221   HD13  LEU  31          3HD1      LEU  31  -5.332  -2.605  -3.768
  222   HD21  LEU  31          3HD2      LEU  31  -4.565  -0.780  -1.317
  223   HD22  LEU  31          1HD2      LEU  31  -2.835  -0.520  -1.542
  224   HD23  LEU  31          2HD2      LEU  31  -3.402  -1.803  -0.472
  225    H    ARG  32           H        ARG  32   0.742  -2.628  -3.319
  226    HA   ARG  32           HA       ARG  32   1.405  -5.317  -3.819
  227    HB2  ARG  32           1HB      ARG  32   2.695  -2.681  -4.293
  228    HB3  ARG  32           2HB      ARG  32   3.724  -4.104  -4.374
  229    HG2  ARG  32           1HG      ARG  32   3.038  -3.776  -6.569
  230    HG3  ARG  32           2HG      ARG  32   1.970  -5.051  -5.979
  231    HD2  ARG  32           1HD      ARG  32   0.403  -3.062  -5.358
  232    HD3  ARG  32           2HD      ARG  32   1.370  -2.177  -6.537
  233    HE   ARG  32           HE       ARG  32  -0.639  -4.106  -7.093
  234   HH11  ARG  32          1HH1      ARG  32   2.425  -2.892  -8.215
  235   HH12  ARG  32          2HH1      ARG  32   2.149  -3.348  -9.864
  236   HH21  ARG  32          1HH2      ARG  32  -1.013  -4.711  -9.260
  237   HH22  ARG  32          2HH2      ARG  32   0.193  -4.381 -10.457
  238    H    ILE  33           H        ILE  33   2.741  -2.950  -1.543
  239    HA   ILE  33           HA       ILE  33   4.772  -4.640  -0.524
  240    HB   ILE  33           HB       ILE  33   5.146  -3.022   1.141
  241   HG12  ILE  33          1HG1      ILE  33   2.362  -1.950   0.634
  242   HG13  ILE  33          2HG1      ILE  33   2.815  -2.969   1.996
  243   HG21  ILE  33          1HG2      ILE  33   5.877  -1.759  -0.549
  244   HG22  ILE  33          2HG2      ILE  33   4.460  -2.111  -1.537
  245   HG23  ILE  33          3HG2      ILE  33   4.396  -0.827  -0.331
  246   HD11  ILE  33          3HD1      ILE  33   4.623  -0.952   2.200
  247   HD12  ILE  33          1HD1      ILE  33   3.209  -0.107   1.571
  248   HD13  ILE  33          2HD1      ILE  33   3.089  -1.033   3.068
  249    H    HIS  34           H        HIS  34   1.396  -4.552  -0.044
  250    HA   HIS  34           HA       HIS  34   1.419  -5.751   2.579
  251    HB2  HIS  34           1HB      HIS  34  -0.744  -5.122   0.582
  252    HB3  HIS  34           2HB      HIS  34  -1.079  -6.069   2.028
  253    HD1  HIS  34           HD1      HIS  34   0.538  -4.497   4.099
  254    HD2  HIS  34           HD2      HIS  34  -1.869  -2.729   1.211
  255    HE1  HIS  34           HE1      HIS  34  -0.045  -2.225   5.008
  256    H    THR  35           H        THR  35   0.387  -6.847  -0.654
  257    HA   THR  35           HA       THR  35   0.452  -9.614   0.264
  258    HB   THR  35           HB       THR  35  -1.472  -8.979  -1.067
  259    HG1  THR  35           HG1      THR  35  -1.408 -10.840  -2.092
  260   HG21  THR  35          3HG2      THR  35   0.516  -8.306  -3.240
  261   HG22  THR  35          1HG2      THR  35  -0.470  -7.151  -2.344
  262   HG23  THR  35          2HG2      THR  35  -1.239  -8.319  -3.420
  263    H    GLY  36           H        GLY  36   2.114 -10.938  -0.086
  264    HA2  GLY  36           1HA      GLY  36   3.630 -11.120  -2.414
  265    HA3  GLY  36           2HA      GLY  36   4.499 -10.046  -1.328
  266    H    SER  37           H        SER  37   4.940 -10.903   0.875
  267    HA   SER  37           HA       SER  37   4.800 -13.687   1.400
  268    HB2  SER  37           1HB      SER  37   6.555 -13.645  -0.401
  269    HB3  SER  37           2HB      SER  37   7.558 -12.676   0.677
  270    HG   SER  37           HG       SER  37   6.503 -15.193   1.425
  271    H    GLY  38           H        GLY  38   5.751 -14.264   3.440
  272    HA2  GLY  38           1HA      GLY  38   5.343 -12.657   5.541
  273    HA3  GLY  38           2HA      GLY  38   6.642 -13.841   5.545
  274    HA   PRO  39           HA       PRO  39   8.124  -9.259   5.531
  275    HB2  PRO  39           1HB      PRO  39   8.206  -8.728   8.193
  276    HB3  PRO  39           2HB      PRO  39   6.804  -8.357   7.182
  277    HG2  PRO  39           1HG      PRO  39   7.263 -10.688   9.004
  278    HG3  PRO  39           2HG      PRO  39   5.801  -9.708   8.787
  279    HD2  PRO  39           1HD      PRO  39   6.108 -12.140   7.637
  280    HD3  PRO  39           2HD      PRO  39   5.177 -10.834   6.875
  281    H    SER  40           H        SER  40  10.241  -8.608   6.173
  282    HA   SER  40           HA       SER  40  12.019 -10.835   6.607
  283    HB2  SER  40           1HB      SER  40  12.404  -7.915   6.001
  284    HB3  SER  40           2HB      SER  40  13.770  -8.920   6.487
  285    HG   SER  40           HG       SER  40  13.770  -9.803   4.582
  286    H    SER  41           H        SER  41  11.467  -7.722   8.256
  287    HA   SER  41           HA       SER  41  12.939  -8.638  10.580
  288    HB2  SER  41           1HB      SER  41  13.083  -6.278   9.718
  289    HB3  SER  41           2HB      SER  41  11.414  -6.048  10.239
  290    HG   SER  41           HG       SER  41  12.216  -6.745  12.373
  291    H    GLY  42           H        GLY  42  11.797 -10.213  11.613
  292    HA2  GLY  42           1HA      GLY  42   8.991 -10.193  11.983
  293    HA3  GLY  42           2HA      GLY  42  10.138 -11.189  12.866
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1 -14.228  33.937  -8.818
    2    HA2  GLY   1           1HA      GLY   1 -13.242  33.937 -11.199
    3    HA3  GLY   1           2HA      GLY   1 -12.339  34.820  -9.976
    4    H    SER   2           H        SER   2 -10.252  34.363  -9.850
    5    HA   SER   2           HA       SER   2  -8.869  32.636 -11.438
    6    HB2  SER   2           1HB      SER   2  -8.183  33.562  -8.642
    7    HB3  SER   2           2HB      SER   2  -7.045  32.728  -9.701
    8    HG   SER   2           HG       SER   2  -6.674  34.590 -10.574
    9    H    SER   3           H        SER   3  -9.101  30.523 -11.702
   10    HA   SER   3           HA       SER   3 -10.219  28.812  -9.719
   11    HB2  SER   3           1HB      SER   3 -10.635  28.205 -11.974
   12    HB3  SER   3           2HB      SER   3  -8.926  28.304 -12.398
   13    HG   SER   3           HG       SER   3  -9.338  26.167 -12.147
   14    H    GLY   4           H        GLY   4  -9.110  28.402  -7.908
   15    HA2  GLY   4           1HA      GLY   4  -6.629  26.948  -8.091
   16    HA3  GLY   4           2HA      GLY   4  -6.444  28.549  -7.392
   17    H    SER   5           H        SER   5  -7.708  25.344  -6.941
   18    HA   SER   5           HA       SER   5  -8.223  26.000  -4.114
   19    HB2  SER   5           1HB      SER   5  -9.744  24.135  -5.942
   20    HB3  SER   5           2HB      SER   5  -9.905  24.098  -4.186
   21    HG   SER   5           HG       SER   5 -11.445  25.449  -5.431
   22    H    SER   6           H        SER   6  -6.966  24.957  -2.729
   23    HA   SER   6           HA       SER   6  -5.256  22.815  -3.663
   24    HB2  SER   6           1HB      SER   6  -4.236  24.508  -2.273
   25    HB3  SER   6           2HB      SER   6  -5.435  24.252  -1.006
   26    HG   SER   6           HG       SER   6  -4.553  22.269  -0.579
   27    H    GLY   7           H        GLY   7  -6.479  20.988  -3.923
   28    HA2  GLY   7           1HA      GLY   7  -7.872  19.994  -1.514
   29    HA3  GLY   7           2HA      GLY   7  -8.364  19.613  -3.157
   30    H    GLY   8           H        GLY   8  -5.572  19.291  -0.967
   31    HA2  GLY   8           1HA      GLY   8  -4.850  16.813  -2.378
   32    HA3  GLY   8           2HA      GLY   8  -3.780  17.745  -1.342
   33    H    GLU   9           H        GLU   9  -6.704  15.738  -1.291
   34    HA   GLU   9           HA       GLU   9  -5.962  14.906   1.437
   35    HB2  GLU   9           1HB      GLU   9  -8.632  15.466   0.206
   36    HB3  GLU   9           2HB      GLU   9  -8.511  14.286   1.504
   37    HG2  GLU   9           1HG      GLU   9  -7.355  17.024   1.819
   38    HG3  GLU   9           2HG      GLU   9  -9.074  16.731   2.077
   39    H    LYS  10           H        LYS  10  -6.670  12.695   2.013
   40    HA   LYS  10           HA       LYS  10  -6.343  10.899  -0.293
   41    HB2  LYS  10           1HB      LYS  10  -5.775  10.437   2.641
   42    HB3  LYS  10           2HB      LYS  10  -5.589   9.223   1.382
   43    HG2  LYS  10           1HG      LYS  10  -3.443   9.957   1.537
   44    HG3  LYS  10           2HG      LYS  10  -4.047  11.069   0.306
   45    HD2  LYS  10           1HD      LYS  10  -4.579  12.663   2.202
   46    HD3  LYS  10           2HD      LYS  10  -3.641  11.590   3.244
   47    HE2  LYS  10           1HE      LYS  10  -1.779  11.862   1.490
   48    HE3  LYS  10           2HE      LYS  10  -2.716  13.240   0.914
   49    HZ1  LYS  10           3HZ      LYS  10  -2.021  14.477   2.606
   50    HZ2  LYS  10           1HZ      LYS  10  -0.885  13.269   2.936
   51    HZ3  LYS  10           2HZ      LYS  10  -2.367  13.280   3.749
   52    HA   PRO  11           HA       PRO  11 -10.726  10.322   1.149
   53    HB2  PRO  11           1HB      PRO  11 -11.797  10.322  -1.346
   54    HB3  PRO  11           2HB      PRO  11 -11.525  11.801  -0.417
   55    HG2  PRO  11           1HG      PRO  11  -9.860  10.599  -2.595
   56    HG3  PRO  11           2HG      PRO  11 -10.304  12.295  -2.333
   57    HD2  PRO  11           1HD      PRO  11  -7.884  11.299  -1.638
   58    HD3  PRO  11           2HD      PRO  11  -8.674  12.606  -0.733
   59    H    TYR  12           H        TYR  12  -8.363   8.583  -0.335
   60    HA   TYR  12           HA       TYR  12 -10.117   6.243  -0.708
   61    HB2  TYR  12           1HB      TYR  12  -7.508   6.902  -2.090
   62    HB3  TYR  12           2HB      TYR  12  -8.370   5.377  -2.261
   63    HD1  TYR  12           HD1      TYR  12  -8.555   9.007  -2.938
   64    HD2  TYR  12           HD2      TYR  12 -10.226   5.175  -3.728
   65    HE1  TYR  12           HE1      TYR  12  -9.879   9.970  -4.773
   66    HE2  TYR  12           HE2      TYR  12 -11.554   6.127  -5.566
   67    HH   TYR  12           HH       TYR  12 -10.958   9.103  -6.917
   68    HA   PRO  13           HA       PRO  13  -7.484   5.265   2.923
   69    HB2  PRO  13           1HB      PRO  13  -9.384   3.765   4.153
   70    HB3  PRO  13           2HB      PRO  13  -9.305   5.525   4.300
   71    HG2  PRO  13           1HG      PRO  13 -11.045   3.847   2.533
   72    HG3  PRO  13           2HG      PRO  13 -11.470   5.282   3.485
   73    HD2  PRO  13           1HD      PRO  13 -11.000   5.388   0.820
   74    HD3  PRO  13           2HD      PRO  13 -10.614   6.733   1.912
   75    H    CYS  14           H        CYS  14  -6.364   3.396   3.360
   76    HA   CYS  14           HA       CYS  14  -6.411   1.360   1.348
   77    HB2  CYS  14           1HB      CYS  14  -4.274   1.941   2.218
   78    HB3  CYS  14           2HB      CYS  14  -4.814   1.727   3.880
   79    H    GLU  15           H        GLU  15  -6.508  -0.968   1.868
   80    HA   GLU  15           HA       GLU  15  -8.709  -1.479   3.738
   81    HB2  GLU  15           1HB      GLU  15  -7.801  -3.618   1.904
   82    HB3  GLU  15           2HB      GLU  15  -9.431  -3.133   2.351
   83    HG2  GLU  15           1HG      GLU  15  -7.635  -1.977   0.258
   84    HG3  GLU  15           2HG      GLU  15  -9.273  -2.608   0.093
   85    H    ILE  16           H        ILE  16  -5.467  -2.569   2.876
   86    HA   ILE  16           HA       ILE  16  -5.322  -4.699   4.729
   87    HB   ILE  16           HB       ILE  16  -3.003  -3.072   3.689
   88   HG12  ILE  16          1HG1      ILE  16  -3.030  -5.221   2.081
   89   HG13  ILE  16          2HG1      ILE  16  -4.758  -5.083   2.382
   90   HG21  ILE  16          1HG2      ILE  16  -2.094  -4.439   5.293
   91   HG22  ILE  16          2HG2      ILE  16  -3.290  -5.710   5.043
   92   HG23  ILE  16          3HG2      ILE  16  -1.988  -5.482   3.875
   93   HD11  ILE  16          3HD1      ILE  16  -4.954  -3.310   1.053
   94   HD12  ILE  16          1HD1      ILE  16  -3.501  -2.548   1.700
   95   HD13  ILE  16          2HD1      ILE  16  -3.368  -3.770   0.436
   96    H    CYS  17           H        CYS  17  -3.424  -1.692   4.904
   97    HA   CYS  17           HA       CYS  17  -3.374  -1.914   7.804
   98    HB2  CYS  17           1HB      CYS  17  -1.748  -0.054   7.685
   99    HB3  CYS  17           2HB      CYS  17  -1.276  -1.419   6.678
  100    H    GLY  18           H        GLY  18  -4.405   0.416   5.328
  101    HA2  GLY  18           1HA      GLY  18  -6.661   1.407   5.870
  102    HA3  GLY  18           2HA      GLY  18  -5.948   1.813   7.424
  103    H    THR  19           H        THR  19  -3.349   2.386   5.965
  104    HA   THR  19           HA       THR  19  -3.404   5.109   5.909
  105    HB   THR  19           HB       THR  19  -1.724   3.195   4.303
  106    HG1  THR  19           HG1      THR  19  -1.171   3.217   6.444
  107   HG21  THR  19          3HG2      THR  19  -0.262   5.096   3.745
  108   HG22  THR  19          1HG2      THR  19  -1.448   6.200   4.439
  109   HG23  THR  19          2HG2      THR  19  -1.856   5.254   3.008
  110    H    ARG  20           H        ARG  20  -4.244   6.648   4.654
  111    HA   ARG  20           HA       ARG  20  -5.694   5.858   2.259
  112    HB2  ARG  20           1HB      ARG  20  -5.543   8.625   3.447
  113    HB3  ARG  20           2HB      ARG  20  -6.780   7.969   2.383
  114    HG2  ARG  20           1HG      ARG  20  -7.846   6.869   4.067
  115    HG3  ARG  20           2HG      ARG  20  -6.368   6.647   5.006
  116    HD2  ARG  20           1HD      ARG  20  -7.443   9.400   4.603
  117    HD3  ARG  20           2HD      ARG  20  -8.214   8.342   5.783
  118    HE   ARG  20           HE       ARG  20  -5.349   8.533   6.046
  119   HH11  ARG  20          1HH1      ARG  20  -8.429   9.876   6.959
  120   HH12  ARG  20          2HH1      ARG  20  -7.827  10.604   8.411
  121   HH21  ARG  20          1HH2      ARG  20  -4.546   9.486   7.956
  122   HH22  ARG  20          2HH2      ARG  20  -5.618  10.382   8.977
  123    H    PHE  21           H        PHE  21  -5.494   7.048   0.259
  124    HA   PHE  21           HA       PHE  21  -2.870   8.319  -0.124
  125    HB2  PHE  21           1HB      PHE  21  -4.138   6.168  -1.819
  126    HB3  PHE  21           2HB      PHE  21  -2.820   7.183  -2.395
  127    HD1  PHE  21           HD2      PHE  21  -3.678   5.016   0.518
  128    HD2  PHE  21           HD1      PHE  21  -0.676   6.405  -2.161
  129    HE1  PHE  21           HE2      PHE  21  -2.053   3.484   1.549
  130    HE2  PHE  21           HE1      PHE  21   0.954   4.874  -1.134
  131    HZ   PHE  21           HZ       PHE  21   0.266   3.411   0.724
  132    H    ARG  22           H        ARG  22  -2.853  10.111  -1.376
  133    HA   ARG  22           HA       ARG  22  -4.950  11.739  -1.745
  134    HB2  ARG  22           1HB      ARG  22  -2.512  12.183  -2.313
  135    HB3  ARG  22           2HB      ARG  22  -2.844  11.470  -3.886
  136    HG2  ARG  22           1HG      ARG  22  -4.556  13.182  -4.287
  137    HG3  ARG  22           2HG      ARG  22  -4.174  13.909  -2.725
  138    HD2  ARG  22           1HD      ARG  22  -1.775  14.073  -3.591
  139    HD3  ARG  22           2HD      ARG  22  -2.455  13.733  -5.182
  140    HE   ARG  22           HE       ARG  22  -3.931  15.821  -4.143
  141   HH11  ARG  22          1HH1      ARG  22  -0.606  15.215  -4.978
  142   HH12  ARG  22          2HH1      ARG  22  -0.266  16.868  -5.367
  143   HH21  ARG  22          1HH2      ARG  22  -3.496  18.001  -4.653
  144   HH22  ARG  22          2HH2      ARG  22  -1.910  18.453  -5.181
  145    H    HIS  23           H        HIS  23  -3.842   9.448  -4.243
  146    HA   HIS  23           HA       HIS  23  -6.557   9.543  -5.388
  147    HB2  HIS  23           1HB      HIS  23  -3.871   9.536  -6.704
  148    HB3  HIS  23           2HB      HIS  23  -5.223   8.766  -7.528
  149    HD2  HIS  23           HD2      HIS  23  -5.952  12.047  -5.581
  150    HE1  HIS  23           HE1      HIS  23  -5.976  12.930  -9.730
  151    HE2  HIS  23           HE2      HIS  23  -6.375  13.826  -7.410
  152    H    LEU  24           H        LEU  24  -7.289   7.571  -6.426
  153    HA   LEU  24           HA       LEU  24  -6.753   5.274  -4.839
  154    HB2  LEU  24           1HB      LEU  24  -8.938   5.873  -5.940
  155    HB3  LEU  24           2HB      LEU  24  -8.222   5.354  -7.465
  156    HG   LEU  24           HG       LEU  24  -8.208   3.108  -6.833
  157   HD11  LEU  24          1HD1      LEU  24  -8.247   4.192  -4.068
  158   HD12  LEU  24          2HD1      LEU  24  -7.268   2.902  -4.767
  159   HD13  LEU  24          3HD1      LEU  24  -8.956   2.602  -4.351
  160   HD21  LEU  24          3HD2      LEU  24 -10.492   2.638  -6.069
  161   HD22  LEU  24          1HD2      LEU  24 -10.457   3.900  -7.301
  162   HD23  LEU  24          2HD2      LEU  24 -10.678   4.330  -5.605
  163    H    GLN  25           H        GLN  25  -6.279   5.881  -8.324
  164    HA   GLN  25           HA       GLN  25  -5.077   3.644  -9.179
  165    HB2  GLN  25           1HB      GLN  25  -3.668   5.037 -10.677
  166    HB3  GLN  25           2HB      GLN  25  -5.353   5.538 -10.646
  167    HG2  GLN  25           1HG      GLN  25  -4.900   7.499  -9.562
  168    HG3  GLN  25           2HG      GLN  25  -3.438   6.869  -8.804
  169   HE21  GLN  25          1HE2      GLN  25  -2.653   9.006  -9.562
  170   HE22  GLN  25          2HE2      GLN  25  -1.994   9.101 -11.156
  171    H    THR  26           H        THR  26  -3.686   5.950  -6.958
  172    HA   THR  26           HA       THR  26  -1.054   4.774  -7.039
  173    HB   THR  26           HB       THR  26  -2.223   6.782  -5.102
  174    HG1  THR  26           HG1      THR  26  -0.380   7.286  -7.200
  175   HG21  THR  26          3HG2      THR  26   0.697   6.532  -5.568
  176   HG22  THR  26          1HG2      THR  26  -0.071   5.295  -4.575
  177   HG23  THR  26          2HG2      THR  26  -0.181   6.993  -4.110
  178    H    LEU  27           H        LEU  27  -3.814   4.769  -4.819
  179    HA   LEU  27           HA       LEU  27  -2.676   3.348  -2.715
  180    HB2  LEU  27           1HB      LEU  27  -4.802   4.388  -2.441
  181    HB3  LEU  27           2HB      LEU  27  -5.503   3.431  -3.745
  182    HG   LEU  27           HG       LEU  27  -5.403   1.435  -2.379
  183   HD11  LEU  27          1HD1      LEU  27  -3.363   1.901  -1.149
  184   HD12  LEU  27          2HD1      LEU  27  -4.684   1.539  -0.039
  185   HD13  LEU  27          3HD1      LEU  27  -4.166   3.208  -0.278
  186   HD21  LEU  27          3HD2      LEU  27  -7.031   3.660  -1.906
  187   HD22  LEU  27          1HD2      LEU  27  -6.589   3.045  -0.313
  188   HD23  LEU  27          2HD2      LEU  27  -7.362   1.979  -1.486
  189    H    LYS  28           H        LYS  28  -4.327   2.153  -5.617
  190    HA   LYS  28           HA       LYS  28  -4.374  -0.555  -5.040
  191    HB2  LYS  28           1HB      LYS  28  -4.052   0.900  -7.662
  192    HB3  LYS  28           2HB      LYS  28  -4.226  -0.848  -7.566
  193    HG2  LYS  28           1HG      LYS  28  -6.417  -0.714  -6.806
  194    HG3  LYS  28           2HG      LYS  28  -6.238   0.965  -6.293
  195    HD2  LYS  28           1HD      LYS  28  -6.357   1.769  -8.484
  196    HD3  LYS  28           2HD      LYS  28  -5.986   0.190  -9.181
  197    HE2  LYS  28           1HE      LYS  28  -8.177  -0.622  -8.283
  198    HE3  LYS  28           2HE      LYS  28  -8.540   1.041  -7.824
  199    HZ1  LYS  28           3HZ      LYS  28  -9.534   0.573  -9.934
  200    HZ2  LYS  28           1HZ      LYS  28  -8.065   0.025 -10.573
  201    HZ3  LYS  28           2HZ      LYS  28  -8.260   1.659 -10.181
  202    H    SER  29           H        SER  29  -1.717   1.454  -6.112
  203    HA   SER  29           HA       SER  29   0.028  -0.777  -6.650
  204    HB2  SER  29           1HB      SER  29   0.303   2.204  -6.695
  205    HB3  SER  29           2HB      SER  29   1.759   1.211  -6.650
  206    HG   SER  29           HG       SER  29  -0.241   1.343  -8.629
  207    H    HIS  30           H        HIS  30  -0.887   1.060  -3.915
  208    HA   HIS  30           HA       HIS  30   1.509   0.654  -2.391
  209    HB2  HIS  30           1HB      HIS  30   0.388   2.485  -1.574
  210    HB3  HIS  30           2HB      HIS  30  -1.199   1.781  -1.872
  211    HD1  HIS  30           HD1      HIS  30   1.722   1.202   0.502
  212    HD2  HIS  30           HD2      HIS  30  -2.425   0.969   0.394
  213    HE1  HIS  30           HE1      HIS  30   1.023   0.576   2.835
  214    H    LEU  31           H        LEU  31  -1.439  -1.101  -2.941
  215    HA   LEU  31           HA       LEU  31  -1.260  -2.813  -0.673
  216    HB2  LEU  31           1HB      LEU  31  -2.606  -3.636  -3.206
  217    HB3  LEU  31           2HB      LEU  31  -3.085  -3.935  -1.537
  218    HG   LEU  31           HG       LEU  31  -3.488  -1.472  -3.201
  219   HD11  LEU  31          1HD1      LEU  31  -5.523  -2.341  -3.343
  220   HD12  LEU  31          2HD1      LEU  31  -5.701  -2.092  -1.607
  221   HD13  LEU  31          3HD1      LEU  31  -5.104  -3.635  -2.219
  222   HD21  LEU  31          3HD2      LEU  31  -2.642  -0.487  -1.260
  223   HD22  LEU  31          1HD2      LEU  31  -3.381  -1.698  -0.211
  224   HD23  LEU  31          2HD2      LEU  31  -4.388  -0.490  -1.010
  225    H    ARG  32           H        ARG  32   0.678  -2.549  -3.340
  226    HA   ARG  32           HA       ARG  32   1.154  -5.259  -4.008
  227    HB2  ARG  32           1HB      ARG  32   2.653  -2.696  -4.420
  228    HB3  ARG  32           2HB      ARG  32   3.420  -4.231  -4.803
  229    HG2  ARG  32           1HG      ARG  32   2.326  -3.093  -6.732
  230    HG3  ARG  32           2HG      ARG  32   1.770  -4.742  -6.436
  231    HD2  ARG  32           1HD      ARG  32   0.308  -2.451  -5.201
  232    HD3  ARG  32           2HD      ARG  32   0.054  -2.822  -6.906
  233    HE   ARG  32           HE       ARG  32  -1.007  -4.236  -4.699
  234   HH11  ARG  32          1HH1      ARG  32   0.334  -4.724  -7.874
  235   HH12  ARG  32          2HH1      ARG  32  -0.534  -6.198  -8.156
  236   HH21  ARG  32          1HH2      ARG  32  -2.154  -6.174  -5.058
  237   HH22  ARG  32          2HH2      ARG  32  -1.949  -7.021  -6.554
  238    H    ILE  33           H        ILE  33   2.501  -3.093  -1.594
  239    HA   ILE  33           HA       ILE  33   4.616  -4.868  -0.822
  240    HB   ILE  33           HB       ILE  33   5.147  -3.326   0.875
  241   HG12  ILE  33          1HG1      ILE  33   2.370  -2.168   0.554
  242   HG13  ILE  33          2HG1      ILE  33   2.907  -3.183   1.888
  243   HG21  ILE  33          1HG2      ILE  33   4.339  -2.279  -1.729
  244   HG22  ILE  33          2HG2      ILE  33   4.450  -1.049  -0.471
  245   HG23  ILE  33          3HG2      ILE  33   5.845  -2.064  -0.836
  246   HD11  ILE  33          3HD1      ILE  33   3.270  -1.235   2.916
  247   HD12  ILE  33          1HD1      ILE  33   4.751  -1.199   1.960
  248   HD13  ILE  33          2HD1      ILE  33   3.321  -0.330   1.403
  249    H    HIS  34           H        HIS  34   1.298  -4.376   0.108
  250    HA   HIS  34           HA       HIS  34   1.393  -5.711   2.607
  251    HB2  HIS  34           1HB      HIS  34  -0.819  -5.013   0.695
  252    HB3  HIS  34           2HB      HIS  34  -1.138  -5.997   2.121
  253    HD1  HIS  34           HD1      HIS  34   0.239  -4.651   4.340
  254    HD2  HIS  34           HD2      HIS  34  -1.547  -2.487   1.276
  255    HE1  HIS  34           HE1      HIS  34  -0.188  -2.363   5.293
  256    H    THR  35           H        THR  35   0.128  -6.813  -0.543
  257    HA   THR  35           HA       THR  35   0.456  -9.585   0.376
  258    HB   THR  35           HB       THR  35  -1.800  -8.887  -0.441
  259    HG1  THR  35           HG1      THR  35  -1.215 -11.075  -0.569
  260   HG21  THR  35          3HG2      THR  35  -0.775  -7.406  -2.274
  261   HG22  THR  35          1HG2      THR  35  -2.214  -8.341  -2.682
  262   HG23  THR  35          2HG2      THR  35  -0.624  -8.896  -3.205
  263    H    GLY  36           H        GLY  36   2.089 -10.757  -0.383
  264    HA2  GLY  36           1HA      GLY  36   3.077 -10.275  -3.094
  265    HA3  GLY  36           2HA      GLY  36   4.225 -10.097  -1.776
  266    H    SER  37           H        SER  37   3.919 -12.045  -4.087
  267    HA   SER  37           HA       SER  37   4.213 -14.484  -2.464
  268    HB2  SER  37           1HB      SER  37   2.771 -14.150  -5.095
  269    HB3  SER  37           2HB      SER  37   3.301 -15.723  -4.498
  270    HG   SER  37           HG       SER  37   2.085 -14.815  -2.481
  271    H    GLY  38           H        GLY  38   6.328 -12.795  -3.162
  272    HA2  GLY  38           1HA      GLY  38   7.680 -14.293  -5.317
  273    HA3  GLY  38           2HA      GLY  38   8.079 -12.648  -4.844
  274    HA   PRO  39           HA       PRO  39  10.853 -15.834  -2.718
  275    HB2  PRO  39           1HB      PRO  39  13.167 -15.150  -3.962
  276    HB3  PRO  39           2HB      PRO  39  12.069 -16.386  -4.588
  277    HG2  PRO  39           1HG      PRO  39  12.359 -13.520  -5.405
  278    HG3  PRO  39           2HG      PRO  39  12.161 -14.959  -6.422
  279    HD2  PRO  39           1HD      PRO  39  10.108 -13.291  -5.845
  280    HD3  PRO  39           2HD      PRO  39   9.881 -15.034  -6.092
  281    H    SER  40           H        SER  40  11.239 -15.043  -0.750
  282    HA   SER  40           HA       SER  40  11.624 -12.344  -0.123
  283    HB2  SER  40           1HB      SER  40  12.043 -13.058   2.110
  284    HB3  SER  40           2HB      SER  40  10.896 -14.218   1.440
  285    HG   SER  40           HG       SER  40  13.087 -15.314   0.853
  286    H    SER  41           H        SER  41  13.651 -11.709   1.286
  287    HA   SER  41           HA       SER  41  15.747 -11.125  -0.314
  288    HB2  SER  41           1HB      SER  41  17.146 -10.938   1.746
  289    HB3  SER  41           2HB      SER  41  15.565 -10.175   1.907
  290    HG   SER  41           HG       SER  41  16.466 -12.619   2.997
  291    H    GLY  42           H        GLY  42  17.983 -11.930  -0.398
  292    HA2  GLY  42           1HA      GLY  42  18.060 -14.655  -1.161
  293    HA3  GLY  42           2HA      GLY  42  19.450 -13.591  -1.004
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1  -1.714  21.873 -10.520
    2    HA2  GLY   1           1HA      GLY   1  -3.316  22.031 -12.439
    3    HA3  GLY   1           2HA      GLY   1  -3.531  20.298 -12.239
    4    H    SER   2           H        SER   2  -5.813  20.838 -12.043
    5    HA   SER   2           HA       SER   2  -6.488  21.773  -9.330
    6    HB2  SER   2           1HB      SER   2  -7.214  23.161 -11.438
    7    HB3  SER   2           2HB      SER   2  -8.460  21.922 -11.583
    8    HG   SER   2           HG       SER   2  -9.471  22.796  -9.967
    9    H    SER   3           H        SER   3  -8.081  20.665  -8.196
   10    HA   SER   3           HA       SER   3  -8.447  17.906  -9.036
   11    HB2  SER   3           1HB      SER   3  -9.130  17.466  -6.782
   12    HB3  SER   3           2HB      SER   3  -7.741  18.549  -6.694
   13    HG   SER   3           HG       SER   3 -10.477  19.169  -6.330
   14    H    GLY   4           H        GLY   4 -10.645  16.903  -8.531
   15    HA2  GLY   4           1HA      GLY   4 -12.605  18.254 -10.119
   16    HA3  GLY   4           2HA      GLY   4 -12.809  16.711  -9.304
   17    H    SER   5           H        SER   5 -15.007  17.870  -9.108
   18    HA   SER   5           HA       SER   5 -15.319  19.981  -7.261
   19    HB2  SER   5           1HB      SER   5 -17.046  19.309  -8.920
   20    HB3  SER   5           2HB      SER   5 -17.331  17.838  -7.989
   21    HG   SER   5           HG       SER   5 -17.493  20.350  -6.737
   22    H    SER   6           H        SER   6 -15.610  16.460  -6.897
   23    HA   SER   6           HA       SER   6 -15.545  16.835  -3.975
   24    HB2  SER   6           1HB      SER   6 -16.692  14.696  -3.771
   25    HB3  SER   6           2HB      SER   6 -17.607  15.755  -4.844
   26    HG   SER   6           HG       SER   6 -17.436  13.695  -5.750
   27    H    GLY   7           H        GLY   7 -13.498  16.606  -3.318
   28    HA2  GLY   7           1HA      GLY   7 -12.073  14.168  -4.163
   29    HA3  GLY   7           2HA      GLY   7 -11.252  15.721  -4.170
   30    H    GLY   8           H        GLY   8 -10.282  16.406  -2.350
   31    HA2  GLY   8           1HA      GLY   8 -10.347  16.614   0.089
   32    HA3  GLY   8           2HA      GLY   8 -10.909  14.950   0.143
   33    H    GLU   9           H        GLU   9  -8.911  15.327   1.743
   34    HA   GLU   9           HA       GLU   9  -6.391  14.841   0.354
   35    HB2  GLU   9           1HB      GLU   9  -7.110  15.438   3.213
   36    HB3  GLU   9           2HB      GLU   9  -5.510  14.856   2.776
   37    HG2  GLU   9           1HG      GLU   9  -4.943  16.791   1.700
   38    HG3  GLU   9           2HG      GLU   9  -6.615  17.201   1.322
   39    H    LYS  10           H        LYS  10  -6.316  12.781  -0.359
   40    HA   LYS  10           HA       LYS  10  -6.106  10.517  -0.311
   41    HB2  LYS  10           1HB      LYS  10  -5.964  10.725   2.694
   42    HB3  LYS  10           2HB      LYS  10  -5.273   9.478   1.665
   43    HG2  LYS  10           1HG      LYS  10  -3.542  10.849   0.948
   44    HG3  LYS  10           2HG      LYS  10  -4.389  12.325   1.417
   45    HD2  LYS  10           1HD      LYS  10  -2.801  12.121   3.088
   46    HD3  LYS  10           2HD      LYS  10  -4.210  11.353   3.821
   47    HE2  LYS  10           1HE      LYS  10  -2.265   9.989   4.219
   48    HE3  LYS  10           2HE      LYS  10  -3.338   9.155   3.097
   49    HZ1  LYS  10           3HZ      LYS  10  -0.658  10.129   2.693
   50    HZ2  LYS  10           1HZ      LYS  10  -1.722  10.542   1.444
   51    HZ3  LYS  10           2HZ      LYS  10  -1.505   8.919   1.869
   52    HA   PRO  11           HA       PRO  11 -10.593  10.344   1.170
   53    HB2  PRO  11           1HB      PRO  11 -11.745  10.320  -1.288
   54    HB3  PRO  11           2HB      PRO  11 -11.408  11.810  -0.400
   55    HG2  PRO  11           1HG      PRO  11  -9.844  10.524  -2.605
   56    HG3  PRO  11           2HG      PRO  11 -10.239  12.236  -2.365
   57    HD2  PRO  11           1HD      PRO  11  -7.822  11.196  -1.727
   58    HD3  PRO  11           2HD      PRO  11  -8.551  12.540  -0.825
   59    H    TYR  12           H        TYR  12  -8.318   8.515  -0.330
   60    HA   TYR  12           HA       TYR  12 -10.138   6.213  -0.608
   61    HB2  TYR  12           1HB      TYR  12  -7.558   6.780  -2.080
   62    HB3  TYR  12           2HB      TYR  12  -8.457   5.271  -2.190
   63    HD1  TYR  12           HD1      TYR  12  -8.582   8.888  -2.946
   64    HD2  TYR  12           HD2      TYR  12 -10.363   5.079  -3.594
   65    HE1  TYR  12           HE1      TYR  12  -9.939   9.839  -4.763
   66    HE2  TYR  12           HE2      TYR  12 -11.725   6.019  -5.414
   67    HH   TYR  12           HH       TYR  12 -12.605   8.360  -6.032
   68    HA   PRO  13           HA       PRO  13  -7.407   5.263   2.964
   69    HB2  PRO  13           1HB      PRO  13  -9.310   3.875   4.314
   70    HB3  PRO  13           2HB      PRO  13  -9.161   5.634   4.400
   71    HG2  PRO  13           1HG      PRO  13 -11.030   3.970   2.757
   72    HG3  PRO  13           2HG      PRO  13 -11.364   5.448   3.677
   73    HD2  PRO  13           1HD      PRO  13 -10.996   5.453   0.994
   74    HD3  PRO  13           2HD      PRO  13 -10.518   6.817   2.026
   75    H    CYS  14           H        CYS  14  -6.130   3.519   3.020
   76    HA   CYS  14           HA       CYS  14  -6.332   1.418   1.202
   77    HB2  CYS  14           1HB      CYS  14  -4.206   1.968   2.189
   78    HB3  CYS  14           2HB      CYS  14  -4.809   1.613   3.805
   79    H    GLU  15           H        GLU  15  -6.535  -0.910   1.695
   80    HA   GLU  15           HA       GLU  15  -8.796  -1.350   3.512
   81    HB2  GLU  15           1HB      GLU  15  -9.391  -2.074   1.363
   82    HB3  GLU  15           2HB      GLU  15  -7.809  -2.779   1.062
   83    HG2  GLU  15           1HG      GLU  15  -8.293  -4.702   2.174
   84    HG3  GLU  15           2HG      GLU  15  -9.429  -3.915   3.269
   85    H    ILE  16           H        ILE  16  -5.569  -2.508   2.724
   86    HA   ILE  16           HA       ILE  16  -5.548  -4.705   4.510
   87    HB   ILE  16           HB       ILE  16  -3.212  -3.100   3.466
   88   HG12  ILE  16          1HG1      ILE  16  -3.145  -5.361   2.037
   89   HG13  ILE  16          2HG1      ILE  16  -4.879  -5.290   2.333
   90   HG21  ILE  16          1HG2      ILE  16  -3.382  -5.761   4.855
   91   HG22  ILE  16          2HG2      ILE  16  -1.983  -5.268   3.902
   92   HG23  ILE  16          3HG2      ILE  16  -2.451  -4.340   5.326
   93   HD11  ILE  16          3HD1      ILE  16  -4.013  -2.717   1.511
   94   HD12  ILE  16          1HD1      ILE  16  -3.365  -3.913   0.389
   95   HD13  ILE  16          2HD1      ILE  16  -5.101  -3.835   0.690
   96    H    CYS  17           H        CYS  17  -3.571  -1.761   4.827
   97    HA   CYS  17           HA       CYS  17  -3.647  -2.058   7.724
   98    HB2  CYS  17           1HB      CYS  17  -1.899  -0.327   7.734
   99    HB3  CYS  17           2HB      CYS  17  -1.476  -1.663   6.670
  100    H    GLY  18           H        GLY  18  -4.369   0.415   5.271
  101    HA2  GLY  18           1HA      GLY  18  -6.635   1.484   5.787
  102    HA3  GLY  18           2HA      GLY  18  -5.885   1.894   7.323
  103    H    THR  19           H        THR  19  -3.269   2.351   5.963
  104    HA   THR  19           HA       THR  19  -3.134   5.026   5.810
  105    HB   THR  19           HB       THR  19  -1.698   3.052   4.035
  106    HG1  THR  19           HG1      THR  19  -0.900   4.500   6.361
  107   HG21  THR  19          3HG2      THR  19  -1.188   6.005   4.403
  108   HG22  THR  19          1HG2      THR  19  -1.634   5.186   2.907
  109   HG23  THR  19          2HG2      THR  19  -0.061   4.881   3.643
  110    H    ARG  20           H        ARG  20  -4.067   6.590   4.674
  111    HA   ARG  20           HA       ARG  20  -5.638   5.927   2.330
  112    HB2  ARG  20           1HB      ARG  20  -5.266   8.680   3.491
  113    HB3  ARG  20           2HB      ARG  20  -6.617   8.067   2.546
  114    HG2  ARG  20           1HG      ARG  20  -7.306   6.657   4.391
  115    HG3  ARG  20           2HG      ARG  20  -5.911   7.183   5.336
  116    HD2  ARG  20           1HD      ARG  20  -7.597   8.534   6.157
  117    HD3  ARG  20           2HD      ARG  20  -6.858   9.564   4.931
  118    HE   ARG  20           HE       ARG  20  -8.805   8.391   3.533
  119   HH11  ARG  20          1HH1      ARG  20  -8.824   9.894   6.673
  120   HH12  ARG  20          2HH1      ARG  20 -10.475  10.410   6.560
  121   HH21  ARG  20          1HH2      ARG  20 -10.978   9.063   3.373
  122   HH22  ARG  20          2HH2      ARG  20 -11.699   9.936   4.683
  123    H    PHE  21           H        PHE  21  -5.541   7.405   0.413
  124    HA   PHE  21           HA       PHE  21  -2.879   8.486  -0.119
  125    HB2  PHE  21           1HB      PHE  21  -4.227   6.351  -1.777
  126    HB3  PHE  21           2HB      PHE  21  -2.880   7.323  -2.360
  127    HD1  PHE  21           HD2      PHE  21  -3.829   5.082   0.457
  128    HD2  PHE  21           HD1      PHE  21  -0.722   6.580  -2.037
  129    HE1  PHE  21           HE2      PHE  21  -2.249   3.498   1.480
  130    HE2  PHE  21           HE1      PHE  21   0.863   4.997  -1.019
  131    HZ   PHE  21           HZ       PHE  21   0.101   3.454   0.743
  132    H    ARG  22           H        ARG  22  -2.968  10.359  -1.187
  133    HA   ARG  22           HA       ARG  22  -5.118  11.901  -1.583
  134    HB2  ARG  22           1HB      ARG  22  -3.835  12.876  -3.621
  135    HB3  ARG  22           2HB      ARG  22  -3.099  12.958  -2.026
  136    HG2  ARG  22           1HG      ARG  22  -1.310  12.164  -3.135
  137    HG3  ARG  22           2HG      ARG  22  -2.102  10.613  -2.852
  138    HD2  ARG  22           1HD      ARG  22  -3.055  10.622  -5.043
  139    HD3  ARG  22           2HD      ARG  22  -2.528  12.281  -5.323
  140    HE   ARG  22           HE       ARG  22  -0.977   9.906  -5.659
  141   HH11  ARG  22          1HH1      ARG  22  -0.807  13.289  -4.857
  142   HH12  ARG  22          2HH1      ARG  22   0.837  13.464  -5.377
  143   HH21  ARG  22          1HH2      ARG  22   1.187  10.122  -6.347
  144   HH22  ARG  22          2HH2      ARG  22   1.969  11.662  -6.225
  145    H    HIS  23           H        HIS  23  -4.020   9.392  -3.802
  146    HA   HIS  23           HA       HIS  23  -6.593   9.621  -5.212
  147    HB2  HIS  23           1HB      HIS  23  -3.837   9.310  -6.385
  148    HB3  HIS  23           2HB      HIS  23  -5.277   8.821  -7.272
  149    HD2  HIS  23           HD2      HIS  23  -4.831  12.192  -5.254
  150    HE1  HIS  23           HE1      HIS  23  -5.683  13.064  -9.318
  151    HE2  HIS  23           HE2      HIS  23  -5.213  14.026  -7.038
  152    H    LEU  24           H        LEU  24  -7.035   7.573  -6.527
  153    HA   LEU  24           HA       LEU  24  -6.696   5.314  -4.736
  154    HB2  LEU  24           1HB      LEU  24  -8.894   5.890  -5.732
  155    HB3  LEU  24           2HB      LEU  24  -8.237   5.499  -7.320
  156    HG   LEU  24           HG       LEU  24  -8.213   3.217  -6.888
  157   HD11  LEU  24          1HD1      LEU  24  -7.062   3.009  -4.874
  158   HD12  LEU  24          2HD1      LEU  24  -8.664   2.368  -4.509
  159   HD13  LEU  24          3HD1      LEU  24  -8.228   3.998  -3.994
  160   HD21  LEU  24          3HD2      LEU  24 -10.441   2.689  -5.907
  161   HD22  LEU  24          1HD2      LEU  24 -10.481   3.939  -7.150
  162   HD23  LEU  24          2HD2      LEU  24 -10.589   4.386  -5.447
  163    H    GLN  25           H        GLN  25  -6.284   5.856  -8.240
  164    HA   GLN  25           HA       GLN  25  -5.151   3.589  -9.093
  165    HB2  GLN  25           1HB      GLN  25  -3.559   5.085 -10.481
  166    HB3  GLN  25           2HB      GLN  25  -5.295   5.267 -10.701
  167    HG2  GLN  25           1HG      GLN  25  -4.400   7.441 -10.614
  168    HG3  GLN  25           2HG      GLN  25  -5.194   7.170  -9.064
  169   HE21  GLN  25          1HE2      GLN  25  -2.015   6.275 -10.358
  170   HE22  GLN  25          2HE2      GLN  25  -1.102   6.997  -9.083
  171    H    THR  26           H        THR  26  -3.527   6.005  -7.104
  172    HA   THR  26           HA       THR  26  -0.983   4.699  -7.158
  173    HB   THR  26           HB       THR  26  -2.094   6.843  -5.343
  174    HG1  THR  26           HG1      THR  26  -0.508   8.084  -6.597
  175   HG21  THR  26          3HG2      THR  26  -0.335   6.628  -3.993
  176   HG22  THR  26          1HG2      THR  26   0.769   6.724  -5.364
  177   HG23  THR  26          2HG2      THR  26   0.120   5.163  -4.863
  178    H    LEU  27           H        LEU  27  -3.705   4.779  -4.900
  179    HA   LEU  27           HA       LEU  27  -2.521   3.351  -2.802
  180    HB2  LEU  27           1HB      LEU  27  -4.539   4.461  -2.348
  181    HB3  LEU  27           2HB      LEU  27  -5.363   3.691  -3.702
  182    HG   LEU  27           HG       LEU  27  -5.359   1.562  -2.494
  183   HD11  LEU  27          1HD1      LEU  27  -4.086   3.142  -0.264
  184   HD12  LEU  27          2HD1      LEU  27  -3.324   1.856  -1.200
  185   HD13  LEU  27          3HD1      LEU  27  -4.685   1.487  -0.141
  186   HD21  LEU  27          3HD2      LEU  27  -7.359   2.527  -2.051
  187   HD22  LEU  27          1HD2      LEU  27  -6.633   4.008  -1.425
  188   HD23  LEU  27          2HD2      LEU  27  -6.706   2.565  -0.413
  189    H    LYS  28           H        LYS  28  -4.638   2.161  -5.413
  190    HA   LYS  28           HA       LYS  28  -4.747  -0.493  -4.871
  191    HB2  LYS  28           1HB      LYS  28  -4.379   0.863  -7.542
  192    HB3  LYS  28           2HB      LYS  28  -4.726  -0.854  -7.382
  193    HG2  LYS  28           1HG      LYS  28  -6.873  -0.489  -6.630
  194    HG3  LYS  28           2HG      LYS  28  -6.509   1.143  -6.064
  195    HD2  LYS  28           1HD      LYS  28  -6.731   2.063  -8.153
  196    HD3  LYS  28           2HD      LYS  28  -6.278   0.569  -8.977
  197    HE2  LYS  28           1HE      LYS  28  -8.461  -0.401  -8.258
  198    HE3  LYS  28           2HE      LYS  28  -8.903   1.184  -7.625
  199    HZ1  LYS  28           3HZ      LYS  28  -9.504   1.827  -9.643
  200    HZ2  LYS  28           1HZ      LYS  28  -9.221   0.259 -10.214
  201    HZ3  LYS  28           2HZ      LYS  28  -7.995   1.421 -10.291
  202    H    SER  29           H        SER  29  -1.990   1.269  -6.139
  203    HA   SER  29           HA       SER  29  -0.440  -1.101  -6.649
  204    HB2  SER  29           1HB      SER  29  -0.055   0.902  -7.990
  205    HB3  SER  29           2HB      SER  29   0.369   1.816  -6.543
  206    HG   SER  29           HG       SER  29   2.223   0.660  -6.347
  207    H    HIS  30           H        HIS  30  -0.871   1.147  -4.022
  208    HA   HIS  30           HA       HIS  30   1.459   0.569  -2.556
  209    HB2  HIS  30           1HB      HIS  30   0.431   2.434  -1.711
  210    HB3  HIS  30           2HB      HIS  30  -1.188   1.784  -1.955
  211    HD1  HIS  30           HD1      HIS  30   1.766   1.303   0.384
  212    HD2  HIS  30           HD2      HIS  30  -2.365   0.870   0.314
  213    HE1  HIS  30           HE1      HIS  30   1.115   0.685   2.733
  214    H    LEU  31           H        LEU  31  -1.468  -1.195  -3.029
  215    HA   LEU  31           HA       LEU  31  -1.360  -2.813  -0.701
  216    HB2  LEU  31           1HB      LEU  31  -2.543  -3.754  -3.280
  217    HB3  LEU  31           2HB      LEU  31  -3.094  -4.042  -1.631
  218    HG   LEU  31           HG       LEU  31  -3.486  -1.613  -3.348
  219   HD11  LEU  31          1HD1      LEU  31  -5.161  -3.352  -3.509
  220   HD12  LEU  31          2HD1      LEU  31  -5.827  -1.949  -2.674
  221   HD13  LEU  31          3HD1      LEU  31  -5.343  -3.374  -1.755
  222   HD21  LEU  31          3HD2      LEU  31  -3.648  -1.815  -0.350
  223   HD22  LEU  31          1HD2      LEU  31  -4.505  -0.584  -1.278
  224   HD23  LEU  31          2HD2      LEU  31  -2.743  -0.651  -1.319
  225    H    ARG  32           H        ARG  32   0.719  -2.627  -3.268
  226    HA   ARG  32           HA       ARG  32   1.292  -5.351  -3.779
  227    HB2  ARG  32           1HB      ARG  32   2.623  -2.748  -4.311
  228    HB3  ARG  32           2HB      ARG  32   3.627  -4.189  -4.380
  229    HG2  ARG  32           1HG      ARG  32   2.894  -3.813  -6.577
  230    HG3  ARG  32           2HG      ARG  32   1.912  -5.148  -5.971
  231    HD2  ARG  32           1HD      ARG  32   0.258  -3.248  -5.294
  232    HD3  ARG  32           2HD      ARG  32   1.144  -2.309  -6.496
  233    HE   ARG  32           HE       ARG  32   0.069  -3.486  -8.126
  234   HH11  ARG  32          1HH1      ARG  32  -0.106  -5.289  -5.153
  235   HH12  ARG  32          2HH1      ARG  32  -1.149  -6.510  -5.803
  236   HH21  ARG  32          1HH2      ARG  32  -1.303  -5.088  -8.994
  237   HH22  ARG  32          2HH2      ARG  32  -1.828  -6.396  -7.988
  238    H    ILE  33           H        ILE  33   2.794  -2.963  -1.619
  239    HA   ILE  33           HA       ILE  33   4.786  -4.658  -0.588
  240    HB   ILE  33           HB       ILE  33   5.137  -3.048   1.117
  241   HG12  ILE  33          1HG1      ILE  33   2.440  -1.840   0.479
  242   HG13  ILE  33          2HG1      ILE  33   2.723  -2.949   1.817
  243   HG21  ILE  33          1HG2      ILE  33   5.964  -1.847  -0.577
  244   HG22  ILE  33          2HG2      ILE  33   4.562  -2.159  -1.599
  245   HG23  ILE  33          3HG2      ILE  33   4.514  -0.859  -0.410
  246   HD11  ILE  33          3HD1      ILE  33   3.377  -0.106   1.545
  247   HD12  ILE  33          1HD1      ILE  33   3.010  -1.060   2.982
  248   HD13  ILE  33          2HD1      ILE  33   4.631  -1.099   2.287
  249    H    HIS  34           H        HIS  34   1.407  -4.451   0.037
  250    HA   HIS  34           HA       HIS  34   1.479  -5.694   2.624
  251    HB2  HIS  34           1HB      HIS  34  -0.717  -5.042   0.673
  252    HB3  HIS  34           2HB      HIS  34  -1.034  -5.999   2.117
  253    HD1  HIS  34           HD1      HIS  34   0.472  -4.525   4.251
  254    HD2  HIS  34           HD2      HIS  34  -1.651  -2.576   1.258
  255    HE1  HIS  34           HE1      HIS  34  -0.036  -2.238   5.167
  256    H    THR  35           H        THR  35   0.450  -6.780  -0.612
  257    HA   THR  35           HA       THR  35   0.624  -9.557   0.323
  258    HB   THR  35           HB       THR  35  -1.494  -8.856  -0.762
  259    HG1  THR  35           HG1      THR  35   0.132 -10.929  -1.629
  260   HG21  THR  35          3HG2      THR  35  -0.378  -7.266  -2.369
  261   HG22  THR  35          1HG2      THR  35  -1.603  -8.315  -3.080
  262   HG23  THR  35          2HG2      THR  35   0.108  -8.676  -3.310
  263    H    GLY  36           H        GLY  36   2.383 -10.690  -0.154
  264    HA2  GLY  36           1HA      GLY  36   4.136  -9.742  -2.308
  265    HA3  GLY  36           2HA      GLY  36   4.596 -10.835  -1.011
  266    H    SER  37           H        SER  37   2.320 -12.582  -1.294
  267    HA   SER  37           HA       SER  37   1.752 -14.501  -2.374
  268    HB2  SER  37           1HB      SER  37   2.254 -12.657  -4.701
  269    HB3  SER  37           2HB      SER  37   1.781 -14.337  -4.951
  270    HG   SER  37           HG       SER  37  -0.153 -13.946  -4.042
  271    H    GLY  38           H        GLY  38   4.340 -14.409  -1.374
  272    HA2  GLY  38           1HA      GLY  38   5.698 -16.192  -3.281
  273    HA3  GLY  38           2HA      GLY  38   6.594 -14.866  -2.553
  274    HA   PRO  39           HA       PRO  39   7.285 -18.552   0.117
  275    HB2  PRO  39           1HB      PRO  39   9.901 -17.993   0.581
  276    HB3  PRO  39           2HB      PRO  39   9.347 -18.886  -0.840
  277    HG2  PRO  39           1HG      PRO  39  10.079 -15.994  -0.586
  278    HG3  PRO  39           2HG      PRO  39  10.486 -17.142  -1.875
  279    HD2  PRO  39           1HD      PRO  39   8.487 -15.331  -2.114
  280    HD3  PRO  39           2HD      PRO  39   8.426 -16.928  -2.888
  281    H    SER  40           H        SER  40   6.193 -17.991   1.939
  282    HA   SER  40           HA       SER  40   6.194 -15.697   3.386
  283    HB2  SER  40           1HB      SER  40   4.834 -17.788   3.827
  284    HB3  SER  40           2HB      SER  40   6.227 -18.415   4.708
  285    HG   SER  40           HG       SER  40   5.669 -17.224   6.336
  286    H    SER  41           H        SER  41   7.184 -15.177   5.503
  287    HA   SER  41           HA       SER  41  10.038 -15.909   5.512
  288    HB2  SER  41           1HB      SER  41  10.583 -13.736   6.256
  289    HB3  SER  41           2HB      SER  41   9.353 -13.478   5.019
  290    HG   SER  41           HG       SER  41   8.280 -12.477   6.508
  291    H    GLY  42           H        GLY  42  10.872 -16.827   7.286
  292    HA2  GLY  42           1HA      GLY  42  11.112 -17.197   9.603
  293    HA3  GLY  42           2HA      GLY  42   9.510 -16.521   9.855