*HEADER    TRANSCRIPTION                           28-MAR-07   2EN8              
*TITLE     SOLUTION STRUCTURE OF THE C2H2 TYPE ZINC FINGER (REGION 171-          
*TITLE    2 203) OF HUMAN ZINC FINGER PROTEIN 224                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER PROTEIN 224;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-C2H2 DOMAIN;                                            
*COMPND   5 SYNONYM: ZINC FINGER PROTEIN 27, ZINC FINGER PROTEIN 233,            
*COMPND   6 ZINC FINGER PROTEIN 255, BONE MARROW ZINC FINGER 2, BMZF-2,          
*COMPND   7 ZINC FINGER PROTEIN KOX22;                                           
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: ZNF224;                                                        
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P061225-17;                               
*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 2EN8    0                                                

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

15 CYSS SG   181 ZN   ZN   2.19  5.00E+00
15 CYSS CB   181 ZN   ZN   3.25  5.00E+00
18 CYSS SG   181 ZN   ZN   2.19  5.00E+00
18 CYSS CB   181 ZN   ZN   3.25  5.00E+00
31 HIS NE2   181 ZN   ZN   1.90  5.00E+00
35 HIS NE2   181 ZN   ZN   1.90  5.00E+00
15 CYSS SG  18 CYSS SG   3.56  5.00E+00
15 CYSS SG  31 HIS NE2   3.32  5.00E+00
15 CYSS SG  35 HIS NE2   3.32  5.00E+00
18 CYSS SG  31 HIS NE2   3.32  5.00E+00
18 CYSS SG  35 HIS NE2   3.32  5.00E+00
31 HIS NE2  35 HIS NE2   3.00  5.00E+00
15 CYSS SG   181 ZN   ZN   2.39  5.00E+00
15 CYSS CB   181 ZN   ZN   3.51  5.00E+00
18 CYSS SG   181 ZN   ZN   2.39  5.00E+00
18 CYSS CB   181 ZN   ZN   3.51  5.00E+00
31 HIS NE2   181 ZN   ZN   2.10  5.00E+00
35 HIS NE2   181 ZN   ZN   2.10  5.00E+00
15 CYSS SG  18 CYSS SG   3.96  5.00E+00
15 CYSS SG  31 HIS NE2   3.72  5.00E+00
15 CYSS SG  35 HIS NE2   3.72  5.00E+00
18 CYSS SG  31 HIS NE2   3.72  5.00E+00
18 CYSS SG  35 HIS NE2   3.72  5.00E+00
31 HIS NE2  35 HIS NE2   3.60  5.00E+00
 30 ILE  HN     32 GLN  HN      4.59 #SUP  0.97  #QF  0.97
 28 LEU  HN     30 ILE  HN      4.60 #SUP  0.99  #QF  0.99
 27 ALA  HN     30 ILE  HN      4.98 #SUP  0.98  #QF  0.98
 27 ALA  HA     30 ILE  HN      3.68 #SUP  1.00  #QF  0.99
 26 SER  HA     30 ILE  HN      4.78 #SUP  1.00
 30 ILE  HN     31 HIS  HB3     4.63 #SUP  0.63  #QF  0.63
 30 ILE  HN     31 HIS  HB2     5.50 #SUP  1.00
 30 ILE  HN     32 GLN  HG3     5.50 #SUP  1.00
 29 ARG  HB2    30 ILE  HN      3.50 #SUP  0.98  #QF  0.98
 30 ILE  HN     30 ILE  HB      2.85 #SUP  0.99  #QF  0.99
 18 CYSS HN     19 GLY  HN      2.75 #SUP  0.94  #QF  0.94
 15 CYSS HA     18 CYSS HN      4.96 #SUP  0.99  #QF  0.99
 16 ASP  HA     18 CYSS HN      4.77 #SUP  0.99  #QF  0.99
 20 LYS  HA     21 ASN  HN      2.66 #SUP  0.99  #QF  0.99
 18 CYSS HN     19 GLY  HA1     4.23 #SUP  0.98  #QF  0.98
 21 ASN  HN     21 ASN  QB      2.96 #SUP  0.99  #QF  0.99
 17 GLU  HG2    18 CYSS HN      4.68 #SUP  1.00
 17 GLU  HG3    18 CYSS HN      4.68 #SUP  0.99  #QF  0.99
 20 LYS  HB2    21 ASN  HN      4.06 #SUP  0.91  #QF  0.44
 17 GLU  HB2    18 CYSS HN      3.37 #SUP  0.77  #QF  0.77
 20 LYS  HB3    21 ASN  HN      3.57 #SUP  1.00
 20 LYS  HG2    21 ASN  HN      4.37 #SUP  1.00
 16 ASP  HN     18 CYSS HN      4.90 #SUP  0.95  #QF  0.95
 17 GLU  HN     18 CYSS HN      3.06 #SUP  1.00
 15 CYSS HB3    18 CYSS HN      3.39 #SUP  0.87  #QF  0.87
 18 CYSS HN     18 CYSS HB3     3.51 #SUP  0.98  #QF  0.98
 15 CYSS HN     20 LYS  HN      4.15 #SUP  0.99  #QF  0.99
 15 CYSS HN     22 PHE  QE      3.95 #SUP  0.99  #QF  0.99
 15 CYSS HN     21 ASN  HA      3.78 #SUP  0.99  #QF  0.99
 14 THR  HA     15 CYSS HN      2.80 #SUP  0.94  #QF  0.94
 15 CYSS HN     19 GLY  HA1     4.92 #SUP  1.00  #QF  0.99
 15 CYSS HN     15 CYSS HB3     3.08 #SUP  1.00
 15 CYSS HN     15 CYSS HB2     3.19 #SUP  1.00
 14 THR  QG2    15 CYSS HN      3.37 #SUP  0.97  #QF  0.97
 14 THR  HN     15 CYSS HN      4.56 #SUP  0.98  #QF  0.98
 15 CYSS HN     22 PHE  QD      4.42 #SUP  1.00
 24 TYR  HN     24 TYR  QD      3.67 #SUP  0.96  #QF  0.96
 22 PHE  HN     24 TYR  HN      5.50 #SUP  0.99  #QF  0.99
 24 TYR  HN     27 ALA  HN      4.74 #SUP  0.96  #QF  0.96
 24 TYR  HN     24 TYR  HB3     4.07 #SUP  1.00
 22 PHE  HB3    24 TYR  HN      3.72 #SUP  0.96  #QF  0.96
 24 TYR  HN     27 ALA  QB      3.88 #SUP  1.00
 35 HIS  HN     36 MET  HN      3.27 #SUP  0.99  #QF  0.99
 33 ARG  HA     36 MET  HN      4.15 #SUP  0.99  #QF  0.99
 34 VAL  HA     36 MET  HN      4.87 #SUP  0.98  #QF  0.98
 35 HIS  HB3    36 MET  HN      4.45 #SUP  0.98  #QF  0.98
 35 HIS  HB2    36 MET  HN      4.12 #SUP  0.96  #QF  0.96
 36 MET  HN     36 MET  HB3     3.82 #SUP  1.00
 36 MET  HN     36 MET  HB2     3.82 #SUP  0.99  #QF  0.99
 33 ARG  HB3    36 MET  HN      5.38 #SUP  0.94  #QF  0.94
 24 TYR  QD     27 ALA  HN      4.20 #SUP  0.98  #QF  0.98
 26 SER  QB     27 ALA  HN      4.05 #SUP  0.99  #QF  0.99
 26 SER  HN     27 ALA  HN      4.02 #SUP  0.99  #QF  0.99
 24 TYR  HA     27 ALA  HN      4.96 #SUP  1.00
 25 ILE  HA     27 ALA  HN      5.26 #SUP  0.99  #QF  0.45
 27 ALA  HN     28 LEU  HA      5.50 #SUP  1.00
 24 TYR  HB2    27 ALA  HN      3.48 #SUP  0.99  #QF  0.99
 27 ALA  HN     28 LEU  HB3     4.80 #SUP  1.00
 27 ALA  HN     27 ALA  QB      3.08 #SUP  1.00
 27 ALA  HN     28 LEU  HB2     5.50 #SUP  0.99  #QF  0.99
 25 ILE  QG2    27 ALA  HN      4.97 #SUP  0.94  #QF  0.94
 13 HIS  HN     22 PHE  HN      4.16 #SUP  0.99  #QF  0.99
 22 PHE  HN     22 PHE  QD      3.33 #SUP  1.00
 21 ASN  HA     22 PHE  HN      2.93 #SUP  0.98  #QF  0.98
 12 SER  HA     22 PHE  HN      5.40 #SUP  0.47  #QF  0.23
 22 PHE  HN     23 CYS  HA      5.50 #SUP  0.47  #QF  0.23
 13 HIS  HB2    22 PHE  HN      4.18 #SUP  0.98  #QF  0.98
 22 PHE  HN     22 PHE  HB2     3.52 #SUP  1.00
 22 PHE  HN     27 ALA  QB      5.50 #SUP  1.00
 14 THR  QG2    22 PHE  HN      5.28 #SUP  0.99  #QF  0.99
 22 PHE  HN     28 LEU  QD1     5.26 #SUP  1.00
 15 CYSS HN     22 PHE  HN      5.11 #SUP  0.99  #QF  0.99
 15 CYSS HN     19 GLY  HN      4.38 #SUP  0.97  #QF  0.97
 21 ASN  HN     22 PHE  HN      4.70 #SUP  1.00
 22 PHE  HN     22 PHE  QE      5.00 #SUP  1.00
 14 THR  HA     22 PHE  HN      3.94 #SUP  0.96  #QF  0.96
 12 SER  QB     22 PHE  HN      4.64 #SUP  0.99  #QF  0.99
 22 PHE  HN     22 PHE  HB3     3.97 #SUP  1.00
 13 HIS  HB3    22 PHE  HN      4.98 #SUP  0.99  #QF  0.99
 21 ASN  QB     22 PHE  HN      3.57 #SUP  1.00
 11 LYS  HN     11 LYS  QG      4.58 #SUP  0.94  #QF  0.45
 17 GLU  HN     19 GLY  HN      3.95 #SUP  0.99  #QF  0.99
 19 GLY  HN     20 LYS  HN      3.10 #SUP  0.98  #QF  0.97
 15 CYSS HA     16 ASP  HN      3.32 #SUP  0.96  #QF  0.96
 16 ASP  HA     19 GLY  HN      4.56 #SUP  0.99  #QF  0.99
 19 GLY  HN     19 GLY  HA1     2.84 #SUP  0.99  #QF  0.99
 15 CYSS HB3    19 GLY  HN      3.49 #SUP  1.00
 15 CYSS HB2    16 ASP  HN      4.88 #SUP  0.98  #QF  0.98
 16 ASP  HN     16 ASP  QB      3.63 #SUP  0.95  #QF  0.95
 19 GLY  HN     20 LYS  HB2     4.36 #SUP  0.49  #QF  0.49
 14 THR  QG2    19 GLY  HN      4.00 #SUP  1.00
 16 ASP  HN     28 LEU  QD1     4.68 #SUP  0.96  #QF  0.96
 32 GLN  HN     33 ARG  HN      3.33 #SUP  1.00
 33 ARG  HN     34 VAL  HN      3.28 #SUP  1.00
 32 GLN  HE21   33 ARG  HN      5.50 #SUP  0.58  #QF  0.58
 33 ARG  HN     35 HIS  HN      4.65 #SUP  1.00
 30 ILE  HA     33 ARG  HN      4.14 #SUP  0.98  #QF  0.47
 32 GLN  HG3    33 ARG  HN      4.89 #SUP  1.00
 32 GLN  HB2    33 ARG  HN      3.92 #SUP  1.00
 32 GLN  HB3    33 ARG  HN      4.22 #SUP  1.00
 33 ARG  HN     33 ARG  HG3     2.91 #SUP  0.99  #QF  0.99
 33 ARG  HN     33 ARG  HG2     3.45 #SUP  1.00
 33 ARG  HN     34 VAL  QG1     4.73 #SUP  1.00
 29 ARG  HN     30 ILE  HN      3.38 #SUP  1.00
 28 LEU  HN     29 ARG  HN      3.22 #SUP  1.00
 27 ALA  HN     29 ARG  HN      4.41 #SUP  1.00
 13 HIS  HN     13 HIS  HD2     4.10 #SUP  0.98  #QF  0.98
 12 SER  HA     13 HIS  HN      3.00 #SUP  0.88  #QF  0.88
 25 ILE  HA     29 ARG  HN      4.34 #SUP  1.00
 29 ARG  HN     29 ARG  HD2     4.76 #SUP  0.98  #QF  0.98
 13 HIS  HN     13 HIS  HB3     3.81 #SUP  0.99  #QF  0.99
 13 HIS  HN     13 HIS  HB2     3.58 #SUP  0.97  #QF  0.97
 13 HIS  HN     22 PHE  HB2     4.94 #SUP  0.99  #QF  0.99
 28 LEU  HB3    29 ARG  HN      3.32 #SUP  1.00
 29 ARG  HN     29 ARG  HB2     3.09 #SUP  0.97  #QF  0.97
 29 ARG  HN     29 ARG  HG3     3.41 #SUP  0.87  #QF  0.87
 28 LEU  HG     29 ARG  HN      4.00 #SUP  1.00
 28 LEU  QD1    29 ARG  HN      4.61 #SUP  0.99  #QF  0.59
 12 SER  QB     13 HIS  HN      3.63 #SUP  0.98  #QF  0.98
 32 GLN  HA     32 GLN  HE21    5.04 #SUP  1.00
 32 GLN  HB3    32 GLN  HE21    4.63 #SUP  1.00
 32 GLN  HB3    32 GLN  HE22    4.88 #SUP  1.00
 28 LEU  HG     32 GLN  HE21    4.51 #SUP  1.00
 14 THR  QG2    21 ASN  HD22    4.93 #SUP  0.91  #QF  0.91
 20 LYS  HN     20 LYS  HB2     3.06 #SUP  0.99  #QF  0.99
 20 LYS  HN     20 LYS  HB3     3.54 #SUP  1.00
 20 LYS  HN     20 LYS  HG2     4.14 #SUP  1.00
 14 THR  QG2    21 ASN  HD21    4.93 #SUP  0.80  #QF  0.80
 20 LYS  HN     22 PHE  QE      4.56 #SUP  1.00
 39 LYS  HN     39 LYS  HG2     5.50 #SUP  0.99  #QF  0.79
 39 LYS  HN     39 LYS  HG3     5.50 #SUP  0.99  #QF  0.79
 34 VAL  HN     36 MET  HN      4.57 #SUP  1.00
 34 VAL  HN     35 HIS  HN      3.21 #SUP  1.00
 32 GLN  HA     34 VAL  HN      4.10 #SUP  1.00
 34 VAL  HN     35 HIS  HB2     4.83 #SUP  0.98  #QF  0.98
 33 ARG  HB3    34 VAL  HN      3.99 #SUP  1.00  #QF  0.62
 27 ALA  HN     28 LEU  HN      3.28 #SUP  1.00
 28 LEU  HN     28 LEU  HB3     3.19 #SUP  1.00
 27 ALA  QB     28 LEU  HN      3.47 #SUP  1.00
 28 LEU  HN     28 LEU  HG      4.46 #SUP  1.00
 28 LEU  HN     28 LEU  HB2     3.35 #SUP  1.00
 33 ARG  HA     35 HIS  HN      4.52 #SUP  1.00
 32 GLN  HA     35 HIS  HN      4.00 #SUP  1.00
 35 HIS  HN     35 HIS  HB3     3.65 #SUP  0.99  #QF  0.99
 35 HIS  HN     35 HIS  HB2     3.31 #SUP  0.98  #QF  0.98
 34 VAL  HB     35 HIS  HN      4.11 #SUP  1.00
 28 LEU  HN     29 ARG  HB2     5.35 #SUP  0.97  #QF  0.97
 34 VAL  QG2    35 HIS  HN      4.07 #SUP  1.00
 34 VAL  QG1    35 HIS  HN      3.87 #SUP  1.00
 10 GLU  HN     11 LYS  HN      5.21 #SUP  0.40  #QF  0.40
 26 SER  HN     26 SER  QB      3.79 #SUP  0.97  #QF  0.97
 24 TYR  HB2    26 SER  HN      4.81 #SUP  0.96  #QF  0.96
 25 ILE  QG2    26 SER  HN      4.04 #SUP  0.99  #QF  0.99
 25 ILE  HB     26 SER  HN      4.80 #SUP  0.99  #QF  0.99
 14 THR  HN     14 THR  HB      3.32 #SUP  0.94  #QF  0.94
 13 HIS  HB3    14 THR  HN      4.22 #SUP  0.89  #QF  0.89
 13 HIS  HB2    14 THR  HN      4.62 #SUP  0.92  #QF  0.92
 14 THR  HN     14 THR  QG2     4.09 #SUP  0.99  #QF  0.99
 14 THR  HN     28 LEU  QD2     4.27 #SUP  0.61  #QF  0.61
 29 ARG  HN     31 HIS  HN      4.59 #SUP  0.93  #QF  0.93
 31 HIS  HN     33 ARG  HN      4.51 #SUP  0.96  #QF  0.96
 31 HIS  HN     32 GLN  HN      3.35 #SUP  1.00
 22 PHE  QE     31 HIS  HN      5.02 #SUP  0.98  #QF  0.62
 31 HIS  HN     31 HIS  HB3     2.97 #SUP  0.99  #QF  0.99
 31 HIS  HN     31 HIS  HB2     3.09 #SUP  1.00
 31 HIS  HN     32 GLN  HB2     4.91 #SUP  0.99  #QF  0.99
 30 ILE  HB     31 HIS  HN      3.26 #SUP  0.93  #QF  0.93
 30 ILE  HG12   31 HIS  HN      5.27 #SUP  1.00
 38 GLU  HN     38 GLU  HG2     5.35 #SUP  0.90  #QF  0.73
 38 GLU  HN     38 GLU  HG3     5.35 #SUP  0.90  #QF  0.73
 38 GLU  HN     38 GLU  QB      4.14 #SUP  0.99  #QF  0.99
 11 LYS  QB     12 SER  HN      4.30 #SUP  0.90  #QF  0.90
 12 SER  HN     13 HIS  HN      4.52 #SUP  0.97  #QF  0.97
 11 LYS  HA     12 SER  HN      3.30 #SUP  0.90  #QF  0.90
 12 SER  HN     12 SER  QB      3.82 #SUP  0.97  #QF  0.97
 16 ASP  HN     17 GLU  HN      3.62 #SUP  0.98  #QF  0.98
 17 GLU  HN     18 CYSS HA      5.50 #SUP  1.00
 15 CYSS HA     17 GLU  HN      4.08 #SUP  0.97  #QF  0.97
 15 CYSS HB3    17 GLU  HN      4.41 #SUP  1.00
 15 CYSS HB2    17 GLU  HN      4.84 #SUP  0.95  #QF  0.95
 16 ASP  QB     17 GLU  HN      3.74 #SUP  0.99  #QF  0.99
 17 GLU  HN     17 GLU  HG2     4.04 #SUP  1.00
 17 GLU  HN     17 GLU  HG3     4.04 #SUP  1.00
 17 GLU  HN     17 GLU  HB3     3.60 #SUP  0.94  #QF  0.94
 32 GLN  HN     34 VAL  HN      4.79 #SUP  0.95  #QF  0.95
 29 ARG  HA     32 GLN  HN      3.83 #SUP  1.00
 32 GLN  HN     33 ARG  HG3     4.49 #SUP  0.85  #QF  0.85
 28 LEU  HG     32 GLN  HN      4.66 #SUP  1.00
 28 LEU  QD1    32 GLN  HN      4.13 #SUP  0.98  #QF  0.98
 31 HIS  HD2    32 GLN  HN      3.95 #SUP  1.00
 31 HIS  HB3    32 GLN  HN      3.43 #SUP  0.99  #QF  0.99
 32 GLN  HN     32 GLN  HG3     3.14 #SUP  0.99  #QF  0.99
 32 GLN  HN     32 GLN  HB2     3.19 #SUP  1.00
 30 ILE  HB     32 GLN  HN      5.28 #SUP  0.99  #QF  0.99
 18 CYSS HB2    19 GLY  HA2     5.50 #SUP  1.00  #QF  0.99
 24 TYR  QE     26 SER  QB      5.04 #SUP  0.89  #QF  0.89
 23 CYS  HB2    24 TYR  QE      4.85 #SUP  0.90  #QF  0.84
 23 CYS  HB3    24 TYR  QE      4.85 #SUP  0.90  #QF  0.84
 24 TYR  QE     27 ALA  QB      4.45 #SUP  0.96  #QF  0.96
 14 THR  QG2    20 LYS  HN      4.34 #SUP  0.98  #QF  0.98
 14 THR  HA     14 THR  QG2     3.40 #SUP  0.99  #QF  0.99
 14 THR  QG2    16 ASP  HA      4.01 #SUP  0.92  #QF  0.92
 14 THR  QG2    19 GLY  HA2     3.84 #SUP  0.99  #QF  0.99
 14 THR  QG2    20 LYS  HA      4.92 #SUP  0.98  #QF  0.98
 14 THR  QG2    19 GLY  HA1     3.29 #SUP  0.98  #QF  0.95
 14 THR  QG2    15 CYSS HB3     4.18 #SUP  0.99  #QF  0.99
 14 THR  QG2    15 CYSS HB2     4.44 #SUP  0.90  #QF  0.90
 14 THR  QG2    16 ASP  QB      5.11 #SUP  0.87  #QF  0.87
 37 GLY  QA     38 GLU  QB      5.50 #SUP  0.97  #QF  0.39
 34 VAL  HN     34 VAL  QG2     3.11 #SUP  0.99  #QF  0.99
 34 VAL  HN     34 VAL  QG1     3.11 #SUP  0.98  #QF  0.98
 33 ARG  HN     34 VAL  QG2     4.59 #SUP  1.00
 34 VAL  QG2    35 HIS  HD2     4.85 #SUP  1.00
 34 VAL  QG1    35 HIS  HD2     4.85 #SUP  1.00
 31 HIS  HA     34 VAL  QG2     4.19 #SUP  1.00
 31 HIS  HA     34 VAL  QG1     3.99 #SUP  1.00
 32 GLN  HA     34 VAL  QG2     4.72 #SUP  0.99  #QF  0.99
 32 GLN  HA     34 VAL  QG1     4.71 #SUP  1.00
 31 HIS  HB2    34 VAL  QG2     4.87 #SUP  0.96  #QF  0.96
 31 HIS  HB2    34 VAL  QG1     4.73 #SUP  0.98  #QF  0.98
 31 HIS  HE1    35 HIS  HD2     5.31 #SUP  1.00  #QF  0.79
 18 CYSS HA     35 HIS  HE1     4.27 #SUP  0.95  #QF  0.95
 18 CYSS HB2    35 HIS  HE1     3.85 #SUP  1.00
 18 CYSS HB3    35 HIS  HE1     3.08 #SUP  0.94  #QF  0.94
 22 PHE  HB2    24 TYR  HN      4.44 #SUP  0.98  #QF  0.98
 33 ARG  HN     33 ARG  QD      4.11 #SUP  0.99  #QF  0.99
 22 PHE  HB3    28 LEU  HN      4.35 #SUP  1.00
 22 PHE  HB2    28 LEU  HN      4.31 #SUP  1.00
 22 PHE  HZ     31 HIS  HE1     4.50 #SUP  0.97  #QF  0.97
 22 PHE  HB2    28 LEU  HA      3.80 #SUP  0.94  #QF  0.94
 22 PHE  HB3    28 LEU  HA      4.10 #SUP  0.83  #QF  0.83
 13 HIS  HB2    22 PHE  HB3     4.71 #SUP  0.99  #QF  0.99
 13 HIS  HB2    22 PHE  HB2     3.90 #SUP  1.00
 22 PHE  HB3    28 LEU  HB3     4.78 #SUP  1.00
 33 ARG  HB3    33 ARG  QD      3.44 #SUP  1.00  #QF  0.72
 22 PHE  HB3    27 ALA  QB      3.47 #SUP  1.00
 22 PHE  HB2    27 ALA  QB      3.83 #SUP  1.00
 20 LYS  HG3    31 HIS  HE1     3.50 #SUP  0.68  #QF  0.68
 22 PHE  HB2    28 LEU  HG      5.48 #SUP  1.00
 22 PHE  HB3    28 LEU  HB2     4.07 #SUP  1.00
 22 PHE  HB2    28 LEU  HB2     3.82 #SUP  1.00
 22 PHE  HB3    28 LEU  QD2     5.50 #SUP  0.99  #QF  0.96
 31 HIS  HE1    34 VAL  QG2     3.81 #SUP  0.71  #QF  0.71
 31 HIS  HE1    34 VAL  QG1     4.12 #SUP  0.83  #QF  0.83
 24 TYR  QD     27 ALA  QB      3.65 #SUP  0.99  #QF  0.99
 22 PHE  QE     27 ALA  QB      4.02 #SUP  0.99  #QF  0.99
 24 TYR  HB2    27 ALA  QB      3.75 #SUP  0.96  #QF  0.96
 27 ALA  QB     28 LEU  HB2     4.49 #SUP  1.00
 27 ALA  QB     30 ILE  QG2     5.13 #SUP  0.62  #QF  0.62
 27 ALA  QB     30 ILE  QD1     4.27 #SUP  0.96  #QF  0.96
 29 ARG  HN     29 ARG  HD3     4.76 #SUP  1.00
 29 ARG  HA     29 ARG  HD2     4.14 #SUP  1.00
 29 ARG  HB3    29 ARG  HD3     4.02 #SUP  0.89  #QF  0.89
 11 LYS  QG     11 LYS  QE      3.54 #SUP  0.89  #QF  0.89
 13 HIS  HE1    25 ILE  HB      4.14 #SUP  0.99  #QF  0.99
 13 HIS  HE1    25 ILE  HG12    4.66 #SUP  0.99  #QF  0.99
 20 LYS  HG2    20 LYS  HE2     4.00 #SUP  1.00
 20 LYS  HG2    20 LYS  HE3     4.00 #SUP  1.00
 13 HIS  HE1    25 ILE  HG13    5.50 #SUP  1.00
 13 HIS  HE1    25 ILE  QD1     3.76 #SUP  0.99  #QF  0.99
 14 THR  HA     21 ASN  QB      4.45 #SUP  0.98  #QF  0.98
 12 SER  QB     21 ASN  QB      4.35 #SUP  0.98  #QF  0.98
 20 LYS  HD2    21 ASN  QB      5.50 #SUP  0.42  #QF  0.25
 20 LYS  HD3    21 ASN  QB      5.50 #SUP  0.42  #QF  0.25
 14 THR  QG2    21 ASN  QB      4.21 #SUP  1.00
 30 ILE  QG2    31 HIS  HN      3.69 #SUP  0.99  #QF  0.99
 30 ILE  HN     30 ILE  QG2     3.80 #SUP  0.99  #QF  0.99
 30 ILE  QG2    33 ARG  HN      4.72 #SUP  1.00
 27 ALA  HA     30 ILE  QG2     4.38 #SUP  0.99  #QF  0.99
 30 ILE  HA     30 ILE  QG2     3.01 #SUP  1.00
 30 ILE  QG2    33 ARG  QD      3.93 #SUP  0.98  #QF  0.98
 30 ILE  QG2    31 HIS  HB3     5.20 #SUP  0.98  #QF  0.98
 30 ILE  QG2    31 HIS  HB2     4.57 #SUP  1.00
 30 ILE  QG2    33 ARG  HB2     4.47 #SUP  0.89  #QF  0.56
 30 ILE  QG2    33 ARG  HG3     4.74 #SUP  0.89  #QF  0.56
 30 ILE  QG2    30 ILE  HG12    3.18 #SUP  0.98  #QF  0.98
 24 TYR  HB3    25 ILE  QG2     5.08 #SUP  0.99  #QF  0.99
 30 ILE  QG2    30 ILE  QD1     2.76 #SUP  0.46  #QF  0.46
 25 ILE  QG2    29 ARG  HN      4.73 #SUP  1.00
 24 TYR  HN     24 TYR  HB2     4.04 #SUP  1.00
 24 TYR  HB3    27 ALA  HN      4.75 #SUP  1.00
 36 MET  HA     36 MET  QE      4.61 #SUP  0.85  #QF  0.85
 25 ILE  QG2    26 SER  HA      3.98 #SUP  1.00
 25 ILE  QG2    26 SER  QB      4.18 #SUP  0.97  #QF  0.97
 24 TYR  HB3    27 ALA  QB      4.61 #SUP  1.00
 25 ILE  QG2    25 ILE  HG12    3.66 #SUP  0.80  #QF  0.80
 24 TYR  HB2    25 ILE  QG2     4.74 #SUP  0.96  #QF  0.96
 16 ASP  HA     16 ASP  QB      2.92 #SUP  0.99  #QF  0.99
 16 ASP  QB     17 GLU  HB2     5.50 #SUP  0.81  #QF  0.81
 29 ARG  HA     30 ILE  HA      4.91 #SUP  1.00
 30 ILE  HA     33 ARG  QD      3.75 #SUP  1.00
 30 ILE  HA     33 ARG  HG3     3.55 #SUP  0.97  #QF  0.97
 30 ILE  HA     30 ILE  HG12    3.20 #SUP  1.00
 28 LEU  HB3    29 ARG  HA      4.79 #SUP  1.00
 28 LEU  HB2    29 ARG  HN      4.02 #SUP  1.00
 33 ARG  HN     34 VAL  HA      5.50 #SUP  1.00
 25 ILE  HA     28 LEU  HB2     3.81 #SUP  1.00
 13 HIS  HB2    28 LEU  HB3     4.35 #SUP  1.00
 13 HIS  HB2    28 LEU  HB2     4.14 #SUP  0.99  #QF  0.99
 22 PHE  HB2    28 LEU  HB3     4.26 #SUP  1.00
 34 VAL  HA     34 VAL  HB      2.85 #SUP  0.99  #QF  0.99
 27 ALA  QB     28 LEU  HB3     4.62 #SUP  1.00
 28 LEU  HB3    28 LEU  QD2     3.19 #SUP  0.99  #QF  0.74
 28 LEU  HB2    28 LEU  QD1     3.33 #SUP  0.99  #QF  0.83
 34 VAL  HA     34 VAL  QG2     3.21 #SUP  0.99  #QF  0.99
 34 VAL  HA     34 VAL  QG1     3.17 #SUP  0.99  #QF  0.99
 12 SER  QB     13 HIS  HD2     5.21 #SUP  0.95  #QF  0.95
 12 SER  HA     12 SER  QB      3.02 #SUP  1.00
 13 HIS  HB3    25 ILE  HA      4.00 #SUP  0.97  #QF  0.97
 13 HIS  HB2    25 ILE  HA      4.37 #SUP  0.96  #QF  0.96
 25 ILE  HA     27 ALA  QB      4.73 #SUP  0.99  #QF  0.99
 25 ILE  HA     28 LEU  HN      3.66 #SUP  1.00
 13 HIS  HD2    25 ILE  HA      4.64 #SUP  0.98  #QF  0.98
 25 ILE  HA     28 LEU  HB3     3.17 #SUP  0.99  #QF  0.99
 25 ILE  HA     25 ILE  QG2     3.48 #SUP  0.85  #QF  0.85
 25 ILE  HA     25 ILE  QD1     3.42 #SUP  1.00
 29 ARG  HN     30 ILE  HB      5.24 #SUP  1.00
 27 ALA  HA     30 ILE  HB      3.29 #SUP  0.93  #QF  0.93
 29 ARG  HB2    30 ILE  HB      5.00 #SUP  0.99  #QF  0.99
 13 HIS  HD2    25 ILE  QD1     4.81 #SUP  1.00
 13 HIS  HB3    25 ILE  QD1     4.26 #SUP  0.88  #QF  0.88
 25 ILE  QD1    28 LEU  HB3     4.13 #SUP  0.94  #QF  0.94
 25 ILE  HB     25 ILE  QD1     3.48 #SUP  0.98  #QF  0.98
 24 TYR  HA     24 TYR  QD      3.80 #SUP  0.98  #QF  0.98
 24 TYR  HB3    26 SER  QB      4.63 #SUP  0.84  #QF  0.84
 26 SER  QB     29 ARG  HB2     4.93 #SUP  0.96  #QF  0.96
 26 SER  QB     27 ALA  QB      4.69 #SUP  0.95  #QF  0.92
 26 SER  QB     30 ILE  HG13    5.34 #SUP  0.95  #QF  0.92
 24 TYR  QD     26 SER  QB      4.64 #SUP  0.98  #QF  0.98
 26 SER  HA     26 SER  QB      2.78 #SUP  0.90  #QF  0.90
 26 SER  HA     29 ARG  HN      4.10 #SUP  1.00
 30 ILE  HN     30 ILE  QD1     3.74 #SUP  1.00
 27 ALA  HA     30 ILE  QD1     3.36 #SUP  0.99  #QF  0.99
 26 SER  QB     30 ILE  QD1     4.19 #SUP  0.49  #QF  0.49
 30 ILE  HA     30 ILE  QD1     3.98 #SUP  1.00
 30 ILE  QD1    33 ARG  QD      5.18 #SUP  0.84  #QF  0.84
 26 SER  HA     29 ARG  HD2     5.50 #SUP  0.99  #QF  0.99
 26 SER  HA     29 ARG  HD3     5.50 #SUP  1.00
 29 ARG  HB2    30 ILE  QD1     4.72 #SUP  0.86  #QF  0.86
 26 SER  HA     29 ARG  HB2     3.52 #SUP  0.93  #QF  0.93
 26 SER  HA     29 ARG  HG3     3.94 #SUP  0.66  #QF  0.66
 10 GLU  HG3    11 LYS  QB      4.74 #SUP  0.44  #QF  0.44
 10 GLU  HA     10 GLU  HG3     4.22 #SUP  0.99  #QF  0.87
 10 GLU  HA     10 GLU  HG2     4.22 #SUP  0.97  #QF  0.86
 10 GLU  HG2    11 LYS  QB      4.74 #SUP  0.48  #QF  0.48
 22 PHE  QD     27 ALA  HA      4.89 #SUP  0.97  #QF  0.97
 21 ASN  QB     22 PHE  QD      5.00 #SUP  0.99  #QF  0.99
 20 LYS  HB2    22 PHE  QD      4.93 #SUP  0.99  #QF  0.99
 22 PHE  QD     28 LEU  HG      5.48 #SUP  0.99  #QF  0.99
 32 GLN  HG3    35 HIS  HD2     4.80 #SUP  1.00
 14 THR  HA     22 PHE  QD      4.54 #SUP  1.00
 22 PHE  HA     22 PHE  QD      4.14 #SUP  1.00
 15 CYSS HB3    22 PHE  QD      4.88 #SUP  0.99  #QF  0.99
 22 PHE  QD     28 LEU  HA      3.73 #SUP  1.00
 13 HIS  HB2    22 PHE  QD      4.25 #SUP  0.99  #QF  0.44
 22 PHE  QD     28 LEU  HB3     4.38 #SUP  1.00
 22 PHE  QD     27 ALA  QB      3.21 #SUP  0.98  #QF  0.98
 22 PHE  QD     28 LEU  HB2     3.81 #SUP  1.00
 22 PHE  QD     28 LEU  QD1     3.17 #SUP  1.00
 32 GLN  HN     32 GLN  HG2     3.63 #SUP  1.00
 31 HIS  HD2    32 GLN  HG3     4.00 #SUP  1.00
 31 HIS  HD2    32 GLN  HG2     3.94 #SUP  0.99  #QF  0.99
 17 GLU  HA     17 GLU  HG2     3.89 #SUP  1.00
 29 ARG  HA     32 GLN  HG2     4.96 #SUP  1.00
 32 GLN  HA     32 GLN  HG3     3.56 #SUP  1.00
 17 GLU  HG2    35 HIS  HB3     5.11 #SUP  0.93  #QF  0.93
 28 LEU  HA     32 GLN  HG3     4.82 #SUP  0.69  #QF  0.69
 28 LEU  HA     32 GLN  HG2     5.50 #SUP  0.78  #QF  0.78
 28 LEU  HG     32 GLN  HG2     4.16 #SUP  1.00
 28 LEU  QD1    32 GLN  HG2     3.64 #SUP  1.00
 31 HIS  HD2    32 GLN  HA      3.65 #SUP  1.00
 32 GLN  HA     35 HIS  HD2     3.16 #SUP  1.00
 32 GLN  HA     35 HIS  HB2     4.09 #SUP  1.00
 32 GLN  HA     32 GLN  HG2     3.23 #SUP  1.00
 28 LEU  QD1    32 GLN  HA      4.46 #SUP  1.00
 31 HIS  HA     34 VAL  HN      4.29 #SUP  1.00
 31 HIS  HA     33 ARG  HN      4.43 #SUP  1.00
 22 PHE  QE     31 HIS  HA      5.36 #SUP  0.99  #QF  0.45
 30 ILE  HA     31 HIS  HA      5.22 #SUP  1.00  #QF  0.98
 31 HIS  HA     32 GLN  HA      5.50 #SUP  1.00  #QF  0.98
 31 HIS  HA     31 HIS  HB2     2.98 #SUP  1.00
 30 ILE  QG2    31 HIS  HA      3.96 #SUP  0.98  #QF  0.98
 29 ARG  HA     29 ARG  HD3     4.14 #SUP  1.00
 29 ARG  HA     32 GLN  HG3     4.04 #SUP  1.00
 29 ARG  HA     32 GLN  HB2     3.46 #SUP  0.98  #QF  0.98
 29 ARG  HA     29 ARG  HG2     3.34 #SUP  0.95  #QF  0.95
 28 LEU  HG     29 ARG  HA      4.07 #SUP  1.00
 28 LEU  QD1    29 ARG  HA      4.49 #SUP  0.90  #QF  0.86
 32 GLN  HA     33 ARG  HA      4.99 #SUP  0.97  #QF  0.97
 33 ARG  HA     33 ARG  QD      4.21 #SUP  1.00
 33 ARG  HA     36 MET  HG3     4.44 #SUP  0.99  #QF  0.99
 32 GLN  HB3    33 ARG  HA      4.87 #SUP  0.99  #QF  0.80
 33 ARG  HA     36 MET  QE      4.13 #SUP  0.92  #QF  0.88
 33 ARG  HA     33 ARG  HG2     3.29 #SUP  1.00
 21 ASN  HN     22 PHE  QE      4.81 #SUP  0.98  #QF  0.98
 17 GLU  HA     18 CYSS HA      4.91 #SUP  1.00
 22 PHE  QE     31 HIS  HB3     4.07 #SUP  0.78  #QF  0.78
 16 ASP  QB     17 GLU  HA      4.40 #SUP  1.00
 17 GLU  HA     17 GLU  HG3     3.89 #SUP  1.00
 20 LYS  HB2    22 PHE  QE      3.52 #SUP  0.99  #QF  0.99
 20 LYS  HB3    22 PHE  QE      3.78 #SUP  1.00
 12 SER  HA     13 HIS  HD2     4.67 #SUP  0.97  #QF  0.97
 20 LYS  HA     21 ASN  HA      4.78 #SUP  1.00
 20 LYS  HA     21 ASN  QB      4.29 #SUP  1.00
 20 LYS  HA     20 LYS  HG2     3.47 #SUP  1.00
 15 CYSS HB2    20 LYS  HB2     4.41 #SUP  0.99  #QF  0.99
 28 LEU  HA     32 GLN  HN      4.47 #SUP  0.99  #QF  0.99
 28 LEU  HA     31 HIS  HN      3.90 #SUP  0.94  #QF  0.94
 22 PHE  QE     28 LEU  HA      4.03 #SUP  1.00  #QF  0.97
 28 LEU  HA     31 HIS  HD2     4.45 #SUP  1.00  #QF  0.97
 28 LEU  HA     31 HIS  HA      5.50 #SUP  1.00
 28 LEU  HA     31 HIS  HB2     4.59 #SUP  0.98  #QF  0.98
 27 ALA  QB     28 LEU  HA      4.30 #SUP  0.99  #QF  0.99
 28 LEU  HA     28 LEU  HG      3.72 #SUP  1.00
 11 LYS  QB     11 LYS  QE      4.87 #SUP  0.98  #QF  0.98
 18 CYSS HB2    19 GLY  HN      4.63 #SUP  0.99  #QF  0.99
 18 CYSS HB3    19 GLY  HN      4.65 #SUP  1.00
 18 CYSS HN     18 CYSS HB2     3.81 #SUP  0.97  #QF  0.97
 18 CYSS HA     18 CYSS HB2     2.93 #SUP  1.00
 18 CYSS HA     18 CYSS HB3     3.01 #SUP  1.00
 22 PHE  HZ     31 HIS  HA      5.48 #SUP  1.00
 36 MET  HA     37 GLY  QA      4.84 #SUP  0.95  #QF  0.95
  9 GLY  QA     10 GLU  HA      4.74 #SUP  0.97  #QF  0.82
 37 GLY  QA     38 GLU  HA      5.11 #SUP  0.97  #QF  0.82
 36 MET  HA     36 MET  HG2     3.99 #SUP  0.99  #QF  0.99
 17 GLU  HB2    18 CYSS HB3     4.59 #SUP  0.85  #QF  0.85
 17 GLU  HB2    18 CYSS HB2     5.50 #SUP  0.98  #QF  0.98
 21 ASN  HN     22 PHE  HZ      5.27 #SUP  1.00  #QF  0.74
 22 PHE  QD     22 PHE  HZ      3.87 #SUP  1.00
 22 PHE  HZ     31 HIS  HB3     4.22 #SUP  0.99  #QF  0.99
 22 PHE  HZ     31 HIS  HB2     3.72 #SUP  1.00
 39 LYS  HA     39 LYS  QD      4.25 #SUP  0.99  #QF  0.99
 20 LYS  HB2    22 PHE  HZ      3.77 #SUP  1.00  #QF  0.94
 20 LYS  HD2    22 PHE  HZ      4.23 #SUP  1.00  #QF  0.94
 20 LYS  HB3    22 PHE  HZ      4.15 #SUP  1.00
 20 LYS  HG2    22 PHE  HZ      4.68 #SUP  1.00
 36 MET  HA     36 MET  HG3     3.99 #SUP  0.99  #QF  0.99
 33 ARG  HA     36 MET  HG2     4.44 #SUP  0.99  #QF  0.99
 13 HIS  HB3    28 LEU  HB3     4.76 #SUP  0.99  #QF  0.99
 13 HIS  HB3    22 PHE  QD      4.89 #SUP  0.99  #QF  0.99
 11 LYS  HA     12 SER  QB      5.08 #SUP  0.93  #QF  0.93
 13 HIS  HB3    22 PHE  HB2     4.43 #SUP  1.00
 11 LYS  HA     11 LYS  QG      3.57 #SUP  0.96  #QF  0.96
 13 HIS  HB3    28 LEU  HB2     4.29 #SUP  1.00
 34 VAL  HN     34 VAL  HB      3.69 #SUP  1.00
 35 HIS  HN     35 HIS  HD2     4.05 #SUP  0.99  #QF  0.99
 35 HIS  HB2    35 HIS  HD2     3.44 #SUP  0.99  #QF  0.99
 32 GLN  HG2    35 HIS  HD2     4.03 #SUP  0.99  #QF  0.99
 32 GLN  HB3    35 HIS  HD2     4.53 #SUP  1.00
 17 GLU  HG2    35 HIS  HD2     5.11 #SUP  0.98  #QF  0.98
 17 GLU  HB3    35 HIS  HD2     4.03 #SUP  0.94  #QF  0.94
 31 HIS  HD2    35 HIS  HD2     3.82 #SUP  0.95  #QF  0.95
 22 PHE  QD     31 HIS  HD2     4.89 #SUP  0.97  #QF  0.97
 31 HIS  HA     31 HIS  HD2     4.94 #SUP  0.99  #QF  0.99
 20 LYS  HB2    31 HIS  HD2     4.55 #SUP  0.94  #QF  0.94
 28 LEU  QD1    31 HIS  HD2     3.29 #SUP  0.99  #QF  0.99
 31 HIS  HN     31 HIS  HD2     4.83 #SUP  1.00
 22 PHE  HZ     31 HIS  HD2     4.63 #SUP  0.99  #QF  0.99
 15 CYSS HB3    31 HIS  HD2     4.16 #SUP  1.00
 15 CYSS HB2    31 HIS  HD2     3.18 #SUP  0.84  #QF  0.84
 27 ALA  HA     29 ARG  HN      4.84 #SUP  1.00
 24 TYR  QD     27 ALA  HA      4.93 #SUP  0.98  #QF  0.95
 27 ALA  HA     30 ILE  HA      5.50 #SUP  1.00
 27 ALA  HA     30 ILE  HG12    4.95 #SUP  1.00
 33 ARG  HB2    34 VAL  HN      4.37 #SUP  1.00
 33 ARG  HN     33 ARG  HB3     3.78 #SUP  1.00
 33 ARG  HN     33 ARG  HB2     3.45 #SUP  1.00
 30 ILE  HA     33 ARG  HB3     5.30 #SUP  1.00
 29 ARG  HB2    30 ILE  HA      4.95 #SUP  1.00  #QF  0.51
 30 ILE  HA     33 ARG  HB2     5.49 #SUP  1.00  #QF  0.51
 29 ARG  HB3    29 ARG  HD2     4.02 #SUP  1.00  #QF  0.45
 33 ARG  HB2    33 ARG  QD      4.20 #SUP  1.00  #QF  0.45
 17 GLU  HN     17 GLU  HB2     3.36 #SUP  1.00
 15 CYSS HB2    19 GLY  HN      4.18 #SUP  1.00
 15 CYSS HB3    20 LYS  HN      3.29 #SUP  0.99  #QF  0.21
 15 CYSS HB2    20 LYS  HN      3.62 #SUP  0.98  #QF  0.98
 17 GLU  HB3    18 CYSS HN      3.76 #SUP  0.99  #QF  0.99
 15 CYSS HB2    22 PHE  QD      4.36 #SUP  1.00
 15 CYSS HB3    22 PHE  QE      3.38 #SUP  0.96  #QF  0.96
 15 CYSS HB2    22 PHE  QE      3.08 #SUP  1.00  #QF  0.94
 17 GLU  HB2    35 HIS  HD2     4.31 #SUP  0.97  #QF  0.97
 14 THR  HA     15 CYSS HB3     4.81 #SUP  1.00
 14 THR  HA     15 CYSS HB2     4.64 #SUP  1.00
 15 CYSS HB3    19 GLY  HA2     5.17 #SUP  0.99  #QF  0.99
 17 GLU  HB3    35 HIS  HB3     4.91 #SUP  0.60  #QF  0.60
 15 CYSS HB3    17 GLU  HB2     5.23 #SUP  0.97  #QF  0.92
 17 GLU  HB2    35 HIS  HB3     5.50 #SUP  0.97  #QF  0.92
 15 CYSS HB3    20 LYS  HB2     4.04 #SUP  1.00
 15 CYSS HB3    28 LEU  QD1     3.60 #SUP  1.00
 15 CYSS HB2    28 LEU  QD1     3.24 #SUP  0.98  #QF  0.98
 29 ARG  HN     29 ARG  HB3     3.78 #SUP  1.00
 29 ARG  HB3    30 ILE  HN      4.00 #SUP  0.99  #QF  0.99
 15 CYSS HB3    19 GLY  HA1     4.61 #SUP  0.99  #QF  0.99
 25 ILE  HA     25 ILE  HG12    3.87 #SUP  1.00
 25 ILE  HA     25 ILE  HG13    4.07 #SUP  1.00
 15 CYSS HB3    20 LYS  HB3     4.53 #SUP  1.00
 15 CYSS HB2    20 LYS  HB3     4.59 #SUP  1.00
 20 LYS  HD3    21 ASN  HN      4.00 #SUP  0.88  #QF  0.88
 20 LYS  HD2    21 ASN  HN      4.12 #SUP  0.98  #QF  0.98
 20 LYS  HN     20 LYS  HD3     4.79 #SUP  0.90  #QF  0.90
 30 ILE  HN     30 ILE  HG13    3.31 #SUP  0.99  #QF  0.99
 30 ILE  HN     30 ILE  HG12    3.66 #SUP  1.00
 20 LYS  HD2    22 PHE  QE      4.59 #SUP  1.00
 20 LYS  HD3    22 PHE  QE      5.16 #SUP  0.99  #QF  0.99
 20 LYS  HD3    22 PHE  HZ      4.79 #SUP  1.00
 27 ALA  HA     30 ILE  HG13    4.18 #SUP  1.00
 20 LYS  HA     20 LYS  HD3     4.51 #SUP  1.00
 20 LYS  HA     20 LYS  HD2     4.52 #SUP  1.00
 30 ILE  HA     30 ILE  HG13    3.39 #SUP  1.00
 25 ILE  HG13   29 ARG  HG2     4.55 #SUP  0.72  #QF  0.44
 20 LYS  HB3    20 LYS  HD3     3.60 #SUP  0.99  #QF  0.99
 11 LYS  HA     11 LYS  QD      4.39 #SUP  0.98  #QF  0.98
 32 GLN  HA     35 HIS  HB3     5.06 #SUP  1.00
 17 GLU  HG3    35 HIS  HB3     5.11 #SUP  0.98  #QF  0.98
 32 GLN  HN     32 GLN  HB3     3.60 #SUP  1.00
 31 HIS  HB2    32 GLN  HN      4.27 #SUP  1.00
 22 PHE  QD     31 HIS  HB3     4.71 #SUP  0.97  #QF  0.97
 22 PHE  QD     31 HIS  HB2     4.72 #SUP  0.98  #QF  0.98
 31 HIS  HB3    31 HIS  HD2     3.67 #SUP  1.00  #QF  0.96
 22 PHE  QE     31 HIS  HB2     3.57 #SUP  0.97  #QF  0.97
 29 ARG  HA     32 GLN  HB3     4.48 #SUP  1.00
 32 GLN  HB3    35 HIS  HB2     4.88 #SUP  0.95  #QF  0.95
 31 HIS  HB3    32 GLN  HB2     5.50 #SUP  1.00  #QF  0.99
 32 GLN  HB2    35 HIS  HB2     5.50 #SUP  1.00  #QF  0.99
 32 GLN  HB2    33 ARG  HG3     4.65 #SUP  0.88  #QF  0.88
 28 LEU  QD1    31 HIS  HB3     4.02 #SUP  0.98  #QF  0.98
 28 LEU  QD1    31 HIS  HB2     5.06 #SUP  0.97  #QF  0.97
 21 ASN  HA     22 PHE  QD      3.88 #SUP  1.00
 21 ASN  HA     22 PHE  QE      4.87 #SUP  1.00
 14 THR  HA     21 ASN  HA      3.39 #SUP  0.92  #QF  0.92
 13 HIS  HB2    21 ASN  HA      5.50 #SUP  1.00  #QF  0.88
 15 CYSS HB2    21 ASN  HA      5.50 #SUP  1.00  #QF  0.88
 21 ASN  HA     22 PHE  HB2     4.84 #SUP  0.94  #QF  0.94
 30 ILE  HB     31 HIS  HB2     4.75 #SUP  0.96  #QF  0.96
 14 THR  QG2    21 ASN  HA      4.07 #SUP  0.99  #QF  0.99
 23 CYS  HB2    24 TYR  QD      4.66 #SUP  0.73  #QF  0.24
 23 CYS  HB3    24 TYR  QD      4.66 #SUP  0.73  #QF  0.24
 29 ARG  HN     29 ARG  HG2     3.64 #SUP  1.00
 29 ARG  HG3    30 ILE  HN      4.74 #SUP  1.00
 29 ARG  HG2    30 ILE  HN      4.73 #SUP  0.99  #QF  0.99
 26 SER  HA     29 ARG  HG2     4.43 #SUP  1.00
 25 ILE  HA     28 LEU  HG      5.16 #SUP  1.00
 28 LEU  HG     32 GLN  HG3     3.96 #SUP  1.00
 25 ILE  HG12   29 ARG  HG3     4.63 #SUP  0.96  #QF  0.96
 25 ILE  HG13   29 ARG  HG3     4.74 #SUP  0.98  #QF  0.98
 25 ILE  QG2    29 ARG  HG2     4.20 #SUP  0.99  #QF  0.99
 33 ARG  HG3    34 VAL  HN      4.90 #SUP  0.99  #QF  0.99
 33 ARG  HG2    34 VAL  HN      5.23 #SUP  1.00
 33 ARG  HA     33 ARG  HG3     3.76 #SUP  1.00
 30 ILE  HA     33 ARG  HG2     4.30 #SUP  0.99  #QF  0.99
 22 PHE  QE     28 LEU  QD2     5.24 #SUP  0.98  #QF  0.97
 28 LEU  QD2    31 HIS  HD2     5.50 #SUP  0.98  #QF  0.97
 28 LEU  QD2    29 ARG  HA      4.89 #SUP  0.99  #QF  0.99
 22 PHE  HB2    28 LEU  QD2     4.73 #SUP  1.00
 28 LEU  QD2    29 ARG  HN      4.63 #SUP  1.00
 28 LEU  QD2    32 GLN  HE21    4.52 #SUP  0.97  #QF  0.97
 22 PHE  QD     28 LEU  QD2     4.41 #SUP  1.00
 28 LEU  HN     28 LEU  QD2     4.35 #SUP  1.00
 28 LEU  QD2    32 GLN  HE22    4.31 #SUP  0.91  #QF  0.91
 20 LYS  HG2    22 PHE  QE      4.77 #SUP  1.00
 15 CYSS HA     28 LEU  QD2     4.60 #SUP  0.67  #QF  0.67
 25 ILE  HA     28 LEU  QD2     3.98 #SUP  0.99  #QF  0.99
 13 HIS  HB3    28 LEU  QD2     3.21 #SUP  0.98  #QF  0.98
 13 HIS  HB2    28 LEU  QD2     3.51 #SUP  1.00
 27 ALA  QB     28 LEU  QD2     5.50 #SUP  1.00
 28 LEU  QD2    29 ARG  HG3     5.50 #SUP  1.00
 28 LEU  HB2    28 LEU  QD2     3.40 #SUP  0.98  #QF  0.98
 20 LYS  HG2    31 HIS  HE1     5.20 #SUP  1.00
 20 LYS  HN     20 LYS  HG3     4.01 #SUP  1.00
 20 LYS  HG3    22 PHE  QE      4.80 #SUP  1.00
 20 LYS  HA     20 LYS  HG3     3.97 #SUP  1.00
 13 HIS  HD2    23 CYS  HA      5.22 #SUP  0.91  #QF  0.88
 13 HIS  HD2    24 TYR  HA      4.64 #SUP  0.47  #QF  0.47
 13 HIS  HB2    13 HIS  HD2     3.96 #SUP  1.00
 15 CYSS HN     28 LEU  QD1     3.97 #SUP  0.99  #QF  0.99
 28 LEU  QD1    32 GLN  HE21    4.02 #SUP  1.00
 28 LEU  QD1    31 HIS  HN      4.85 #SUP  1.00
 28 LEU  HN     28 LEU  QD1     4.26 #SUP  1.00
 28 LEU  QD1    32 GLN  HE22    4.51 #SUP  1.00
 22 PHE  QE     28 LEU  QD1     3.14 #SUP  1.00  #QF  0.95
 28 LEU  QD1    35 HIS  HD2     4.78 #SUP  0.97  #QF  0.97
 22 PHE  HZ     28 LEU  QD1     4.85 #SUP  1.00
 14 THR  HA     28 LEU  QD1     4.70 #SUP  1.00
 15 CYSS HA     28 LEU  QD1     3.27 #SUP  0.96  #QF  0.96
 22 PHE  HB3    28 LEU  QD1     5.03 #SUP  1.00
 28 LEU  HA     28 LEU  QD1     2.98 #SUP  1.00
 28 LEU  QD1    32 GLN  HG3     3.43 #SUP  0.97  #QF  0.92
 22 PHE  HB2    28 LEU  QD1     4.20 #SUP  1.00
 28 LEU  QD1    32 GLN  HB2     4.55 #SUP  1.00
 28 LEU  QD1    32 GLN  HB3     4.65 #SUP  1.00
 28 LEU  HB3    28 LEU  QD1     3.61 #SUP  1.00
 27 ALA  QB     28 LEU  QD1     5.50 #SUP  0.98  #QF  0.97
 28 LEU  QD1    29 ARG  HG2     5.50 #SUP  0.98  #QF  0.97
 14 THR  HB     15 CYSS HN      4.18 #SUP  0.98  #QF  0.98
 13 HIS  HE1    25 ILE  QG2     5.15 #SUP  0.98  #QF  0.98
 25 ILE  QG2    28 LEU  HN      5.11 #SUP  0.93  #QF  0.93
 25 ILE  QG2    29 ARG  HG3     3.83 #SUP  0.80  #QF  0.80
 30 ILE  QG2    32 GLN  HN      5.38 #SUP  1.00
 33 ARG  HN     36 MET  QE      5.10 #SUP  0.80  #QF  0.80
 24 TYR  HB3    26 SER  HN      5.11 #SUP  0.98  #QF  0.98
 22 PHE  QE     28 LEU  HB2     5.05 #SUP  1.00
 28 LEU  HB2    29 ARG  HA      5.50 #SUP  1.00
 24 TYR  QD     25 ILE  QG2     5.35 #SUP  0.98  #QF  0.98
 17 GLU  HG3    35 HIS  HD2     5.11 #SUP  0.99  #QF  0.99
 31 HIS  HD2    32 GLN  HB3     5.50 #SUP  0.99  #QF  0.99
 31 HIS  HD2    32 GLN  HB2     5.30 #SUP  1.00
 15 CYSS HN     31 HIS  HD2     5.46 #SUP  0.98  #QF  0.98
 39 LYS  HG2    39 LYS  QD      2.98 #SUP  0.89  #QF  0.79
 39 LYS  HG3    39 LYS  QD      2.98 #SUP  0.89  #QF  0.79
 32 GLN  HB2    35 HIS  HD2     5.06 #SUP  1.00
 32 GLN  HB2    32 GLN  HE21    5.20 #SUP  1.00
 20 LYS  HG3    22 PHE  HZ      4.98 #SUP  1.00
 13 HIS  HD2    22 PHE  HB2     5.24 #SUP  0.98  #QF  0.98
 13 HIS  HD2    25 ILE  HB      5.20 #SUP  0.98  #QF  0.98
 13 HIS  HD2    28 LEU  QD2     5.30 #SUP  0.96  #QF  0.96
 14 THR  HN     28 LEU  QD1     5.39 #SUP  1.00  #QF  0.71
 32 GLN  HB2    34 VAL  QG2     5.50 #SUP  0.95  #QF  0.95
 34 VAL  QG2    35 HIS  HB2     5.08 #SUP  1.00  #QF  0.97
 31 HIS  HB3    34 VAL  QG1     5.21 #SUP  0.99  #QF  0.99
  9 GLY  QA     10 GLU  QB      5.03 
 10 GLU  HA     10 GLU  QG      3.61 
 10 GLU  QG     11 LYS  QB      4.03 
 12 SER  QB     21 ASN  QD2     4.84 
 17 GLU  HA     17 GLU  QG      3.40 
 17 GLU  QG     18 CYSS HN      4.10 
 17 GLU  QG     32 GLN  HA      4.69 
 17 GLU  QG     32 GLN  HB3     4.64 
 17 GLU  QG     35 HIS  HB3     4.34 
 17 GLU  QG     35 HIS  HD2     4.37 
 20 LYS  HB3    20 LYS  QE      4.67 
 20 LYS  HG3    20 LYS  QE      3.48 
 21 ASN  HN     21 ASN  QD2     4.67 
 21 ASN  HA     21 ASN  QD2     4.83 
 23 CYS  QB     24 TYR  HN      3.72 
 23 CYS  QB     24 TYR  QD      3.99 
 23 CYS  QB     24 TYR  QE      4.09 
 25 ILE  QG2    29 ARG  QD      4.12 
 26 SER  HA     29 ARG  QD      4.71 
 29 ARG  HN     29 ARG  QD      4.10 
 29 ARG  HA     29 ARG  QD      3.38 
 29 ARG  HB3    29 ARG  QD      3.37 
 33 ARG  HA     36 MET  QB      3.63 
 33 ARG  HA     36 MET  QG      3.62 
 36 MET  HN     36 MET  QB      3.19 
 36 MET  HN     36 MET  QG      3.72 
 36 MET  HA     36 MET  QG      3.49 
 36 MET  QB     37 GLY  QA      4.43 
 37 GLY  QA     38 GLU  QG      5.16 
 38 GLU  HN     38 GLU  QG      4.56 
     14   THR  PHI  -135.00     -75.00
     14   THR  PSI    92.00     152.00
     15   CYSS  PHI  -124.00     -64.00
     15   CYSS  PSI   102.00     162.00
     21   ASN  PHI  -150.00     -90.00
     21   ASN  PSI   109.00     169.00
     22   PHE  PHI  -155.00     -95.00
     22   PHE  PSI   111.00     171.00
     25   ILE  PHI   -94.00     -34.00
     25   ILE  PSI   -66.00      -6.00
     26   SER  PHI   -91.00     -31.00
     26   SER  PSI   -70.00     -10.00
     27   ALA  PHI   -96.00     -36.00
     27   ALA  PSI   -71.00     -11.00
     28   LEU  PHI   -92.00     -32.00
     28   LEU  PSI   -74.00     -14.00
     29   ARG  PHI   -93.00     -33.00
     29   ARG  PSI   -67.00      -7.00
     30   ILE  PHI   -93.00     -33.00
     30   ILE  PSI   -68.00      -8.00
     31   HIS  PHI   -94.00     -34.00
     31   HIS  PSI   -70.00     -10.00
     32   GLN  PHI   -94.00     -34.00
     32   GLN  PSI   -72.00     -12.00
     33   ARG  PHI   -94.00     -34.00
     33   ARG  PSI   -71.00     -11.00
     35   HIS  PHI  -125.50     -65.50
     35   HIS  PSI   -39.79      20.21


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1   1.346 -28.121 -19.951
    2    HA2  GLY   1           1HA      GLY   1   1.868 -25.726 -20.899
    3    HA3  GLY   1           2HA      GLY   1   1.141 -26.432 -22.334
    4    H    SER   2           H        SER   2   0.510 -25.887 -18.879
    5    HA   SER   2           HA       SER   2  -2.257 -25.210 -19.579
    6    HB2  SER   2           1HB      SER   2  -3.196 -26.563 -17.876
    7    HB3  SER   2           2HB      SER   2  -2.032 -27.603 -18.696
    8    HG   SER   2           HG       SER   2  -1.036 -27.801 -16.869
    9    H    SER   3           H        SER   3  -2.977 -23.412 -18.617
   10    HA   SER   3           HA       SER   3  -1.213 -21.814 -17.075
   11    HB2  SER   3           1HB      SER   3  -3.017 -20.201 -16.997
   12    HB3  SER   3           2HB      SER   3  -2.966 -20.911 -18.611
   13    HG   SER   3           HG       SER   3  -4.779 -21.470 -16.510
   14    H    GLY   4           H        GLY   4  -0.956 -21.632 -14.935
   15    HA2  GLY   4           1HA      GLY   4  -3.006 -22.819 -13.179
   16    HA3  GLY   4           2HA      GLY   4  -1.309 -23.221 -12.965
   17    H    SER   5           H        SER   5  -3.063 -20.170 -13.534
   18    HA   SER   5           HA       SER   5  -1.501 -18.959 -11.373
   19    HB2  SER   5           1HB      SER   5  -1.498 -17.815 -13.560
   20    HB3  SER   5           2HB      SER   5  -3.251 -17.646 -13.468
   21    HG   SER   5           HG       SER   5  -2.541 -16.620 -11.274
   22    H    SER   6           H        SER   6  -2.661 -19.873  -9.630
   23    HA   SER   6           HA       SER   6  -5.490 -19.244  -9.375
   24    HB2  SER   6           1HB      SER   6  -4.610 -21.470  -8.680
   25    HB3  SER   6           2HB      SER   6  -3.668 -20.669  -7.422
   26    HG   SER   6           HG       SER   6  -5.801 -21.544  -6.809
   27    H    GLY   7           H        GLY   7  -6.374 -17.895  -7.825
   28    HA2  GLY   7           1HA      GLY   7  -4.454 -16.227  -6.323
   29    HA3  GLY   7           2HA      GLY   7  -5.794 -15.513  -7.208
   30    H    SER   8           H        SER   8  -4.770 -16.514  -4.224
   31    HA   SER   8           HA       SER   8  -7.535 -16.562  -3.226
   32    HB2  SER   8           1HB      SER   8  -7.000 -18.310  -1.639
   33    HB3  SER   8           2HB      SER   8  -6.584 -18.873  -3.257
   34    HG   SER   8           HG       SER   8  -4.723 -17.702  -1.466
   35    H    GLY   9           H        GLY   9  -7.791 -14.806  -2.019
   36    HA2  GLY   9           1HA      GLY   9  -5.820 -14.214   0.053
   37    HA3  GLY   9           2HA      GLY   9  -6.132 -12.949  -1.127
   38    H    GLU  10           H        GLU  10  -7.814 -11.614  -0.813
   39    HA   GLU  10           HA       GLU  10 -10.115 -12.382   0.722
   40    HB2  GLU  10           1HB      GLU  10  -8.198 -11.721   2.367
   41    HB3  GLU  10           2HB      GLU  10  -8.580 -10.078   1.872
   42    HG2  GLU  10           1HG      GLU  10 -10.760 -10.209   2.742
   43    HG3  GLU  10           2HG      GLU  10 -10.670 -11.961   2.912
   44    H    LYS  11           H        LYS  11 -11.767 -10.730   0.750
   45    HA   LYS  11           HA       LYS  11 -11.858  -9.263  -1.688
   46    HB2  LYS  11           1HB      LYS  11 -13.807 -10.317  -0.376
   47    HB3  LYS  11           2HB      LYS  11 -13.746  -8.870   0.623
   48    HG2  LYS  11           1HG      LYS  11 -15.307  -8.210  -0.882
   49    HG3  LYS  11           2HG      LYS  11 -13.857  -7.679  -1.737
   50    HD2  LYS  11           1HD      LYS  11 -15.107 -10.383  -2.166
   51    HD3  LYS  11           2HD      LYS  11 -15.559  -8.960  -3.107
   52    HE2  LYS  11           1HE      LYS  11 -13.935  -9.801  -4.467
   53    HE3  LYS  11           2HE      LYS  11 -12.935  -8.793  -3.422
   54    HZ1  LYS  11           3HZ      LYS  11 -13.053 -11.154  -2.093
   55    HZ2  LYS  11           1HZ      LYS  11 -11.772 -10.644  -3.074
   56    HZ3  LYS  11           2HZ      LYS  11 -12.976 -11.647  -3.709
   57    H    SER  12           H        SER  12 -10.320  -8.595   1.152
   58    HA   SER  12           HA       SER  12 -10.657  -5.686   0.851
   59    HB2  SER  12           1HB      SER  12 -11.218  -6.589   3.087
   60    HB3  SER  12           2HB      SER  12  -9.579  -7.226   3.226
   61    HG   SER  12           HG       SER  12 -10.505  -4.634   3.479
   62    H    HIS  13           H        HIS  13  -8.927  -4.398   0.445
   63    HA   HIS  13           HA       HIS  13  -6.645  -5.518  -0.768
   64    HB2  HIS  13           1HB      HIS  13  -6.865  -2.705   0.307
   65    HB3  HIS  13           2HB      HIS  13  -5.853  -3.272  -1.018
   66    HD1  HIS  13           HD1      HIS  13  -6.931  -3.481  -3.321
   67    HD2  HIS  13           HD2      HIS  13  -9.605  -2.384  -0.337
   68    HE1  HIS  13           HE1      HIS  13  -9.027  -2.782  -4.521
   69    H    THR  14           H        THR  14  -4.832  -6.291   0.078
   70    HA   THR  14           HA       THR  14  -4.199  -5.619   2.877
   71    HB   THR  14           HB       THR  14  -3.568  -8.136   1.326
   72    HG1  THR  14           HG1      THR  14  -5.730  -7.570   2.497
   73   HG21  THR  14          3HG2      THR  14  -2.375  -8.947   3.186
   74   HG22  THR  14          1HG2      THR  14  -2.943  -7.642   4.227
   75   HG23  THR  14          2HG2      THR  14  -1.775  -7.306   2.949
   76    H    CYS  15           H        CYS  15  -2.256  -4.768   3.353
   77    HA   CYS  15           HA       CYS  15  -0.580  -3.861   1.220
   78    HB2  CYS  15           1HB      CYS  15  -1.012  -2.583   3.338
   79    HB3  CYS  15           2HB      CYS  15  -0.022  -3.764   4.189
   80    H    ASP  16           H        ASP  16   0.878  -5.076   0.232
   81    HA   ASP  16           HA       ASP  16   1.823  -7.542   1.318
   82    HB2  ASP  16           1HB      ASP  16   2.246  -6.001  -1.194
   83    HB3  ASP  16           2HB      ASP  16   3.465  -7.198  -0.761
   84    H    GLU  17           H        GLU  17   2.753  -4.338   1.754
   85    HA   GLU  17           HA       GLU  17   5.571  -4.713   2.039
   86    HB2  GLU  17           1HB      GLU  17   3.867  -2.517   3.223
   87    HB3  GLU  17           2HB      GLU  17   5.602  -2.475   2.945
   88    HG2  GLU  17           1HG      GLU  17   3.724  -2.885   0.660
   89    HG3  GLU  17           2HG      GLU  17   4.011  -1.269   1.303
   90    H    CYS  18           H        CYS  18   2.837  -4.588   4.287
   91    HA   CYS  18           HA       CYS  18   4.591  -5.749   6.350
   92    HB2  CYS  18           1HB      CYS  18   3.215  -4.556   8.045
   93    HB3  CYS  18           2HB      CYS  18   4.106  -3.467   6.988
   94    H    GLY  19           H        GLY  19   1.292  -5.475   5.096
   95    HA2  GLY  19           1HA      GLY  19   0.114  -7.608   4.740
   96    HA3  GLY  19           2HA      GLY  19   0.727  -8.110   6.308
   97    H    LYS  20           H        LYS  20  -0.411  -4.864   5.822
   98    HA   LYS  20           HA       LYS  20  -2.389  -5.195   7.877
   99    HB2  LYS  20           1HB      LYS  20  -1.365  -2.917   6.238
  100    HB3  LYS  20           2HB      LYS  20  -2.917  -2.738   7.046
  101    HG2  LYS  20           1HG      LYS  20  -0.563  -3.690   8.606
  102    HG3  LYS  20           2HG      LYS  20  -0.716  -1.975   8.216
  103    HD2  LYS  20           1HD      LYS  20  -2.675  -1.743   9.450
  104    HD3  LYS  20           2HD      LYS  20  -3.012  -3.476   9.421
  105    HE2  LYS  20           1HE      LYS  20  -2.299  -3.033  11.613
  106    HE3  LYS  20           2HE      LYS  20  -0.898  -3.744  10.815
  107    HZ1  LYS  20           3HZ      LYS  20  -0.105  -1.897  12.000
  108    HZ2  LYS  20           1HZ      LYS  20  -1.365  -0.896  11.476
  109    HZ3  LYS  20           2HZ      LYS  20  -0.166  -1.386  10.388
  110    H    ASN  21           H        ASN  21  -4.573  -3.895   7.322
  111    HA   ASN  21           HA       ASN  21  -5.633  -4.944   4.789
  112    HB2  ASN  21           1HB      ASN  21  -6.182  -6.258   7.024
  113    HB3  ASN  21           2HB      ASN  21  -7.381  -4.982   7.211
  114   HD21  ASN  21          1HD2      ASN  21  -6.162  -7.201   4.725
  115   HD22  ASN  21          2HD2      ASN  21  -7.714  -7.589   4.071
  116    H    PHE  22           H        PHE  22  -7.103  -3.664   3.754
  117    HA   PHE  22           HA       PHE  22  -8.168  -1.316   5.113
  118    HB2  PHE  22           1HB      PHE  22  -6.620  -1.062   2.529
  119    HB3  PHE  22           2HB      PHE  22  -7.361   0.243   3.450
  120    HD1  PHE  22           HD2      PHE  22  -4.584  -2.144   3.314
  121    HD2  PHE  22           HD1      PHE  22  -6.311   1.130   5.414
  122    HE1  PHE  22           HE2      PHE  22  -2.483  -1.838   4.557
  123    HE2  PHE  22           HE1      PHE  22  -4.213   1.443   6.660
  124    HZ   PHE  22           HZ       PHE  22  -2.296  -0.043   6.234
  125    H    CYS  23           H        CYS  23 -10.278  -1.516   4.770
  126    HA   CYS  23           HA       CYS  23 -11.575  -3.029   2.894
  127    HB2  CYS  23           1HB      CYS  23 -12.433  -0.482   4.264
  128    HB3  CYS  23           2HB      CYS  23 -13.516  -1.401   3.226
  129    HG   CYS  23           HG       CYS  23 -14.406  -2.399   5.480
  130    H    TYR  24           H        TYR  24 -10.647   0.383   2.609
  131    HA   TYR  24           HA       TYR  24 -11.331   0.267  -0.251
  132    HB2  TYR  24           1HB      TYR  24 -10.968   2.885   0.119
  133    HB3  TYR  24           2HB      TYR  24 -12.507   2.098   0.452
  134    HD1  TYR  24           HD2      TYR  24 -12.762   1.180   2.917
  135    HD2  TYR  24           HD1      TYR  24 -10.044   4.238   1.748
  136    HE1  TYR  24           HE2      TYR  24 -12.672   1.980   5.241
  137    HE2  TYR  24           HE1      TYR  24  -9.946   5.046   4.069
  138    HH   TYR  24           HH       TYR  24 -10.334   4.085   6.371
  139    H    ILE  25           H        ILE  25  -9.724   0.180  -1.664
  140    HA   ILE  25           HA       ILE  25  -7.066  -0.071  -1.111
  141    HB   ILE  25           HB       ILE  25  -8.218  -0.428  -3.343
  142   HG12  ILE  25          1HG1      ILE  25  -6.097   0.328  -4.626
  143   HG13  ILE  25          2HG1      ILE  25  -5.515   0.861  -3.052
  144   HG21  ILE  25          1HG2      ILE  25  -9.206   1.803  -3.535
  145   HG22  ILE  25          2HG2      ILE  25  -7.594   2.504  -3.669
  146   HG23  ILE  25          3HG2      ILE  25  -8.193   1.422  -4.926
  147   HD11  ILE  25          3HD1      ILE  25  -6.101  -1.913  -3.999
  148   HD12  ILE  25          1HD1      ILE  25  -4.619  -1.263  -3.298
  149   HD13  ILE  25          2HD1      ILE  25  -6.036  -1.526  -2.280
  150    H    SER  26           H        SER  26  -8.808   2.934  -1.796
  151    HA   SER  26           HA       SER  26  -6.792   4.749  -2.026
  152    HB2  SER  26           1HB      SER  26  -9.362   5.081  -0.460
  153    HB3  SER  26           2HB      SER  26  -8.321   6.408  -0.976
  154    HG   SER  26           HG       SER  26  -8.651   5.460  -3.169
  155    H    ALA  27           H        ALA  27  -8.104   3.451   1.004
  156    HA   ALA  27           HA       ALA  27  -6.533   4.970   2.762
  157    HB1  ALA  27           3HB      ALA  27  -7.004   2.391   3.880
  158    HB2  ALA  27           1HB      ALA  27  -7.800   3.921   4.248
  159    HB3  ALA  27           2HB      ALA  27  -8.428   2.886   2.965
  160    H    LEU  28           H        LEU  28  -5.988   1.730   1.401
  161    HA   LEU  28           HA       LEU  28  -3.642   1.068   2.687
  162    HB2  LEU  28           1HB      LEU  28  -4.446  -0.647   1.412
  163    HB3  LEU  28           2HB      LEU  28  -4.828   0.402   0.048
  164    HG   LEU  28           HG       LEU  28  -2.321   0.534  -0.358
  165   HD11  LEU  28          1HD1      LEU  28  -1.713  -2.007   0.767
  166   HD12  LEU  28          2HD1      LEU  28  -2.293  -0.945   2.050
  167   HD13  LEU  28          3HD1      LEU  28  -0.927  -0.453   1.049
  168   HD21  LEU  28          3HD2      LEU  28  -2.456  -2.067  -1.096
  169   HD22  LEU  28          1HD2      LEU  28  -3.205  -0.741  -1.986
  170   HD23  LEU  28          2HD2      LEU  28  -4.166  -1.699  -0.859
  171    H    ARG  29           H        ARG  29  -4.015   2.908  -0.332
  172    HA   ARG  29           HA       ARG  29  -1.333   3.295  -0.927
  173    HB2  ARG  29           1HB      ARG  29  -3.540   5.312  -1.365
  174    HB3  ARG  29           2HB      ARG  29  -2.033   5.185  -2.262
  175    HG2  ARG  29           1HG      ARG  29  -4.153   3.050  -2.214
  176    HG3  ARG  29           2HG      ARG  29  -4.019   4.295  -3.457
  177    HD2  ARG  29           1HD      ARG  29  -1.991   2.170  -2.781
  178    HD3  ARG  29           2HD      ARG  29  -2.969   2.277  -4.244
  179    HE   ARG  29           HE       ARG  29  -0.558   3.737  -3.654
  180   HH11  ARG  29          1HH1      ARG  29  -3.480   3.648  -5.545
  181   HH12  ARG  29          2HH1      ARG  29  -2.851   4.661  -6.803
  182   HH21  ARG  29          1HH2      ARG  29   0.281   5.070  -5.303
  183   HH22  ARG  29          2HH2      ARG  29  -0.712   5.468  -6.665
  184    H    ILE  30           H        ILE  30  -3.463   5.208   1.162
  185    HA   ILE  30           HA       ILE  30  -1.623   7.249   1.761
  186    HB   ILE  30           HB       ILE  30  -3.897   6.213   3.458
  187   HG12  ILE  30          1HG1      ILE  30  -3.875   8.623   1.641
  188   HG13  ILE  30          2HG1      ILE  30  -4.425   7.038   1.108
  189   HG21  ILE  30          1HG2      ILE  30  -2.762   7.493   4.969
  190   HG22  ILE  30          2HG2      ILE  30  -2.044   8.519   3.728
  191   HG23  ILE  30          3HG2      ILE  30  -3.731   8.745   4.192
  192   HD11  ILE  30          3HD1      ILE  30  -5.959   9.002   2.277
  193   HD12  ILE  30          1HD1      ILE  30  -6.403   7.307   2.073
  194   HD13  ILE  30          2HD1      ILE  30  -5.680   7.854   3.586
  195    H    HIS  31           H        HIS  31  -2.246   4.118   3.262
  196    HA   HIS  31           HA       HIS  31  -0.521   4.532   5.491
  197    HB2  HIS  31           1HB      HIS  31  -2.044   2.858   5.930
  198    HB3  HIS  31           2HB      HIS  31  -1.951   2.197   4.300
  199    HD1  HIS  31           HD1      HIS  31  -0.118   2.171   7.589
  200    HD2  HIS  31           HD2      HIS  31  -0.120   0.161   3.954
  201    HE1  HIS  31           HE1      HIS  31   1.394   0.188   7.917
  202    H    GLN  32           H        GLN  32  -0.129   3.085   2.299
  203    HA   GLN  32           HA       GLN  32   2.308   1.837   2.563
  204    HB2  GLN  32           1HB      GLN  32   1.030   3.294   0.271
  205    HB3  GLN  32           2HB      GLN  32   2.641   2.609   0.104
  206    HG2  GLN  32           1HG      GLN  32   1.543   0.432   0.962
  207    HG3  GLN  32           2HG      GLN  32   0.031   1.217   0.508
  208   HE21  GLN  32          1HE2      GLN  32   0.233   2.301  -1.760
  209   HE22  GLN  32          2HE2      GLN  32   0.873   1.274  -2.993
  210    H    ARG  33           H        ARG  33   1.607   5.239   2.495
  211    HA   ARG  33           HA       ARG  33   4.035   6.334   1.764
  212    HB2  ARG  33           1HB      ARG  33   2.194   7.340   3.941
  213    HB3  ARG  33           2HB      ARG  33   3.401   8.290   3.085
  214    HG2  ARG  33           1HG      ARG  33   2.184   8.111   1.034
  215    HG3  ARG  33           2HG      ARG  33   1.051   6.965   1.754
  216    HD2  ARG  33           1HD      ARG  33   0.353   8.733   3.346
  217    HD3  ARG  33           2HD      ARG  33   1.409   9.864   2.501
  218    HE   ARG  33           HE       ARG  33  -0.430   8.608   0.726
  219   HH11  ARG  33          1HH1      ARG  33  -0.126  11.123   3.114
  220   HH12  ARG  33          2HH1      ARG  33  -1.416  12.078   2.462
  221   HH21  ARG  33          1HH2      ARG  33  -2.130   9.857  -0.142
  222   HH22  ARG  33          2HH2      ARG  33  -2.555  11.357   0.610
  223    H    VAL  34           H        VAL  34   3.138   4.734   4.725
  224    HA   VAL  34           HA       VAL  34   5.302   5.646   6.319
  225    HB   VAL  34           HB       VAL  34   4.719   3.928   7.879
  226   HG11  VAL  34          1HG1      VAL  34   2.486   4.488   8.334
  227   HG12  VAL  34          2HG1      VAL  34   3.123   5.872   7.444
  228   HG13  VAL  34          3HG1      VAL  34   2.099   4.692   6.626
  229   HG21  VAL  34          3HG2      VAL  34   4.145   1.889   7.213
  230   HG22  VAL  34          1HG2      VAL  34   2.629   2.520   6.571
  231   HG23  VAL  34          2HG2      VAL  34   4.061   2.452   5.544
  232    H    HIS  35           H        HIS  35   4.992   3.208   3.886
  233    HA   HIS  35           HA       HIS  35   7.412   1.817   4.664
  234    HB2  HIS  35           1HB      HIS  35   5.512   1.506   2.340
  235    HB3  HIS  35           2HB      HIS  35   6.987   0.557   2.497
  236    HD1  HIS  35           HD1      HIS  35   7.099  -1.050   4.628
  237    HD2  HIS  35           HD2      HIS  35   3.373   0.580   3.778
  238    HE1  HIS  35           HE1      HIS  35   5.447  -2.440   5.917
  239    H    MET  36           H        MET  36   6.411   4.272   2.397
  240    HA   MET  36           HA       MET  36   8.406   4.257   0.520
  241    HB2  MET  36           1HB      MET  36   7.230   6.702   1.854
  242    HB3  MET  36           2HB      MET  36   8.067   6.681   0.307
  243    HG2  MET  36           1HG      MET  36   5.674   4.950   0.703
  244    HG3  MET  36           2HG      MET  36   5.466   6.675   0.410
  245    HE1  MET  36           3HE      MET  36   4.968   3.650  -1.080
  246    HE2  MET  36           1HE      MET  36   5.730   3.568  -2.669
  247    HE3  MET  36           2HE      MET  36   6.672   3.215  -1.221
  248    H    GLY  37           H        GLY  37  10.546   4.268   0.662
  249    HA2  GLY  37           1HA      GLY  37  11.982   6.156   2.225
  250    HA3  GLY  37           2HA      GLY  37  12.012   4.577   2.996
  251    H    GLU  38           H        GLU  38  12.106   2.965   0.694
  252    HA   GLU  38           HA       GLU  38  14.904   3.236   0.051
  253    HB2  GLU  38           1HB      GLU  38  12.802   1.166  -0.363
  254    HB3  GLU  38           2HB      GLU  38  14.196   1.144  -1.434
  255    HG2  GLU  38           1HG      GLU  38  15.685   0.967   0.478
  256    HG3  GLU  38           2HG      GLU  38  14.305   1.037   1.572
  257    H    LYS  39           H        LYS  39  13.515   5.403  -0.943
  258    HA   LYS  39           HA       LYS  39  13.998   5.080  -3.801
  259    HB2  LYS  39           1HB      LYS  39  11.422   6.187  -2.669
  260    HB3  LYS  39           2HB      LYS  39  11.897   6.287  -4.359
  261    HG2  LYS  39           1HG      LYS  39  11.520   4.064  -4.743
  262    HG3  LYS  39           2HG      LYS  39  11.809   3.612  -3.061
  263    HD2  LYS  39           1HD      LYS  39   9.485   3.346  -3.431
  264    HD3  LYS  39           2HD      LYS  39   9.668   4.833  -2.498
  265    HE2  LYS  39           1HE      LYS  39   8.226   5.574  -4.100
  266    HE3  LYS  39           2HE      LYS  39   9.754   5.908  -4.914
  267    HZ1  LYS  39           3HZ      LYS  39   9.225   4.500  -6.523
  268    HZ2  LYS  39           1HZ      LYS  39   7.682   4.349  -5.846
  269    HZ3  LYS  39           2HZ      LYS  39   8.900   3.252  -5.427
  270    H    CYS  40           H        CYS  40  14.911   6.840  -4.724
  271    HA   CYS  40           HA       CYS  40  15.033   9.304  -3.116
  272    HB2  CYS  40           1HB      CYS  40  17.346   9.555  -4.308
  273    HB3  CYS  40           2HB      CYS  40  17.205   8.525  -2.888
  274    HG   CYS  40           HG       CYS  40  16.809   7.073  -5.920
  275    H    SER  41           H        SER  41  14.620   7.823  -6.207
  276    HA   SER  41           HA       SER  41  14.016  10.460  -7.356
  277    HB2  SER  41           1HB      SER  41  15.674   8.264  -8.597
  278    HB3  SER  41           2HB      SER  41  14.929   9.542  -9.556
  279    HG   SER  41           HG       SER  41  16.749   9.924  -7.410
  280    H    GLY  42           H        GLY  42  12.370   8.273  -6.209
  281    HA2  GLY  42           1HA      GLY  42  10.577   6.906  -6.772
  282    HA3  GLY  42           2HA      GLY  42  10.110   8.356  -7.648
  283    HA   PRO  43           HA       PRO  43  12.278   5.330 -10.775
  284    HB2  PRO  43           1HB      PRO  43  12.394   2.741  -9.967
  285    HB3  PRO  43           2HB      PRO  43  13.697   3.899  -9.672
  286    HG2  PRO  43           1HG      PRO  43  11.534   2.969  -7.823
  287    HG3  PRO  43           2HG      PRO  43  13.258   3.217  -7.492
  288    HD2  PRO  43           1HD      PRO  43  11.365   5.022  -6.791
  289    HD3  PRO  43           2HD      PRO  43  13.012   5.497  -7.253
  290    H    SER  44           H        SER  44   9.935   3.634  -8.682
  291    HA   SER  44           HA       SER  44   8.254   3.213 -11.067
  292    HB2  SER  44           1HB      SER  44   8.733   1.458  -8.665
  293    HB3  SER  44           2HB      SER  44   7.305   1.260  -9.681
  294    HG   SER  44           HG       SER  44   9.356   0.021 -10.172
  295    H    SER  45           H        SER  45   5.915   3.093 -10.627
  296    HA   SER  45           HA       SER  45   5.071   5.338  -9.093
  297    HB2  SER  45           1HB      SER  45   3.856   4.836 -11.094
  298    HB3  SER  45           2HB      SER  45   3.539   3.185 -10.561
  299    HG   SER  45           HG       SER  45   1.795   3.944  -9.695
  300    H    GLY  46           H        GLY  46   3.522   5.330  -7.353
  301    HA2  GLY  46           1HA      GLY  46   2.315   3.587  -5.860
  302    HA3  GLY  46           2HA      GLY  46   3.960   3.052  -5.548
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1 -32.229 -18.833 -13.357
    2    HA2  GLY   1           1HA      GLY   1 -31.346 -17.829 -10.882
    3    HA3  GLY   1           2HA      GLY   1 -31.570 -19.566 -10.731
    4    H    SER   2           H        SER   2 -29.090 -18.346 -10.402
    5    HA   SER   2           HA       SER   2 -27.566 -19.768 -12.397
    6    HB2  SER   2           1HB      SER   2 -26.183 -17.822 -13.040
    7    HB3  SER   2           2HB      SER   2 -27.865 -17.619 -13.528
    8    HG   SER   2           HG       SER   2 -28.138 -16.349 -11.602
    9    H    SER   3           H        SER   3 -25.256 -19.841 -11.867
   10    HA   SER   3           HA       SER   3 -24.806 -19.435  -8.982
   11    HB2  SER   3           1HB      SER   3 -23.436 -21.401  -8.948
   12    HB3  SER   3           2HB      SER   3 -24.932 -21.831  -9.778
   13    HG   SER   3           HG       SER   3 -23.716 -22.401 -11.380
   14    H    GLY   4           H        GLY   4 -24.301 -17.359 -10.746
   15    HA2  GLY   4           1HA      GLY   4 -21.348 -17.357 -10.883
   16    HA3  GLY   4           2HA      GLY   4 -22.372 -16.488 -12.017
   17    H    SER   5           H        SER   5 -20.223 -15.678 -10.024
   18    HA   SER   5           HA       SER   5 -21.333 -13.181  -9.319
   19    HB2  SER   5           1HB      SER   5 -21.195 -13.455  -6.822
   20    HB3  SER   5           2HB      SER   5 -22.513 -14.352  -7.577
   21    HG   SER   5           HG       SER   5 -20.191 -15.280  -6.356
   22    H    SER   6           H        SER   6 -19.796 -12.071  -7.610
   23    HA   SER   6           HA       SER   6 -17.187 -12.162  -8.746
   24    HB2  SER   6           1HB      SER   6 -16.686 -10.301  -7.382
   25    HB3  SER   6           2HB      SER   6 -18.404 -10.131  -7.740
   26    HG   SER   6           HG       SER   6 -18.887 -10.549  -5.709
   27    H    GLY   7           H        GLY   7 -15.222 -12.163  -7.199
   28    HA2  GLY   7           1HA      GLY   7 -15.209 -13.613  -4.812
   29    HA3  GLY   7           2HA      GLY   7 -14.986 -14.764  -6.121
   30    H    SER   8           H        SER   8 -13.432 -13.302  -7.872
   31    HA   SER   8           HA       SER   8 -10.874 -13.784  -7.098
   32    HB2  SER   8           1HB      SER   8 -12.035 -11.795  -9.016
   33    HB3  SER   8           2HB      SER   8 -10.298 -11.788  -8.707
   34    HG   SER   8           HG       SER   8 -11.874 -13.682  -9.998
   35    H    GLY   9           H        GLY   9  -9.079 -12.263  -6.604
   36    HA2  GLY   9           1HA      GLY   9  -8.077 -10.756  -5.193
   37    HA3  GLY   9           2HA      GLY   9  -9.477  -9.730  -5.470
   38    H    GLU  10           H        GLU  10  -7.871 -10.294  -3.023
   39    HA   GLU  10           HA       GLU  10  -9.288 -11.891  -1.217
   40    HB2  GLU  10           1HB      GLU  10  -6.971 -10.662  -1.025
   41    HB3  GLU  10           2HB      GLU  10  -7.936  -9.386  -0.296
   42    HG2  GLU  10           1HG      GLU  10  -8.814 -11.102   1.308
   43    HG3  GLU  10           2HG      GLU  10  -7.609 -12.214   0.662
   44    H    LYS  11           H        LYS  11 -10.590 -11.181   0.630
   45    HA   LYS  11           HA       LYS  11 -12.827  -9.661  -0.204
   46    HB2  LYS  11           1HB      LYS  11 -11.973 -10.980   2.331
   47    HB3  LYS  11           2HB      LYS  11 -13.274  -9.800   2.410
   48    HG2  LYS  11           1HG      LYS  11 -13.361 -12.040   0.429
   49    HG3  LYS  11           2HG      LYS  11 -13.861 -12.285   2.104
   50    HD2  LYS  11           1HD      LYS  11 -15.356 -10.233   1.759
   51    HD3  LYS  11           2HD      LYS  11 -15.049 -10.458   0.036
   52    HE2  LYS  11           1HE      LYS  11 -16.064 -12.679   1.787
   53    HE3  LYS  11           2HE      LYS  11 -17.151 -11.533   1.004
   54    HZ1  LYS  11           3HZ      LYS  11 -16.915 -12.563  -0.936
   55    HZ2  LYS  11           1HZ      LYS  11 -16.177 -13.830  -0.093
   56    HZ3  LYS  11           2HZ      LYS  11 -15.229 -12.626  -0.810
   57    H    SER  12           H        SER  12  -9.834  -8.634   0.727
   58    HA   SER  12           HA       SER  12 -10.664  -5.917   0.966
   59    HB2  SER  12           1HB      SER  12 -10.981  -7.073   3.316
   60    HB3  SER  12           2HB      SER  12  -9.234  -6.857   3.422
   61    HG   SER  12           HG       SER  12 -11.185  -5.040   3.750
   62    H    HIS  13           H        HIS  13  -8.930  -4.453   0.832
   63    HA   HIS  13           HA       HIS  13  -6.619  -5.479  -0.482
   64    HB2  HIS  13           1HB      HIS  13  -7.038  -2.676   0.568
   65    HB3  HIS  13           2HB      HIS  13  -5.932  -3.180  -0.706
   66    HD1  HIS  13           HD1      HIS  13  -6.897  -3.504  -3.049
   67    HD2  HIS  13           HD2      HIS  13  -9.756  -2.529  -0.198
   68    HE1  HIS  13           HE1      HIS  13  -8.980  -2.957  -4.347
   69    H    THR  14           H        THR  14  -4.924  -6.358   0.481
   70    HA   THR  14           HA       THR  14  -4.227  -5.477   3.205
   71    HB   THR  14           HB       THR  14  -3.614  -8.114   1.856
   72    HG1  THR  14           HG1      THR  14  -5.726  -8.148   2.500
   73   HG21  THR  14          3HG2      THR  14  -2.135  -6.898   3.815
   74   HG22  THR  14          1HG2      THR  14  -2.221  -8.637   3.540
   75   HG23  THR  14          2HG2      THR  14  -3.257  -7.884   4.752
   76    H    CYS  15           H        CYS  15  -2.312  -4.539   3.546
   77    HA   CYS  15           HA       CYS  15  -0.629  -3.838   1.375
   78    HB2  CYS  15           1HB      CYS  15  -0.951  -2.479   3.457
   79    HB3  CYS  15           2HB      CYS  15   0.012  -3.670   4.325
   80    H    ASP  16           H        ASP  16   0.741  -5.147   0.380
   81    HA   ASP  16           HA       ASP  16   1.637  -7.606   1.511
   82    HB2  ASP  16           1HB      ASP  16   1.285  -6.903  -0.998
   83    HB3  ASP  16           2HB      ASP  16   2.960  -6.371  -0.874
   84    H    GLU  17           H        GLU  17   2.696  -4.424   1.822
   85    HA   GLU  17           HA       GLU  17   5.502  -4.883   2.041
   86    HB2  GLU  17           1HB      GLU  17   3.921  -2.617   3.258
   87    HB3  GLU  17           2HB      GLU  17   5.638  -2.634   2.880
   88    HG2  GLU  17           1HG      GLU  17   4.791  -3.065   0.445
   89    HG3  GLU  17           2HG      GLU  17   3.299  -2.359   1.061
   90    H    CYS  18           H        CYS  18   2.862  -4.578   4.389
   91    HA   CYS  18           HA       CYS  18   4.639  -5.780   6.409
   92    HB2  CYS  18           1HB      CYS  18   3.335  -4.511   8.121
   93    HB3  CYS  18           2HB      CYS  18   4.266  -3.484   7.036
   94    H    GLY  19           H        GLY  19   1.363  -5.495   5.142
   95    HA2  GLY  19           1HA      GLY  19   0.123  -7.603   4.913
   96    HA3  GLY  19           2HA      GLY  19   0.715  -8.032   6.511
   97    H    LYS  20           H        LYS  20  -0.269  -4.771   5.947
   98    HA   LYS  20           HA       LYS  20  -2.249  -4.904   7.986
   99    HB2  LYS  20           1HB      LYS  20  -1.259  -2.800   6.110
  100    HB3  LYS  20           2HB      LYS  20  -2.782  -2.533   6.949
  101    HG2  LYS  20           1HG      LYS  20  -0.434  -3.384   8.555
  102    HG3  LYS  20           2HG      LYS  20  -0.482  -1.726   7.950
  103    HD2  LYS  20           1HD      LYS  20  -2.835  -1.619   8.936
  104    HD3  LYS  20           2HD      LYS  20  -2.418  -3.106   9.790
  105    HE2  LYS  20           1HE      LYS  20  -0.301  -1.746  10.504
  106    HE3  LYS  20           2HE      LYS  20  -1.305  -0.352  10.106
  107    HZ1  LYS  20           3HZ      LYS  20  -2.996  -1.736  11.601
  108    HZ2  LYS  20           1HZ      LYS  20  -1.924  -0.596  12.245
  109    HZ3  LYS  20           2HZ      LYS  20  -1.543  -2.243  12.303
  110    H    ASN  21           H        ASN  21  -4.433  -3.623   7.347
  111    HA   ASN  21           HA       ASN  21  -5.560  -4.877   4.943
  112    HB2  ASN  21           1HB      ASN  21  -6.054  -6.128   7.159
  113    HB3  ASN  21           2HB      ASN  21  -7.132  -4.779   7.505
  114   HD21  ASN  21          1HD2      ASN  21  -6.563  -7.565   5.534
  115   HD22  ASN  21          2HD2      ASN  21  -8.126  -7.623   4.800
  116    H    PHE  22           H        PHE  22  -7.094  -3.690   3.878
  117    HA   PHE  22           HA       PHE  22  -8.187  -1.292   5.093
  118    HB2  PHE  22           1HB      PHE  22  -6.598  -1.079   2.531
  119    HB3  PHE  22           2HB      PHE  22  -7.351   0.234   3.430
  120    HD1  PHE  22           HD2      PHE  22  -4.551  -2.122   3.325
  121    HD2  PHE  22           HD1      PHE  22  -6.327   1.139   5.405
  122    HE1  PHE  22           HE2      PHE  22  -2.460  -1.786   4.577
  123    HE2  PHE  22           HE1      PHE  22  -4.238   1.482   6.659
  124    HZ   PHE  22           HZ       PHE  22  -2.301   0.017   6.246
  125    H    CYS  23           H        CYS  23 -10.282  -1.543   4.694
  126    HA   CYS  23           HA       CYS  23 -11.461  -3.146   2.790
  127    HB2  CYS  23           1HB      CYS  23 -12.428  -0.723   4.276
  128    HB3  CYS  23           2HB      CYS  23 -13.458  -1.498   3.078
  129    HG   CYS  23           HG       CYS  23 -13.109  -2.264   6.197
  130    H    TYR  24           H        TYR  24 -10.581   0.270   2.543
  131    HA   TYR  24           HA       TYR  24 -11.271   0.184  -0.318
  132    HB2  TYR  24           1HB      TYR  24 -10.956   2.803   0.084
  133    HB3  TYR  24           2HB      TYR  24 -12.482   1.985   0.401
  134    HD1  TYR  24           HD2      TYR  24 -12.673   0.989   2.867
  135    HD2  TYR  24           HD1      TYR  24 -10.124   4.198   1.721
  136    HE1  TYR  24           HE2      TYR  24 -12.608   1.763   5.200
  137    HE2  TYR  24           HE1      TYR  24 -10.052   4.980   4.052
  138    HH   TYR  24           HH       TYR  24 -12.098   3.597   6.518
  139    H    ILE  25           H        ILE  25  -9.653   0.132  -1.719
  140    HA   ILE  25           HA       ILE  25  -6.997  -0.085  -1.165
  141    HB   ILE  25           HB       ILE  25  -8.064  -0.450  -3.401
  142   HG12  ILE  25          1HG1      ILE  25  -6.052   0.395  -4.698
  143   HG13  ILE  25          2HG1      ILE  25  -5.520   1.166  -3.207
  144   HG21  ILE  25          1HG2      ILE  25  -9.238   1.727  -3.489
  145   HG22  ILE  25          2HG2      ILE  25  -7.683   2.522  -3.728
  146   HG23  ILE  25          3HG2      ILE  25  -8.291   1.392  -4.938
  147   HD11  ILE  25          3HD1      ILE  25  -6.108  -1.768  -3.340
  148   HD12  ILE  25          1HD1      ILE  25  -4.536  -1.107  -3.787
  149   HD13  ILE  25          2HD1      ILE  25  -5.154  -0.883  -2.150
  150    H    SER  26           H        SER  26  -8.741   2.922  -1.881
  151    HA   SER  26           HA       SER  26  -6.746   4.755  -2.021
  152    HB2  SER  26           1HB      SER  26  -9.294   5.109  -0.424
  153    HB3  SER  26           2HB      SER  26  -8.294   6.403  -1.085
  154    HG   SER  26           HG       SER  26  -9.012   5.978  -3.058
  155    H    ALA  27           H        ALA  27  -8.110   3.416   0.970
  156    HA   ALA  27           HA       ALA  27  -6.557   4.918   2.765
  157    HB1  ALA  27           3HB      ALA  27  -7.856   3.879   4.232
  158    HB2  ALA  27           1HB      ALA  27  -8.495   2.878   2.928
  159    HB3  ALA  27           2HB      ALA  27  -7.095   2.333   3.853
  160    H    LEU  28           H        LEU  28  -6.039   1.668   1.412
  161    HA   LEU  28           HA       LEU  28  -3.705   1.006   2.743
  162    HB2  LEU  28           1HB      LEU  28  -4.540  -0.741   1.531
  163    HB3  LEU  28           2HB      LEU  28  -4.907   0.264   0.131
  164    HG   LEU  28           HG       LEU  28  -2.450   0.326  -0.359
  165   HD11  LEU  28          1HD1      LEU  28  -1.928  -2.085   1.201
  166   HD12  LEU  28          2HD1      LEU  28  -2.173  -0.642   2.184
  167   HD13  LEU  28          3HD1      LEU  28  -0.924  -0.659   0.940
  168   HD21  LEU  28          3HD2      LEU  28  -3.191  -1.187  -1.817
  169   HD22  LEU  28          1HD2      LEU  28  -4.302  -1.890  -0.641
  170   HD23  LEU  28          2HD2      LEU  28  -2.619  -2.415  -0.687
  171    H    ARG  29           H        ARG  29  -4.082   2.787  -0.306
  172    HA   ARG  29           HA       ARG  29  -1.386   3.105  -0.928
  173    HB2  ARG  29           1HB      ARG  29  -3.567   5.131  -1.447
  174    HB3  ARG  29           2HB      ARG  29  -2.067   4.936  -2.344
  175    HG2  ARG  29           1HG      ARG  29  -4.224   2.844  -2.193
  176    HG3  ARG  29           2HG      ARG  29  -4.074   4.030  -3.491
  177    HD2  ARG  29           1HD      ARG  29  -2.103   1.880  -2.735
  178    HD3  ARG  29           2HD      ARG  29  -3.058   1.984  -4.214
  179    HE   ARG  29           HE       ARG  29  -0.575   3.274  -3.690
  180   HH11  ARG  29          1HH1      ARG  29  -3.602   3.625  -5.373
  181   HH12  ARG  29          2HH1      ARG  29  -2.955   4.679  -6.587
  182   HH21  ARG  29          1HH2      ARG  29   0.289   4.661  -5.282
  183   HH22  ARG  29          2HH2      ARG  29  -0.741   5.266  -6.535
  184    H    ILE  30           H        ILE  30  -3.502   5.101   1.094
  185    HA   ILE  30           HA       ILE  30  -1.665   7.164   1.611
  186    HB   ILE  30           HB       ILE  30  -3.916   6.171   3.363
  187   HG12  ILE  30          1HG1      ILE  30  -3.976   8.578   1.559
  188   HG13  ILE  30          2HG1      ILE  30  -4.384   6.978   0.948
  189   HG21  ILE  30          1HG2      ILE  30  -3.819   8.586   4.186
  190   HG22  ILE  30          2HG2      ILE  30  -2.561   7.486   4.748
  191   HG23  ILE  30          3HG2      ILE  30  -2.213   8.640   3.461
  192   HD11  ILE  30          3HD1      ILE  30  -6.014   8.820   2.363
  193   HD12  ILE  30          1HD1      ILE  30  -6.445   7.251   1.684
  194   HD13  ILE  30          2HD1      ILE  30  -5.836   7.361   3.336
  195    H    HIS  31           H        HIS  31  -2.230   4.067   3.191
  196    HA   HIS  31           HA       HIS  31  -0.494   4.563   5.398
  197    HB2  HIS  31           1HB      HIS  31  -1.994   2.885   5.899
  198    HB3  HIS  31           2HB      HIS  31  -1.911   2.183   4.286
  199    HD1  HIS  31           HD1      HIS  31  -0.003   2.291   7.538
  200    HD2  HIS  31           HD2      HIS  31  -0.102   0.128   3.992
  201    HE1  HIS  31           HE1      HIS  31   1.522   0.326   7.906
  202    H    GLN  32           H        GLN  32  -0.131   2.900   2.294
  203    HA   GLN  32           HA       GLN  32   2.326   1.735   2.560
  204    HB2  GLN  32           1HB      GLN  32   1.053   3.122   0.215
  205    HB3  GLN  32           2HB      GLN  32   2.633   2.362   0.079
  206    HG2  GLN  32           1HG      GLN  32   1.465   0.271   1.021
  207    HG3  GLN  32           2HG      GLN  32  -0.028   1.095   0.575
  208   HE21  GLN  32          1HE2      GLN  32   0.228   2.130  -1.741
  209   HE22  GLN  32          2HE2      GLN  32   0.771   1.020  -2.948
  210    H    ARG  33           H        ARG  33   1.593   5.128   2.335
  211    HA   ARG  33           HA       ARG  33   3.986   6.228   1.541
  212    HB2  ARG  33           1HB      ARG  33   2.133   7.243   3.704
  213    HB3  ARG  33           2HB      ARG  33   3.371   8.198   2.900
  214    HG2  ARG  33           1HG      ARG  33   2.225   8.074   0.817
  215    HG3  ARG  33           2HG      ARG  33   1.084   6.887   1.453
  216    HD2  ARG  33           1HD      ARG  33   0.360   8.632   3.113
  217    HD3  ARG  33           2HD      ARG  33   1.341   9.789   2.214
  218    HE   ARG  33           HE       ARG  33  -0.521   8.384   0.554
  219   HH11  ARG  33          1HH1      ARG  33  -0.140  11.062   2.746
  220   HH12  ARG  33          2HH1      ARG  33  -1.458  11.966   2.077
  221   HH21  ARG  33          1HH2      ARG  33  -2.258   9.565  -0.335
  222   HH22  ARG  33          2HH2      ARG  33  -2.663  11.113   0.325
  223    H    VAL  34           H        VAL  34   3.102   4.954   4.706
  224    HA   VAL  34           HA       VAL  34   5.309   5.856   6.169
  225    HB   VAL  34           HB       VAL  34   4.789   4.197   7.799
  226   HG11  VAL  34          1HG1      VAL  34   2.576   4.730   8.274
  227   HG12  VAL  34          2HG1      VAL  34   3.087   6.049   7.219
  228   HG13  VAL  34          3HG1      VAL  34   2.108   4.731   6.574
  229   HG21  VAL  34          3HG2      VAL  34   3.664   2.728   5.472
  230   HG22  VAL  34          1HG2      VAL  34   4.649   2.141   6.812
  231   HG23  VAL  34          2HG2      VAL  34   2.933   2.467   7.055
  232    H    HIS  35           H        HIS  35   4.941   3.146   3.984
  233    HA   HIS  35           HA       HIS  35   7.391   1.862   4.715
  234    HB2  HIS  35           1HB      HIS  35   5.512   1.558   2.377
  235    HB3  HIS  35           2HB      HIS  35   7.005   0.632   2.506
  236    HD1  HIS  35           HD1      HIS  35   7.167  -0.955   4.677
  237    HD2  HIS  35           HD2      HIS  35   3.395   0.513   3.743
  238    HE1  HIS  35           HE1      HIS  35   5.548  -2.411   5.936
  239    H    MET  36           H        MET  36   6.450   4.328   2.434
  240    HA   MET  36           HA       MET  36   8.457   4.319   0.584
  241    HB2  MET  36           1HB      MET  36   7.218   6.701   1.969
  242    HB3  MET  36           2HB      MET  36   8.220   6.813   0.529
  243    HG2  MET  36           1HG      MET  36   5.636   5.284   0.718
  244    HG3  MET  36           2HG      MET  36   5.812   6.903   0.045
  245    HE1  MET  36           3HE      MET  36   4.515   4.509  -1.922
  246    HE2  MET  36           1HE      MET  36   4.648   6.268  -1.971
  247    HE3  MET  36           2HE      MET  36   5.286   5.298  -3.299
  248    H    GLY  37           H        GLY  37  10.595   4.739   0.518
  249    HA2  GLY  37           1HA      GLY  37  12.282   4.510   2.619
  250    HA3  GLY  37           2HA      GLY  37  12.685   5.461   1.198
  251    H    GLU  38           H        GLU  38  12.263   5.531   4.513
  252    HA   GLU  38           HA       GLU  38  12.199   8.474   4.483
  253    HB2  GLU  38           1HB      GLU  38  10.691   6.565   6.242
  254    HB3  GLU  38           2HB      GLU  38  11.099   8.174   6.820
  255    HG2  GLU  38           1HG      GLU  38   9.635   7.716   4.243
  256    HG3  GLU  38           2HG      GLU  38   8.809   7.870   5.792
  257    H    LYS  39           H        LYS  39  14.474   8.500   4.573
  258    HA   LYS  39           HA       LYS  39  15.873   7.168   6.707
  259    HB2  LYS  39           1HB      LYS  39  16.845   9.297   4.791
  260    HB3  LYS  39           2HB      LYS  39  17.858   8.303   5.830
  261    HG2  LYS  39           1HG      LYS  39  16.667   6.338   4.550
  262    HG3  LYS  39           2HG      LYS  39  16.425   7.589   3.328
  263    HD2  LYS  39           1HD      LYS  39  18.987   8.032   3.767
  264    HD3  LYS  39           2HD      LYS  39  18.950   6.357   4.322
  265    HE2  LYS  39           1HE      LYS  39  18.480   5.534   2.238
  266    HE3  LYS  39           2HE      LYS  39  17.660   7.007   1.722
  267    HZ1  LYS  39           3HZ      LYS  39  20.048   7.994   1.918
  268    HZ2  LYS  39           1HZ      LYS  39  19.593   7.131   0.536
  269    HZ3  LYS  39           2HZ      LYS  39  20.527   6.383   1.730
  270    H    CYS  40           H        CYS  40  15.440  10.607   5.851
  271    HA   CYS  40           HA       CYS  40  16.519  11.780   8.072
  272    HB2  CYS  40           1HB      CYS  40  15.639  13.003   6.100
  273    HB3  CYS  40           2HB      CYS  40  14.002  12.695   6.666
  274    HG   CYS  40           HG       CYS  40  14.592  14.092   9.159
  275    H    SER  41           H        SER  41  13.162  10.668   7.702
  276    HA   SER  41           HA       SER  41  11.947  11.436   9.960
  277    HB2  SER  41           1HB      SER  41  10.624   9.416   9.916
  278    HB3  SER  41           2HB      SER  41  10.999   9.865   8.252
  279    HG   SER  41           HG       SER  41  12.113   7.796   9.818
  280    H    GLY  42           H        GLY  42  14.241   8.726   9.783
  281    HA2  GLY  42           1HA      GLY  42  14.436   8.840  12.731
  282    HA3  GLY  42           2HA      GLY  42  14.614   7.357  11.806
  283    HA   PRO  43           HA       PRO  43  18.821   9.183  12.681
  284    HB2  PRO  43           1HB      PRO  43  19.858   6.931  13.786
  285    HB3  PRO  43           2HB      PRO  43  18.988   8.148  14.726
  286    HG2  PRO  43           1HG      PRO  43  18.005   5.540  13.633
  287    HG3  PRO  43           2HG      PRO  43  17.717   6.266  15.225
  288    HD2  PRO  43           1HD      PRO  43  15.893   6.366  13.226
  289    HD3  PRO  43           2HD      PRO  43  16.064   7.661  14.429
  290    H    SER  44           H        SER  44  17.403   6.946  10.697
  291    HA   SER  44           HA       SER  44  19.195   5.252   9.642
  292    HB2  SER  44           1HB      SER  44  17.069   5.392   8.596
  293    HB3  SER  44           2HB      SER  44  17.296   7.093   8.189
  294    HG   SER  44           HG       SER  44  18.685   6.539   6.598
  295    H    SER  45           H        SER  45  20.902   5.271   8.178
  296    HA   SER  45           HA       SER  45  22.095   7.905   7.620
  297    HB2  SER  45           1HB      SER  45  23.515   5.417   8.596
  298    HB3  SER  45           2HB      SER  45  24.338   6.856   7.994
  299    HG   SER  45           HG       SER  45  24.152   6.882  10.269
  300    H    GLY  46           H        GLY  46  22.371   4.439   6.809
  301    HA2  GLY  46           1HA      GLY  46  22.905   5.248   4.019
  302    HA3  GLY  46           2HA      GLY  46  23.497   3.764   4.751
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1 -16.981 -28.400  14.262
    2    HA2  GLY   1           1HA      GLY   1 -17.566 -29.698  11.702
    3    HA3  GLY   1           2HA      GLY   1 -18.751 -29.106  12.857
    4    H    SER   2           H        SER   2 -17.826 -26.512  13.242
    5    HA   SER   2           HA       SER   2 -18.530 -25.338  10.653
    6    HB2  SER   2           1HB      SER   2 -19.079 -23.316  11.928
    7    HB3  SER   2           2HB      SER   2 -19.914 -24.718  12.598
    8    HG   SER   2           HG       SER   2 -17.841 -24.749  13.985
    9    H    SER   3           H        SER   3 -17.495 -23.195  10.149
   10    HA   SER   3           HA       SER   3 -14.619 -23.518  10.293
   11    HB2  SER   3           1HB      SER   3 -16.012 -22.815   8.217
   12    HB3  SER   3           2HB      SER   3 -16.015 -21.213   8.956
   13    HG   SER   3           HG       SER   3 -13.743 -21.263   8.921
   14    H    GLY   4           H        GLY   4 -17.040 -21.107  11.259
   15    HA2  GLY   4           1HA      GLY   4 -16.564 -20.182  13.555
   16    HA3  GLY   4           2HA      GLY   4 -14.962 -19.827  12.925
   17    H    SER   5           H        SER   5 -15.439 -17.620  13.581
   18    HA   SER   5           HA       SER   5 -17.442 -15.971  12.857
   19    HB2  SER   5           1HB      SER   5 -15.146 -15.459  14.002
   20    HB3  SER   5           2HB      SER   5 -14.638 -15.013  12.373
   21    HG   SER   5           HG       SER   5 -16.823 -13.773  12.550
   22    H    SER   6           H        SER   6 -14.653 -16.704  10.764
   23    HA   SER   6           HA       SER   6 -15.103 -15.254   8.558
   24    HB2  SER   6           1HB      SER   6 -14.411 -18.195   8.670
   25    HB3  SER   6           2HB      SER   6 -14.315 -17.230   7.197
   26    HG   SER   6           HG       SER   6 -12.798 -15.899   8.247
   27    H    GLY   7           H        GLY   7 -16.702 -14.899   7.164
   28    HA2  GLY   7           1HA      GLY   7 -18.958 -16.799   7.147
   29    HA3  GLY   7           2HA      GLY   7 -19.087 -15.083   6.790
   30    H    SER   8           H        SER   8 -18.616 -14.331   4.745
   31    HA   SER   8           HA       SER   8 -18.348 -16.427   2.701
   32    HB2  SER   8           1HB      SER   8 -20.387 -15.139   2.475
   33    HB3  SER   8           2HB      SER   8 -19.482 -13.626   2.524
   34    HG   SER   8           HG       SER   8 -18.758 -15.475   0.574
   35    H    GLY   9           H        GLY   9 -17.213 -13.166   3.540
   36    HA2  GLY   9           1HA      GLY   9 -14.869 -12.630   3.394
   37    HA3  GLY   9           2HA      GLY   9 -14.740 -13.757   2.052
   38    H    GLU  10           H        GLU  10 -13.618 -11.442   1.570
   39    HA   GLU  10           HA       GLU  10 -15.007 -10.420  -0.653
   40    HB2  GLU  10           1HB      GLU  10 -16.372  -9.346   1.117
   41    HB3  GLU  10           2HB      GLU  10 -14.924  -8.556   1.725
   42    HG2  GLU  10           1HG      GLU  10 -15.915  -6.912   0.445
   43    HG3  GLU  10           2HG      GLU  10 -14.711  -7.591  -0.650
   44    H    LYS  11           H        LYS  11 -13.765  -8.936  -1.866
   45    HA   LYS  11           HA       LYS  11 -11.025  -9.268  -1.794
   46    HB2  LYS  11           1HB      LYS  11 -12.070  -8.482  -3.797
   47    HB3  LYS  11           2HB      LYS  11 -12.692  -7.051  -2.984
   48    HG2  LYS  11           1HG      LYS  11 -10.929  -6.113  -4.050
   49    HG3  LYS  11           2HG      LYS  11 -10.107  -6.625  -2.574
   50    HD2  LYS  11           1HD      LYS  11 -10.258  -8.560  -4.824
   51    HD3  LYS  11           2HD      LYS  11  -9.154  -7.192  -4.985
   52    HE2  LYS  11           1HE      LYS  11  -7.751  -8.662  -3.961
   53    HE3  LYS  11           2HE      LYS  11  -8.481  -7.938  -2.529
   54    HZ1  LYS  11           3HZ      LYS  11 -10.122 -10.039  -3.329
   55    HZ2  LYS  11           1HZ      LYS  11  -9.164  -9.942  -1.938
   56    HZ3  LYS  11           2HZ      LYS  11  -8.535 -10.625  -3.352
   57    H    SER  12           H        SER  12  -9.459  -8.513  -0.536
   58    HA   SER  12           HA       SER  12  -9.863  -5.958   0.860
   59    HB2  SER  12           1HB      SER  12  -8.706  -6.977   2.854
   60    HB3  SER  12           2HB      SER  12 -10.312  -7.628   2.528
   61    HG   SER  12           HG       SER  12  -8.860  -9.310   2.925
   62    H    HIS  13           H        HIS  13  -8.240  -4.586   0.564
   63    HA   HIS  13           HA       HIS  13  -5.869  -5.437  -0.837
   64    HB2  HIS  13           1HB      HIS  13  -6.364  -2.686   0.288
   65    HB3  HIS  13           2HB      HIS  13  -5.365  -3.136  -1.090
   66    HD1  HIS  13           HD1      HIS  13  -6.464  -3.155  -3.347
   67    HD2  HIS  13           HD2      HIS  13  -9.201  -2.838  -0.237
   68    HE1  HIS  13           HE1      HIS  13  -8.677  -2.683  -4.445
   69    H    THR  14           H        THR  14  -4.401  -6.514   0.335
   70    HA   THR  14           HA       THR  14  -3.756  -5.567   3.035
   71    HB   THR  14           HB       THR  14  -3.040  -8.151   1.639
   72    HG1  THR  14           HG1      THR  14  -4.414  -8.953   3.418
   73   HG21  THR  14          3HG2      THR  14  -1.598  -6.914   3.644
   74   HG22  THR  14          1HG2      THR  14  -1.569  -8.634   3.256
   75   HG23  THR  14          2HG2      THR  14  -2.642  -8.034   4.521
   76    H    CYS  15           H        CYS  15  -1.824  -4.701   3.547
   77    HA   CYS  15           HA       CYS  15  -0.100  -3.830   1.448
   78    HB2  CYS  15           1HB      CYS  15  -0.520  -2.497   3.493
   79    HB3  CYS  15           2HB      CYS  15   0.326  -3.715   4.441
   80    H    ASP  16           H        ASP  16   1.641  -4.787   0.627
   81    HA   ASP  16           HA       ASP  16   2.492  -7.341   1.699
   82    HB2  ASP  16           1HB      ASP  16   2.199  -7.043  -0.732
   83    HB3  ASP  16           2HB      ASP  16   3.470  -5.823  -0.729
   84    H    GLU  17           H        GLU  17   3.356  -4.120   2.110
   85    HA   GLU  17           HA       GLU  17   6.178  -4.433   2.422
   86    HB2  GLU  17           1HB      GLU  17   4.419  -2.265   3.576
   87    HB3  GLU  17           2HB      GLU  17   6.155  -2.188   3.308
   88    HG2  GLU  17           1HG      GLU  17   4.244  -2.612   1.043
   89    HG3  GLU  17           2HG      GLU  17   4.620  -1.000   1.647
   90    H    CYS  18           H        CYS  18   3.427  -4.333   4.652
   91    HA   CYS  18           HA       CYS  18   5.195  -5.421   6.744
   92    HB2  CYS  18           1HB      CYS  18   3.787  -4.267   8.413
   93    HB3  CYS  18           2HB      CYS  18   4.570  -3.136   7.314
   94    H    GLY  19           H        GLY  19   1.879  -5.277   5.493
   95    HA2  GLY  19           1HA      GLY  19   0.860  -7.524   5.128
   96    HA3  GLY  19           2HA      GLY  19   1.400  -7.907   6.757
   97    H    LYS  20           H        LYS  20   0.147  -4.752   6.023
   98    HA   LYS  20           HA       LYS  20  -1.920  -5.044   7.984
   99    HB2  LYS  20           1HB      LYS  20  -0.918  -2.851   6.233
  100    HB3  LYS  20           2HB      LYS  20  -2.542  -2.698   6.891
  101    HG2  LYS  20           1HG      LYS  20  -0.252  -3.350   8.695
  102    HG3  LYS  20           2HG      LYS  20  -0.533  -1.687   8.174
  103    HD2  LYS  20           1HD      LYS  20  -2.619  -1.587   9.226
  104    HD3  LYS  20           2HD      LYS  20  -2.742  -3.343   9.350
  105    HE2  LYS  20           1HE      LYS  20  -1.260  -3.446  11.134
  106    HE3  LYS  20           2HE      LYS  20  -0.548  -1.878  10.761
  107    HZ1  LYS  20           3HZ      LYS  20  -2.176  -2.116  12.742
  108    HZ2  LYS  20           1HZ      LYS  20  -3.375  -2.032  11.551
  109    HZ3  LYS  20           2HZ      LYS  20  -2.279  -0.758  11.739
  110    H    ASN  21           H        ASN  21  -4.147  -3.933   7.232
  111    HA   ASN  21           HA       ASN  21  -5.016  -5.165   4.716
  112    HB2  ASN  21           1HB      ASN  21  -5.505  -6.585   6.835
  113    HB3  ASN  21           2HB      ASN  21  -6.737  -5.373   7.171
  114   HD21  ASN  21          1HD2      ASN  21  -5.580  -7.420   4.518
  115   HD22  ASN  21          2HD2      ASN  21  -7.149  -7.810   3.908
  116    H    PHE  22           H        PHE  22  -6.591  -4.062   3.623
  117    HA   PHE  22           HA       PHE  22  -7.938  -1.826   4.911
  118    HB2  PHE  22           1HB      PHE  22  -6.337  -1.406   2.382
  119    HB3  PHE  22           2HB      PHE  22  -7.219  -0.188   3.297
  120    HD1  PHE  22           HD2      PHE  22  -4.238  -2.325   3.233
  121    HD2  PHE  22           HD1      PHE  22  -6.295   0.794   5.271
  122    HE1  PHE  22           HE2      PHE  22  -2.206  -1.838   4.532
  123    HE2  PHE  22           HE1      PHE  22  -4.266   1.286   6.573
  124    HZ   PHE  22           HZ       PHE  22  -2.219  -0.031   6.205
  125    H    CYS  23           H        CYS  23  -9.999  -2.247   4.480
  126    HA   CYS  23           HA       CYS  23 -11.010  -3.881   2.501
  127    HB2  CYS  23           1HB      CYS  23 -12.291  -3.071   4.465
  128    HB3  CYS  23           2HB      CYS  23 -12.395  -1.481   3.717
  129    HG   CYS  23           HG       CYS  23 -14.875  -2.592   3.377
  130    H    TYR  24           H        TYR  24 -10.468  -0.386   2.405
  131    HA   TYR  24           HA       TYR  24 -11.090  -0.430  -0.473
  132    HB2  TYR  24           1HB      TYR  24 -11.094   2.189   0.037
  133    HB3  TYR  24           2HB      TYR  24 -12.522   1.187   0.276
  134    HD1  TYR  24           HD2      TYR  24 -12.805   0.166   2.663
  135    HD2  TYR  24           HD1      TYR  24 -10.324   3.509   1.783
  136    HE1  TYR  24           HE2      TYR  24 -12.892   0.845   5.025
  137    HE2  TYR  24           HE1      TYR  24 -10.403   4.196   4.144
  138    HH   TYR  24           HH       TYR  24 -12.559   2.726   6.414
  139    H    ILE  25           H        ILE  25  -9.477  -0.141  -1.860
  140    HA   ILE  25           HA       ILE  25  -6.819  -0.122  -1.262
  141    HB   ILE  25           HB       ILE  25  -7.708  -0.466  -3.534
  142   HG12  ILE  25          1HG1      ILE  25  -5.917   0.844  -4.740
  143   HG13  ILE  25          2HG1      ILE  25  -5.577   1.653  -3.215
  144   HG21  ILE  25          1HG2      ILE  25  -9.257   1.562  -3.341
  145   HG22  ILE  25          2HG2      ILE  25  -7.858   2.514  -3.836
  146   HG23  ILE  25          3HG2      ILE  25  -8.493   1.260  -4.902
  147   HD11  ILE  25          3HD1      ILE  25  -4.125   0.029  -2.820
  148   HD12  ILE  25          1HD1      ILE  25  -5.509  -1.036  -2.578
  149   HD13  ILE  25          2HD1      ILE  25  -4.736  -0.940  -4.160
  150    H    SER  26           H        SER  26  -8.826   2.746  -1.891
  151    HA   SER  26           HA       SER  26  -7.062   4.779  -1.819
  152    HB2  SER  26           1HB      SER  26  -9.812   4.496  -0.690
  153    HB3  SER  26           2HB      SER  26  -8.900   5.956  -0.307
  154    HG   SER  26           HG       SER  26  -8.937   5.142  -2.968
  155    H    ALA  27           H        ALA  27  -8.262   3.047   1.032
  156    HA   ALA  27           HA       ALA  27  -6.863   4.588   2.944
  157    HB1  ALA  27           3HB      ALA  27  -8.648   2.401   2.966
  158    HB2  ALA  27           1HB      ALA  27  -7.220   1.919   3.883
  159    HB3  ALA  27           2HB      ALA  27  -8.103   3.379   4.329
  160    H    LEU  28           H        LEU  28  -6.158   1.334   1.654
  161    HA   LEU  28           HA       LEU  28  -3.760   0.859   2.898
  162    HB2  LEU  28           1HB      LEU  28  -4.527  -0.928   1.680
  163    HB3  LEU  28           2HB      LEU  28  -4.903   0.059   0.269
  164    HG   LEU  28           HG       LEU  28  -2.459   0.220  -0.188
  165   HD11  LEU  28          1HD1      LEU  28  -1.603  -2.066   1.257
  166   HD12  LEU  28          2HD1      LEU  28  -2.291  -0.917   2.404
  167   HD13  LEU  28          3HD1      LEU  28  -0.982  -0.417   1.333
  168   HD21  LEU  28          3HD2      LEU  28  -3.734  -1.359  -1.437
  169   HD22  LEU  28          1HD2      LEU  28  -3.745  -2.502  -0.094
  170   HD23  LEU  28          2HD2      LEU  28  -2.239  -2.156  -0.945
  171    H    ARG  29           H        ARG  29  -4.239   2.525  -0.211
  172    HA   ARG  29           HA       ARG  29  -1.610   3.046  -0.858
  173    HB2  ARG  29           1HB      ARG  29  -3.928   4.940  -1.279
  174    HB3  ARG  29           2HB      ARG  29  -2.428   4.897  -2.197
  175    HG2  ARG  29           1HG      ARG  29  -4.120   2.451  -2.102
  176    HG3  ARG  29           2HG      ARG  29  -4.617   3.800  -3.125
  177    HD2  ARG  29           1HD      ARG  29  -3.321   2.662  -4.616
  178    HD3  ARG  29           2HD      ARG  29  -2.085   3.684  -3.882
  179    HE   ARG  29           HE       ARG  29  -1.956   1.512  -2.339
  180   HH11  ARG  29          1HH1      ARG  29  -2.077   1.853  -5.801
  181   HH12  ARG  29          2HH1      ARG  29  -1.160   0.415  -6.105
  182   HH21  ARG  29          1HH2      ARG  29  -0.748  -0.383  -2.726
  183   HH22  ARG  29          2HH2      ARG  29  -0.405  -0.857  -4.356
  184    H    ILE  30           H        ILE  30  -3.708   4.741   1.403
  185    HA   ILE  30           HA       ILE  30  -2.014   6.957   1.862
  186    HB   ILE  30           HB       ILE  30  -4.117   5.728   3.646
  187   HG12  ILE  30          1HG1      ILE  30  -4.346   8.271   2.056
  188   HG13  ILE  30          2HG1      ILE  30  -4.713   6.711   1.329
  189   HG21  ILE  30          1HG2      ILE  30  -2.838   8.450   3.854
  190   HG22  ILE  30          2HG2      ILE  30  -4.078   7.780   4.912
  191   HG23  ILE  30          3HG2      ILE  30  -2.461   7.076   4.894
  192   HD11  ILE  30          3HD1      ILE  30  -6.273   8.333   3.161
  193   HD12  ILE  30          1HD1      ILE  30  -6.780   7.042   2.071
  194   HD13  ILE  30          2HD1      ILE  30  -6.143   6.649   3.669
  195    H    HIS  31           H        HIS  31  -2.471   3.918   3.655
  196    HA   HIS  31           HA       HIS  31  -0.614   4.410   5.684
  197    HB2  HIS  31           1HB      HIS  31  -1.948   2.585   6.146
  198    HB3  HIS  31           2HB      HIS  31  -1.836   1.953   4.506
  199    HD1  HIS  31           HD1      HIS  31   0.169   2.158   7.700
  200    HD2  HIS  31           HD2      HIS  31   0.106   0.053   4.118
  201    HE1  HIS  31           HE1      HIS  31   1.869   0.324   7.968
  202    H    GLN  32           H        GLN  32  -0.202   2.946   2.491
  203    HA   GLN  32           HA       GLN  32   2.376   2.012   2.664
  204    HB2  GLN  32           1HB      GLN  32   0.946   3.333   0.361
  205    HB3  GLN  32           2HB      GLN  32   2.535   2.599   0.198
  206    HG2  GLN  32           1HG      GLN  32   1.440   0.488   1.153
  207    HG3  GLN  32           2HG      GLN  32  -0.089   1.284   0.780
  208   HE21  GLN  32          1HE2      GLN  32   0.009   2.319  -1.534
  209   HE22  GLN  32          2HE2      GLN  32   0.534   1.235  -2.773
  210    H    ARG  33           H        ARG  33   1.274   5.296   2.605
  211    HA   ARG  33           HA       ARG  33   3.482   6.679   1.702
  212    HB2  ARG  33           1HB      ARG  33   1.571   7.376   3.936
  213    HB3  ARG  33           2HB      ARG  33   2.744   8.503   3.266
  214    HG2  ARG  33           1HG      ARG  33   1.680   8.371   1.096
  215    HG3  ARG  33           2HG      ARG  33   0.544   7.165   1.705
  216    HD2  ARG  33           1HD      ARG  33  -0.723   9.067   1.887
  217    HD3  ARG  33           2HD      ARG  33   0.020   9.019   3.485
  218    HE   ARG  33           HE       ARG  33   1.757  10.532   2.138
  219   HH11  ARG  33          1HH1      ARG  33  -1.718  10.634   2.314
  220   HH12  ARG  33          2HH1      ARG  33  -1.811  12.346   2.064
  221   HH21  ARG  33          1HH2      ARG  33   1.648  12.787   1.809
  222   HH22  ARG  33          2HH2      ARG  33   0.104  13.569   1.776
  223    H    VAL  34           H        VAL  34   3.196   4.738   4.501
  224    HA   VAL  34           HA       VAL  34   5.330   5.993   5.979
  225    HB   VAL  34           HB       VAL  34   5.091   4.199   7.568
  226   HG11  VAL  34          1HG1      VAL  34   3.233   6.043   7.135
  227   HG12  VAL  34          2HG1      VAL  34   2.249   4.612   6.819
  228   HG13  VAL  34          3HG1      VAL  34   3.051   4.806   8.378
  229   HG21  VAL  34          3HG2      VAL  34   3.090   2.538   6.827
  230   HG22  VAL  34          1HG2      VAL  34   3.874   2.819   5.272
  231   HG23  VAL  34          2HG2      VAL  34   4.803   2.172   6.624
  232    H    HIS  35           H        HIS  35   4.965   3.307   3.761
  233    HA   HIS  35           HA       HIS  35   7.676   2.375   4.211
  234    HB2  HIS  35           1HB      HIS  35   5.637   1.478   2.164
  235    HB3  HIS  35           2HB      HIS  35   7.148   0.660   2.550
  236    HD1  HIS  35           HD1      HIS  35   7.289  -0.317   5.064
  237    HD2  HIS  35           HD2      HIS  35   3.509   0.719   3.686
  238    HE1  HIS  35           HE1      HIS  35   5.672  -1.471   6.606
  239    H    MET  36           H        MET  36   6.697   5.039   2.859
  240    HA   MET  36           HA       MET  36   8.219   4.812   0.366
  241    HB2  MET  36           1HB      MET  36   7.057   6.631  -0.436
  242    HB3  MET  36           2HB      MET  36   5.857   5.928   0.641
  243    HG2  MET  36           1HG      MET  36   6.827   7.535   2.406
  244    HG3  MET  36           2HG      MET  36   7.529   8.375   1.025
  245    HE1  MET  36           3HE      MET  36   4.642   9.521  -1.054
  246    HE2  MET  36           1HE      MET  36   6.102   8.532  -1.115
  247    HE3  MET  36           2HE      MET  36   4.516   7.762  -1.071
  248    H    GLY  37           H        GLY  37   8.170   6.509   3.451
  249    HA2  GLY  37           1HA      GLY  37  10.196   8.379   2.949
  250    HA3  GLY  37           2HA      GLY  37   9.769   7.748   4.532
  251    H    GLU  38           H        GLU  38  12.213   8.161   4.652
  252    HA   GLU  38           HA       GLU  38  13.839   6.085   3.444
  253    HB2  GLU  38           1HB      GLU  38  14.552   8.306   5.367
  254    HB3  GLU  38           2HB      GLU  38  15.709   7.207   4.630
  255    HG2  GLU  38           1HG      GLU  38  14.792   8.045   2.393
  256    HG3  GLU  38           2HG      GLU  38  14.072   9.351   3.332
  257    H    LYS  39           H        LYS  39  13.414   7.216   6.803
  258    HA   LYS  39           HA       LYS  39  14.482   4.888   7.975
  259    HB2  LYS  39           1HB      LYS  39  12.751   7.116   9.019
  260    HB3  LYS  39           2HB      LYS  39  13.207   5.760  10.041
  261    HG2  LYS  39           1HG      LYS  39  15.340   7.235   8.582
  262    HG3  LYS  39           2HG      LYS  39  14.614   7.968  10.014
  263    HD2  LYS  39           1HD      LYS  39  15.699   5.162  10.003
  264    HD3  LYS  39           2HD      LYS  39  16.698   6.565  10.386
  265    HE2  LYS  39           1HE      LYS  39  14.130   5.895  11.811
  266    HE3  LYS  39           2HE      LYS  39  15.721   5.379  12.369
  267    HZ1  LYS  39           3HZ      LYS  39  16.350   7.549  12.827
  268    HZ2  LYS  39           1HZ      LYS  39  14.735   7.515  13.331
  269    HZ3  LYS  39           2HZ      LYS  39  15.145   8.227  11.853
  270    H    CYS  40           H        CYS  40  13.518   3.058   7.110
  271    HA   CYS  40           HA       CYS  40  10.693   2.651   7.842
  272    HB2  CYS  40           1HB      CYS  40  12.275   1.637   5.486
  273    HB3  CYS  40           2HB      CYS  40  10.770   0.877   5.990
  274    HG   CYS  40           HG       CYS  40  10.838   4.215   5.334
  275    H    SER  41           H        SER  41  12.746   2.217   9.685
  276    HA   SER  41           HA       SER  41  12.397  -0.636  10.156
  277    HB2  SER  41           1HB      SER  41  15.052   0.704   9.751
  278    HB3  SER  41           2HB      SER  41  14.920  -0.666  10.853
  279    HG   SER  41           HG       SER  41  15.292  -1.650   8.982
  280    H    GLY  42           H        GLY  42  11.607  -0.805  12.140
  281    HA2  GLY  42           1HA      GLY  42  11.707   1.321  14.028
  282    HA3  GLY  42           2HA      GLY  42  11.088  -0.298  14.323
  283    HA   PRO  43           HA       PRO  43  14.853   0.182  16.931
  284    HB2  PRO  43           1HB      PRO  43  13.805  -1.128  19.065
  285    HB3  PRO  43           2HB      PRO  43  13.551   0.597  18.778
  286    HG2  PRO  43           1HG      PRO  43  11.739  -1.709  18.181
  287    HG3  PRO  43           2HG      PRO  43  11.344  -0.127  18.876
  288    HD2  PRO  43           1HD      PRO  43  10.911  -0.722  16.271
  289    HD3  PRO  43           2HD      PRO  43  11.329   0.913  16.820
  290    H    SER  44           H        SER  44  13.253  -2.288  15.372
  291    HA   SER  44           HA       SER  44  15.307  -4.240  16.182
  292    HB2  SER  44           1HB      SER  44  12.948  -4.766  16.981
  293    HB3  SER  44           2HB      SER  44  12.521  -4.988  15.285
  294    HG   SER  44           HG       SER  44  14.008  -6.660  15.160
  295    H    SER  45           H        SER  45  16.447  -5.164  14.584
  296    HA   SER  45           HA       SER  45  15.843  -4.332  11.847
  297    HB2  SER  45           1HB      SER  45  18.309  -5.277  13.259
  298    HB3  SER  45           2HB      SER  45  18.202  -5.452  11.508
  299    HG   SER  45           HG       SER  45  18.920  -3.321  12.794
  300    H    GLY  46           H        GLY  46  14.780  -5.668  10.553
  301    HA2  GLY  46           1HA      GLY  46  15.365  -8.538  10.677
  302    HA3  GLY  46           2HA      GLY  46  13.694  -8.030  10.872
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1   4.716 -19.396  -4.287
    2    HA2  GLY   1           1HA      GLY   1   4.682 -18.828  -6.986
    3    HA3  GLY   1           2HA      GLY   1   5.936 -19.774  -6.197
    4    H    SER   2           H        SER   2   5.437 -22.114  -5.878
    5    HA   SER   2           HA       SER   2   3.983 -23.128  -8.229
    6    HB2  SER   2           1HB      SER   2   6.562 -23.515  -7.827
    7    HB3  SER   2           2HB      SER   2   5.987 -24.792  -6.755
    8    HG   SER   2           HG       SER   2   4.856 -24.649  -9.296
    9    H    SER   3           H        SER   3   4.701 -23.818  -4.823
   10    HA   SER   3           HA       SER   3   2.132 -25.244  -4.661
   11    HB2  SER   3           1HB      SER   3   4.834 -26.120  -3.699
   12    HB3  SER   3           2HB      SER   3   3.391 -26.633  -2.824
   13    HG   SER   3           HG       SER   3   4.110 -27.162  -5.505
   14    H    GLY   4           H        GLY   4   1.311 -23.195  -3.897
   15    HA2  GLY   4           1HA      GLY   4   0.976 -23.025  -1.165
   16    HA3  GLY   4           2HA      GLY   4   2.339 -21.976  -1.529
   17    H    SER   5           H        SER   5  -0.878 -22.654  -2.920
   18    HA   SER   5           HA       SER   5  -1.179 -19.813  -3.514
   19    HB2  SER   5           1HB      SER   5  -3.013 -20.439  -4.918
   20    HB3  SER   5           2HB      SER   5  -1.729 -21.612  -5.208
   21    HG   SER   5           HG       SER   5  -2.836 -23.122  -4.088
   22    H    SER   6           H        SER   6  -2.804 -22.387  -1.701
   23    HA   SER   6           HA       SER   6  -5.049 -21.191  -0.780
   24    HB2  SER   6           1HB      SER   6  -4.417 -23.459  -0.130
   25    HB3  SER   6           2HB      SER   6  -3.110 -22.829   0.873
   26    HG   SER   6           HG       SER   6  -5.094 -21.577   1.806
   27    H    GLY   7           H        GLY   7  -5.648 -19.721   0.774
   28    HA2  GLY   7           1HA      GLY   7  -5.154 -18.365   2.710
   29    HA3  GLY   7           2HA      GLY   7  -3.478 -18.308   2.183
   30    H    SER   8           H        SER   8  -6.721 -17.108   1.571
   31    HA   SER   8           HA       SER   8  -5.520 -14.809   0.179
   32    HB2  SER   8           1HB      SER   8  -6.770 -16.442  -1.340
   33    HB3  SER   8           2HB      SER   8  -8.239 -15.920  -0.516
   34    HG   SER   8           HG       SER   8  -6.423 -14.160  -1.803
   35    H    GLY   9           H        GLY   9  -8.552 -15.915   1.707
   36    HA2  GLY   9           1HA      GLY   9  -9.466 -14.879   3.653
   37    HA3  GLY   9           2HA      GLY   9  -8.590 -13.411   3.244
   38    H    GLU  10           H        GLU  10 -10.298 -12.010   3.251
   39    HA   GLU  10           HA       GLU  10 -12.518 -12.590   1.414
   40    HB2  GLU  10           1HB      GLU  10 -12.776 -11.927   3.963
   41    HB3  GLU  10           2HB      GLU  10 -12.591 -10.299   3.327
   42    HG2  GLU  10           1HG      GLU  10 -14.918 -10.793   3.490
   43    HG3  GLU  10           2HG      GLU  10 -14.477 -10.737   1.785
   44    H    LYS  11           H        LYS  11 -13.367 -10.786   0.143
   45    HA   LYS  11           HA       LYS  11 -11.445  -9.577  -1.452
   46    HB2  LYS  11           1HB      LYS  11 -14.368  -9.152  -1.024
   47    HB3  LYS  11           2HB      LYS  11 -13.482  -7.955  -1.958
   48    HG2  LYS  11           1HG      LYS  11 -14.232  -9.375  -3.599
   49    HG3  LYS  11           2HG      LYS  11 -12.617 -10.015  -3.285
   50    HD2  LYS  11           1HD      LYS  11 -13.924 -11.930  -3.300
   51    HD3  LYS  11           2HD      LYS  11 -13.827 -11.549  -1.580
   52    HE2  LYS  11           1HE      LYS  11 -16.013 -10.807  -1.488
   53    HE3  LYS  11           2HE      LYS  11 -16.075 -10.456  -3.214
   54    HZ1  LYS  11           3HZ      LYS  11 -17.229 -12.572  -2.166
   55    HZ2  LYS  11           1HZ      LYS  11 -15.699 -13.242  -2.434
   56    HZ3  LYS  11           2HZ      LYS  11 -16.574 -12.589  -3.726
   57    H    SER  12           H        SER  12  -9.888  -8.494  -0.265
   58    HA   SER  12           HA       SER  12 -10.534  -5.778   0.426
   59    HB2  SER  12           1HB      SER  12  -9.999  -7.823   2.533
   60    HB3  SER  12           2HB      SER  12  -9.315  -6.212   2.748
   61    HG   SER  12           HG       SER  12 -11.331  -5.351   2.776
   62    H    HIS  13           H        HIS  13  -8.787  -4.445   0.269
   63    HA   HIS  13           HA       HIS  13  -6.459  -5.461  -1.010
   64    HB2  HIS  13           1HB      HIS  13  -6.838  -2.717   0.199
   65    HB3  HIS  13           2HB      HIS  13  -5.691  -3.173  -1.056
   66    HD1  HIS  13           HD1      HIS  13  -6.634  -3.526  -3.452
   67    HD2  HIS  13           HD2      HIS  13  -9.441  -2.238  -0.672
   68    HE1  HIS  13           HE1      HIS  13  -8.624  -2.786  -4.799
   69    H    THR  14           H        THR  14  -4.457  -5.884  -0.236
   70    HA   THR  14           HA       THR  14  -3.992  -5.453   2.642
   71    HB   THR  14           HB       THR  14  -3.317  -7.911   1.019
   72    HG1  THR  14           HG1      THR  14  -5.456  -7.742   1.947
   73   HG21  THR  14          3HG2      THR  14  -2.696  -8.288   3.747
   74   HG22  THR  14          1HG2      THR  14  -1.925  -6.782   3.251
   75   HG23  THR  14          2HG2      THR  14  -1.588  -8.275   2.376
   76    H    CYS  15           H        CYS  15  -2.022  -4.690   3.222
   77    HA   CYS  15           HA       CYS  15  -0.342  -3.624   1.152
   78    HB2  CYS  15           1HB      CYS  15  -0.816  -2.452   3.315
   79    HB3  CYS  15           2HB      CYS  15   0.158  -3.668   4.134
   80    H    ASP  16           H        ASP  16   1.044  -4.870   0.090
   81    HA   ASP  16           HA       ASP  16   2.039  -7.337   1.091
   82    HB2  ASP  16           1HB      ASP  16   3.352  -5.869  -1.170
   83    HB3  ASP  16           2HB      ASP  16   3.076  -7.598  -0.977
   84    H    GLU  17           H        GLU  17   2.980  -4.122   1.580
   85    HA   GLU  17           HA       GLU  17   5.784  -4.478   1.871
   86    HB2  GLU  17           1HB      GLU  17   4.088  -2.384   3.230
   87    HB3  GLU  17           2HB      GLU  17   5.802  -2.292   2.852
   88    HG2  GLU  17           1HG      GLU  17   4.935  -2.603   0.389
   89    HG3  GLU  17           2HG      GLU  17   3.444  -1.960   1.076
   90    H    CYS  18           H        CYS  18   3.074  -4.504   4.155
   91    HA   CYS  18           HA       CYS  18   4.861  -5.768   6.126
   92    HB2  CYS  18           1HB      CYS  18   3.491  -4.681   7.902
   93    HB3  CYS  18           2HB      CYS  18   4.379  -3.533   6.904
   94    H    GLY  19           H        GLY  19   1.543  -5.442   4.935
   95    HA2  GLY  19           1HA      GLY  19   0.394  -7.583   4.478
   96    HA3  GLY  19           2HA      GLY  19   0.996  -8.131   6.035
   97    H    LYS  20           H        LYS  20  -0.214  -4.893   5.551
   98    HA   LYS  20           HA       LYS  20  -2.169  -5.266   7.624
   99    HB2  LYS  20           1HB      LYS  20  -1.247  -2.960   5.952
  100    HB3  LYS  20           2HB      LYS  20  -2.765  -2.830   6.832
  101    HG2  LYS  20           1HG      LYS  20  -0.341  -3.734   8.299
  102    HG3  LYS  20           2HG      LYS  20  -0.504  -2.025   7.889
  103    HD2  LYS  20           1HD      LYS  20  -2.497  -1.814   9.133
  104    HD3  LYS  20           2HD      LYS  20  -2.693  -3.564   9.262
  105    HE2  LYS  20           1HE      LYS  20  -0.635  -3.645  10.638
  106    HE3  LYS  20           2HE      LYS  20  -0.556  -1.885  10.572
  107    HZ1  LYS  20           3HZ      LYS  20  -1.587  -2.627  12.616
  108    HZ2  LYS  20           1HZ      LYS  20  -2.764  -3.482  11.753
  109    HZ3  LYS  20           2HZ      LYS  20  -2.715  -1.794  11.670
  110    H    ASN  21           H        ASN  21  -4.374  -3.966   7.038
  111    HA   ASN  21           HA       ASN  21  -5.420  -5.053   4.519
  112    HB2  ASN  21           1HB      ASN  21  -5.928  -6.493   6.612
  113    HB3  ASN  21           2HB      ASN  21  -7.044  -5.201   7.047
  114   HD21  ASN  21          1HD2      ASN  21  -6.173  -7.069   4.154
  115   HD22  ASN  21          2HD2      ASN  21  -7.800  -7.383   3.662
  116    H    PHE  22           H        PHE  22  -6.898  -3.788   3.491
  117    HA   PHE  22           HA       PHE  22  -8.072  -1.515   4.883
  118    HB2  PHE  22           1HB      PHE  22  -6.475  -1.125   2.346
  119    HB3  PHE  22           2HB      PHE  22  -7.274   0.122   3.298
  120    HD1  PHE  22           HD2      PHE  22  -4.436  -2.202   3.166
  121    HD2  PHE  22           HD1      PHE  22  -6.276   1.001   5.281
  122    HE1  PHE  22           HE2      PHE  22  -2.371  -1.877   4.463
  123    HE2  PHE  22           HE1      PHE  22  -4.213   1.333   6.580
  124    HZ   PHE  22           HZ       PHE  22  -2.257  -0.108   6.173
  125    H    CYS  23           H        CYS  23 -10.164  -1.774   4.475
  126    HA   CYS  23           HA       CYS  23 -11.370  -3.280   2.544
  127    HB2  CYS  23           1HB      CYS  23 -12.383  -0.712   3.778
  128    HB3  CYS  23           2HB      CYS  23 -13.383  -1.838   2.868
  129    HG   CYS  23           HG       CYS  23 -14.004  -2.274   5.505
  130    H    TYR  24           H        TYR  24 -10.537   0.163   2.315
  131    HA   TYR  24           HA       TYR  24 -11.111   0.046  -0.569
  132    HB2  TYR  24           1HB      TYR  24 -10.845   2.671  -0.169
  133    HB3  TYR  24           2HB      TYR  24 -12.369   1.833   0.102
  134    HD1  TYR  24           HD2      TYR  24 -12.643   0.857   2.560
  135    HD2  TYR  24           HD1      TYR  24 -10.066   4.070   1.493
  136    HE1  TYR  24           HE2      TYR  24 -12.664   1.641   4.891
  137    HE2  TYR  24           HE1      TYR  24 -10.079   4.863   3.821
  138    HH   TYR  24           HH       TYR  24 -10.514   3.607   6.189
  139    H    ILE  25           H        ILE  25  -9.460   0.051  -1.935
  140    HA   ILE  25           HA       ILE  25  -6.814  -0.135  -1.291
  141    HB   ILE  25           HB       ILE  25  -7.855  -0.507  -3.563
  142   HG12  ILE  25          1HG1      ILE  25  -5.756   0.305  -4.782
  143   HG13  ILE  25          2HG1      ILE  25  -5.252   0.982  -3.237
  144   HG21  ILE  25          1HG2      ILE  25  -8.980   1.628  -3.804
  145   HG22  ILE  25          2HG2      ILE  25  -7.430   2.469  -3.785
  146   HG23  ILE  25          3HG2      ILE  25  -7.833   1.393  -5.122
  147   HD11  ILE  25          3HD1      ILE  25  -4.188  -1.054  -3.259
  148   HD12  ILE  25          1HD1      ILE  25  -5.653  -1.418  -2.349
  149   HD13  ILE  25          2HD1      ILE  25  -5.536  -1.871  -4.049
  150    H    SER  26           H        SER  26  -8.637   2.822  -1.955
  151    HA   SER  26           HA       SER  26  -6.644   4.694  -2.084
  152    HB2  SER  26           1HB      SER  26  -9.337   4.910  -0.724
  153    HB3  SER  26           2HB      SER  26  -8.290   6.289  -1.057
  154    HG   SER  26           HG       SER  26  -9.546   6.217  -2.810
  155    H    ALA  27           H        ALA  27  -8.083   3.301   0.840
  156    HA   ALA  27           HA       ALA  27  -6.687   4.851   2.715
  157    HB1  ALA  27           3HB      ALA  27  -8.506   2.696   2.771
  158    HB2  ALA  27           1HB      ALA  27  -7.117   2.229   3.753
  159    HB3  ALA  27           2HB      ALA  27  -7.989   3.720   4.109
  160    H    LEU  28           H        LEU  28  -5.927   1.659   1.342
  161    HA   LEU  28           HA       LEU  28  -3.623   1.095   2.760
  162    HB2  LEU  28           1HB      LEU  28  -4.298  -0.659   1.461
  163    HB3  LEU  28           2HB      LEU  28  -4.650   0.366   0.071
  164    HG   LEU  28           HG       LEU  28  -2.163   0.584  -0.260
  165   HD11  LEU  28          1HD1      LEU  28  -1.967  -0.470   2.233
  166   HD12  LEU  28          2HD1      LEU  28  -0.666  -0.461   1.042
  167   HD13  LEU  28          3HD1      LEU  28  -1.677  -1.893   1.232
  168   HD21  LEU  28          3HD2      LEU  28  -2.578  -0.927  -1.828
  169   HD22  LEU  28          1HD2      LEU  28  -3.940  -1.550  -0.897
  170   HD23  LEU  28          2HD2      LEU  28  -2.324  -2.212  -0.646
  171    H    ARG  29           H        ARG  29  -3.964   2.965  -0.236
  172    HA   ARG  29           HA       ARG  29  -1.279   3.440  -0.760
  173    HB2  ARG  29           1HB      ARG  29  -3.530   5.404  -1.211
  174    HB3  ARG  29           2HB      ARG  29  -2.002   5.330  -2.078
  175    HG2  ARG  29           1HG      ARG  29  -3.740   2.926  -2.118
  176    HG3  ARG  29           2HG      ARG  29  -4.225   4.325  -3.077
  177    HD2  ARG  29           1HD      ARG  29  -1.545   2.949  -3.221
  178    HD3  ARG  29           2HD      ARG  29  -2.868   2.724  -4.364
  179    HE   ARG  29           HE       ARG  29  -2.465   5.394  -4.417
  180   HH11  ARG  29          1HH1      ARG  29  -0.344   2.656  -4.768
  181   HH12  ARG  29          2HH1      ARG  29   0.754   3.477  -5.827
  182   HH21  ARG  29          1HH2      ARG  29  -1.027   6.486  -5.811
  183   HH22  ARG  29          2HH2      ARG  29   0.365   5.656  -6.419
  184    H    ILE  30           H        ILE  30  -3.468   5.062   1.466
  185    HA   ILE  30           HA       ILE  30  -1.758   7.228   2.104
  186    HB   ILE  30           HB       ILE  30  -3.994   5.988   3.710
  187   HG12  ILE  30          1HG1      ILE  30  -3.958   8.499   2.024
  188   HG13  ILE  30          2HG1      ILE  30  -4.605   6.953   1.487
  189   HG21  ILE  30          1HG2      ILE  30  -2.283   7.317   5.018
  190   HG22  ILE  30          2HG2      ILE  30  -2.809   8.724   4.095
  191   HG23  ILE  30          3HG2      ILE  30  -3.953   7.873   5.133
  192   HD11  ILE  30          3HD1      ILE  30  -6.555   7.490   2.367
  193   HD12  ILE  30          1HD1      ILE  30  -5.812   7.551   3.965
  194   HD13  ILE  30          2HD1      ILE  30  -5.884   9.005   2.970
  195    H    HIS  31           H        HIS  31  -2.268   4.045   3.567
  196    HA   HIS  31           HA       HIS  31  -0.516   4.463   5.763
  197    HB2  HIS  31           1HB      HIS  31  -1.954   2.718   6.189
  198    HB3  HIS  31           2HB      HIS  31  -1.881   2.112   4.537
  199    HD1  HIS  31           HD1      HIS  31   0.079   2.079   7.759
  200    HD2  HIS  31           HD2      HIS  31  -0.033   0.120   4.097
  201    HE1  HIS  31           HE1      HIS  31   1.654   0.133   7.990
  202    H    GLN  32           H        GLN  32  -0.106   3.105   2.535
  203    HA   GLN  32           HA       GLN  32   2.381   1.950   2.741
  204    HB2  GLN  32           1HB      GLN  32   1.047   3.433   0.494
  205    HB3  GLN  32           2HB      GLN  32   2.662   2.765   0.302
  206    HG2  GLN  32           1HG      GLN  32   1.545   0.571   1.162
  207    HG3  GLN  32           2HG      GLN  32   0.059   1.360   0.638
  208   HE21  GLN  32          1HE2      GLN  32   0.347   2.423  -1.621
  209   HE22  GLN  32          2HE2      GLN  32   1.047   1.395  -2.821
  210    H    ARG  33           H        ARG  33   1.550   5.319   2.786
  211    HA   ARG  33           HA       ARG  33   3.928   6.525   2.053
  212    HB2  ARG  33           1HB      ARG  33   2.066   7.406   4.267
  213    HB3  ARG  33           2HB      ARG  33   3.231   8.422   3.431
  214    HG2  ARG  33           1HG      ARG  33   1.996   8.033   1.324
  215    HG3  ARG  33           2HG      ARG  33   0.790   7.126   2.239
  216    HD2  ARG  33           1HD      ARG  33   1.538  10.005   2.740
  217    HD3  ARG  33           2HD      ARG  33   0.133   9.474   1.815
  218    HE   ARG  33           HE       ARG  33  -0.142   8.217   4.212
  219   HH11  ARG  33          1HH1      ARG  33   0.292  11.530   3.232
  220   HH12  ARG  33          2HH1      ARG  33  -0.588  12.179   4.575
  221   HH21  ARG  33          1HH2      ARG  33  -1.304   9.061   5.985
  222   HH22  ARG  33          2HH2      ARG  33  -1.495  10.774   6.141
  223    H    VAL  34           H        VAL  34   3.058   4.960   5.071
  224    HA   VAL  34           HA       VAL  34   5.203   5.873   6.645
  225    HB   VAL  34           HB       VAL  34   4.704   4.103   8.165
  226   HG11  VAL  34          1HG1      VAL  34   2.974   5.955   7.675
  227   HG12  VAL  34          2HG1      VAL  34   2.026   4.658   6.944
  228   HG13  VAL  34          3HG1      VAL  34   2.480   4.569   8.646
  229   HG21  VAL  34          3HG2      VAL  34   3.749   2.739   5.727
  230   HG22  VAL  34          1HG2      VAL  34   4.562   2.088   7.151
  231   HG23  VAL  34          2HG2      VAL  34   2.832   2.431   7.202
  232    H    HIS  35           H        HIS  35   4.987   3.415   4.199
  233    HA   HIS  35           HA       HIS  35   7.453   2.115   4.927
  234    HB2  HIS  35           1HB      HIS  35   5.612   1.882   2.549
  235    HB3  HIS  35           2HB      HIS  35   7.126   0.990   2.660
  236    HD1  HIS  35           HD1      HIS  35   7.287  -0.776   4.643
  237    HD2  HIS  35           HD2      HIS  35   3.506   0.790   3.930
  238    HE1  HIS  35           HE1      HIS  35   5.688  -2.316   5.824
  239    H    MET  36           H        MET  36   6.435   4.652   2.750
  240    HA   MET  36           HA       MET  36   8.571   4.774   0.997
  241    HB2  MET  36           1HB      MET  36   6.686   6.803   2.111
  242    HB3  MET  36           2HB      MET  36   8.068   7.365   1.181
  243    HG2  MET  36           1HG      MET  36   6.198   7.175  -0.282
  244    HG3  MET  36           2HG      MET  36   7.348   5.900  -0.680
  245    HE1  MET  36           3HE      MET  36   5.084   4.582  -2.056
  246    HE2  MET  36           1HE      MET  36   6.604   3.934  -1.438
  247    HE3  MET  36           2HE      MET  36   5.088   3.095  -1.106
  248    H    GLY  37           H        GLY  37   8.245   6.423   4.143
  249    HA2  GLY  37           1HA      GLY  37  10.006   6.674   5.700
  250    HA3  GLY  37           2HA      GLY  37  11.158   6.342   4.415
  251    H    GLU  38           H        GLU  38  11.234   8.054   2.659
  252    HA   GLU  38           HA       GLU  38  10.493  10.725   3.470
  253    HB2  GLU  38           1HB      GLU  38  13.366   9.819   3.432
  254    HB3  GLU  38           2HB      GLU  38  12.916  11.507   3.237
  255    HG2  GLU  38           1HG      GLU  38  11.556  11.018   5.453
  256    HG3  GLU  38           2HG      GLU  38  12.787   9.770   5.634
  257    H    LYS  39           H        LYS  39  10.293  12.082   1.760
  258    HA   LYS  39           HA       LYS  39  11.552  11.417  -0.780
  259    HB2  LYS  39           1HB      LYS  39   9.400  11.568  -1.999
  260    HB3  LYS  39           2HB      LYS  39   9.476  10.183  -0.918
  261    HG2  LYS  39           1HG      LYS  39   8.307  11.842   0.754
  262    HG3  LYS  39           2HG      LYS  39   7.817  12.642  -0.741
  263    HD2  LYS  39           1HD      LYS  39   7.463   9.689  -0.475
  264    HD3  LYS  39           2HD      LYS  39   6.319  10.773   0.321
  265    HE2  LYS  39           1HE      LYS  39   7.030  10.948  -2.601
  266    HE3  LYS  39           2HE      LYS  39   5.663  10.021  -1.985
  267    HZ1  LYS  39           3HZ      LYS  39   5.951  12.866  -1.281
  268    HZ2  LYS  39           1HZ      LYS  39   4.550  11.919  -1.350
  269    HZ3  LYS  39           2HZ      LYS  39   5.297  12.430  -2.779
  270    H    CYS  40           H        CYS  40  11.321  13.146  -2.382
  271    HA   CYS  40           HA       CYS  40  10.785  15.759  -1.132
  272    HB2  CYS  40           1HB      CYS  40  13.058  14.910  -2.915
  273    HB3  CYS  40           2HB      CYS  40  12.603  16.601  -2.745
  274    HG   CYS  40           HG       CYS  40  14.262  16.916  -0.814
  275    H    SER  41           H        SER  41   8.703  15.866  -2.003
  276    HA   SER  41           HA       SER  41   8.638  16.345  -4.906
  277    HB2  SER  41           1HB      SER  41   6.614  14.827  -3.249
  278    HB3  SER  41           2HB      SER  41   6.302  15.395  -4.890
  279    HG   SER  41           HG       SER  41   7.186  13.141  -4.487
  280    H    GLY  42           H        GLY  42   8.027  18.349  -5.355
  281    HA2  GLY  42           1HA      GLY  42   7.284  20.271  -3.516
  282    HA3  GLY  42           2HA      GLY  42   6.945  20.373  -5.238
  283    HA   PRO  43           HA       PRO  43   2.663  20.288  -4.260
  284    HB2  PRO  43           1HB      PRO  43   1.682  19.463  -6.653
  285    HB3  PRO  43           2HB      PRO  43   2.313  21.092  -6.383
  286    HG2  PRO  43           1HG      PRO  43   3.650  18.726  -7.640
  287    HG3  PRO  43           2HG      PRO  43   3.660  20.423  -8.157
  288    HD2  PRO  43           1HD      PRO  43   5.720  19.298  -6.805
  289    HD3  PRO  43           2HD      PRO  43   5.281  21.009  -6.626
  290    H    SER  44           H        SER  44   2.882  18.507  -2.738
  291    HA   SER  44           HA       SER  44   2.478  15.818  -3.760
  292    HB2  SER  44           1HB      SER  44   3.979  16.433  -1.769
  293    HB3  SER  44           2HB      SER  44   2.484  16.628  -0.854
  294    HG   SER  44           HG       SER  44   3.782  14.399  -1.311
  295    H    SER  45           H        SER  45   0.748  14.449  -2.881
  296    HA   SER  45           HA       SER  45  -1.776  15.393  -3.421
  297    HB2  SER  45           1HB      SER  45  -2.629  13.398  -2.237
  298    HB3  SER  45           2HB      SER  45  -1.259  13.005  -3.276
  299    HG   SER  45           HG       SER  45  -0.628  12.081  -1.462
  300    H    GLY  46           H        GLY  46  -0.164  15.189  -0.267
  301    HA2  GLY  46           1HA      GLY  46  -0.477  16.832   1.428
  302    HA3  GLY  46           2HA      GLY  46  -2.048  17.206   0.734
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1   3.391 -22.462   3.599
    2    HA2  GLY   1           1HA      GLY   1   0.997 -23.226   3.126
    3    HA3  GLY   1           2HA      GLY   1   1.700 -24.837   3.157
    4    H    SER   2           H        SER   2   1.375 -21.902   5.135
    5    HA   SER   2           HA       SER   2   1.756 -23.457   7.564
    6    HB2  SER   2           1HB      SER   2   1.335 -20.501   7.084
    7    HB3  SER   2           2HB      SER   2   1.503 -21.215   8.687
    8    HG   SER   2           HG       SER   2   3.435 -21.653   6.678
    9    H    SER   3           H        SER   3   0.106 -24.465   8.478
   10    HA   SER   3           HA       SER   3  -1.976 -24.959   9.249
   11    HB2  SER   3           1HB      SER   3  -1.744 -22.573  10.139
   12    HB3  SER   3           2HB      SER   3  -2.735 -22.078   8.766
   13    HG   SER   3           HG       SER   3  -3.782 -22.651  10.898
   14    H    GLY   4           H        GLY   4  -1.463 -25.471   6.570
   15    HA2  GLY   4           1HA      GLY   4  -3.001 -24.592   4.559
   16    HA3  GLY   4           2HA      GLY   4  -2.754 -26.311   4.831
   17    H    SER   5           H        SER   5  -4.208 -26.325   7.359
   18    HA   SER   5           HA       SER   5  -6.881 -26.512   6.237
   19    HB2  SER   5           1HB      SER   5  -7.438 -27.605   8.406
   20    HB3  SER   5           2HB      SER   5  -6.099 -28.388   7.567
   21    HG   SER   5           HG       SER   5  -5.080 -28.102   9.380
   22    H    SER   6           H        SER   6  -6.262 -23.917   6.274
   23    HA   SER   6           HA       SER   6  -8.242 -22.809   8.008
   24    HB2  SER   6           1HB      SER   6  -6.924 -21.465   9.426
   25    HB3  SER   6           2HB      SER   6  -6.119 -23.034   9.455
   26    HG   SER   6           HG       SER   6  -4.864 -20.948   9.044
   27    H    GLY   7           H        GLY   7  -8.368 -20.380   7.732
   28    HA2  GLY   7           1HA      GLY   7  -7.644 -18.473   6.367
   29    HA3  GLY   7           2HA      GLY   7  -7.377 -19.613   5.056
   30    H    SER   8           H        SER   8  -9.557 -17.467   6.487
   31    HA   SER   8           HA       SER   8 -11.941 -18.652   5.349
   32    HB2  SER   8           1HB      SER   8 -13.061 -16.602   6.226
   33    HB3  SER   8           2HB      SER   8 -12.163 -17.483   7.462
   34    HG   SER   8           HG       SER   8 -10.553 -15.960   7.363
   35    H    GLY   9           H        GLY   9  -9.912 -15.796   4.773
   36    HA2  GLY   9           1HA      GLY   9  -9.435 -14.846   2.687
   37    HA3  GLY   9           2HA      GLY   9 -10.708 -15.827   1.974
   38    H    GLU  10           H        GLU  10  -9.916 -12.797   2.216
   39    HA   GLU  10           HA       GLU  10 -12.685 -11.894   2.289
   40    HB2  GLU  10           1HB      GLU  10 -11.817 -11.591   4.594
   41    HB3  GLU  10           2HB      GLU  10 -10.534 -10.574   3.953
   42    HG2  GLU  10           1HG      GLU  10 -12.115  -8.927   3.231
   43    HG3  GLU  10           2HG      GLU  10 -13.467  -9.975   3.658
   44    H    LYS  11           H        LYS  11 -13.096 -10.436   0.746
   45    HA   LYS  11           HA       LYS  11 -11.013  -9.683  -1.070
   46    HB2  LYS  11           1HB      LYS  11 -13.911  -8.822  -0.960
   47    HB3  LYS  11           2HB      LYS  11 -12.813  -8.536  -2.304
   48    HG2  LYS  11           1HG      LYS  11 -12.705 -10.830  -2.836
   49    HG3  LYS  11           2HG      LYS  11 -13.465 -11.295  -1.312
   50    HD2  LYS  11           1HD      LYS  11 -15.502 -10.005  -2.096
   51    HD3  LYS  11           2HD      LYS  11 -14.727  -9.930  -3.680
   52    HE2  LYS  11           1HE      LYS  11 -15.156 -12.527  -2.231
   53    HE3  LYS  11           2HE      LYS  11 -16.391 -11.822  -3.274
   54    HZ1  LYS  11           3HZ      LYS  11 -14.945 -11.962  -5.134
   55    HZ2  LYS  11           1HZ      LYS  11 -14.916 -13.474  -4.375
   56    HZ3  LYS  11           2HZ      LYS  11 -13.624 -12.401  -4.173
   57    H    SER  12           H        SER  12  -9.577  -8.351   0.006
   58    HA   SER  12           HA       SER  12 -10.387  -5.587   0.221
   59    HB2  SER  12           1HB      SER  12  -9.499  -7.159   2.643
   60    HB3  SER  12           2HB      SER  12  -9.415  -5.399   2.564
   61    HG   SER  12           HG       SER  12 -11.363  -6.113   3.520
   62    H    HIS  13           H        HIS  13  -8.667  -4.151   0.091
   63    HA   HIS  13           HA       HIS  13  -6.333  -5.108  -1.185
   64    HB2  HIS  13           1HB      HIS  13  -6.871  -2.392   0.036
   65    HB3  HIS  13           2HB      HIS  13  -5.560  -2.771  -1.078
   66    HD1  HIS  13           HD1      HIS  13  -6.157  -3.036  -3.567
   67    HD2  HIS  13           HD2      HIS  13  -9.412  -2.161  -1.138
   68    HE1  HIS  13           HE1      HIS  13  -8.022  -2.420  -5.138
   69    H    THR  14           H        THR  14  -4.756  -6.187  -0.213
   70    HA   THR  14           HA       THR  14  -4.084  -5.528   2.572
   71    HB   THR  14           HB       THR  14  -3.435  -8.012   0.973
   72    HG1  THR  14           HG1      THR  14  -5.313  -8.642   1.692
   73   HG21  THR  14          3HG2      THR  14  -3.125  -8.129   3.869
   74   HG22  THR  14          1HG2      THR  14  -2.018  -6.988   3.106
   75   HG23  THR  14          2HG2      THR  14  -2.037  -8.675   2.594
   76    H    CYS  15           H        CYS  15  -2.116  -4.771   3.115
   77    HA   CYS  15           HA       CYS  15  -0.376  -3.855   1.028
   78    HB2  CYS  15           1HB      CYS  15  -0.787  -2.556   3.101
   79    HB3  CYS  15           2HB      CYS  15   0.038  -3.807   4.025
   80    H    ASP  16           H        ASP  16   1.215  -4.961   0.121
   81    HA   ASP  16           HA       ASP  16   2.035  -7.510   1.181
   82    HB2  ASP  16           1HB      ASP  16   1.767  -6.763  -1.316
   83    HB3  ASP  16           2HB      ASP  16   3.411  -6.163  -1.117
   84    H    GLU  17           H        GLU  17   2.980  -4.342   1.704
   85    HA   GLU  17           HA       GLU  17   5.797  -4.742   2.002
   86    HB2  GLU  17           1HB      GLU  17   4.136  -2.550   3.244
   87    HB3  GLU  17           2HB      GLU  17   5.858  -2.519   2.891
   88    HG2  GLU  17           1HG      GLU  17   3.818  -2.828   0.719
   89    HG3  GLU  17           2HG      GLU  17   4.288  -1.244   1.335
   90    H    CYS  18           H        CYS  18   3.039  -4.623   4.220
   91    HA   CYS  18           HA       CYS  18   4.744  -5.872   6.270
   92    HB2  CYS  18           1HB      CYS  18   3.454  -4.643   7.992
   93    HB3  CYS  18           2HB      CYS  18   4.352  -3.566   6.927
   94    H    GLY  19           H        GLY  19   1.519  -5.500   4.902
   95    HA2  GLY  19           1HA      GLY  19   0.302  -7.627   4.563
   96    HA3  GLY  19           2HA      GLY  19   0.774  -8.048   6.203
   97    H    LYS  20           H        LYS  20  -0.009  -4.772   5.849
   98    HA   LYS  20           HA       LYS  20  -2.110  -4.817   7.668
   99    HB2  LYS  20           1HB      LYS  20  -1.102  -2.836   5.680
  100    HB3  LYS  20           2HB      LYS  20  -2.673  -2.541   6.414
  101    HG2  LYS  20           1HG      LYS  20  -0.223  -3.099   8.054
  102    HG3  LYS  20           2HG      LYS  20  -0.660  -1.473   7.523
  103    HD2  LYS  20           1HD      LYS  20  -2.566  -1.417   8.835
  104    HD3  LYS  20           2HD      LYS  20  -2.680  -3.176   8.922
  105    HE2  LYS  20           1HE      LYS  20  -0.313  -1.825  10.126
  106    HE3  LYS  20           2HE      LYS  20  -1.854  -1.755  10.980
  107    HZ1  LYS  20           3HZ      LYS  20  -0.484  -3.642  11.674
  108    HZ2  LYS  20           1HZ      LYS  20  -0.512  -4.253  10.097
  109    HZ3  LYS  20           2HZ      LYS  20  -1.945  -4.150  10.990
  110    H    ASN  21           H        ASN  21  -4.333  -3.725   6.988
  111    HA   ASN  21           HA       ASN  21  -5.387  -5.071   4.602
  112    HB2  ASN  21           1HB      ASN  21  -5.790  -6.269   6.918
  113    HB3  ASN  21           2HB      ASN  21  -7.046  -5.046   7.092
  114   HD21  ASN  21          1HD2      ASN  21  -6.149  -7.992   5.661
  115   HD22  ASN  21          2HD2      ASN  21  -7.578  -8.244   4.723
  116    H    PHE  22           H        PHE  22  -6.867  -3.921   3.474
  117    HA   PHE  22           HA       PHE  22  -8.234  -1.669   4.682
  118    HB2  PHE  22           1HB      PHE  22  -6.477  -1.192   2.272
  119    HB3  PHE  22           2HB      PHE  22  -7.381   0.005   3.193
  120    HD1  PHE  22           HD1      PHE  22  -6.624   0.686   5.423
  121    HD2  PHE  22           HD2      PHE  22  -4.353  -1.983   3.008
  122    HE1  PHE  22           HE1      PHE  22  -4.653   1.086   6.841
  123    HE2  PHE  22           HE2      PHE  22  -2.378  -1.589   4.422
  124    HZ   PHE  22           HZ       PHE  22  -2.527  -0.053   6.342
  125    H    CYS  23           H        CYS  23 -10.260  -2.039   4.082
  126    HA   CYS  23           HA       CYS  23 -11.052  -3.597   1.893
  127    HB2  CYS  23           1HB      CYS  23 -12.421  -3.030   3.947
  128    HB3  CYS  23           2HB      CYS  23 -12.731  -1.462   3.212
  129    HG   CYS  23           HG       CYS  23 -14.920  -2.340   2.192
  130    H    TYR  24           H        TYR  24 -10.338  -0.203   2.172
  131    HA   TYR  24           HA       TYR  24 -11.122   0.171  -0.644
  132    HB2  TYR  24           1HB      TYR  24 -10.963   2.700   0.180
  133    HB3  TYR  24           2HB      TYR  24 -12.433   1.750   0.369
  134    HD1  TYR  24           HD2      TYR  24 -12.650   0.449   2.632
  135    HD2  TYR  24           HD1      TYR  24 -10.062   3.772   2.027
  136    HE1  TYR  24           HE2      TYR  24 -12.594   0.840   5.059
  137    HE2  TYR  24           HE1      TYR  24  -9.999   4.172   4.453
  138    HH   TYR  24           HH       TYR  24 -10.955   1.956   6.706
  139    H    ILE  25           H        ILE  25  -9.414   0.131  -1.936
  140    HA   ILE  25           HA       ILE  25  -6.783   0.113  -1.395
  141    HB   ILE  25           HB       ILE  25  -7.802  -0.085  -3.673
  142   HG12  ILE  25          1HG1      ILE  25  -5.823   1.260  -4.777
  143   HG13  ILE  25          2HG1      ILE  25  -5.319   1.488  -3.105
  144   HG21  ILE  25          1HG2      ILE  25  -9.078   2.078  -3.470
  145   HG22  ILE  25          2HG2      ILE  25  -7.557   2.911  -3.783
  146   HG23  ILE  25          3HG2      ILE  25  -8.237   1.832  -5.000
  147   HD11  ILE  25          3HD1      ILE  25  -5.524  -1.040  -4.683
  148   HD12  ILE  25          1HD1      ILE  25  -4.156  -0.396  -3.776
  149   HD13  ILE  25          2HD1      ILE  25  -5.545  -1.066  -2.920
  150    H    SER  26           H        SER  26  -8.678   3.078  -1.905
  151    HA   SER  26           HA       SER  26  -6.826   5.033  -1.803
  152    HB2  SER  26           1HB      SER  26  -9.404   5.032  -0.214
  153    HB3  SER  26           2HB      SER  26  -8.481   6.462  -0.674
  154    HG   SER  26           HG       SER  26  -8.805   5.673  -2.905
  155    H    ALA  27           H        ALA  27  -8.149   3.388   1.059
  156    HA   ALA  27           HA       ALA  27  -6.667   4.771   2.988
  157    HB1  ALA  27           3HB      ALA  27  -6.999   2.220   4.019
  158    HB2  ALA  27           1HB      ALA  27  -8.106   3.581   4.197
  159    HB3  ALA  27           2HB      ALA  27  -8.345   2.414   2.896
  160    H    LEU  28           H        LEU  28  -5.982   1.646   1.418
  161    HA   LEU  28           HA       LEU  28  -3.622   0.996   2.666
  162    HB2  LEU  28           1HB      LEU  28  -4.391  -0.637   1.247
  163    HB3  LEU  28           2HB      LEU  28  -4.713   0.501  -0.059
  164    HG   LEU  28           HG       LEU  28  -2.232   0.670  -0.398
  165   HD11  LEU  28          1HD1      LEU  28  -2.179  -0.762   2.019
  166   HD12  LEU  28          2HD1      LEU  28  -0.814  -0.285   1.011
  167   HD13  LEU  28          3HD1      LEU  28  -1.577  -1.856   0.774
  168   HD21  LEU  28          3HD2      LEU  28  -2.064  -1.562  -1.498
  169   HD22  LEU  28          1HD2      LEU  28  -3.531  -0.667  -1.896
  170   HD23  LEU  28          2HD2      LEU  28  -3.596  -1.996  -0.738
  171    H    ARG  29           H        ARG  29  -4.041   3.050  -0.205
  172    HA   ARG  29           HA       ARG  29  -1.368   3.581  -0.735
  173    HB2  ARG  29           1HB      ARG  29  -3.646   5.539  -1.056
  174    HB3  ARG  29           2HB      ARG  29  -2.127   5.530  -1.943
  175    HG2  ARG  29           1HG      ARG  29  -4.175   3.328  -2.070
  176    HG3  ARG  29           2HG      ARG  29  -4.061   4.657  -3.226
  177    HD2  ARG  29           1HD      ARG  29  -1.997   2.535  -2.666
  178    HD3  ARG  29           2HD      ARG  29  -2.935   2.749  -4.143
  179    HE   ARG  29           HE       ARG  29  -1.521   5.101  -3.722
  180   HH11  ARG  29          1HH1      ARG  29  -0.847   1.746  -4.360
  181   HH12  ARG  29          2HH1      ARG  29   0.639   2.068  -5.190
  182   HH21  ARG  29          1HH2      ARG  29   0.434   5.538  -4.813
  183   HH22  ARG  29          2HH2      ARG  29   1.367   4.225  -5.447
  184    H    ILE  30           H        ILE  30  -3.603   5.267   1.441
  185    HA   ILE  30           HA       ILE  30  -1.851   7.323   2.219
  186    HB   ILE  30           HB       ILE  30  -4.158   6.076   3.714
  187   HG12  ILE  30          1HG1      ILE  30  -4.050   8.740   2.305
  188   HG13  ILE  30          2HG1      ILE  30  -4.546   7.264   1.485
  189   HG21  ILE  30          1HG2      ILE  30  -4.114   7.943   5.206
  190   HG22  ILE  30          2HG2      ILE  30  -2.508   7.215   5.197
  191   HG23  ILE  30          3HG2      ILE  30  -2.806   8.703   4.299
  192   HD11  ILE  30          3HD1      ILE  30  -6.302   7.008   3.269
  193   HD12  ILE  30          1HD1      ILE  30  -5.894   8.645   3.782
  194   HD13  ILE  30          2HD1      ILE  30  -6.517   8.360   2.156
  195    H    HIS  31           H        HIS  31  -2.293   4.041   3.390
  196    HA   HIS  31           HA       HIS  31  -0.648   4.362   5.708
  197    HB2  HIS  31           1HB      HIS  31  -2.089   2.587   5.989
  198    HB3  HIS  31           2HB      HIS  31  -1.954   2.072   4.310
  199    HD1  HIS  31           HD1      HIS  31  -0.114   1.873   7.594
  200    HD2  HIS  31           HD2      HIS  31  -0.062   0.131   3.823
  201    HE1  HIS  31           HE1      HIS  31   1.476  -0.067   7.772
  202    H    GLN  32           H        GLN  32  -0.148   3.139   2.431
  203    HA   GLN  32           HA       GLN  32   2.357   2.025   2.657
  204    HB2  GLN  32           1HB      GLN  32   1.048   3.551   0.422
  205    HB3  GLN  32           2HB      GLN  32   2.672   2.900   0.248
  206    HG2  GLN  32           1HG      GLN  32   1.604   0.668   0.982
  207    HG3  GLN  32           2HG      GLN  32   0.080   1.446   0.558
  208   HE21  GLN  32          1HE2      GLN  32   0.249   2.626  -1.652
  209   HE22  GLN  32          2HE2      GLN  32   0.925   1.681  -2.930
  210    H    ARG  33           H        ARG  33   1.459   5.331   2.952
  211    HA   ARG  33           HA       ARG  33   3.780   6.665   2.229
  212    HB2  ARG  33           1HB      ARG  33   1.890   7.299   4.503
  213    HB3  ARG  33           2HB      ARG  33   3.074   8.413   3.832
  214    HG2  ARG  33           1HG      ARG  33   1.931   8.438   1.717
  215    HG3  ARG  33           2HG      ARG  33   0.810   7.192   2.270
  216    HD2  ARG  33           1HD      ARG  33  -0.337   8.639   3.638
  217    HD3  ARG  33           2HD      ARG  33   1.047   9.714   3.837
  218    HE   ARG  33           HE       ARG  33  -1.003   9.979   1.930
  219   HH11  ARG  33          1HH1      ARG  33   2.457  10.232   2.222
  220   HH12  ARG  33          2HH1      ARG  33   2.609  11.403   0.953
  221   HH21  ARG  33          1HH2      ARG  33  -0.816  11.520   0.258
  222   HH22  ARG  33          2HH2      ARG  33   0.747  12.135  -0.162
  223    H    VAL  34           H        VAL  34   3.146   4.644   4.969
  224    HA   VAL  34           HA       VAL  34   5.307   5.576   6.592
  225    HB   VAL  34           HB       VAL  34   4.857   3.738   8.035
  226   HG11  VAL  34          1HG1      VAL  34   2.804   4.390   8.700
  227   HG12  VAL  34          2HG1      VAL  34   2.986   5.581   7.411
  228   HG13  VAL  34          3HG1      VAL  34   2.082   4.094   7.119
  229   HG21  VAL  34          3HG2      VAL  34   3.191   1.956   7.286
  230   HG22  VAL  34          1HG2      VAL  34   3.501   2.526   5.645
  231   HG23  VAL  34          2HG2      VAL  34   4.820   1.868   6.614
  232    H    HIS  35           H        HIS  35   4.954   3.217   4.053
  233    HA   HIS  35           HA       HIS  35   7.523   1.987   4.582
  234    HB2  HIS  35           1HB      HIS  35   5.518   1.609   2.351
  235    HB3  HIS  35           2HB      HIS  35   7.023   0.705   2.484
  236    HD1  HIS  35           HD1      HIS  35   7.234  -0.728   4.806
  237    HD2  HIS  35           HD2      HIS  35   3.428   0.474   3.654
  238    HE1  HIS  35           HE1      HIS  35   5.648  -2.197   6.090
  239    H    MET  36           H        MET  36   6.936   4.910   3.612
  240    HA   MET  36           HA       MET  36   8.813   4.892   1.346
  241    HB2  MET  36           1HB      MET  36   6.689   6.855   2.186
  242    HB3  MET  36           2HB      MET  36   7.947   7.283   1.035
  243    HG2  MET  36           1HG      MET  36   7.120   5.073  -0.148
  244    HG3  MET  36           2HG      MET  36   5.641   5.445   0.734
  245    HE1  MET  36           3HE      MET  36   3.978   7.334   0.102
  246    HE2  MET  36           1HE      MET  36   5.204   8.368   0.836
  247    HE3  MET  36           2HE      MET  36   4.493   8.810  -0.717
  248    H    GLY  37           H        GLY  37  10.803   5.667   1.636
  249    HA2  GLY  37           1HA      GLY  37  11.329   7.792   3.526
  250    HA3  GLY  37           2HA      GLY  37  12.010   6.238   3.985
  251    H    GLU  38           H        GLU  38  13.667   8.371   3.593
  252    HA   GLU  38           HA       GLU  38  14.677   8.782   1.039
  253    HB2  GLU  38           1HB      GLU  38  16.206   8.741   3.647
  254    HB3  GLU  38           2HB      GLU  38  16.767   9.465   2.147
  255    HG2  GLU  38           1HG      GLU  38  14.855  11.019   2.217
  256    HG3  GLU  38           2HG      GLU  38  14.385  10.329   3.770
  257    H    LYS  39           H        LYS  39  15.111   7.148  -0.313
  258    HA   LYS  39           HA       LYS  39  16.057   4.607   0.439
  259    HB2  LYS  39           1HB      LYS  39  16.314   4.170  -1.898
  260    HB3  LYS  39           2HB      LYS  39  14.881   5.170  -1.704
  261    HG2  LYS  39           1HG      LYS  39  15.835   6.981  -2.716
  262    HG3  LYS  39           2HG      LYS  39  17.474   6.513  -2.257
  263    HD2  LYS  39           1HD      LYS  39  17.498   6.067  -4.516
  264    HD3  LYS  39           2HD      LYS  39  17.026   4.495  -3.864
  265    HE2  LYS  39           1HE      LYS  39  14.932   6.493  -4.611
  266    HE3  LYS  39           2HE      LYS  39  15.713   5.532  -5.865
  267    HZ1  LYS  39           3HZ      LYS  39  15.092   3.543  -4.458
  268    HZ2  LYS  39           1HZ      LYS  39  13.819   4.333  -5.244
  269    HZ3  LYS  39           2HZ      LYS  39  14.077   4.582  -3.591
  270    H    CYS  40           H        CYS  40  17.662   7.585   0.152
  271    HA   CYS  40           HA       CYS  40  20.267   6.209   0.211
  272    HB2  CYS  40           1HB      CYS  40  20.130   7.383  -1.881
  273    HB3  CYS  40           2HB      CYS  40  19.550   8.841  -1.087
  274    HG   CYS  40           HG       CYS  40  22.578   7.718  -0.115
  275    H    SER  41           H        SER  41  20.265   6.152   2.476
  276    HA   SER  41           HA       SER  41  19.899   8.533   4.032
  277    HB2  SER  41           1HB      SER  41  20.716   5.709   4.635
  278    HB3  SER  41           2HB      SER  41  20.935   6.964   5.854
  279    HG   SER  41           HG       SER  41  18.618   5.804   4.899
  280    H    GLY  42           H        GLY  42  21.733   8.913   5.786
  281    HA2  GLY  42           1HA      GLY  42  23.753  10.353   4.739
  282    HA3  GLY  42           2HA      GLY  42  23.931   9.483   6.255
  283    HA   PRO  43           HA       PRO  43  26.571   7.729   2.621
  284    HB2  PRO  43           1HB      PRO  43  28.804   9.265   2.782
  285    HB3  PRO  43           2HB      PRO  43  27.449   9.649   1.715
  286    HG2  PRO  43           1HG      PRO  43  28.116  10.772   4.409
  287    HG3  PRO  43           2HG      PRO  43  27.563  11.616   2.951
  288    HD2  PRO  43           1HD      PRO  43  25.900  11.000   4.998
  289    HD3  PRO  43           2HD      PRO  43  25.357  11.049   3.308
  290    H    SER  44           H        SER  44  27.947   9.240   5.549
  291    HA   SER  44           HA       SER  44  29.920   7.308   6.011
  292    HB2  SER  44           1HB      SER  44  30.134   8.259   8.214
  293    HB3  SER  44           2HB      SER  44  29.793   9.573   7.089
  294    HG   SER  44           HG       SER  44  28.537   9.284   9.219
  295    H    SER  45           H        SER  45  30.012   5.501   7.332
  296    HA   SER  45           HA       SER  45  27.471   4.511   8.422
  297    HB2  SER  45           1HB      SER  45  29.202   3.227   6.365
  298    HB3  SER  45           2HB      SER  45  28.474   2.182   7.584
  299    HG   SER  45           HG       SER  45  27.241   2.637   5.564
  300    H    GLY  46           H        GLY  46  27.939   4.612  10.547
  301    HA2  GLY  46           1HA      GLY  46  30.435   3.305  11.442
  302    HA3  GLY  46           2HA      GLY  46  29.682   4.651  12.286
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1   1.979 -27.419   4.091
    2    HA2  GLY   1           1HA      GLY   1   1.629 -30.040   2.881
    3    HA3  GLY   1           2HA      GLY   1   1.411 -29.976   4.624
    4    H    SER   2           H        SER   2   0.200 -27.425   4.785
    5    HA   SER   2           HA       SER   2  -2.406 -28.041   3.564
    6    HB2  SER   2           1HB      SER   2  -1.710 -26.533   6.091
    7    HB3  SER   2           2HB      SER   2  -3.336 -26.599   5.411
    8    HG   SER   2           HG       SER   2  -3.461 -28.719   5.870
    9    H    SER   3           H        SER   3  -3.804 -25.988   3.321
   10    HA   SER   3           HA       SER   3  -2.881 -24.436   1.278
   11    HB2  SER   3           1HB      SER   3  -4.667 -22.807   1.869
   12    HB3  SER   3           2HB      SER   3  -5.233 -24.477   1.892
   13    HG   SER   3           HG       SER   3  -4.249 -23.419   4.275
   14    H    GLY   4           H        GLY   4  -1.851 -22.484   1.027
   15    HA2  GLY   4           1HA      GLY   4   0.159 -21.773   2.800
   16    HA3  GLY   4           2HA      GLY   4  -0.472 -20.722   1.541
   17    H    SER   5           H        SER   5  -2.266 -19.336   2.052
   18    HA   SER   5           HA       SER   5  -2.409 -18.716   4.929
   19    HB2  SER   5           1HB      SER   5  -2.857 -16.378   4.257
   20    HB3  SER   5           2HB      SER   5  -1.300 -16.947   3.657
   21    HG   SER   5           HG       SER   5  -2.809 -17.542   1.728
   22    H    SER   6           H        SER   6  -4.307 -19.057   5.854
   23    HA   SER   6           HA       SER   6  -6.689 -19.297   4.160
   24    HB2  SER   6           1HB      SER   6  -5.898 -20.420   6.818
   25    HB3  SER   6           2HB      SER   6  -7.612 -20.218   6.458
   26    HG   SER   6           HG       SER   6  -6.321 -22.265   5.822
   27    H    GLY   7           H        GLY   7  -7.059 -17.050   3.913
   28    HA2  GLY   7           1HA      GLY   7  -8.882 -15.921   5.687
   29    HA3  GLY   7           2HA      GLY   7  -7.306 -15.259   6.095
   30    H    SER   8           H        SER   8  -8.823 -16.059   2.976
   31    HA   SER   8           HA       SER   8  -8.635 -13.222   2.236
   32    HB2  SER   8           1HB      SER   8  -6.680 -14.452   1.306
   33    HB3  SER   8           2HB      SER   8  -7.793 -15.512   0.441
   34    HG   SER   8           HG       SER   8  -6.832 -13.357  -0.503
   35    H    GLY   9           H        GLY   9 -10.925 -13.233   2.667
   36    HA2  GLY   9           1HA      GLY   9 -12.485 -14.583   0.550
   37    HA3  GLY   9           2HA      GLY   9 -13.105 -14.267   2.164
   38    H    GLU  10           H        GLU  10 -13.572 -12.084   2.769
   39    HA   GLU  10           HA       GLU  10 -14.998 -10.632   0.908
   40    HB2  GLU  10           1HB      GLU  10 -14.923 -10.445   3.494
   41    HB3  GLU  10           2HB      GLU  10 -13.645  -9.270   3.217
   42    HG2  GLU  10           1HG      GLU  10 -15.091  -7.804   2.085
   43    HG3  GLU  10           2HG      GLU  10 -16.336  -9.040   1.914
   44    H    LYS  11           H        LYS  11 -14.275  -9.754  -0.911
   45    HA   LYS  11           HA       LYS  11 -11.788  -9.248  -1.780
   46    HB2  LYS  11           1HB      LYS  11 -13.881  -8.888  -3.086
   47    HB3  LYS  11           2HB      LYS  11 -14.097  -7.354  -2.252
   48    HG2  LYS  11           1HG      LYS  11 -11.935  -6.592  -3.178
   49    HG3  LYS  11           2HG      LYS  11 -11.830  -8.101  -4.087
   50    HD2  LYS  11           1HD      LYS  11 -14.282  -6.421  -4.342
   51    HD3  LYS  11           2HD      LYS  11 -12.814  -5.930  -5.190
   52    HE2  LYS  11           1HE      LYS  11 -14.064  -7.257  -6.706
   53    HE3  LYS  11           2HE      LYS  11 -12.723  -8.257  -6.147
   54    HZ1  LYS  11           3HZ      LYS  11 -14.106  -9.697  -5.172
   55    HZ2  LYS  11           1HZ      LYS  11 -15.302  -9.016  -6.156
   56    HZ3  LYS  11           2HZ      LYS  11 -15.120  -8.489  -4.559
   57    H    SER  12           H        SER  12 -10.182  -8.390  -0.609
   58    HA   SER  12           HA       SER  12 -10.395  -5.591   0.161
   59    HB2  SER  12           1HB      SER  12  -9.569  -5.976   2.430
   60    HB3  SER  12           2HB      SER  12 -11.085  -6.842   2.182
   61    HG   SER  12           HG       SER  12  -8.937  -7.882   3.091
   62    H    HIS  13           H        HIS  13  -8.358  -4.564   0.471
   63    HA   HIS  13           HA       HIS  13  -6.206  -5.903  -0.981
   64    HB2  HIS  13           1HB      HIS  13  -6.538  -3.014  -0.146
   65    HB3  HIS  13           2HB      HIS  13  -5.185  -3.643  -1.082
   66    HD1  HIS  13           HD1      HIS  13  -5.565  -4.064  -3.567
   67    HD2  HIS  13           HD2      HIS  13  -8.993  -2.857  -1.554
   68    HE1  HIS  13           HE1      HIS  13  -7.249  -3.544  -5.361
   69    H    THR  14           H        THR  14  -4.075  -6.015  -0.193
   70    HA   THR  14           HA       THR  14  -3.746  -5.533   2.689
   71    HB   THR  14           HB       THR  14  -2.891  -8.039   1.227
   72    HG1  THR  14           HG1      THR  14  -4.361  -8.984   2.816
   73   HG21  THR  14          3HG2      THR  14  -1.838  -8.770   3.178
   74   HG22  THR  14          1HG2      THR  14  -2.644  -7.563   4.180
   75   HG23  THR  14          2HG2      THR  14  -1.362  -7.075   3.071
   76    H    CYS  15           H        CYS  15  -1.757  -4.816   3.328
   77    HA   CYS  15           HA       CYS  15  -0.026  -3.804   1.256
   78    HB2  CYS  15           1HB      CYS  15  -0.580  -2.512   3.322
   79    HB3  CYS  15           2HB      CYS  15   0.341  -3.687   4.256
   80    H    ASP  16           H        ASP  16   1.520  -4.978   0.358
   81    HA   ASP  16           HA       ASP  16   2.458  -7.421   1.519
   82    HB2  ASP  16           1HB      ASP  16   2.943  -5.919  -1.006
   83    HB3  ASP  16           2HB      ASP  16   4.168  -7.081  -0.504
   84    H    GLU  17           H        GLU  17   3.352  -4.163   1.818
   85    HA   GLU  17           HA       GLU  17   6.143  -4.464   2.237
   86    HB2  GLU  17           1HB      GLU  17   4.356  -2.312   3.375
   87    HB3  GLU  17           2HB      GLU  17   6.091  -2.220   3.107
   88    HG2  GLU  17           1HG      GLU  17   4.095  -2.583   0.891
   89    HG3  GLU  17           2HG      GLU  17   4.666  -1.009   1.440
   90    H    CYS  18           H        CYS  18   3.367  -4.322   4.442
   91    HA   CYS  18           HA       CYS  18   5.099  -5.440   6.549
   92    HB2  CYS  18           1HB      CYS  18   3.738  -4.252   8.208
   93    HB3  CYS  18           2HB      CYS  18   4.477  -3.126   7.074
   94    H    GLY  19           H        GLY  19   1.889  -5.359   5.096
   95    HA2  GLY  19           1HA      GLY  19   0.816  -7.550   4.784
   96    HA3  GLY  19           2HA      GLY  19   1.331  -7.943   6.418
   97    H    LYS  20           H        LYS  20   0.241  -4.737   5.944
   98    HA   LYS  20           HA       LYS  20  -1.909  -5.066   7.772
   99    HB2  LYS  20           1HB      LYS  20  -0.834  -2.824   6.121
  100    HB3  LYS  20           2HB      LYS  20  -2.451  -2.660   6.793
  101    HG2  LYS  20           1HG      LYS  20  -0.239  -3.494   8.597
  102    HG3  LYS  20           2HG      LYS  20  -0.339  -1.805   8.093
  103    HD2  LYS  20           1HD      LYS  20  -2.808  -1.963   8.814
  104    HD3  LYS  20           2HD      LYS  20  -2.311  -3.423   9.673
  105    HE2  LYS  20           1HE      LYS  20  -2.134  -1.718  11.266
  106    HE3  LYS  20           2HE      LYS  20  -0.480  -1.974  10.711
  107    HZ1  LYS  20           3HZ      LYS  20  -1.996   0.389  10.650
  108    HZ2  LYS  20           1HZ      LYS  20  -1.640  -0.054   9.057
  109    HZ3  LYS  20           2HZ      LYS  20  -0.389   0.157  10.175
  110    H    ASN  21           H        ASN  21  -4.164  -4.343   7.276
  111    HA   ASN  21           HA       ASN  21  -4.997  -5.245   4.598
  112    HB2  ASN  21           1HB      ASN  21  -6.230  -5.856   7.284
  113    HB3  ASN  21           2HB      ASN  21  -7.104  -6.072   5.771
  114   HD21  ASN  21          1HD2      ASN  21  -7.166  -8.303   6.658
  115   HD22  ASN  21          2HD2      ASN  21  -5.863  -9.362   6.249
  116    H    PHE  22           H        PHE  22  -6.489  -4.032   3.547
  117    HA   PHE  22           HA       PHE  22  -7.876  -1.907   4.997
  118    HB2  PHE  22           1HB      PHE  22  -6.312  -1.371   2.465
  119    HB3  PHE  22           2HB      PHE  22  -7.209  -0.196   3.422
  120    HD1  PHE  22           HD2      PHE  22  -4.189  -2.268   3.262
  121    HD2  PHE  22           HD1      PHE  22  -6.301   0.716   5.443
  122    HE1  PHE  22           HE2      PHE  22  -2.161  -1.794   4.571
  123    HE2  PHE  22           HE1      PHE  22  -4.275   1.195   6.755
  124    HZ   PHE  22           HZ       PHE  22  -2.202  -0.062   6.321
  125    H    CYS  23           H        CYS  23  -9.947  -2.289   4.586
  126    HA   CYS  23           HA       CYS  23 -11.054  -3.858   2.645
  127    HB2  CYS  23           1HB      CYS  23 -12.262  -2.876   4.598
  128    HB3  CYS  23           2HB      CYS  23 -12.327  -1.342   3.738
  129    HG   CYS  23           HG       CYS  23 -14.386  -1.860   2.270
  130    H    TYR  24           H        TYR  24 -10.440  -0.368   2.444
  131    HA   TYR  24           HA       TYR  24 -11.025  -0.493  -0.437
  132    HB2  TYR  24           1HB      TYR  24 -10.915   2.139  -0.014
  133    HB3  TYR  24           2HB      TYR  24 -12.384   1.209   0.259
  134    HD1  TYR  24           HD2      TYR  24 -12.732   0.301   2.672
  135    HD2  TYR  24           HD1      TYR  24 -10.058   3.463   1.693
  136    HE1  TYR  24           HE2      TYR  24 -12.785   1.062   5.010
  137    HE2  TYR  24           HE1      TYR  24 -10.102   4.232   4.028
  138    HH   TYR  24           HH       TYR  24 -12.376   3.329   6.218
  139    H    ILE  25           H        ILE  25  -9.410  -0.298  -1.840
  140    HA   ILE  25           HA       ILE  25  -6.743  -0.357  -1.209
  141    HB   ILE  25           HB       ILE  25  -7.750  -0.779  -3.474
  142   HG12  ILE  25          1HG1      ILE  25  -5.754   0.197  -4.711
  143   HG13  ILE  25          2HG1      ILE  25  -5.303   0.968  -3.195
  144   HG21  ILE  25          1HG2      ILE  25  -7.551   2.218  -3.737
  145   HG22  ILE  25          2HG2      ILE  25  -8.000   1.083  -5.008
  146   HG23  ILE  25          3HG2      ILE  25  -9.052   1.302  -3.609
  147   HD11  ILE  25          3HD1      ILE  25  -4.091  -0.885  -2.898
  148   HD12  ILE  25          1HD1      ILE  25  -5.625  -1.593  -2.391
  149   HD13  ILE  25          2HD1      ILE  25  -5.050  -1.821  -4.043
  150    H    SER  26           H        SER  26  -8.723   2.500  -1.903
  151    HA   SER  26           HA       SER  26  -6.881   4.494  -2.008
  152    HB2  SER  26           1HB      SER  26  -9.542   4.508  -0.571
  153    HB3  SER  26           2HB      SER  26  -8.597   5.960  -0.898
  154    HG   SER  26           HG       SER  26  -8.787   5.507  -3.117
  155    H    ALA  27           H        ALA  27  -8.150   2.989   0.942
  156    HA   ALA  27           HA       ALA  27  -6.777   4.599   2.787
  157    HB1  ALA  27           3HB      ALA  27  -7.033   2.008   3.886
  158    HB2  ALA  27           1HB      ALA  27  -8.053   3.420   4.163
  159    HB3  ALA  27           2HB      ALA  27  -8.443   2.290   2.866
  160    H    LEU  28           H        LEU  28  -5.921   1.421   1.427
  161    HA   LEU  28           HA       LEU  28  -3.554   0.965   2.755
  162    HB2  LEU  28           1HB      LEU  28  -4.190  -0.805   1.456
  163    HB3  LEU  28           2HB      LEU  28  -4.609   0.215   0.081
  164    HG   LEU  28           HG       LEU  28  -2.135   0.539  -0.287
  165   HD11  LEU  28          1HD1      LEU  28  -0.999  -1.678   0.768
  166   HD12  LEU  28          2HD1      LEU  28  -2.090  -1.212   2.072
  167   HD13  LEU  28          3HD1      LEU  28  -0.886  -0.068   1.478
  168   HD21  LEU  28          3HD2      LEU  28  -3.860  -1.546  -1.024
  169   HD22  LEU  28          1HD2      LEU  28  -2.313  -2.303  -0.644
  170   HD23  LEU  28          2HD2      LEU  28  -2.392  -1.017  -1.849
  171    H    ARG  29           H        ARG  29  -4.059   2.854  -0.204
  172    HA   ARG  29           HA       ARG  29  -1.410   3.450  -0.793
  173    HB2  ARG  29           1HB      ARG  29  -3.770   5.299  -1.171
  174    HB3  ARG  29           2HB      ARG  29  -2.255   5.331  -2.063
  175    HG2  ARG  29           1HG      ARG  29  -4.044   2.927  -2.097
  176    HG3  ARG  29           2HG      ARG  29  -4.288   4.287  -3.195
  177    HD2  ARG  29           1HD      ARG  29  -1.787   2.621  -2.939
  178    HD3  ARG  29           2HD      ARG  29  -2.957   2.547  -4.255
  179    HE   ARG  29           HE       ARG  29  -2.200   5.127  -4.298
  180   HH11  ARG  29          1HH1      ARG  29  -0.396   2.150  -4.221
  181   HH12  ARG  29          2HH1      ARG  29   0.954   2.793  -5.096
  182   HH21  ARG  29          1HH2      ARG  29  -0.428   5.985  -5.451
  183   HH22  ARG  29          2HH2      ARG  29   0.935   4.975  -5.794
  184    H    ILE  30           H        ILE  30  -3.641   5.024   1.443
  185    HA   ILE  30           HA       ILE  30  -1.992   7.228   2.078
  186    HB   ILE  30           HB       ILE  30  -4.157   5.909   3.719
  187   HG12  ILE  30          1HG1      ILE  30  -4.335   8.486   2.169
  188   HG13  ILE  30          2HG1      ILE  30  -4.697   6.933   1.423
  189   HG21  ILE  30          1HG2      ILE  30  -2.487   7.302   5.001
  190   HG22  ILE  30          2HG2      ILE  30  -3.059   8.686   4.071
  191   HG23  ILE  30          3HG2      ILE  30  -4.171   7.812   5.125
  192   HD11  ILE  30          3HD1      ILE  30  -6.107   7.155   3.897
  193   HD12  ILE  30          1HD1      ILE  30  -6.411   8.581   2.905
  194   HD13  ILE  30          2HD1      ILE  30  -6.739   6.972   2.261
  195    H    HIS  31           H        HIS  31  -2.248   3.973   3.388
  196    HA   HIS  31           HA       HIS  31  -0.551   4.444   5.633
  197    HB2  HIS  31           1HB      HIS  31  -1.885   2.598   5.993
  198    HB3  HIS  31           2HB      HIS  31  -1.751   2.043   4.327
  199    HD1  HIS  31           HD1      HIS  31   0.291   2.164   7.514
  200    HD2  HIS  31           HD2      HIS  31   0.112   0.090   3.919
  201    HE1  HIS  31           HE1      HIS  31   1.964   0.298   7.730
  202    H    GLN  32           H        GLN  32  -0.057   2.909   2.464
  203    HA   GLN  32           HA       GLN  32   2.490   2.018   2.614
  204    HB2  GLN  32           1HB      GLN  32   1.141   3.510   0.370
  205    HB3  GLN  32           2HB      GLN  32   2.740   2.799   0.196
  206    HG2  GLN  32           1HG      GLN  32   1.634   0.617   0.965
  207    HG3  GLN  32           2HG      GLN  32   0.111   1.430   0.606
  208   HE21  GLN  32          1HE2      GLN  32  -0.052   2.379  -1.594
  209   HE22  GLN  32          2HE2      GLN  32   0.639   1.490  -2.904
  210    H    ARG  33           H        ARG  33   1.480   5.377   2.421
  211    HA   ARG  33           HA       ARG  33   3.763   6.712   1.796
  212    HB2  ARG  33           1HB      ARG  33   1.800   7.404   3.988
  213    HB3  ARG  33           2HB      ARG  33   2.992   8.517   3.331
  214    HG2  ARG  33           1HG      ARG  33   1.942   8.364   1.138
  215    HG3  ARG  33           2HG      ARG  33   0.757   7.225   1.780
  216    HD2  ARG  33           1HD      ARG  33  -0.137   8.897   3.252
  217    HD3  ARG  33           2HD      ARG  33   1.147  10.027   2.820
  218    HE   ARG  33           HE       ARG  33  -1.260   9.514   1.361
  219   HH11  ARG  33          1HH1      ARG  33   2.064  10.508   1.074
  220   HH12  ARG  33          2HH1      ARG  33   1.808  11.398  -0.390
  221   HH21  ARG  33          1HH2      ARG  33  -1.610  10.683  -0.567
  222   HH22  ARG  33          2HH2      ARG  33  -0.283  11.497  -1.322
  223    H    VAL  34           H        VAL  34   2.959   5.305   4.945
  224    HA   VAL  34           HA       VAL  34   5.130   6.252   6.410
  225    HB   VAL  34           HB       VAL  34   4.688   4.569   8.006
  226   HG11  VAL  34          1HG1      VAL  34   1.959   4.658   6.860
  227   HG12  VAL  34          2HG1      VAL  34   2.522   5.052   8.485
  228   HG13  VAL  34          3HG1      VAL  34   2.751   6.202   7.168
  229   HG21  VAL  34          3HG2      VAL  34   3.148   2.611   7.326
  230   HG22  VAL  34          1HG2      VAL  34   3.636   3.006   5.677
  231   HG23  VAL  34          2HG2      VAL  34   4.850   2.545   6.870
  232    H    HIS  35           H        HIS  35   4.874   3.503   4.230
  233    HA   HIS  35           HA       HIS  35   7.414   2.384   4.873
  234    HB2  HIS  35           1HB      HIS  35   5.517   2.015   2.561
  235    HB3  HIS  35           2HB      HIS  35   7.070   1.187   2.633
  236    HD1  HIS  35           HD1      HIS  35   7.387  -0.410   4.796
  237    HD2  HIS  35           HD2      HIS  35   3.504   0.768   3.904
  238    HE1  HIS  35           HE1      HIS  35   5.897  -2.009   6.039
  239    H    MET  36           H        MET  36   6.278   4.754   2.550
  240    HA   MET  36           HA       MET  36   8.541   4.848   0.894
  241    HB2  MET  36           1HB      MET  36   6.420   6.870   1.577
  242    HB3  MET  36           2HB      MET  36   7.737   7.255   0.476
  243    HG2  MET  36           1HG      MET  36   6.999   5.122  -0.777
  244    HG3  MET  36           2HG      MET  36   5.503   5.304   0.135
  245    HE1  MET  36           3HE      MET  36   4.854   9.106  -0.723
  246    HE2  MET  36           1HE      MET  36   3.709   7.777  -0.545
  247    HE3  MET  36           2HE      MET  36   5.037   7.955   0.602
  248    H    GLY  37           H        GLY  37  10.501   4.927   1.885
  249    HA2  GLY  37           1HA      GLY  37  10.968   7.165   3.754
  250    HA3  GLY  37           2HA      GLY  37  11.866   5.655   3.774
  251    H    GLU  38           H        GLU  38  11.097   8.292   1.497
  252    HA   GLU  38           HA       GLU  38  13.570   7.905   0.077
  253    HB2  GLU  38           1HB      GLU  38  12.847   9.879  -1.232
  254    HB3  GLU  38           2HB      GLU  38  11.620   8.622  -1.160
  255    HG2  GLU  38           1HG      GLU  38  10.300   9.845   0.347
  256    HG3  GLU  38           2HG      GLU  38  11.612  10.964   0.712
  257    H    LYS  39           H        LYS  39  15.175   9.594  -0.213
  258    HA   LYS  39           HA       LYS  39  15.659  11.027   2.299
  259    HB2  LYS  39           1HB      LYS  39  17.485  10.175   0.054
  260    HB3  LYS  39           2HB      LYS  39  18.003  11.261   1.337
  261    HG2  LYS  39           1HG      LYS  39  17.171   9.378   2.916
  262    HG3  LYS  39           2HG      LYS  39  17.308   8.361   1.479
  263    HD2  LYS  39           1HD      LYS  39  19.375   8.163   2.597
  264    HD3  LYS  39           2HD      LYS  39  19.671   9.261   1.247
  265    HE2  LYS  39           1HE      LYS  39  19.509  11.171   2.726
  266    HE3  LYS  39           2HE      LYS  39  19.096  10.121   4.080
  267    HZ1  LYS  39           3HZ      LYS  39  21.243   9.887   4.493
  268    HZ2  LYS  39           1HZ      LYS  39  21.639  10.869   3.173
  269    HZ3  LYS  39           2HZ      LYS  39  21.485   9.197   2.967
  270    H    CYS  40           H        CYS  40  15.565  13.177   2.411
  271    HA   CYS  40           HA       CYS  40  15.174  14.670  -0.085
  272    HB2  CYS  40           1HB      CYS  40  14.215  16.436   1.358
  273    HB3  CYS  40           2HB      CYS  40  13.369  14.902   1.526
  274    HG   CYS  40           HG       CYS  40  14.979  16.697   3.815
  275    H    SER  41           H        SER  41  16.277  16.626  -0.465
  276    HA   SER  41           HA       SER  41  18.995  16.631   0.096
  277    HB2  SER  41           1HB      SER  41  18.947  19.012  -0.708
  278    HB3  SER  41           2HB      SER  41  18.149  17.869  -1.789
  279    HG   SER  41           HG       SER  41  16.183  18.534  -0.486
  280    H    GLY  42           H        GLY  42  16.384  18.469   1.650
  281    HA2  GLY  42           1HA      GLY  42  16.413  18.845   4.026
  282    HA3  GLY  42           2HA      GLY  42  18.170  18.857   3.960
  283    HA   PRO  43           HA       PRO  43  16.528  23.098   2.233
  284    HB2  PRO  43           1HB      PRO  43  14.004  23.732   3.005
  285    HB3  PRO  43           2HB      PRO  43  14.363  22.890   1.493
  286    HG2  PRO  43           1HG      PRO  43  13.437  21.771   4.111
  287    HG3  PRO  43           2HG      PRO  43  12.903  21.366   2.470
  288    HD2  PRO  43           1HD      PRO  43  14.655  19.832   3.852
  289    HD3  PRO  43           2HD      PRO  43  14.713  19.991   2.085
  290    H    SER  44           H        SER  44  17.342  24.725   3.392
  291    HA   SER  44           HA       SER  44  16.990  24.682   6.306
  292    HB2  SER  44           1HB      SER  44  19.042  26.145   4.627
  293    HB3  SER  44           2HB      SER  44  18.986  26.118   6.389
  294    HG   SER  44           HG       SER  44  20.357  24.511   5.047
  295    H    SER  45           H        SER  45  14.825  25.610   4.850
  296    HA   SER  45           HA       SER  45  14.953  28.531   5.203
  297    HB2  SER  45           1HB      SER  45  13.058  26.857   3.537
  298    HB3  SER  45           2HB      SER  45  12.954  28.608   3.722
  299    HG   SER  45           HG       SER  45  15.208  27.220   2.694
  300    H    GLY  46           H        GLY  46  14.693  26.967   7.478
  301    HA2  GLY  46           1HA      GLY  46  11.857  26.897   8.160
  302    HA3  GLY  46           2HA      GLY  46  13.182  26.313   9.155
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1   6.796 -26.592  14.502
    2    HA2  GLY   1           1HA      GLY   1   4.787 -24.552  15.001
    3    HA3  GLY   1           2HA      GLY   1   6.003 -24.532  13.733
    4    H    SER   2           H        SER   2   3.054 -24.055  13.700
    5    HA   SER   2           HA       SER   2   2.370 -26.061  11.651
    6    HB2  SER   2           1HB      SER   2  -0.004 -25.747  12.278
    7    HB3  SER   2           2HB      SER   2   0.958 -26.358  13.624
    8    HG   SER   2           HG       SER   2   0.255 -23.638  13.211
    9    H    SER   3           H        SER   3   2.956 -24.930   9.853
   10    HA   SER   3           HA       SER   3   2.014 -22.187   9.520
   11    HB2  SER   3           1HB      SER   3   3.508 -22.026   7.678
   12    HB3  SER   3           2HB      SER   3   4.377 -22.936   8.914
   13    HG   SER   3           HG       SER   3   4.638 -24.299   7.323
   14    H    GLY   4           H        GLY   4   0.287 -21.653   8.345
   15    HA2  GLY   4           1HA      GLY   4  -0.668 -22.452   6.001
   16    HA3  GLY   4           2HA      GLY   4  -1.194 -23.786   7.016
   17    H    SER   5           H        SER   5  -3.182 -23.622   7.786
   18    HA   SER   5           HA       SER   5  -5.277 -22.696   8.060
   19    HB2  SER   5           1HB      SER   5  -3.517 -21.030   9.871
   20    HB3  SER   5           2HB      SER   5  -5.278 -21.049   9.956
   21    HG   SER   5           HG       SER   5  -4.145 -22.527  11.410
   22    H    SER   6           H        SER   6  -4.185 -21.713   5.709
   23    HA   SER   6           HA       SER   6  -4.930 -18.864   5.750
   24    HB2  SER   6           1HB      SER   6  -3.638 -18.659   3.654
   25    HB3  SER   6           2HB      SER   6  -2.639 -19.254   4.980
   26    HG   SER   6           HG       SER   6  -3.491 -21.415   3.966
   27    H    GLY   7           H        GLY   7  -7.134 -19.036   5.487
   28    HA2  GLY   7           1HA      GLY   7  -8.405 -20.780   3.659
   29    HA3  GLY   7           2HA      GLY   7  -9.130 -19.360   4.399
   30    H    SER   8           H        SER   8  -9.987 -19.751   1.978
   31    HA   SER   8           HA       SER   8  -8.450 -18.873  -0.185
   32    HB2  SER   8           1HB      SER   8 -10.651 -20.011  -0.388
   33    HB3  SER   8           2HB      SER   8 -11.437 -18.540   0.185
   34    HG   SER   8           HG       SER   8 -10.504 -17.470  -1.646
   35    H    GLY   9           H        GLY   9  -8.648 -16.844  -1.388
   36    HA2  GLY   9           1HA      GLY   9  -8.123 -14.604   0.270
   37    HA3  GLY   9           2HA      GLY   9  -8.307 -14.573  -1.477
   38    H    GLU  10           H        GLU  10  -9.243 -12.579   0.332
   39    HA   GLU  10           HA       GLU  10 -12.088 -12.671  -0.350
   40    HB2  GLU  10           1HB      GLU  10 -11.952 -13.392   1.984
   41    HB3  GLU  10           2HB      GLU  10 -11.021 -11.956   2.386
   42    HG2  GLU  10           1HG      GLU  10 -13.170 -11.452   3.098
   43    HG3  GLU  10           2HG      GLU  10 -13.037 -10.633   1.543
   44    H    LYS  11           H        LYS  11 -13.009 -10.687  -0.797
   45    HA   LYS  11           HA       LYS  11 -11.463  -8.700  -1.900
   46    HB2  LYS  11           1HB      LYS  11 -13.812  -8.824  -2.384
   47    HB3  LYS  11           2HB      LYS  11 -14.230  -8.534  -0.701
   48    HG2  LYS  11           1HG      LYS  11 -14.633  -6.504  -1.781
   49    HG3  LYS  11           2HG      LYS  11 -13.080  -6.279  -0.972
   50    HD2  LYS  11           1HD      LYS  11 -12.647  -5.420  -3.071
   51    HD3  LYS  11           2HD      LYS  11 -12.093  -7.087  -3.245
   52    HE2  LYS  11           1HE      LYS  11 -13.360  -6.865  -5.142
   53    HE3  LYS  11           2HE      LYS  11 -14.568  -7.491  -4.021
   54    HZ1  LYS  11           3HZ      LYS  11 -15.071  -5.043  -3.572
   55    HZ2  LYS  11           1HZ      LYS  11 -15.608  -5.699  -5.036
   56    HZ3  LYS  11           2HZ      LYS  11 -14.224  -4.728  -5.001
   57    H    SER  12           H        SER  12  -9.787  -7.878  -0.749
   58    HA   SER  12           HA       SER  12 -10.270  -5.810   1.098
   59    HB2  SER  12           1HB      SER  12  -9.303  -6.787   3.131
   60    HB3  SER  12           2HB      SER  12 -10.746  -7.673   2.641
   61    HG   SER  12           HG       SER  12  -9.523  -9.368   2.628
   62    H    HIS  13           H        HIS  13  -8.747  -4.453   0.445
   63    HA   HIS  13           HA       HIS  13  -6.344  -5.254  -0.818
   64    HB2  HIS  13           1HB      HIS  13  -6.848  -2.549   0.420
   65    HB3  HIS  13           2HB      HIS  13  -5.811  -2.937  -0.950
   66    HD1  HIS  13           HD1      HIS  13  -6.947  -3.254  -3.245
   67    HD2  HIS  13           HD2      HIS  13  -9.577  -2.306  -0.171
   68    HE1  HIS  13           HE1      HIS  13  -9.112  -2.650  -4.374
   69    H    THR  14           H        THR  14  -4.819  -6.336   0.256
   70    HA   THR  14           HA       THR  14  -4.132  -5.488   2.986
   71    HB   THR  14           HB       THR  14  -3.493  -8.071   1.547
   72    HG1  THR  14           HG1      THR  14  -5.486  -7.248   3.326
   73   HG21  THR  14          3HG2      THR  14  -2.288  -8.785   3.373
   74   HG22  THR  14          1HG2      THR  14  -3.086  -7.663   4.475
   75   HG23  THR  14          2HG2      THR  14  -1.860  -7.074   3.352
   76    H    CYS  15           H        CYS  15  -2.190  -4.637   3.447
   77    HA   CYS  15           HA       CYS  15  -0.462  -3.854   1.310
   78    HB2  CYS  15           1HB      CYS  15  -0.898  -2.503   3.387
   79    HB3  CYS  15           2HB      CYS  15   0.075  -3.668   4.279
   80    H    ASP  16           H        ASP  16   0.984  -5.130   0.385
   81    HA   ASP  16           HA       ASP  16   1.871  -7.569   1.587
   82    HB2  ASP  16           1HB      ASP  16   2.304  -6.171  -1.004
   83    HB3  ASP  16           2HB      ASP  16   3.510  -7.358  -0.515
   84    H    GLU  17           H        GLU  17   2.934  -4.339   1.697
   85    HA   GLU  17           HA       GLU  17   5.717  -4.758   2.032
   86    HB2  GLU  17           1HB      GLU  17   4.024  -2.484   3.080
   87    HB3  GLU  17           2HB      GLU  17   5.771  -2.477   2.889
   88    HG2  GLU  17           1HG      GLU  17   4.056  -3.007   0.514
   89    HG3  GLU  17           2HG      GLU  17   4.224  -1.356   1.110
   90    H    CYS  18           H        CYS  18   3.029  -4.446   4.320
   91    HA   CYS  18           HA       CYS  18   4.805  -5.510   6.418
   92    HB2  CYS  18           1HB      CYS  18   3.523  -4.235   8.067
   93    HB3  CYS  18           2HB      CYS  18   4.216  -3.162   6.855
   94    H    GLY  19           H        GLY  19   1.497  -5.368   5.166
   95    HA2  GLY  19           1HA      GLY  19   0.356  -7.534   4.926
   96    HA3  GLY  19           2HA      GLY  19   0.992  -7.951   6.510
   97    H    LYS  20           H        LYS  20  -0.283  -4.782   5.776
   98    HA   LYS  20           HA       LYS  20  -2.233  -5.064   7.888
   99    HB2  LYS  20           1HB      LYS  20  -1.235  -2.817   6.188
  100    HB3  LYS  20           2HB      LYS  20  -2.784  -2.638   7.002
  101    HG2  LYS  20           1HG      LYS  20  -0.437  -3.538   8.591
  102    HG3  LYS  20           2HG      LYS  20  -0.553  -1.840   8.125
  103    HD2  LYS  20           1HD      LYS  20  -2.883  -1.856   9.092
  104    HD3  LYS  20           2HD      LYS  20  -2.510  -3.449   9.754
  105    HE2  LYS  20           1HE      LYS  20  -0.914  -0.949  10.296
  106    HE3  LYS  20           2HE      LYS  20  -2.165  -1.586  11.363
  107    HZ1  LYS  20           3HZ      LYS  20  -0.891  -3.454  11.859
  108    HZ2  LYS  20           1HZ      LYS  20   0.239  -2.195  11.863
  109    HZ3  LYS  20           2HZ      LYS  20   0.141  -3.239  10.536
  110    H    ASN  21           H        ASN  21  -4.462  -3.961   7.377
  111    HA   ASN  21           HA       ASN  21  -5.478  -5.031   4.830
  112    HB2  ASN  21           1HB      ASN  21  -6.002  -6.334   7.059
  113    HB3  ASN  21           2HB      ASN  21  -7.201  -5.063   7.277
  114   HD21  ASN  21          1HD2      ASN  21  -6.711  -8.076   6.088
  115   HD22  ASN  21          2HD2      ASN  21  -8.013  -8.158   4.955
  116    H    PHE  22           H        PHE  22  -6.980  -3.811   3.767
  117    HA   PHE  22           HA       PHE  22  -8.136  -1.480   5.068
  118    HB2  PHE  22           1HB      PHE  22  -6.529  -1.169   2.527
  119    HB3  PHE  22           2HB      PHE  22  -7.310   0.107   3.455
  120    HD1  PHE  22           HD2      PHE  22  -4.470  -2.193   3.299
  121    HD2  PHE  22           HD1      PHE  22  -6.325   0.956   5.480
  122    HE1  PHE  22           HE2      PHE  22  -2.396  -1.865   4.581
  123    HE2  PHE  22           HE1      PHE  22  -4.254   1.290   6.766
  124    HZ   PHE  22           HZ       PHE  22  -2.286  -0.122   6.318
  125    H    CYS  23           H        CYS  23 -10.225  -1.738   4.648
  126    HA   CYS  23           HA       CYS  23 -11.362  -3.285   2.661
  127    HB2  CYS  23           1HB      CYS  23 -12.430  -0.921   4.194
  128    HB3  CYS  23           2HB      CYS  23 -13.423  -1.810   3.047
  129    HG   CYS  23           HG       CYS  23 -12.076  -4.029   4.990
  130    H    TYR  24           H        TYR  24 -10.598   0.170   2.612
  131    HA   TYR  24           HA       TYR  24 -11.313   0.244  -0.239
  132    HB2  TYR  24           1HB      TYR  24 -10.960   2.832   0.310
  133    HB3  TYR  24           2HB      TYR  24 -12.487   2.010   0.613
  134    HD1  TYR  24           HD2      TYR  24 -12.659   0.891   3.015
  135    HD2  TYR  24           HD1      TYR  24 -10.046   4.096   2.012
  136    HE1  TYR  24           HE2      TYR  24 -12.532   1.523   5.388
  137    HE2  TYR  24           HE1      TYR  24  -9.911   4.736   4.383
  138    HH   TYR  24           HH       TYR  24 -10.507   4.237   6.462
  139    H    ILE  25           H        ILE  25  -9.706   0.160  -1.648
  140    HA   ILE  25           HA       ILE  25  -7.042  -0.051  -1.147
  141    HB   ILE  25           HB       ILE  25  -8.175  -0.375  -3.370
  142   HG12  ILE  25          1HG1      ILE  25  -6.129   0.622  -4.656
  143   HG13  ILE  25          2HG1      ILE  25  -5.550   1.042  -3.048
  144   HG21  ILE  25          1HG2      ILE  25  -7.763   2.603  -3.597
  145   HG22  ILE  25          2HG2      ILE  25  -8.298   1.530  -4.889
  146   HG23  ILE  25          3HG2      ILE  25  -9.318   1.782  -3.473
  147   HD11  ILE  25          3HD1      ILE  25  -4.556  -0.990  -3.372
  148   HD12  ILE  25          1HD1      ILE  25  -6.034  -1.470  -2.540
  149   HD13  ILE  25          2HD1      ILE  25  -5.916  -1.633  -4.292
  150    H    SER  26           H        SER  26  -8.843   2.947  -1.687
  151    HA   SER  26           HA       SER  26  -6.860   4.804  -1.885
  152    HB2  SER  26           1HB      SER  26  -9.570   4.848  -0.637
  153    HB3  SER  26           2HB      SER  26  -8.504   6.223  -0.346
  154    HG   SER  26           HG       SER  26  -9.717   5.371  -2.699
  155    H    ALA  27           H        ALA  27  -8.085   3.356   1.111
  156    HA   ALA  27           HA       ALA  27  -6.523   4.837   2.906
  157    HB1  ALA  27           3HB      ALA  27  -7.715   3.681   4.375
  158    HB2  ALA  27           1HB      ALA  27  -8.365   2.711   3.053
  159    HB3  ALA  27           2HB      ALA  27  -6.909   2.187   3.900
  160    H    LEU  28           H        LEU  28  -5.934   1.613   1.505
  161    HA   LEU  28           HA       LEU  28  -3.528   1.017   2.688
  162    HB2  LEU  28           1HB      LEU  28  -4.371  -0.695   1.411
  163    HB3  LEU  28           2HB      LEU  28  -4.742   0.362   0.050
  164    HG   LEU  28           HG       LEU  28  -2.244   0.492  -0.356
  165   HD11  LEU  28          1HD1      LEU  28  -1.526  -1.991   0.744
  166   HD12  LEU  28          2HD1      LEU  28  -2.247  -1.053   2.052
  167   HD13  LEU  28          3HD1      LEU  28  -0.882  -0.399   1.147
  168   HD21  LEU  28          3HD2      LEU  28  -3.147  -0.807  -1.961
  169   HD22  LEU  28          1HD2      LEU  28  -4.049  -1.792  -0.809
  170   HD23  LEU  28          2HD2      LEU  28  -2.334  -2.102  -1.080
  171    H    ARG  29           H        ARG  29  -4.058   2.902  -0.276
  172    HA   ARG  29           HA       ARG  29  -1.404   3.363  -0.958
  173    HB2  ARG  29           1HB      ARG  29  -3.675   5.326  -1.301
  174    HB3  ARG  29           2HB      ARG  29  -2.198   5.241  -2.252
  175    HG2  ARG  29           1HG      ARG  29  -4.271   3.061  -2.149
  176    HG3  ARG  29           2HG      ARG  29  -4.199   4.316  -3.389
  177    HD2  ARG  29           1HD      ARG  29  -2.040   2.300  -2.776
  178    HD3  ARG  29           2HD      ARG  29  -3.144   2.247  -4.150
  179    HE   ARG  29           HE       ARG  29  -1.576   4.661  -3.958
  180   HH11  ARG  29          1HH1      ARG  29  -1.764   1.423  -5.222
  181   HH12  ARG  29          2HH1      ARG  29  -0.637   1.719  -6.504
  182   HH21  ARG  29          1HH2      ARG  29  -0.091   5.063  -5.642
  183   HH22  ARG  29          2HH2      ARG  29   0.315   3.789  -6.742
  184    H    ILE  30           H        ILE  30  -3.519   5.180   1.227
  185    HA   ILE  30           HA       ILE  30  -1.711   7.265   1.793
  186    HB   ILE  30           HB       ILE  30  -3.936   6.159   3.511
  187   HG12  ILE  30          1HG1      ILE  30  -4.051   8.695   1.912
  188   HG13  ILE  30          2HG1      ILE  30  -4.366   7.151   1.128
  189   HG21  ILE  30          1HG2      ILE  30  -2.774   8.916   3.708
  190   HG22  ILE  30          2HG2      ILE  30  -3.786   8.055   4.865
  191   HG23  ILE  30          3HG2      ILE  30  -2.108   7.568   4.629
  192   HD11  ILE  30          3HD1      ILE  30  -6.471   7.910   1.719
  193   HD12  ILE  30          1HD1      ILE  30  -6.068   6.783   3.014
  194   HD13  ILE  30          2HD1      ILE  30  -5.922   8.521   3.280
  195    H    HIS  31           H        HIS  31  -2.281   4.138   3.344
  196    HA   HIS  31           HA       HIS  31  -0.524   4.544   5.526
  197    HB2  HIS  31           1HB      HIS  31  -1.962   2.792   5.932
  198    HB3  HIS  31           2HB      HIS  31  -1.864   2.188   4.280
  199    HD1  HIS  31           HD1      HIS  31   0.104   2.203   7.505
  200    HD2  HIS  31           HD2      HIS  31  -0.047   0.171   3.885
  201    HE1  HIS  31           HE1      HIS  31   1.677   0.257   7.760
  202    H    GLN  32           H        GLN  32  -0.100   2.936   2.387
  203    HA   GLN  32           HA       GLN  32   2.386   1.880   2.586
  204    HB2  GLN  32           1HB      GLN  32   1.065   3.342   0.319
  205    HB3  GLN  32           2HB      GLN  32   2.689   2.691   0.142
  206    HG2  GLN  32           1HG      GLN  32   1.660   0.476   0.942
  207    HG3  GLN  32           2HG      GLN  32   0.114   1.230   0.556
  208   HE21  GLN  32          1HE2      GLN  32  -0.071   2.130  -1.657
  209   HE22  GLN  32          2HE2      GLN  32   0.670   1.254  -2.948
  210    H    ARG  33           H        ARG  33   1.579   5.285   2.365
  211    HA   ARG  33           HA       ARG  33   3.908   6.500   1.698
  212    HB2  ARG  33           1HB      ARG  33   2.097   7.292   3.987
  213    HB3  ARG  33           2HB      ARG  33   3.279   8.343   3.219
  214    HG2  ARG  33           1HG      ARG  33   2.057   8.120   1.092
  215    HG3  ARG  33           2HG      ARG  33   0.845   7.139   1.920
  216    HD2  ARG  33           1HD      ARG  33  -0.134   9.218   1.999
  217    HD3  ARG  33           2HD      ARG  33   0.723   9.184   3.540
  218    HE   ARG  33           HE       ARG  33   2.218  10.334   1.356
  219   HH11  ARG  33          1HH1      ARG  33  -0.000  10.923   3.973
  220   HH12  ARG  33          2HH1      ARG  33   0.404  12.602   4.111
  221   HH21  ARG  33          1HH2      ARG  33   2.758  12.543   1.527
  222   HH22  ARG  33          2HH2      ARG  33   1.972  13.523   2.718
  223    H    VAL  34           H        VAL  34   3.140   5.053   4.832
  224    HA   VAL  34           HA       VAL  34   5.394   5.885   6.252
  225    HB   VAL  34           HB       VAL  34   4.946   4.141   7.812
  226   HG11  VAL  34          1HG1      VAL  34   2.732   4.604   8.378
  227   HG12  VAL  34          2HG1      VAL  34   3.212   5.997   7.406
  228   HG13  VAL  34          3HG1      VAL  34   2.225   4.720   6.693
  229   HG21  VAL  34          3HG2      VAL  34   4.821   2.151   6.656
  230   HG22  VAL  34          1HG2      VAL  34   3.132   2.401   7.096
  231   HG23  VAL  34          2HG2      VAL  34   3.685   2.789   5.467
  232    H    HIS  35           H        HIS  35   4.933   3.165   4.062
  233    HA   HIS  35           HA       HIS  35   7.448   1.940   4.600
  234    HB2  HIS  35           1HB      HIS  35   5.450   1.655   2.361
  235    HB3  HIS  35           2HB      HIS  35   6.964   0.756   2.384
  236    HD1  HIS  35           HD1      HIS  35   7.279  -0.858   4.531
  237    HD2  HIS  35           HD2      HIS  35   3.429   0.515   3.786
  238    HE1  HIS  35           HE1      HIS  35   5.759  -2.380   5.834
  239    H    MET  36           H        MET  36   6.707   4.808   3.129
  240    HA   MET  36           HA       MET  36   8.857   4.677   1.156
  241    HB2  MET  36           1HB      MET  36   6.898   6.896   1.771
  242    HB3  MET  36           2HB      MET  36   8.064   6.901   0.455
  243    HG2  MET  36           1HG      MET  36   6.084   4.683   0.659
  244    HG3  MET  36           2HG      MET  36   5.585   6.248   0.021
  245    HE1  MET  36           3HE      MET  36   5.937   5.813  -3.397
  246    HE2  MET  36           1HE      MET  36   5.271   4.332  -2.709
  247    HE3  MET  36           2HE      MET  36   4.912   5.890  -1.963
  248    H    GLY  37           H        GLY  37   9.345   4.636   4.078
  249    HA2  GLY  37           1HA      GLY  37  10.898   5.504   5.528
  250    HA3  GLY  37           2HA      GLY  37  11.578   6.352   4.148
  251    H    GLU  38           H        GLU  38  11.428   7.381   6.789
  252    HA   GLU  38           HA       GLU  38   9.425   9.518   6.484
  253    HB2  GLU  38           1HB      GLU  38   9.525   7.936   8.575
  254    HB3  GLU  38           2HB      GLU  38  10.851   8.983   9.061
  255    HG2  GLU  38           1HG      GLU  38   8.023   9.834   8.485
  256    HG3  GLU  38           2HG      GLU  38   8.782   9.710  10.071
  257    H    LYS  39           H        LYS  39  11.303  10.153   4.900
  258    HA   LYS  39           HA       LYS  39  13.745  11.073   5.482
  259    HB2  LYS  39           1HB      LYS  39  11.632  12.594   3.944
  260    HB3  LYS  39           2HB      LYS  39  13.351  12.965   3.904
  261    HG2  LYS  39           1HG      LYS  39  12.359  10.235   3.186
  262    HG3  LYS  39           2HG      LYS  39  12.339  11.552   2.010
  263    HD2  LYS  39           1HD      LYS  39  14.742  11.864   2.308
  264    HD3  LYS  39           2HD      LYS  39  14.769  10.573   3.512
  265    HE2  LYS  39           1HE      LYS  39  13.847   9.057   1.708
  266    HE3  LYS  39           2HE      LYS  39  14.192  10.355   0.566
  267    HZ1  LYS  39           3HZ      LYS  39  16.029   8.590   1.982
  268    HZ2  LYS  39           1HZ      LYS  39  16.532  10.191   1.764
  269    HZ3  LYS  39           2HZ      LYS  39  16.136   9.239   0.423
  270    H    CYS  40           H        CYS  40  14.650  12.339   6.958
  271    HA   CYS  40           HA       CYS  40  12.985  14.401   8.247
  272    HB2  CYS  40           1HB      CYS  40  13.545  12.485   9.738
  273    HB3  CYS  40           2HB      CYS  40  15.252  12.849   9.512
  274    HG   CYS  40           HG       CYS  40  14.680  15.588  10.525
  275    H    SER  41           H        SER  41  13.637  16.096   6.950
  276    HA   SER  41           HA       SER  41  16.479  16.843   7.181
  277    HB2  SER  41           1HB      SER  41  16.218  17.997   4.979
  278    HB3  SER  41           2HB      SER  41  16.032  16.246   4.878
  279    HG   SER  41           HG       SER  41  14.406  17.737   3.812
  280    H    GLY  42           H        GLY  42  16.089  18.099   9.029
  281    HA2  GLY  42           1HA      GLY  42  15.982  20.658   9.143
  282    HA3  GLY  42           2HA      GLY  42  14.312  20.420   8.650
  283    HA   PRO  43           HA       PRO  43  15.098  19.887  13.378
  284    HB2  PRO  43           1HB      PRO  43  14.887  22.447  14.255
  285    HB3  PRO  43           2HB      PRO  43  16.432  21.700  13.835
  286    HG2  PRO  43           1HG      PRO  43  14.714  23.538  12.214
  287    HG3  PRO  43           2HG      PRO  43  16.475  23.545  12.420
  288    HD2  PRO  43           1HD      PRO  43  15.269  22.505  10.230
  289    HD3  PRO  43           2HD      PRO  43  16.787  21.857  10.881
  290    H    SER  44           H        SER  44  12.860  20.920  11.196
  291    HA   SER  44           HA       SER  44  10.764  22.131  12.309
  292    HB2  SER  44           1HB      SER  44  10.666  21.125  10.077
  293    HB3  SER  44           2HB      SER  44  10.584  19.515  10.793
  294    HG   SER  44           HG       SER  44   8.580  21.119  10.240
  295    H    SER  45           H        SER  45  11.117  18.595  12.644
  296    HA   SER  45           HA       SER  45   9.232  18.507  14.803
  297    HB2  SER  45           1HB      SER  45   9.684  16.122  14.854
  298    HB3  SER  45           2HB      SER  45   9.527  16.642  13.176
  299    HG   SER  45           HG       SER  45  12.081  16.682  14.278
  300    H    GLY  46           H        GLY  46   9.611  18.108  16.975
  301    HA2  GLY  46           1HA      GLY  46  11.712  19.362  18.225
  302    HA3  GLY  46           2HA      GLY  46  10.762  18.083  18.966
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1  14.465 -18.987  -8.000
    2    HA2  GLY   1           1HA      GLY   1  12.867 -20.367  -6.294
    3    HA3  GLY   1           2HA      GLY   1  14.620 -20.404  -6.182
    4    H    SER   2           H        SER   2  12.279 -17.819  -5.485
    5    HA   SER   2           HA       SER   2  13.170 -17.873  -2.683
    6    HB2  SER   2           1HB      SER   2  13.116 -15.379  -2.684
    7    HB3  SER   2           2HB      SER   2  14.361 -16.044  -3.742
    8    HG   SER   2           HG       SER   2  11.967 -14.746  -4.395
    9    H    SER   3           H        SER   3  11.630 -17.394  -1.153
   10    HA   SER   3           HA       SER   3   8.990 -18.024  -1.648
   11    HB2  SER   3           1HB      SER   3   9.881 -18.059   0.604
   12    HB3  SER   3           2HB      SER   3  10.147 -16.316   0.567
   13    HG   SER   3           HG       SER   3   8.242 -16.603   1.618
   14    H    GLY   4           H        GLY   4   7.072 -16.813  -1.821
   15    HA2  GLY   4           1HA      GLY   4   7.405 -13.964  -2.487
   16    HA3  GLY   4           2HA      GLY   4   6.580 -15.031  -3.613
   17    H    SER   5           H        SER   5   4.748 -13.611  -3.387
   18    HA   SER   5           HA       SER   5   3.313 -13.927  -0.837
   19    HB2  SER   5           1HB      SER   5   3.404 -11.748  -2.870
   20    HB3  SER   5           2HB      SER   5   1.886 -12.006  -2.010
   21    HG   SER   5           HG       SER   5   2.842 -10.781  -0.575
   22    H    SER   6           H        SER   6   2.574 -16.035  -1.414
   23    HA   SER   6           HA       SER   6   0.281 -15.954  -3.249
   24    HB2  SER   6           1HB      SER   6   2.606 -17.822  -3.294
   25    HB3  SER   6           2HB      SER   6   1.012 -18.484  -3.656
   26    HG   SER   6           HG       SER   6   1.002 -16.422  -5.094
   27    H    GLY   7           H        GLY   7  -1.004 -15.719  -1.350
   28    HA2  GLY   7           1HA      GLY   7  -1.958 -18.182  -0.314
   29    HA3  GLY   7           2HA      GLY   7  -0.968 -17.367   0.888
   30    H    SER   8           H        SER   8  -1.558 -14.911   1.053
   31    HA   SER   8           HA       SER   8  -3.943 -14.613   2.302
   32    HB2  SER   8           1HB      SER   8  -2.658 -12.450   0.619
   33    HB3  SER   8           2HB      SER   8  -3.734 -12.213   1.996
   34    HG   SER   8           HG       SER   8  -1.943 -13.621   3.048
   35    H    GLY   9           H        GLY   9  -6.038 -14.479   1.777
   36    HA2  GLY   9           1HA      GLY   9  -6.805 -13.742  -0.948
   37    HA3  GLY   9           2HA      GLY   9  -7.280 -15.337  -0.382
   38    H    GLU  10           H        GLU  10  -7.648 -11.878   0.170
   39    HA   GLU  10           HA       GLU  10 -10.256 -12.443   1.408
   40    HB2  GLU  10           1HB      GLU  10  -8.539 -11.745   3.099
   41    HB3  GLU  10           2HB      GLU  10  -8.408 -10.209   2.254
   42    HG2  GLU  10           1HG      GLU  10 -10.560  -9.554   2.857
   43    HG3  GLU  10           2HG      GLU  10 -11.043 -11.197   3.272
   44    H    LYS  11           H        LYS  11 -11.839 -10.749   1.167
   45    HA   LYS  11           HA       LYS  11 -11.661  -9.489  -1.427
   46    HB2  LYS  11           1HB      LYS  11 -13.808  -9.957   0.586
   47    HB3  LYS  11           2HB      LYS  11 -14.028  -8.637  -0.556
   48    HG2  LYS  11           1HG      LYS  11 -15.087 -10.462  -1.549
   49    HG3  LYS  11           2HG      LYS  11 -13.531 -10.351  -2.376
   50    HD2  LYS  11           1HD      LYS  11 -13.728 -12.081   0.038
   51    HD3  LYS  11           2HD      LYS  11 -14.456 -12.655  -1.465
   52    HE2  LYS  11           1HE      LYS  11 -11.646 -11.614  -1.405
   53    HE3  LYS  11           2HE      LYS  11 -12.005 -13.279  -0.952
   54    HZ1  LYS  11           3HZ      LYS  11 -12.944 -12.145  -3.514
   55    HZ2  LYS  11           1HZ      LYS  11 -12.766 -13.771  -3.082
   56    HZ3  LYS  11           2HZ      LYS  11 -11.399 -12.816  -3.363
   57    H    SER  12           H        SER  12  -9.761  -8.396   0.220
   58    HA   SER  12           HA       SER  12 -10.568  -5.622   0.222
   59    HB2  SER  12           1HB      SER  12  -9.944  -7.104   2.766
   60    HB3  SER  12           2HB      SER  12  -9.637  -5.373   2.627
   61    HG   SER  12           HG       SER  12 -12.089  -6.757   2.519
   62    H    HIS  13           H        HIS  13  -8.860  -4.231  -0.025
   63    HA   HIS  13           HA       HIS  13  -6.474  -5.222  -1.093
   64    HB2  HIS  13           1HB      HIS  13  -6.724  -2.482   0.131
   65    HB3  HIS  13           2HB      HIS  13  -5.758  -2.975  -1.256
   66    HD1  HIS  13           HD1      HIS  13  -6.975  -3.207  -3.528
   67    HD2  HIS  13           HD2      HIS  13  -9.408  -1.920  -0.415
   68    HE1  HIS  13           HE1      HIS  13  -9.080  -2.371  -4.621
   69    H    THR  14           H        THR  14  -4.804  -6.147  -0.128
   70    HA   THR  14           HA       THR  14  -4.278  -5.512   2.701
   71    HB   THR  14           HB       THR  14  -3.551  -8.032   1.195
   72    HG1  THR  14           HG1      THR  14  -5.549  -8.533   1.675
   73   HG21  THR  14          3HG2      THR  14  -2.450  -6.931   3.535
   74   HG22  THR  14          1HG2      THR  14  -2.216  -8.559   2.900
   75   HG23  THR  14          2HG2      THR  14  -3.506  -8.242   4.060
   76    H    CYS  15           H        CYS  15  -2.345  -4.709   3.267
   77    HA   CYS  15           HA       CYS  15  -0.517  -3.891   1.221
   78    HB2  CYS  15           1HB      CYS  15  -1.047  -2.586   3.318
   79    HB3  CYS  15           2HB      CYS  15  -0.092  -3.766   4.209
   80    H    ASP  16           H        ASP  16   0.808  -5.308   0.295
   81    HA   ASP  16           HA       ASP  16   1.672  -7.713   1.551
   82    HB2  ASP  16           1HB      ASP  16   2.159  -6.360  -1.054
   83    HB3  ASP  16           2HB      ASP  16   3.339  -7.560  -0.534
   84    H    GLU  17           H        GLU  17   2.722  -4.524   1.781
   85    HA   GLU  17           HA       GLU  17   5.520  -4.961   2.095
   86    HB2  GLU  17           1HB      GLU  17   3.870  -2.678   3.186
   87    HB3  GLU  17           2HB      GLU  17   5.607  -2.689   2.916
   88    HG2  GLU  17           1HG      GLU  17   3.812  -3.204   0.606
   89    HG3  GLU  17           2HG      GLU  17   3.956  -1.557   1.216
   90    H    CYS  18           H        CYS  18   2.791  -4.727   4.332
   91    HA   CYS  18           HA       CYS  18   4.532  -5.824   6.439
   92    HB2  CYS  18           1HB      CYS  18   3.238  -4.531   8.096
   93    HB3  CYS  18           2HB      CYS  18   4.067  -3.486   6.948
   94    H    GLY  19           H        GLY  19   1.255  -5.561   5.143
   95    HA2  GLY  19           1HA      GLY  19   0.100  -7.750   4.902
   96    HA3  GLY  19           2HA      GLY  19   0.598  -8.073   6.556
   97    H    LYS  20           H        LYS  20  -0.281  -4.841   6.005
   98    HA   LYS  20           HA       LYS  20  -2.478  -4.988   7.792
   99    HB2  LYS  20           1HB      LYS  20  -1.209  -2.863   6.135
  100    HB3  LYS  20           2HB      LYS  20  -2.838  -2.572   6.729
  101    HG2  LYS  20           1HG      LYS  20  -0.732  -3.490   8.629
  102    HG3  LYS  20           2HG      LYS  20  -0.766  -1.803   8.110
  103    HD2  LYS  20           1HD      LYS  20  -3.211  -1.792   8.783
  104    HD3  LYS  20           2HD      LYS  20  -2.906  -3.348   9.559
  105    HE2  LYS  20           1HE      LYS  20  -1.224  -0.935  10.158
  106    HE3  LYS  20           2HE      LYS  20  -2.750  -1.223  10.993
  107    HZ1  LYS  20           3HZ      LYS  20  -0.511  -3.170  10.903
  108    HZ2  LYS  20           1HZ      LYS  20  -1.923  -3.286  11.827
  109    HZ3  LYS  20           2HZ      LYS  20  -0.779  -2.091  12.178
  110    H    ASN  21           H        ASN  21  -4.687  -4.269   7.302
  111    HA   ASN  21           HA       ASN  21  -5.533  -5.066   4.594
  112    HB2  ASN  21           1HB      ASN  21  -6.837  -5.675   7.250
  113    HB3  ASN  21           2HB      ASN  21  -7.655  -5.885   5.705
  114   HD21  ASN  21          1HD2      ASN  21  -7.516  -8.052   7.159
  115   HD22  ASN  21          2HD2      ASN  21  -6.312  -9.151   6.584
  116    H    PHE  22           H        PHE  22  -6.775  -3.660   3.523
  117    HA   PHE  22           HA       PHE  22  -8.153  -1.551   5.032
  118    HB2  PHE  22           1HB      PHE  22  -6.603  -1.049   2.486
  119    HB3  PHE  22           2HB      PHE  22  -7.417   0.150   3.486
  120    HD1  PHE  22           HD2      PHE  22  -4.505  -2.052   3.199
  121    HD2  PHE  22           HD1      PHE  22  -6.430   0.950   5.523
  122    HE1  PHE  22           HE2      PHE  22  -2.428  -1.711   4.473
  123    HE2  PHE  22           HE1      PHE  22  -4.356   1.296   6.800
  124    HZ   PHE  22           HZ       PHE  22  -2.352  -0.037   6.277
  125    H    CYS  23           H        CYS  23 -10.245  -1.714   4.607
  126    HA   CYS  23           HA       CYS  23 -11.420  -3.240   2.627
  127    HB2  CYS  23           1HB      CYS  23 -12.464  -0.838   4.129
  128    HB3  CYS  23           2HB      CYS  23 -13.468  -1.792   3.044
  129    HG   CYS  23           HG       CYS  23 -13.209  -4.155   4.520
  130    H    TYR  24           H        TYR  24 -10.474   0.153   2.549
  131    HA   TYR  24           HA       TYR  24 -11.249   0.255  -0.291
  132    HB2  TYR  24           1HB      TYR  24 -10.879   2.838   0.247
  133    HB3  TYR  24           2HB      TYR  24 -12.409   2.031   0.569
  134    HD1  TYR  24           HD2      TYR  24 -12.546   0.912   2.983
  135    HD2  TYR  24           HD1      TYR  24  -9.961   4.123   1.928
  136    HE1  TYR  24           HE2      TYR  24 -12.392   1.559   5.351
  137    HE2  TYR  24           HE1      TYR  24  -9.799   4.778   4.293
  138    HH   TYR  24           HH       TYR  24 -10.082   3.762   6.508
  139    H    ILE  25           H        ILE  25  -9.724   0.542  -1.798
  140    HA   ILE  25           HA       ILE  25  -7.035   0.140  -1.322
  141    HB   ILE  25           HB       ILE  25  -8.261   0.035  -3.551
  142   HG12  ILE  25          1HG1      ILE  25  -6.096   1.049  -4.731
  143   HG13  ILE  25          2HG1      ILE  25  -5.507   1.071  -3.073
  144   HG21  ILE  25          1HG2      ILE  25  -9.160   2.344  -3.415
  145   HG22  ILE  25          2HG2      ILE  25  -7.524   2.955  -3.656
  146   HG23  ILE  25          3HG2      ILE  25  -8.308   2.008  -4.921
  147   HD11  ILE  25          3HD1      ILE  25  -5.771  -1.282  -2.870
  148   HD12  ILE  25          1HD1      ILE  25  -6.625  -1.376  -4.410
  149   HD13  ILE  25          2HD1      ILE  25  -4.910  -0.964  -4.376
  150    H    SER  26           H        SER  26  -8.734   3.226  -1.788
  151    HA   SER  26           HA       SER  26  -6.697   5.020  -1.807
  152    HB2  SER  26           1HB      SER  26  -8.846   5.939  -1.968
  153    HB3  SER  26           2HB      SER  26  -9.402   5.137  -0.499
  154    HG   SER  26           HG       SER  26  -8.615   7.567  -0.642
  155    H    ALA  27           H        ALA  27  -8.117   3.553   1.101
  156    HA   ALA  27           HA       ALA  27  -6.574   4.873   3.010
  157    HB1  ALA  27           3HB      ALA  27  -8.354   2.612   2.940
  158    HB2  ALA  27           1HB      ALA  27  -6.986   2.298   4.009
  159    HB3  ALA  27           2HB      ALA  27  -7.998   3.720   4.265
  160    H    LEU  28           H        LEU  28  -5.964   1.772   1.378
  161    HA   LEU  28           HA       LEU  28  -3.609   1.066   2.653
  162    HB2  LEU  28           1HB      LEU  28  -4.472  -0.575   1.284
  163    HB3  LEU  28           2HB      LEU  28  -4.736   0.538  -0.057
  164    HG   LEU  28           HG       LEU  28  -2.236   0.592  -0.362
  165   HD11  LEU  28          1HD1      LEU  28  -1.546  -1.878   0.725
  166   HD12  LEU  28          2HD1      LEU  28  -2.386  -1.024   2.019
  167   HD13  LEU  28          3HD1      LEU  28  -0.983  -0.289   1.244
  168   HD21  LEU  28          3HD2      LEU  28  -2.324  -1.154  -1.828
  169   HD22  LEU  28          1HD2      LEU  28  -4.046  -0.966  -1.495
  170   HD23  LEU  28          2HD2      LEU  28  -3.123  -2.227  -0.677
  171    H    ARG  29           H        ARG  29  -4.033   3.057  -0.260
  172    HA   ARG  29           HA       ARG  29  -1.354   3.511  -0.844
  173    HB2  ARG  29           1HB      ARG  29  -3.605   5.495  -1.201
  174    HB3  ARG  29           2HB      ARG  29  -2.092   5.445  -2.096
  175    HG2  ARG  29           1HG      ARG  29  -4.103   3.213  -2.148
  176    HG3  ARG  29           2HG      ARG  29  -4.108   4.553  -3.297
  177    HD2  ARG  29           1HD      ARG  29  -1.879   2.571  -2.848
  178    HD3  ARG  29           2HD      ARG  29  -2.954   2.645  -4.244
  179    HE   ARG  29           HE       ARG  29  -1.598   5.106  -3.899
  180   HH11  ARG  29          1HH1      ARG  29  -1.117   1.833  -4.981
  181   HH12  ARG  29          2HH1      ARG  29   0.164   2.243  -6.073
  182   HH21  ARG  29          1HH2      ARG  29   0.087   5.660  -5.332
  183   HH22  ARG  29          2HH2      ARG  29   0.849   4.421  -6.271
  184    H    ILE  30           H        ILE  30  -3.513   5.241   1.360
  185    HA   ILE  30           HA       ILE  30  -1.738   7.320   2.034
  186    HB   ILE  30           HB       ILE  30  -3.949   6.117   3.705
  187   HG12  ILE  30          1HG1      ILE  30  -4.046   8.623   2.028
  188   HG13  ILE  30          2HG1      ILE  30  -4.528   7.051   1.402
  189   HG21  ILE  30          1HG2      ILE  30  -3.807   8.688   4.483
  190   HG22  ILE  30          2HG2      ILE  30  -2.960   7.374   5.297
  191   HG23  ILE  30          3HG2      ILE  30  -2.108   8.380   4.126
  192   HD11  ILE  30          3HD1      ILE  30  -6.093   6.978   3.450
  193   HD12  ILE  30          1HD1      ILE  30  -5.824   8.720   3.509
  194   HD13  ILE  30          2HD1      ILE  30  -6.528   7.985   2.069
  195    H    HIS  31           H        HIS  31  -2.246   4.106   3.405
  196    HA   HIS  31           HA       HIS  31  -0.467   4.480   5.604
  197    HB2  HIS  31           1HB      HIS  31  -1.968   2.780   6.033
  198    HB3  HIS  31           2HB      HIS  31  -1.897   2.158   4.387
  199    HD1  HIS  31           HD1      HIS  31   0.104   2.159   7.593
  200    HD2  HIS  31           HD2      HIS  31  -0.146   0.084   4.003
  201    HE1  HIS  31           HE1      HIS  31   1.625   0.174   7.856
  202    H    GLN  32           H        GLN  32  -0.151   3.210   2.341
  203    HA   GLN  32           HA       GLN  32   2.313   1.962   2.504
  204    HB2  GLN  32           1HB      GLN  32   0.920   3.435   0.293
  205    HB3  GLN  32           2HB      GLN  32   2.543   2.802   0.051
  206    HG2  GLN  32           1HG      GLN  32   1.569   0.570   0.866
  207    HG3  GLN  32           2HG      GLN  32  -0.000   1.310   0.555
  208   HE21  GLN  32          1HE2      GLN  32   0.037   2.517  -1.680
  209   HE22  GLN  32          2HE2      GLN  32   0.606   1.551  -2.995
  210    H    ARG  33           H        ARG  33   1.546   5.338   2.599
  211    HA   ARG  33           HA       ARG  33   3.895   6.530   1.776
  212    HB2  ARG  33           1HB      ARG  33   2.160   7.372   4.106
  213    HB3  ARG  33           2HB      ARG  33   3.307   8.397   3.253
  214    HG2  ARG  33           1HG      ARG  33   1.962   8.032   1.177
  215    HG3  ARG  33           2HG      ARG  33   0.760   7.214   2.178
  216    HD2  ARG  33           1HD      ARG  33  -0.107   9.321   2.209
  217    HD3  ARG  33           2HD      ARG  33   0.971   9.437   3.599
  218    HE   ARG  33           HE       ARG  33   2.274  10.920   2.431
  219   HH11  ARG  33          1HH1      ARG  33   0.056   9.356   0.250
  220   HH12  ARG  33          2HH1      ARG  33   0.427  10.400  -1.083
  221   HH21  ARG  33          1HH2      ARG  33   2.771  12.300   0.684
  222   HH22  ARG  33          2HH2      ARG  33   1.972  12.073  -0.835
  223    H    VAL  34           H        VAL  34   3.213   4.811   4.739
  224    HA   VAL  34           HA       VAL  34   5.485   5.686   6.199
  225    HB   VAL  34           HB       VAL  34   5.011   3.938   7.754
  226   HG11  VAL  34          1HG1      VAL  34   2.809   4.465   8.367
  227   HG12  VAL  34          2HG1      VAL  34   3.369   5.872   7.461
  228   HG13  VAL  34          3HG1      VAL  34   2.305   4.692   6.693
  229   HG21  VAL  34          3HG2      VAL  34   2.972   2.382   6.904
  230   HG22  VAL  34          1HG2      VAL  34   3.845   2.625   5.391
  231   HG23  VAL  34          2HG2      VAL  34   4.672   1.929   6.785
  232    H    HIS  35           H        HIS  35   4.945   3.177   3.836
  233    HA   HIS  35           HA       HIS  35   7.457   1.851   4.364
  234    HB2  HIS  35           1HB      HIS  35   5.382   1.502   2.196
  235    HB3  HIS  35           2HB      HIS  35   6.852   0.537   2.298
  236    HD1  HIS  35           HD1      HIS  35   7.084  -0.889   4.601
  237    HD2  HIS  35           HD2      HIS  35   3.299   0.532   3.647
  238    HE1  HIS  35           HE1      HIS  35   5.487  -2.245   5.991
  239    H    MET  36           H        MET  36   7.174   4.758   3.413
  240    HA   MET  36           HA       MET  36   8.757   4.605   0.952
  241    HB2  MET  36           1HB      MET  36   7.365   6.919   2.305
  242    HB3  MET  36           2HB      MET  36   8.374   7.087   0.874
  243    HG2  MET  36           1HG      MET  36   6.786   5.293  -0.129
  244    HG3  MET  36           2HG      MET  36   5.701   5.798   1.165
  245    HE1  MET  36           3HE      MET  36   6.059   8.396   1.752
  246    HE2  MET  36           1HE      MET  36   5.959   9.674   0.541
  247    HE3  MET  36           2HE      MET  36   4.524   8.737   0.953
  248    H    GLY  37           H        GLY  37  10.727   5.786   0.740
  249    HA2  GLY  37           1HA      GLY  37  12.084   6.209   3.331
  250    HA3  GLY  37           2HA      GLY  37  12.887   5.607   1.888
  251    H    GLU  38           H        GLU  38  14.399   7.379   2.376
  252    HA   GLU  38           HA       GLU  38  14.059  10.016   2.538
  253    HB2  GLU  38           1HB      GLU  38  16.102  10.362   1.305
  254    HB3  GLU  38           2HB      GLU  38  16.250   8.881   2.240
  255    HG2  GLU  38           1HG      GLU  38  15.536   7.674   0.106
  256    HG3  GLU  38           2HG      GLU  38  15.872   9.198  -0.714
  257    H    LYS  39           H        LYS  39  12.821  11.466   1.571
  258    HA   LYS  39           HA       LYS  39  12.005  10.999  -1.217
  259    HB2  LYS  39           1HB      LYS  39  10.253  11.169   0.628
  260    HB3  LYS  39           2HB      LYS  39  10.679  12.872   0.740
  261    HG2  LYS  39           1HG      LYS  39  10.176  12.970  -1.767
  262    HG3  LYS  39           2HG      LYS  39   9.388  11.408  -1.533
  263    HD2  LYS  39           1HD      LYS  39   7.809  12.324  -0.029
  264    HD3  LYS  39           2HD      LYS  39   8.726  13.823   0.136
  265    HE2  LYS  39           1HE      LYS  39   6.830  14.235  -1.275
  266    HE3  LYS  39           2HE      LYS  39   8.288  14.288  -2.264
  267    HZ1  LYS  39           3HZ      LYS  39   7.518  12.651  -3.521
  268    HZ2  LYS  39           1HZ      LYS  39   6.041  12.755  -2.701
  269    HZ3  LYS  39           2HZ      LYS  39   7.222  11.661  -2.182
  270    H    CYS  40           H        CYS  40  13.091  12.155  -2.658
  271    HA   CYS  40           HA       CYS  40  14.147  14.782  -1.871
  272    HB2  CYS  40           1HB      CYS  40  15.766  14.552  -3.623
  273    HB3  CYS  40           2HB      CYS  40  15.745  13.040  -2.724
  274    HG   CYS  40           HG       CYS  40  15.298  11.519  -4.739
  275    H    SER  41           H        SER  41  13.533  16.612  -2.888
  276    HA   SER  41           HA       SER  41  11.748  16.360  -5.215
  277    HB2  SER  41           1HB      SER  41  11.353  18.018  -2.726
  278    HB3  SER  41           2HB      SER  41  10.523  18.389  -4.237
  279    HG   SER  41           HG       SER  41  10.044  15.921  -4.003
  280    H    GLY  42           H        GLY  42  12.053  17.806  -6.840
  281    HA2  GLY  42           1HA      GLY  42  14.514  19.158  -7.029
  282    HA3  GLY  42           2HA      GLY  42  13.153  19.358  -8.124
  283    HA   PRO  43           HA       PRO  43  13.916  23.197  -5.444
  284    HB2  PRO  43           1HB      PRO  43  14.867  24.820  -7.401
  285    HB3  PRO  43           2HB      PRO  43  15.914  23.807  -6.401
  286    HG2  PRO  43           1HG      PRO  43  14.888  23.316  -9.170
  287    HG3  PRO  43           2HG      PRO  43  16.513  23.046  -8.515
  288    HD2  PRO  43           1HD      PRO  43  14.720  21.042  -8.837
  289    HD3  PRO  43           2HD      PRO  43  15.920  21.049  -7.528
  290    H    SER  44           H        SER  44  12.090  22.129  -8.012
  291    HA   SER  44           HA       SER  44  10.375  24.518  -7.883
  292    HB2  SER  44           1HB      SER  44   9.730  23.789 -10.314
  293    HB3  SER  44           2HB      SER  44  11.200  24.726 -10.050
  294    HG   SER  44           HG       SER  44  11.337  21.927  -9.975
  295    H    SER  45           H        SER  45  10.621  21.038  -8.270
  296    HA   SER  45           HA       SER  45   8.997  19.396  -8.300
  297    HB2  SER  45           1HB      SER  45   9.500  20.231  -5.841
  298    HB3  SER  45           2HB      SER  45   7.817  20.753  -5.910
  299    HG   SER  45           HG       SER  45   7.168  18.720  -5.963
  300    H    GLY  46           H        GLY  46   8.188  21.094 -10.183
  301    HA2  GLY  46           1HA      GLY  46   5.358  21.678  -9.589
  302    HA3  GLY  46           2HA      GLY  46   6.302  22.465 -10.844
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1   3.545 -20.577 -14.917
    2    HA2  GLY   1           1HA      GLY   1   1.910 -18.757 -15.479
    3    HA3  GLY   1           2HA      GLY   1   1.784 -20.147 -16.546
    4    H    SER   2           H        SER   2  -0.230 -20.765 -16.898
    5    HA   SER   2           HA       SER   2  -2.518 -20.829 -16.683
    6    HB2  SER   2           1HB      SER   2  -3.222 -22.360 -15.005
    7    HB3  SER   2           2HB      SER   2  -1.576 -22.836 -15.423
    8    HG   SER   2           HG       SER   2  -1.067 -21.301 -13.554
    9    H    SER   3           H        SER   3  -1.628 -18.278 -16.092
   10    HA   SER   3           HA       SER   3  -2.893 -17.439 -13.613
   11    HB2  SER   3           1HB      SER   3  -1.299 -16.011 -15.733
   12    HB3  SER   3           2HB      SER   3  -2.163 -15.124 -14.478
   13    HG   SER   3           HG       SER   3  -0.272 -15.453 -13.527
   14    H    GLY   4           H        GLY   4  -5.069 -17.508 -13.726
   15    HA2  GLY   4           1HA      GLY   4  -6.428 -15.573 -15.321
   16    HA3  GLY   4           2HA      GLY   4  -6.689 -17.198 -15.939
   17    H    SER   5           H        SER   5  -6.556 -15.729 -12.690
   18    HA   SER   5           HA       SER   5  -9.297 -16.625 -12.215
   19    HB2  SER   5           1HB      SER   5  -6.991 -17.318 -10.379
   20    HB3  SER   5           2HB      SER   5  -8.693 -17.654 -10.066
   21    HG   SER   5           HG       SER   5  -7.248 -19.359 -11.069
   22    H    SER   6           H        SER   6 -10.458 -15.198 -11.071
   23    HA   SER   6           HA       SER   6  -9.008 -12.953  -9.832
   24    HB2  SER   6           1HB      SER   6 -10.667 -12.645 -11.851
   25    HB3  SER   6           2HB      SER   6 -11.899 -12.769 -10.596
   26    HG   SER   6           HG       SER   6 -10.034 -10.767 -11.073
   27    H    GLY   7           H        GLY   7  -8.790 -14.142  -7.852
   28    HA2  GLY   7           1HA      GLY   7 -10.600 -13.502  -5.875
   29    HA3  GLY   7           2HA      GLY   7 -11.072 -15.102  -6.428
   30    H    SER   8           H        SER   8  -8.239 -13.275  -5.297
   31    HA   SER   8           HA       SER   8  -6.551 -15.399  -4.751
   32    HB2  SER   8           1HB      SER   8  -6.858 -12.705  -3.430
   33    HB3  SER   8           2HB      SER   8  -5.605 -13.846  -2.941
   34    HG   SER   8           HG       SER   8  -5.407 -12.136  -4.849
   35    H    GLY   9           H        GLY   9  -8.672 -13.748  -2.396
   36    HA2  GLY   9           1HA      GLY   9  -9.746 -16.035  -1.240
   37    HA3  GLY   9           2HA      GLY   9  -8.267 -15.681  -0.360
   38    H    GLU  10           H        GLU  10  -8.381 -12.861  -0.479
   39    HA   GLU  10           HA       GLU  10 -10.713 -12.362   1.252
   40    HB2  GLU  10           1HB      GLU  10  -8.491 -12.274   2.380
   41    HB3  GLU  10           2HB      GLU  10  -8.039 -10.954   1.310
   42    HG2  GLU  10           1HG      GLU  10  -9.423  -9.453   2.344
   43    HG3  GLU  10           2HG      GLU  10 -10.522 -10.701   2.927
   44    H    LYS  11           H        LYS  11 -12.008 -10.644   0.853
   45    HA   LYS  11           HA       LYS  11 -11.576  -9.234  -1.664
   46    HB2  LYS  11           1HB      LYS  11 -13.927  -9.767   0.093
   47    HB3  LYS  11           2HB      LYS  11 -13.968  -8.339  -0.934
   48    HG2  LYS  11           1HG      LYS  11 -13.385 -11.087  -1.997
   49    HG3  LYS  11           2HG      LYS  11 -15.018 -10.428  -1.876
   50    HD2  LYS  11           1HD      LYS  11 -12.846  -8.908  -3.275
   51    HD3  LYS  11           2HD      LYS  11 -13.738 -10.184  -4.108
   52    HE2  LYS  11           1HE      LYS  11 -15.830  -8.904  -3.211
   53    HE3  LYS  11           2HE      LYS  11 -14.704  -7.555  -3.065
   54    HZ1  LYS  11           3HZ      LYS  11 -15.125  -7.173  -5.199
   55    HZ2  LYS  11           1HZ      LYS  11 -15.923  -8.652  -5.402
   56    HZ3  LYS  11           2HZ      LYS  11 -14.241  -8.569  -5.560
   57    H    SER  12           H        SER  12  -9.777  -8.417   0.211
   58    HA   SER  12           HA       SER  12 -10.545  -5.634   0.557
   59    HB2  SER  12           1HB      SER  12  -9.675  -7.388   2.864
   60    HB3  SER  12           2HB      SER  12  -9.712  -5.626   2.927
   61    HG   SER  12           HG       SER  12 -11.732  -5.837   3.425
   62    H    HIS  13           H        HIS  13  -8.913  -4.333   0.025
   63    HA   HIS  13           HA       HIS  13  -6.501  -5.255  -1.000
   64    HB2  HIS  13           1HB      HIS  13  -6.852  -2.506   0.187
   65    HB3  HIS  13           2HB      HIS  13  -5.834  -2.982  -1.169
   66    HD1  HIS  13           HD1      HIS  13  -6.964  -3.235  -3.468
   67    HD2  HIS  13           HD2      HIS  13  -9.564  -2.115  -0.427
   68    HE1  HIS  13           HE1      HIS  13  -9.078  -2.512  -4.623
   69    H    THR  14           H        THR  14  -4.827  -6.157  -0.023
   70    HA   THR  14           HA       THR  14  -4.280  -5.452   2.785
   71    HB   THR  14           HB       THR  14  -3.571  -7.987   1.295
   72    HG1  THR  14           HG1      THR  14  -5.231  -8.881   2.380
   73   HG21  THR  14          3HG2      THR  14  -3.252  -7.511   4.245
   74   HG22  THR  14          1HG2      THR  14  -1.958  -7.139   3.106
   75   HG23  THR  14          2HG2      THR  14  -2.557  -8.792   3.252
   76    H    CYS  15           H        CYS  15  -2.278  -4.776   3.384
   77    HA   CYS  15           HA       CYS  15  -0.513  -3.877   1.294
   78    HB2  CYS  15           1HB      CYS  15  -1.029  -2.579   3.399
   79    HB3  CYS  15           2HB      CYS  15  -0.050  -3.750   4.276
   80    H    ASP  16           H        ASP  16   0.931  -5.169   0.383
   81    HA   ASP  16           HA       ASP  16   1.782  -7.621   1.574
   82    HB2  ASP  16           1HB      ASP  16   2.542  -6.142  -0.935
   83    HB3  ASP  16           2HB      ASP  16   3.398  -7.599  -0.437
   84    H    GLU  17           H        GLU  17   2.857  -4.396   1.768
   85    HA   GLU  17           HA       GLU  17   5.624  -4.833   2.190
   86    HB2  GLU  17           1HB      GLU  17   3.892  -2.573   3.206
   87    HB3  GLU  17           2HB      GLU  17   5.647  -2.568   3.112
   88    HG2  GLU  17           1HG      GLU  17   4.048  -3.036   0.642
   89    HG3  GLU  17           2HG      GLU  17   4.223  -1.400   1.275
   90    H    CYS  18           H        CYS  18   2.859  -4.574   4.389
   91    HA   CYS  18           HA       CYS  18   4.563  -5.681   6.524
   92    HB2  CYS  18           1HB      CYS  18   3.153  -4.448   8.147
   93    HB3  CYS  18           2HB      CYS  18   4.024  -3.374   7.056
   94    H    GLY  19           H        GLY  19   1.334  -5.531   5.105
   95    HA2  GLY  19           1HA      GLY  19   0.187  -7.680   4.810
   96    HA3  GLY  19           2HA      GLY  19   0.749  -8.113   6.417
   97    H    LYS  20           H        LYS  20  -0.361  -4.888   5.867
   98    HA   LYS  20           HA       LYS  20  -2.465  -5.229   7.795
   99    HB2  LYS  20           1HB      LYS  20  -1.336  -2.927   6.254
  100    HB3  LYS  20           2HB      LYS  20  -2.909  -2.753   7.020
  101    HG2  LYS  20           1HG      LYS  20  -0.670  -3.805   8.660
  102    HG3  LYS  20           2HG      LYS  20  -0.676  -2.087   8.253
  103    HD2  LYS  20           1HD      LYS  20  -2.927  -1.875   9.194
  104    HD3  LYS  20           2HD      LYS  20  -2.919  -3.593   9.600
  105    HE2  LYS  20           1HE      LYS  20  -0.774  -3.046  10.917
  106    HE3  LYS  20           2HE      LYS  20  -1.292  -1.366  10.778
  107    HZ1  LYS  20           3HZ      LYS  20  -2.614  -3.591  12.197
  108    HZ2  LYS  20           1HZ      LYS  20  -3.493  -2.227  11.718
  109    HZ3  LYS  20           2HZ      LYS  20  -2.190  -2.061  12.782
  110    H    ASN  21           H        ASN  21  -4.683  -4.336   7.338
  111    HA   ASN  21           HA       ASN  21  -5.559  -5.097   4.629
  112    HB2  ASN  21           1HB      ASN  21  -6.605  -5.880   7.305
  113    HB3  ASN  21           2HB      ASN  21  -7.781  -5.608   6.022
  114   HD21  ASN  21          1HD2      ASN  21  -4.842  -7.387   6.816
  115   HD22  ASN  21          2HD2      ASN  21  -5.184  -8.752   5.812
  116    H    PHE  22           H        PHE  22  -6.900  -3.728   3.585
  117    HA   PHE  22           HA       PHE  22  -8.136  -1.536   5.084
  118    HB2  PHE  22           1HB      PHE  22  -6.575  -1.101   2.532
  119    HB3  PHE  22           2HB      PHE  22  -7.361   0.131   3.513
  120    HD1  PHE  22           HD2      PHE  22  -4.547  -2.231   3.349
  121    HD2  PHE  22           HD1      PHE  22  -6.322   1.011   5.462
  122    HE1  PHE  22           HE2      PHE  22  -2.467  -1.930   4.628
  123    HE2  PHE  22           HE1      PHE  22  -4.244   1.317   6.743
  124    HZ   PHE  22           HZ       PHE  22  -2.314  -0.155   6.329
  125    H    CYS  23           H        CYS  23 -10.237  -1.726   4.698
  126    HA   CYS  23           HA       CYS  23 -11.464  -3.187   2.715
  127    HB2  CYS  23           1HB      CYS  23 -12.610  -2.308   4.723
  128    HB3  CYS  23           2HB      CYS  23 -12.552  -0.690   4.033
  129    HG   CYS  23           HG       CYS  23 -14.239  -3.319   2.633
  130    H    TYR  24           H        TYR  24 -10.594   0.245   2.676
  131    HA   TYR  24           HA       TYR  24 -11.327   0.347  -0.172
  132    HB2  TYR  24           1HB      TYR  24 -10.945   2.927   0.386
  133    HB3  TYR  24           2HB      TYR  24 -12.480   2.122   0.694
  134    HD1  TYR  24           HD2      TYR  24 -12.729   1.060   3.082
  135    HD2  TYR  24           HD1      TYR  24  -9.933   4.113   2.099
  136    HE1  TYR  24           HE2      TYR  24 -12.584   1.684   5.456
  137    HE2  TYR  24           HE1      TYR  24  -9.779   4.745   4.471
  138    HH   TYR  24           HH       TYR  24 -11.968   3.606   6.821
  139    H    ILE  25           H        ILE  25  -9.749   0.359  -1.619
  140    HA   ILE  25           HA       ILE  25  -7.079   0.065  -1.131
  141    HB   ILE  25           HB       ILE  25  -8.229  -0.179  -3.356
  142   HG12  ILE  25          1HG1      ILE  25  -6.229   0.437  -4.658
  143   HG13  ILE  25          2HG1      ILE  25  -5.659   1.419  -3.313
  144   HG21  ILE  25          1HG2      ILE  25  -7.708   2.779  -3.598
  145   HG22  ILE  25          2HG2      ILE  25  -8.434   1.720  -4.806
  146   HG23  ILE  25          3HG2      ILE  25  -9.295   2.068  -3.307
  147   HD11  ILE  25          3HD1      ILE  25  -5.082  -1.246  -3.805
  148   HD12  ILE  25          1HD1      ILE  25  -4.739  -0.338  -2.333
  149   HD13  ILE  25          2HD1      ILE  25  -6.228  -1.274  -2.465
  150    H    SER  26           H        SER  26  -8.781   3.125  -1.733
  151    HA   SER  26           HA       SER  26  -6.781   4.938  -1.837
  152    HB2  SER  26           1HB      SER  26  -9.437   5.066  -0.429
  153    HB3  SER  26           2HB      SER  26  -8.341   6.447  -0.418
  154    HG   SER  26           HG       SER  26  -9.212   6.877  -2.279
  155    H    ALA  27           H        ALA  27  -8.067   3.507   1.148
  156    HA   ALA  27           HA       ALA  27  -6.489   4.907   2.973
  157    HB1  ALA  27           3HB      ALA  27  -6.870   2.244   3.913
  158    HB2  ALA  27           1HB      ALA  27  -7.702   3.721   4.399
  159    HB3  ALA  27           2HB      ALA  27  -8.322   2.760   3.055
  160    H    LEU  28           H        LEU  28  -5.922   1.630   1.674
  161    HA   LEU  28           HA       LEU  28  -3.501   1.069   2.797
  162    HB2  LEU  28           1HB      LEU  28  -4.449  -0.625   1.519
  163    HB3  LEU  28           2HB      LEU  28  -4.653   0.419   0.114
  164    HG   LEU  28           HG       LEU  28  -2.191   0.370  -0.213
  165   HD11  LEU  28          1HD1      LEU  28  -0.858  -0.376   1.389
  166   HD12  LEU  28          2HD1      LEU  28  -1.580  -1.979   1.245
  167   HD13  LEU  28          3HD1      LEU  28  -2.258  -0.805   2.373
  168   HD21  LEU  28          3HD2      LEU  28  -3.021  -1.122  -1.677
  169   HD22  LEU  28          1HD2      LEU  28  -4.012  -1.924  -0.458
  170   HD23  LEU  28          2HD2      LEU  28  -2.296  -2.308  -0.591
  171    H    ARG  29           H        ARG  29  -4.034   2.887  -0.212
  172    HA   ARG  29           HA       ARG  29  -1.390   3.350  -0.906
  173    HB2  ARG  29           1HB      ARG  29  -3.667   5.306  -1.256
  174    HB3  ARG  29           2HB      ARG  29  -2.192   5.223  -2.209
  175    HG2  ARG  29           1HG      ARG  29  -4.244   3.026  -2.087
  176    HG3  ARG  29           2HG      ARG  29  -4.196   4.277  -3.331
  177    HD2  ARG  29           1HD      ARG  29  -2.094   2.199  -2.744
  178    HD3  ARG  29           2HD      ARG  29  -3.115   2.309  -4.177
  179    HE   ARG  29           HE       ARG  29  -1.699   4.689  -4.004
  180   HH11  ARG  29          1HH1      ARG  29  -1.025   1.299  -4.424
  181   HH12  ARG  29          2HH1      ARG  29   0.415   1.566  -5.351
  182   HH21  ARG  29          1HH2      ARG  29   0.194   5.054  -5.223
  183   HH22  ARG  29          2HH2      ARG  29   1.108   3.703  -5.804
  184    H    ILE  30           H        ILE  30  -3.488   5.205   1.266
  185    HA   ILE  30           HA       ILE  30  -1.664   7.286   1.797
  186    HB   ILE  30           HB       ILE  30  -3.902   6.220   3.522
  187   HG12  ILE  30          1HG1      ILE  30  -3.867   8.666   1.750
  188   HG13  ILE  30          2HG1      ILE  30  -4.478   7.103   1.220
  189   HG21  ILE  30          1HG2      ILE  30  -3.643   8.812   4.228
  190   HG22  ILE  30          2HG2      ILE  30  -2.887   7.475   5.093
  191   HG23  ILE  30          3HG2      ILE  30  -1.959   8.395   3.910
  192   HD11  ILE  30          3HD1      ILE  30  -6.386   8.225   1.870
  193   HD12  ILE  30          1HD1      ILE  30  -6.002   7.255   3.291
  194   HD13  ILE  30          2HD1      ILE  30  -5.598   8.972   3.259
  195    H    HIS  31           H        HIS  31  -2.163   4.131   3.276
  196    HA   HIS  31           HA       HIS  31  -0.381   4.592   5.465
  197    HB2  HIS  31           1HB      HIS  31  -1.884   2.922   5.985
  198    HB3  HIS  31           2HB      HIS  31  -1.850   2.240   4.361
  199    HD1  HIS  31           HD1      HIS  31   0.199   2.327   7.535
  200    HD2  HIS  31           HD2      HIS  31  -0.124   0.136   4.020
  201    HE1  HIS  31           HE1      HIS  31   1.702   0.334   7.844
  202    H    GLN  32           H        GLN  32  -0.097   3.199   2.252
  203    HA   GLN  32           HA       GLN  32   2.361   1.936   2.457
  204    HB2  GLN  32           1HB      GLN  32   0.958   3.311   0.189
  205    HB3  GLN  32           2HB      GLN  32   2.574   2.653  -0.034
  206    HG2  GLN  32           1HG      GLN  32   1.575   0.474   0.909
  207    HG3  GLN  32           2HG      GLN  32   0.018   1.215   0.543
  208   HE21  GLN  32          1HE2      GLN  32  -0.112   2.140  -1.726
  209   HE22  GLN  32          2HE2      GLN  32   0.533   1.157  -2.991
  210    H    ARG  33           H        ARG  33   1.611   5.314   2.409
  211    HA   ARG  33           HA       ARG  33   4.036   6.389   1.542
  212    HB2  ARG  33           1HB      ARG  33   2.097   7.477   3.592
  213    HB3  ARG  33           2HB      ARG  33   3.384   8.404   2.834
  214    HG2  ARG  33           1HG      ARG  33   2.347   8.120   0.661
  215    HG3  ARG  33           2HG      ARG  33   1.082   7.121   1.379
  216    HD2  ARG  33           1HD      ARG  33   0.465   9.068   2.813
  217    HD3  ARG  33           2HD      ARG  33   1.620  10.039   1.903
  218    HE   ARG  33           HE       ARG  33  -0.986   9.170   1.036
  219   HH11  ARG  33          1HH1      ARG  33   2.159  10.285   0.042
  220   HH12  ARG  33          2HH1      ARG  33   1.608  10.877  -1.490
  221   HH21  ARG  33          1HH2      ARG  33  -1.723   9.947  -0.978
  222   HH22  ARG  33          2HH2      ARG  33  -0.600  10.686  -2.069
  223    H    VAL  34           H        VAL  34   3.190   4.843   4.516
  224    HA   VAL  34           HA       VAL  34   5.315   5.907   6.097
  225    HB   VAL  34           HB       VAL  34   4.745   4.261   7.739
  226   HG11  VAL  34          1HG1      VAL  34   3.129   6.173   7.169
  227   HG12  VAL  34          2HG1      VAL  34   2.107   4.915   6.472
  228   HG13  VAL  34          3HG1      VAL  34   2.533   4.859   8.182
  229   HG21  VAL  34          3HG2      VAL  34   3.741   2.785   5.400
  230   HG22  VAL  34          1HG2      VAL  34   4.454   2.191   6.899
  231   HG23  VAL  34          2HG2      VAL  34   2.754   2.656   6.855
  232    H    HIS  35           H        HIS  35   4.996   3.256   3.866
  233    HA   HIS  35           HA       HIS  35   7.395   1.912   4.704
  234    HB2  HIS  35           1HB      HIS  35   5.573   1.607   2.321
  235    HB3  HIS  35           2HB      HIS  35   7.046   0.659   2.505
  236    HD1  HIS  35           HD1      HIS  35   7.107  -1.006   4.567
  237    HD2  HIS  35           HD2      HIS  35   3.413   0.721   3.773
  238    HE1  HIS  35           HE1      HIS  35   5.432  -2.392   5.831
  239    H    MET  36           H        MET  36   6.518   4.292   2.287
  240    HA   MET  36           HA       MET  36   9.085   4.177   0.970
  241    HB2  MET  36           1HB      MET  36   8.221   5.681  -0.572
  242    HB3  MET  36           2HB      MET  36   6.781   4.813  -0.055
  243    HG2  MET  36           1HG      MET  36   6.189   6.625   1.436
  244    HG3  MET  36           2HG      MET  36   7.667   7.484   1.010
  245    HE1  MET  36           3HE      MET  36   4.424   5.875  -0.478
  246    HE2  MET  36           1HE      MET  36   4.361   6.601  -2.084
  247    HE3  MET  36           2HE      MET  36   5.640   5.455  -1.685
  248    H    GLY  37           H        GLY  37   7.540   6.066   3.466
  249    HA2  GLY  37           1HA      GLY  37   9.031   8.369   3.542
  250    HA3  GLY  37           2HA      GLY  37   8.440   7.548   4.979
  251    H    GLU  38           H        GLU  38  11.124   8.796   3.654
  252    HA   GLU  38           HA       GLU  38  13.375   8.490   3.893
  253    HB2  GLU  38           1HB      GLU  38  12.164   7.691   6.499
  254    HB3  GLU  38           2HB      GLU  38  13.883   7.406   6.261
  255    HG2  GLU  38           1HG      GLU  38  13.682   9.500   7.323
  256    HG3  GLU  38           2HG      GLU  38  14.097   9.827   5.641
  257    H    LYS  39           H        LYS  39  12.463   6.597   2.242
  258    HA   LYS  39           HA       LYS  39  13.614   4.060   3.182
  259    HB2  LYS  39           1HB      LYS  39  11.240   4.117   2.295
  260    HB3  LYS  39           2HB      LYS  39  11.924   4.480   0.717
  261    HG2  LYS  39           1HG      LYS  39  13.224   2.363   0.865
  262    HG3  LYS  39           2HG      LYS  39  12.349   1.991   2.353
  263    HD2  LYS  39           1HD      LYS  39  10.221   2.194   1.057
  264    HD3  LYS  39           2HD      LYS  39  11.192   2.349  -0.409
  265    HE2  LYS  39           1HE      LYS  39  11.970   0.159  -0.269
  266    HE3  LYS  39           2HE      LYS  39  11.578   0.028   1.445
  267    HZ1  LYS  39           3HZ      LYS  39  10.034  -0.789  -0.707
  268    HZ2  LYS  39           1HZ      LYS  39   9.233   0.544  -0.040
  269    HZ3  LYS  39           2HZ      LYS  39   9.603  -0.793   0.929
  270    H    CYS  40           H        CYS  40  14.912   2.824   1.645
  271    HA   CYS  40           HA       CYS  40  16.740   4.577   0.215
  272    HB2  CYS  40           1HB      CYS  40  17.532   2.773   1.792
  273    HB3  CYS  40           2HB      CYS  40  16.965   1.592   0.617
  274    HG   CYS  40           HG       CYS  40  18.696   2.617  -1.420
  275    H    SER  41           H        SER  41  15.596   5.141  -1.632
  276    HA   SER  41           HA       SER  41  15.029   2.929  -3.495
  277    HB2  SER  41           1HB      SER  41  13.119   4.507  -2.623
  278    HB3  SER  41           2HB      SER  41  13.776   5.634  -3.809
  279    HG   SER  41           HG       SER  41  13.286   4.232  -5.424
  280    H    GLY  42           H        GLY  42  17.210   2.970  -4.243
  281    HA2  GLY  42           1HA      GLY  42  18.360   5.349  -5.345
  282    HA3  GLY  42           2HA      GLY  42  18.982   3.714  -5.519
  283    HA   PRO  43           HA       PRO  43  16.580   5.361  -9.363
  284    HB2  PRO  43           1HB      PRO  43  18.541   6.673 -10.707
  285    HB3  PRO  43           2HB      PRO  43  17.445   7.479  -9.579
  286    HG2  PRO  43           1HG      PRO  43  20.247   6.521  -9.139
  287    HG3  PRO  43           2HG      PRO  43  19.491   8.042  -8.628
  288    HD2  PRO  43           1HD      PRO  43  19.837   5.949  -6.945
  289    HD3  PRO  43           2HD      PRO  43  18.464   7.066  -6.810
  290    H    SER  44           H        SER  44  16.907   4.572 -11.535
  291    HA   SER  44           HA       SER  44  19.117   2.652 -11.815
  292    HB2  SER  44           1HB      SER  44  16.241   2.117 -12.594
  293    HB3  SER  44           2HB      SER  44  17.598   1.008 -12.789
  294    HG   SER  44           HG       SER  44  16.457   0.501 -10.912
  295    H    SER  45           H        SER  45  20.163   2.759 -13.700
  296    HA   SER  45           HA       SER  45  19.844   4.817 -15.505
  297    HB2  SER  45           1HB      SER  45  21.216   2.159 -15.648
  298    HB3  SER  45           2HB      SER  45  21.110   3.149 -17.103
  299    HG   SER  45           HG       SER  45  21.913   4.861 -15.472
  300    H    GLY  46           H        GLY  46  17.781   5.135 -16.258
  301    HA2  GLY  46           1HA      GLY  46  16.462   4.857 -18.248
  302    HA3  GLY  46           2HA      GLY  46  16.849   3.143 -18.215
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1   8.804 -29.842   3.170
    2    HA2  GLY   1           1HA      GLY   1   7.000 -29.313   1.680
    3    HA3  GLY   1           2HA      GLY   1   5.969 -30.393   2.606
    4    H    SER   2           H        SER   2   5.293 -27.742   1.892
    5    HA   SER   2           HA       SER   2   4.386 -26.757   4.369
    6    HB2  SER   2           1HB      SER   2   5.677 -24.734   4.615
    7    HB3  SER   2           2HB      SER   2   6.800 -26.091   4.541
    8    HG   SER   2           HG       SER   2   6.278 -24.099   2.637
    9    H    SER   3           H        SER   3   2.535 -25.776   3.922
   10    HA   SER   3           HA       SER   3   2.058 -24.821   1.204
   11    HB2  SER   3           1HB      SER   3   0.080 -25.122   3.475
   12    HB3  SER   3           2HB      SER   3  -0.296 -24.869   1.771
   13    HG   SER   3           HG       SER   3  -0.491 -27.044   2.203
   14    H    GLY   4           H        GLY   4   1.608 -22.735   0.676
   15    HA2  GLY   4           1HA      GLY   4   1.249 -20.764   2.803
   16    HA3  GLY   4           2HA      GLY   4   2.665 -20.580   1.779
   17    H    SER   5           H        SER   5  -0.721 -21.455   1.100
   18    HA   SER   5           HA       SER   5  -0.782 -19.245  -0.849
   19    HB2  SER   5           1HB      SER   5  -2.289 -21.869  -0.972
   20    HB3  SER   5           2HB      SER   5  -2.356 -20.580  -2.173
   21    HG   SER   5           HG       SER   5  -0.762 -22.547  -2.282
   22    H    SER   6           H        SER   6  -3.114 -18.576  -1.363
   23    HA   SER   6           HA       SER   6  -4.504 -18.192   1.197
   24    HB2  SER   6           1HB      SER   6  -3.657 -16.253  -0.388
   25    HB3  SER   6           2HB      SER   6  -5.164 -16.588  -1.240
   26    HG   SER   6           HG       SER   6  -4.967 -16.034   1.537
   27    H    GLY   7           H        GLY   7  -5.322 -18.531  -2.264
   28    HA2  GLY   7           1HA      GLY   7  -6.831 -20.113  -3.154
   29    HA3  GLY   7           2HA      GLY   7  -7.441 -20.409  -1.533
   30    H    SER   8           H        SER   8  -9.427 -19.703  -1.183
   31    HA   SER   8           HA       SER   8 -10.875 -18.163  -3.028
   32    HB2  SER   8           1HB      SER   8 -11.369 -19.018  -0.192
   33    HB3  SER   8           2HB      SER   8 -12.483 -17.908  -0.989
   34    HG   SER   8           HG       SER   8 -12.029 -20.601  -1.441
   35    H    GLY   9           H        GLY   9  -9.551 -17.269   0.159
   36    HA2  GLY   9           1HA      GLY   9  -8.907 -15.231   0.998
   37    HA3  GLY   9           2HA      GLY   9  -8.826 -14.664  -0.663
   38    H    GLU  10           H        GLU  10  -9.604 -12.842   1.083
   39    HA   GLU  10           HA       GLU  10 -12.534 -12.720   0.787
   40    HB2  GLU  10           1HB      GLU  10 -11.354 -12.795   3.159
   41    HB3  GLU  10           2HB      GLU  10 -11.130 -11.079   2.846
   42    HG2  GLU  10           1HG      GLU  10 -13.118 -10.993   3.923
   43    HG3  GLU  10           2HG      GLU  10 -13.706 -11.214   2.276
   44    H    LYS  11           H        LYS  11 -13.432 -10.556   0.515
   45    HA   LYS  11           HA       LYS  11 -11.953  -9.065  -1.434
   46    HB2  LYS  11           1HB      LYS  11 -14.684  -8.863  -0.223
   47    HB3  LYS  11           2HB      LYS  11 -14.043  -7.503  -1.135
   48    HG2  LYS  11           1HG      LYS  11 -13.673  -9.051  -3.051
   49    HG3  LYS  11           2HG      LYS  11 -14.506 -10.305  -2.130
   50    HD2  LYS  11           1HD      LYS  11 -16.346  -8.404  -1.927
   51    HD3  LYS  11           2HD      LYS  11 -15.584  -7.854  -3.421
   52    HE2  LYS  11           1HE      LYS  11 -15.861 -10.228  -4.266
   53    HE3  LYS  11           2HE      LYS  11 -16.896 -10.505  -2.865
   54    HZ1  LYS  11           3HZ      LYS  11 -17.364  -8.378  -4.882
   55    HZ2  LYS  11           1HZ      LYS  11 -18.398  -8.830  -3.622
   56    HZ3  LYS  11           2HZ      LYS  11 -18.118  -9.892  -4.908
   57    H    SER  12           H        SER  12 -10.140  -8.299  -0.285
   58    HA   SER  12           HA       SER  12 -10.470  -5.728   0.864
   59    HB2  SER  12           1HB      SER  12  -9.722  -6.154   3.127
   60    HB3  SER  12           2HB      SER  12 -11.145  -7.145   2.808
   61    HG   SER  12           HG       SER  12  -9.902  -8.710   3.464
   62    H    HIS  13           H        HIS  13  -8.715  -4.611   0.335
   63    HA   HIS  13           HA       HIS  13  -6.459  -5.841  -0.853
   64    HB2  HIS  13           1HB      HIS  13  -6.861  -3.005   0.117
   65    HB3  HIS  13           2HB      HIS  13  -5.502  -3.543  -0.865
   66    HD1  HIS  13           HD1      HIS  13  -5.892  -3.819  -3.360
   67    HD2  HIS  13           HD2      HIS  13  -9.357  -2.929  -1.249
   68    HE1  HIS  13           HE1      HIS  13  -7.626  -3.297  -5.104
   69    H    THR  14           H        THR  14  -4.409  -6.201  -0.102
   70    HA   THR  14           HA       THR  14  -3.933  -5.702   2.762
   71    HB   THR  14           HB       THR  14  -3.193  -8.203   1.230
   72    HG1  THR  14           HG1      THR  14  -5.345  -8.267   1.854
   73   HG21  THR  14          3HG2      THR  14  -2.849  -8.477   4.036
   74   HG22  THR  14          1HG2      THR  14  -1.993  -7.022   3.526
   75   HG23  THR  14          2HG2      THR  14  -1.627  -8.572   2.769
   76    H    CYS  15           H        CYS  15  -2.061  -4.732   3.231
   77    HA   CYS  15           HA       CYS  15  -0.345  -3.831   1.147
   78    HB2  CYS  15           1HB      CYS  15  -0.807  -2.570   3.258
   79    HB3  CYS  15           2HB      CYS  15   0.157  -3.759   4.128
   80    H    ASP  16           H        ASP  16   1.160  -4.995   0.171
   81    HA   ASP  16           HA       ASP  16   2.113  -7.472   1.224
   82    HB2  ASP  16           1HB      ASP  16   1.822  -6.888  -1.233
   83    HB3  ASP  16           2HB      ASP  16   3.300  -5.940  -1.090
   84    H    GLU  17           H        GLU  17   2.989  -4.270   1.755
   85    HA   GLU  17           HA       GLU  17   5.806  -4.614   2.088
   86    HB2  GLU  17           1HB      GLU  17   4.095  -2.463   3.333
   87    HB3  GLU  17           2HB      GLU  17   5.815  -2.394   2.974
   88    HG2  GLU  17           1HG      GLU  17   3.719  -2.688   0.844
   89    HG3  GLU  17           2HG      GLU  17   4.292  -1.124   1.421
   90    H    CYS  18           H        CYS  18   3.040  -4.493   4.307
   91    HA   CYS  18           HA       CYS  18   4.750  -5.729   6.363
   92    HB2  CYS  18           1HB      CYS  18   3.365  -4.543   8.064
   93    HB3  CYS  18           2HB      CYS  18   4.308  -3.457   7.048
   94    H    GLY  19           H        GLY  19   1.561  -5.484   4.907
   95    HA2  GLY  19           1HA      GLY  19   0.376  -7.605   4.569
   96    HA3  GLY  19           2HA      GLY  19   0.876  -8.055   6.192
   97    H    LYS  20           H        LYS  20   0.010  -4.796   5.959
   98    HA   LYS  20           HA       LYS  20  -2.143  -5.037   7.745
   99    HB2  LYS  20           1HB      LYS  20  -1.062  -2.838   6.033
  100    HB3  LYS  20           2HB      LYS  20  -2.629  -2.620   6.800
  101    HG2  LYS  20           1HG      LYS  20  -0.292  -3.498   8.434
  102    HG3  LYS  20           2HG      LYS  20  -0.470  -1.800   7.987
  103    HD2  LYS  20           1HD      LYS  20  -2.612  -1.681   9.063
  104    HD3  LYS  20           2HD      LYS  20  -2.614  -3.422   9.354
  105    HE2  LYS  20           1HE      LYS  20  -0.359  -1.808  10.431
  106    HE3  LYS  20           2HE      LYS  20  -1.924  -1.697  11.235
  107    HZ1  LYS  20           3HZ      LYS  20  -0.002  -3.800  11.310
  108    HZ2  LYS  20           1HZ      LYS  20  -1.523  -4.378  10.848
  109    HZ3  LYS  20           2HZ      LYS  20  -1.344  -3.537  12.305
  110    H    ASN  21           H        ASN  21  -4.353  -3.988   7.192
  111    HA   ASN  21           HA       ASN  21  -5.302  -5.011   4.600
  112    HB2  ASN  21           1HB      ASN  21  -5.851  -6.398   6.759
  113    HB3  ASN  21           2HB      ASN  21  -7.055  -5.141   7.028
  114   HD21  ASN  21          1HD2      ASN  21  -6.422  -8.059   5.559
  115   HD22  ASN  21          2HD2      ASN  21  -7.769  -8.112   4.478
  116    H    PHE  22           H        PHE  22  -6.881  -3.825   3.574
  117    HA   PHE  22           HA       PHE  22  -8.055  -1.526   4.907
  118    HB2  PHE  22           1HB      PHE  22  -6.456  -1.143   2.371
  119    HB3  PHE  22           2HB      PHE  22  -7.251   0.103   3.328
  120    HD1  PHE  22           HD2      PHE  22  -4.396  -2.187   3.147
  121    HD2  PHE  22           HD1      PHE  22  -6.256   0.954   5.336
  122    HE1  PHE  22           HE2      PHE  22  -2.323  -1.858   4.430
  123    HE2  PHE  22           HE1      PHE  22  -4.185   1.289   6.622
  124    HZ   PHE  22           HZ       PHE  22  -2.215  -0.119   6.170
  125    H    CYS  23           H        CYS  23 -10.140  -1.807   4.482
  126    HA   CYS  23           HA       CYS  23 -11.258  -3.339   2.477
  127    HB2  CYS  23           1HB      CYS  23 -12.568  -2.632   4.378
  128    HB3  CYS  23           2HB      CYS  23 -12.407  -0.942   3.915
  129    HG   CYS  23           HG       CYS  23 -14.115  -3.294   2.107
  130    H    TYR  24           H        TYR  24 -10.414   0.084   2.437
  131    HA   TYR  24           HA       TYR  24 -11.159   0.188  -0.410
  132    HB2  TYR  24           1HB      TYR  24 -10.825   2.775   0.157
  133    HB3  TYR  24           2HB      TYR  24 -12.349   1.942   0.447
  134    HD1  TYR  24           HD2      TYR  24 -12.463   0.760   2.850
  135    HD2  TYR  24           HD1      TYR  24  -9.994   4.082   1.862
  136    HE1  TYR  24           HE2      TYR  24 -12.354   1.379   5.228
  137    HE2  TYR  24           HE1      TYR  24  -9.877   4.709   4.238
  138    HH   TYR  24           HH       TYR  24 -11.728   4.075   6.401
  139    H    ILE  25           H        ILE  25  -9.624   0.477  -1.902
  140    HA   ILE  25           HA       ILE  25  -6.933   0.131  -1.411
  141    HB   ILE  25           HB       ILE  25  -8.081  -0.038  -3.644
  142   HG12  ILE  25          1HG1      ILE  25  -6.036   1.076  -4.859
  143   HG13  ILE  25          2HG1      ILE  25  -5.448   1.329  -3.219
  144   HG21  ILE  25          1HG2      ILE  25  -7.568   2.920  -3.836
  145   HG22  ILE  25          2HG2      ILE  25  -8.391   1.881  -4.999
  146   HG23  ILE  25          3HG2      ILE  25  -9.146   2.236  -3.445
  147   HD11  ILE  25          3HD1      ILE  25  -6.375  -1.390  -3.914
  148   HD12  ILE  25          1HD1      ILE  25  -4.866  -0.834  -4.638
  149   HD13  ILE  25          2HD1      ILE  25  -5.042  -0.870  -2.883
  150    H    SER  26           H        SER  26  -8.691   3.183  -1.863
  151    HA   SER  26           HA       SER  26  -6.703   5.024  -1.889
  152    HB2  SER  26           1HB      SER  26  -9.413   5.041  -0.613
  153    HB3  SER  26           2HB      SER  26  -8.334   6.412  -0.359
  154    HG   SER  26           HG       SER  26  -9.861   5.929  -2.452
  155    H    ALA  27           H        ALA  27  -8.068   3.552   1.047
  156    HA   ALA  27           HA       ALA  27  -6.502   4.877   2.927
  157    HB1  ALA  27           3HB      ALA  27  -7.867   3.702   4.223
  158    HB2  ALA  27           1HB      ALA  27  -8.276   2.623   2.890
  159    HB3  ALA  27           2HB      ALA  27  -6.877   2.277   3.908
  160    H    LEU  28           H        LEU  28  -5.909   1.709   1.401
  161    HA   LEU  28           HA       LEU  28  -3.520   1.063   2.601
  162    HB2  LEU  28           1HB      LEU  28  -4.436  -0.583   1.249
  163    HB3  LEU  28           2HB      LEU  28  -4.646   0.515  -0.113
  164    HG   LEU  28           HG       LEU  28  -2.183   0.496  -0.439
  165   HD11  LEU  28          1HD1      LEU  28  -2.335  -1.076   2.026
  166   HD12  LEU  28          2HD1      LEU  28  -1.002  -0.137   1.355
  167   HD13  LEU  28          3HD1      LEU  28  -1.306  -1.775   0.776
  168   HD21  LEU  28          3HD2      LEU  28  -2.439  -1.196  -1.872
  169   HD22  LEU  28          1HD2      LEU  28  -4.065  -1.358  -1.208
  170   HD23  LEU  28          2HD2      LEU  28  -2.753  -2.355  -0.579
  171    H    ARG  29           H        ARG  29  -4.010   3.033  -0.314
  172    HA   ARG  29           HA       ARG  29  -1.340   3.499  -0.944
  173    HB2  ARG  29           1HB      ARG  29  -3.609   5.465  -1.292
  174    HB3  ARG  29           2HB      ARG  29  -2.112   5.405  -2.213
  175    HG2  ARG  29           1HG      ARG  29  -4.141   3.186  -2.197
  176    HG3  ARG  29           2HG      ARG  29  -4.123   4.493  -3.383
  177    HD2  ARG  29           1HD      ARG  29  -1.901   2.518  -2.873
  178    HD3  ARG  29           2HD      ARG  29  -3.004   2.507  -4.248
  179    HE   ARG  29           HE       ARG  29  -1.874   4.964  -4.372
  180   HH11  ARG  29          1HH1      ARG  29  -0.586   1.737  -4.154
  181   HH12  ARG  29          2HH1      ARG  29   0.863   2.116  -5.026
  182   HH21  ARG  29          1HH2      ARG  29   0.029   5.476  -5.521
  183   HH22  ARG  29          2HH2      ARG  29   1.212   4.243  -5.802
  184    H    ILE  30           H        ILE  30  -3.491   5.247   1.257
  185    HA   ILE  30           HA       ILE  30  -1.676   7.319   1.895
  186    HB   ILE  30           HB       ILE  30  -3.990   6.225   3.497
  187   HG12  ILE  30          1HG1      ILE  30  -3.910   8.781   1.907
  188   HG13  ILE  30          2HG1      ILE  30  -4.367   7.252   1.164
  189   HG21  ILE  30          1HG2      ILE  30  -1.970   8.183   4.155
  190   HG22  ILE  30          2HG2      ILE  30  -3.585   8.889   4.173
  191   HG23  ILE  30          3HG2      ILE  30  -3.229   7.479   5.170
  192   HD11  ILE  30          3HD1      ILE  30  -6.291   8.613   1.878
  193   HD12  ILE  30          1HD1      ILE  30  -6.234   7.032   2.658
  194   HD13  ILE  30          2HD1      ILE  30  -5.737   8.473   3.546
  195    H    HIS  31           H        HIS  31  -2.319   4.162   3.338
  196    HA   HIS  31           HA       HIS  31  -0.650   4.508   5.603
  197    HB2  HIS  31           1HB      HIS  31  -2.118   2.762   5.919
  198    HB3  HIS  31           2HB      HIS  31  -1.968   2.194   4.259
  199    HD1  HIS  31           HD1      HIS  31  -0.032   2.174   7.515
  200    HD2  HIS  31           HD2      HIS  31  -0.243   0.106   3.917
  201    HE1  HIS  31           HE1      HIS  31   1.489   0.190   7.789
  202    H    GLN  32           H        GLN  32  -0.120   3.059   2.412
  203    HA   GLN  32           HA       GLN  32   2.358   1.950   2.701
  204    HB2  GLN  32           1HB      GLN  32   1.099   3.423   0.409
  205    HB3  GLN  32           2HB      GLN  32   2.736   2.794   0.274
  206    HG2  GLN  32           1HG      GLN  32   1.712   0.558   1.017
  207    HG3  GLN  32           2HG      GLN  32   0.167   1.297   0.598
  208   HE21  GLN  32          1HE2      GLN  32   0.001   2.188  -1.605
  209   HE22  GLN  32          2HE2      GLN  32   0.801   1.350  -2.887
  210    H    ARG  33           H        ARG  33   1.552   5.355   2.490
  211    HA   ARG  33           HA       ARG  33   3.900   6.578   1.908
  212    HB2  ARG  33           1HB      ARG  33   1.958   7.323   4.101
  213    HB3  ARG  33           2HB      ARG  33   3.223   8.384   3.497
  214    HG2  ARG  33           1HG      ARG  33   2.205   8.506   1.350
  215    HG3  ARG  33           2HG      ARG  33   1.055   7.232   1.762
  216    HD2  ARG  33           1HD      ARG  33  -0.233   9.118   2.049
  217    HD3  ARG  33           2HD      ARG  33   0.377   8.861   3.683
  218    HE   ARG  33           HE       ARG  33   1.040  11.032   1.893
  219   HH11  ARG  33          1HH1      ARG  33   1.918   9.246   4.749
  220   HH12  ARG  33          2HH1      ARG  33   2.872  10.529   5.417
  221   HH21  ARG  33          1HH2      ARG  33   2.293  12.729   2.761
  222   HH22  ARG  33          2HH2      ARG  33   3.084  12.510   4.285
  223    H    VAL  34           H        VAL  34   3.011   5.201   5.052
  224    HA   VAL  34           HA       VAL  34   5.234   5.991   6.522
  225    HB   VAL  34           HB       VAL  34   4.706   4.295   8.089
  226   HG11  VAL  34          1HG1      VAL  34   2.928   6.097   7.449
  227   HG12  VAL  34          2HG1      VAL  34   2.009   4.703   6.877
  228   HG13  VAL  34          3HG1      VAL  34   2.510   4.798   8.565
  229   HG21  VAL  34          3HG2      VAL  34   2.982   2.489   7.333
  230   HG22  VAL  34          1HG2      VAL  34   3.592   2.858   5.720
  231   HG23  VAL  34          2HG2      VAL  34   4.694   2.278   6.969
  232    H    HIS  35           H        HIS  35   4.823   3.279   4.315
  233    HA   HIS  35           HA       HIS  35   7.297   2.016   4.940
  234    HB2  HIS  35           1HB      HIS  35   5.371   1.783   2.636
  235    HB3  HIS  35           2HB      HIS  35   6.885   0.884   2.668
  236    HD1  HIS  35           HD1      HIS  35   7.161  -0.754   4.818
  237    HD2  HIS  35           HD2      HIS  35   3.321   0.579   3.955
  238    HE1  HIS  35           HE1      HIS  35   5.616  -2.315   6.043
  239    H    MET  36           H        MET  36   6.300   4.481   2.654
  240    HA   MET  36           HA       MET  36   8.508   4.482   0.953
  241    HB2  MET  36           1HB      MET  36   6.847   6.839   1.862
  242    HB3  MET  36           2HB      MET  36   7.911   6.822   0.462
  243    HG2  MET  36           1HG      MET  36   6.455   4.810  -0.292
  244    HG3  MET  36           2HG      MET  36   5.292   5.455   0.864
  245    HE1  MET  36           3HE      MET  36   5.510   9.164  -0.261
  246    HE2  MET  36           1HE      MET  36   3.966   8.348  -0.012
  247    HE3  MET  36           2HE      MET  36   5.316   8.030   1.077
  248    H    GLY  37           H        GLY  37  10.499   5.463   0.988
  249    HA2  GLY  37           1HA      GLY  37  11.267   7.216   3.150
  250    HA3  GLY  37           2HA      GLY  37  11.984   5.614   3.250
  251    H    GLU  38           H        GLU  38  11.603   8.389   1.070
  252    HA   GLU  38           HA       GLU  38  14.388   8.131   0.293
  253    HB2  GLU  38           1HB      GLU  38  12.750   6.788  -1.286
  254    HB3  GLU  38           2HB      GLU  38  12.437   8.383  -1.956
  255    HG2  GLU  38           1HG      GLU  38  14.693   8.657  -2.605
  256    HG3  GLU  38           2HG      GLU  38  15.205   7.254  -1.668
  257    H    LYS  39           H        LYS  39  15.106   9.989  -1.043
  258    HA   LYS  39           HA       LYS  39  14.074  12.426   0.049
  259    HB2  LYS  39           1HB      LYS  39  16.261  11.789  -1.921
  260    HB3  LYS  39           2HB      LYS  39  15.811  13.446  -1.543
  261    HG2  LYS  39           1HG      LYS  39  17.505  13.160  -0.057
  262    HG3  LYS  39           2HG      LYS  39  16.152  12.609   0.934
  263    HD2  LYS  39           1HD      LYS  39  17.810  10.970   1.215
  264    HD3  LYS  39           2HD      LYS  39  16.680  10.272   0.052
  265    HE2  LYS  39           1HE      LYS  39  18.708   9.814  -0.941
  266    HE3  LYS  39           2HE      LYS  39  18.275  11.339  -1.712
  267    HZ1  LYS  39           3HZ      LYS  39  19.671  12.483  -0.067
  268    HZ2  LYS  39           1HZ      LYS  39  20.559  11.398  -1.013
  269    HZ3  LYS  39           2HZ      LYS  39  20.139  10.989   0.573
  270    H    CYS  40           H        CYS  40  14.456  11.289  -3.314
  271    HA   CYS  40           HA       CYS  40  12.336  13.159  -4.107
  272    HB2  CYS  40           1HB      CYS  40  14.544  11.808  -5.651
  273    HB3  CYS  40           2HB      CYS  40  13.191  12.592  -6.456
  274    HG   CYS  40           HG       CYS  40  15.834  13.957  -4.890
  275    H    SER  41           H        SER  41  10.374  12.310  -4.223
  276    HA   SER  41           HA       SER  41   9.949   9.480  -4.461
  277    HB2  SER  41           1HB      SER  41   8.119  11.863  -4.254
  278    HB3  SER  41           2HB      SER  41   7.488  10.248  -4.572
  279    HG   SER  41           HG       SER  41   7.614   9.962  -2.504
  280    H    GLY  42           H        GLY  42  10.591   8.730  -6.436
  281    HA2  GLY  42           1HA      GLY  42  10.587   8.392  -8.711
  282    HA3  GLY  42           2HA      GLY  42   8.870   8.747  -8.581
  283    HA   PRO  43           HA       PRO  43  11.035  11.943 -11.252
  284    HB2  PRO  43           1HB      PRO  43   9.563  11.497 -13.489
  285    HB3  PRO  43           2HB      PRO  43  11.055  10.620 -13.130
  286    HG2  PRO  43           1HG      PRO  43   8.214   9.771 -12.721
  287    HG3  PRO  43           2HG      PRO  43   9.581   8.836 -13.356
  288    HD2  PRO  43           1HD      PRO  43   8.713   8.596 -10.803
  289    HD3  PRO  43           2HD      PRO  43  10.418   8.395 -11.255
  290    H    SER  44           H        SER  44  10.211  13.767 -10.376
  291    HA   SER  44           HA       SER  44   7.344  14.218 -10.312
  292    HB2  SER  44           1HB      SER  44   7.789  16.041  -8.888
  293    HB3  SER  44           2HB      SER  44   9.009  14.846  -8.448
  294    HG   SER  44           HG       SER  44  10.324  16.456  -8.802
  295    H    SER  45           H        SER  45   6.243  15.316 -11.793
  296    HA   SER  45           HA       SER  45   7.727  17.086 -13.621
  297    HB2  SER  45           1HB      SER  45   6.928  14.850 -14.599
  298    HB3  SER  45           2HB      SER  45   5.297  15.506 -14.455
  299    HG   SER  45           HG       SER  45   7.404  16.818 -15.826
  300    H    GLY  46           H        GLY  46   7.150  18.868 -12.286
  301    HA2  GLY  46           1HA      GLY  46   5.772  20.814 -12.421
  302    HA3  GLY  46           2HA      GLY  46   4.399  19.777 -12.780
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1   2.637 -29.329 -13.225
    2    HA2  GLY   1           1HA      GLY   1   2.705 -27.613 -11.685
    3    HA3  GLY   1           2HA      GLY   1   1.848 -26.606 -12.843
    4    H    SER   2           H        SER   2   1.644 -28.175  -9.903
    5    HA   SER   2           HA       SER   2  -1.205 -28.653  -9.939
    6    HB2  SER   2           1HB      SER   2   0.164 -30.128  -8.596
    7    HB3  SER   2           2HB      SER   2   0.833 -28.761  -7.704
    8    HG   SER   2           HG       SER   2  -1.067 -28.486  -6.673
    9    H    SER   3           H        SER   3   1.012 -26.328  -8.438
   10    HA   SER   3           HA       SER   3  -0.496 -24.855  -6.802
   11    HB2  SER   3           1HB      SER   3   0.853 -22.976  -7.265
   12    HB3  SER   3           2HB      SER   3   1.866 -24.354  -7.696
   13    HG   SER   3           HG       SER   3   1.201 -22.335  -9.228
   14    H    GLY   4           H        GLY   4  -1.949 -23.095  -6.923
   15    HA2  GLY   4           1HA      GLY   4  -3.205 -22.582  -9.519
   16    HA3  GLY   4           2HA      GLY   4  -4.218 -23.223  -8.233
   17    H    SER   5           H        SER   5  -5.517 -21.569  -7.712
   18    HA   SER   5           HA       SER   5  -4.239 -18.997  -7.050
   19    HB2  SER   5           1HB      SER   5  -5.862 -19.053  -9.031
   20    HB3  SER   5           2HB      SER   5  -7.134 -19.315  -7.838
   21    HG   SER   5           HG       SER   5  -5.370 -17.212  -7.376
   22    H    SER   6           H        SER   6  -3.937 -19.211  -4.887
   23    HA   SER   6           HA       SER   6  -5.911 -20.373  -3.161
   24    HB2  SER   6           1HB      SER   6  -3.557 -20.564  -2.583
   25    HB3  SER   6           2HB      SER   6  -3.393 -18.809  -2.543
   26    HG   SER   6           HG       SER   6  -4.977 -18.853  -0.820
   27    H    GLY   7           H        GLY   7  -4.709 -17.073  -3.729
   28    HA2  GLY   7           1HA      GLY   7  -5.930 -15.092  -3.635
   29    HA3  GLY   7           2HA      GLY   7  -7.309 -16.000  -3.034
   30    H    SER   8           H        SER   8  -6.054 -13.462  -2.118
   31    HA   SER   8           HA       SER   8  -4.629 -13.776   0.251
   32    HB2  SER   8           1HB      SER   8  -6.629 -11.623  -0.479
   33    HB3  SER   8           2HB      SER   8  -5.472 -11.521   0.848
   34    HG   SER   8           HG       SER   8  -3.803 -11.555  -0.635
   35    H    GLY   9           H        GLY   9  -8.148 -13.517  -0.224
   36    HA2  GLY   9           1HA      GLY   9  -9.167 -15.347   1.376
   37    HA3  GLY   9           2HA      GLY   9  -8.577 -14.215   2.583
   38    H    GLU  10           H        GLU  10  -9.296 -11.870   2.148
   39    HA   GLU  10           HA       GLU  10 -12.170 -11.948   1.521
   40    HB2  GLU  10           1HB      GLU  10 -11.135 -11.234   3.857
   41    HB3  GLU  10           2HB      GLU  10 -10.951  -9.688   3.039
   42    HG2  GLU  10           1HG      GLU  10 -13.005  -9.375   3.932
   43    HG3  GLU  10           2HG      GLU  10 -13.482 -10.133   2.414
   44    H    LYS  11           H        LYS  11 -13.105  -9.998   0.562
   45    HA   LYS  11           HA       LYS  11 -11.553  -9.121  -1.681
   46    HB2  LYS  11           1HB      LYS  11 -14.049  -9.580  -1.676
   47    HB3  LYS  11           2HB      LYS  11 -14.242  -8.059  -0.813
   48    HG2  LYS  11           1HG      LYS  11 -13.155  -6.893  -2.701
   49    HG3  LYS  11           2HG      LYS  11 -13.090  -8.428  -3.571
   50    HD2  LYS  11           1HD      LYS  11 -15.557  -8.578  -3.403
   51    HD3  LYS  11           2HD      LYS  11 -15.573  -6.987  -2.639
   52    HE2  LYS  11           1HE      LYS  11 -14.347  -7.478  -5.341
   53    HE3  LYS  11           2HE      LYS  11 -16.048  -7.065  -5.133
   54    HZ1  LYS  11           3HZ      LYS  11 -13.673  -5.409  -4.745
   55    HZ2  LYS  11           1HZ      LYS  11 -14.989  -5.133  -3.718
   56    HZ3  LYS  11           2HZ      LYS  11 -15.181  -5.000  -5.394
   57    H    SER  12           H        SER  12 -10.153  -8.304   0.469
   58    HA   SER  12           HA       SER  12 -10.487  -5.385   0.374
   59    HB2  SER  12           1HB      SER  12  -9.813  -5.243   2.748
   60    HB3  SER  12           2HB      SER  12 -11.317  -6.142   2.549
   61    HG   SER  12           HG       SER  12  -8.857  -6.990   3.447
   62    H    HIS  13           H        HIS  13  -8.700  -4.332  -0.201
   63    HA   HIS  13           HA       HIS  13  -6.393  -5.593  -1.081
   64    HB2  HIS  13           1HB      HIS  13  -6.675  -2.737  -0.122
   65    HB3  HIS  13           2HB      HIS  13  -5.371  -3.356  -1.131
   66    HD1  HIS  13           HD1      HIS  13  -5.849  -3.669  -3.619
   67    HD2  HIS  13           HD2      HIS  13  -9.160  -2.429  -1.439
   68    HE1  HIS  13           HE1      HIS  13  -7.573  -3.015  -5.329
   69    H    THR  14           H        THR  14  -4.366  -5.946  -0.230
   70    HA   THR  14           HA       THR  14  -4.029  -5.451   2.651
   71    HB   THR  14           HB       THR  14  -3.312  -8.011   1.209
   72    HG1  THR  14           HG1      THR  14  -4.845  -8.699   3.058
   73   HG21  THR  14          3HG2      THR  14  -2.335  -8.796   3.170
   74   HG22  THR  14          1HG2      THR  14  -3.110  -7.565   4.167
   75   HG23  THR  14          2HG2      THR  14  -1.777  -7.125   3.099
   76    H    CYS  15           H        CYS  15  -2.110  -4.620   3.226
   77    HA   CYS  15           HA       CYS  15  -0.271  -3.791   1.214
   78    HB2  CYS  15           1HB      CYS  15  -0.789  -2.551   3.355
   79    HB3  CYS  15           2HB      CYS  15   0.176  -3.757   4.201
   80    H    ASP  16           H        ASP  16   1.145  -5.091   0.269
   81    HA   ASP  16           HA       ASP  16   1.973  -7.573   1.422
   82    HB2  ASP  16           1HB      ASP  16   3.346  -6.290  -0.921
   83    HB3  ASP  16           2HB      ASP  16   3.049  -7.999  -0.609
   84    H    GLU  17           H        GLU  17   3.073  -4.368   1.665
   85    HA   GLU  17           HA       GLU  17   5.846  -4.836   2.035
   86    HB2  GLU  17           1HB      GLU  17   4.120  -2.574   3.060
   87    HB3  GLU  17           2HB      GLU  17   5.878  -2.583   3.034
   88    HG2  GLU  17           1HG      GLU  17   4.395  -3.019   0.491
   89    HG3  GLU  17           2HG      GLU  17   4.508  -1.390   1.155
   90    H    CYS  18           H        CYS  18   3.134  -4.494   4.301
   91    HA   CYS  18           HA       CYS  18   4.849  -5.669   6.391
   92    HB2  CYS  18           1HB      CYS  18   3.502  -4.438   8.047
   93    HB3  CYS  18           2HB      CYS  18   4.308  -3.349   6.922
   94    H    GLY  19           H        GLY  19   1.574  -5.456   5.069
   95    HA2  GLY  19           1HA      GLY  19   0.446  -7.635   4.754
   96    HA3  GLY  19           2HA      GLY  19   0.991  -8.043   6.374
   97    H    LYS  20           H        LYS  20  -0.106  -4.826   5.749
   98    HA   LYS  20           HA       LYS  20  -2.216  -5.110   7.675
   99    HB2  LYS  20           1HB      LYS  20  -1.045  -2.870   6.092
  100    HB3  LYS  20           2HB      LYS  20  -2.661  -2.658   6.753
  101    HG2  LYS  20           1HG      LYS  20  -0.477  -3.613   8.540
  102    HG3  LYS  20           2HG      LYS  20  -0.556  -1.905   8.101
  103    HD2  LYS  20           1HD      LYS  20  -2.891  -1.842   8.908
  104    HD3  LYS  20           2HD      LYS  20  -2.736  -3.526   9.417
  105    HE2  LYS  20           1HE      LYS  20  -0.864  -1.386  10.387
  106    HE3  LYS  20           2HE      LYS  20  -2.397  -1.719  11.191
  107    HZ1  LYS  20           3HZ      LYS  20  -1.655  -3.680  11.995
  108    HZ2  LYS  20           1HZ      LYS  20  -0.148  -2.924  11.854
  109    HZ3  LYS  20           2HZ      LYS  20  -0.667  -4.003  10.660
  110    H    ASN  21           H        ASN  21  -4.440  -4.275   7.199
  111    HA   ASN  21           HA       ASN  21  -5.312  -5.128   4.516
  112    HB2  ASN  21           1HB      ASN  21  -6.599  -5.600   7.204
  113    HB3  ASN  21           2HB      ASN  21  -7.481  -5.778   5.690
  114   HD21  ASN  21          1HD2      ASN  21  -7.215  -7.577   4.493
  115   HD22  ASN  21          2HD2      ASN  21  -6.182  -8.892   4.930
  116    H    PHE  22           H        PHE  22  -6.866  -3.917   3.486
  117    HA   PHE  22           HA       PHE  22  -8.050  -1.643   4.867
  118    HB2  PHE  22           1HB      PHE  22  -6.448  -1.274   2.329
  119    HB3  PHE  22           2HB      PHE  22  -7.286  -0.019   3.235
  120    HD1  PHE  22           HD1      PHE  22  -6.392   0.811   5.333
  121    HD2  PHE  22           HD2      PHE  22  -4.343  -2.164   3.081
  122    HE1  PHE  22           HE1      PHE  22  -4.356   1.220   6.652
  123    HE2  PHE  22           HE2      PHE  22  -2.304  -1.761   4.398
  124    HZ   PHE  22           HZ       PHE  22  -2.309  -0.068   6.186
  125    H    CYS  23           H        CYS  23 -10.142  -1.904   4.470
  126    HA   CYS  23           HA       CYS  23 -11.323  -3.435   2.520
  127    HB2  CYS  23           1HB      CYS  23 -12.321  -2.157   4.592
  128    HB3  CYS  23           2HB      CYS  23 -12.689  -0.920   3.396
  129    HG   CYS  23           HG       CYS  23 -13.658  -3.887   2.316
  130    H    TYR  24           H        TYR  24 -10.540   0.018   2.380
  131    HA   TYR  24           HA       TYR  24 -11.182  -0.016  -0.493
  132    HB2  TYR  24           1HB      TYR  24 -10.969   2.601  -0.015
  133    HB3  TYR  24           2HB      TYR  24 -12.469   1.720   0.255
  134    HD1  TYR  24           HD2      TYR  24 -12.966   0.900   2.614
  135    HD2  TYR  24           HD1      TYR  24  -9.906   3.727   1.748
  136    HE1  TYR  24           HE2      TYR  24 -12.965   1.612   4.968
  137    HE2  TYR  24           HE1      TYR  24  -9.896   4.446   4.101
  138    HH   TYR  24           HH       TYR  24 -11.525   4.425   6.039
  139    H    ILE  25           H        ILE  25  -9.597   0.231  -1.932
  140    HA   ILE  25           HA       ILE  25  -6.930  -0.009  -1.387
  141    HB   ILE  25           HB       ILE  25  -7.986  -0.181  -3.651
  142   HG12  ILE  25          1HG1      ILE  25  -5.995   0.808  -4.857
  143   HG13  ILE  25          2HG1      ILE  25  -5.486   1.482  -3.313
  144   HG21  ILE  25          1HG2      ILE  25  -7.624   2.804  -3.776
  145   HG22  ILE  25          2HG2      ILE  25  -8.343   1.748  -4.990
  146   HG23  ILE  25          3HG2      ILE  25  -9.174   2.025  -3.460
  147   HD11  ILE  25          3HD1      ILE  25  -5.968  -1.230  -2.838
  148   HD12  ILE  25          1HD1      ILE  25  -5.096  -1.149  -4.368
  149   HD13  ILE  25          2HD1      ILE  25  -4.411  -0.407  -2.922
  150    H    SER  26           H        SER  26  -8.697   3.033  -1.915
  151    HA   SER  26           HA       SER  26  -6.747   4.897  -1.835
  152    HB2  SER  26           1HB      SER  26  -8.950   5.706  -2.015
  153    HB3  SER  26           2HB      SER  26  -9.463   4.898  -0.534
  154    HG   SER  26           HG       SER  26  -8.381   7.360  -0.866
  155    H    ALA  27           H        ALA  27  -8.172   3.356   1.036
  156    HA   ALA  27           HA       ALA  27  -6.683   4.692   2.977
  157    HB1  ALA  27           3HB      ALA  27  -7.066   2.094   3.942
  158    HB2  ALA  27           1HB      ALA  27  -8.093   3.503   4.211
  159    HB3  ALA  27           2HB      ALA  27  -8.428   2.411   2.867
  160    H    LEU  28           H        LEU  28  -6.029   1.515   1.492
  161    HA   LEU  28           HA       LEU  28  -3.660   0.909   2.752
  162    HB2  LEU  28           1HB      LEU  28  -4.535  -0.766   1.407
  163    HB3  LEU  28           2HB      LEU  28  -4.723   0.309   0.023
  164    HG   LEU  28           HG       LEU  28  -2.290   0.283  -0.312
  165   HD11  LEU  28          1HD1      LEU  28  -1.477  -1.937   1.171
  166   HD12  LEU  28          2HD1      LEU  28  -2.335  -0.899   2.309
  167   HD13  LEU  28          3HD1      LEU  28  -0.974  -0.261   1.388
  168   HD21  LEU  28          3HD2      LEU  28  -2.201  -1.805  -1.345
  169   HD22  LEU  28          1HD2      LEU  28  -3.926  -1.442  -1.283
  170   HD23  LEU  28          2HD2      LEU  28  -3.218  -2.562  -0.118
  171    H    ARG  29           H        ARG  29  -4.097   2.809  -0.220
  172    HA   ARG  29           HA       ARG  29  -1.426   3.293  -0.806
  173    HB2  ARG  29           1HB      ARG  29  -3.698   5.244  -1.206
  174    HB3  ARG  29           2HB      ARG  29  -2.187   5.184  -2.103
  175    HG2  ARG  29           1HG      ARG  29  -4.228   2.974  -2.100
  176    HG3  ARG  29           2HG      ARG  29  -4.150   4.253  -3.313
  177    HD2  ARG  29           1HD      ARG  29  -2.015   2.216  -2.694
  178    HD3  ARG  29           2HD      ARG  29  -3.028   2.276  -4.135
  179    HE   ARG  29           HE       ARG  29  -0.696   3.876  -3.579
  180   HH11  ARG  29          1HH1      ARG  29  -3.622   3.586  -5.441
  181   HH12  ARG  29          2HH1      ARG  29  -3.070   4.624  -6.714
  182   HH21  ARG  29          1HH2      ARG  29   0.043   5.244  -5.248
  183   HH22  ARG  29          2HH2      ARG  29  -0.985   5.566  -6.603
  184    H    ILE  30           H        ILE  30  -3.619   5.077   1.329
  185    HA   ILE  30           HA       ILE  30  -1.875   7.183   1.967
  186    HB   ILE  30           HB       ILE  30  -4.081   5.976   3.640
  187   HG12  ILE  30          1HG1      ILE  30  -4.180   8.506   2.006
  188   HG13  ILE  30          2HG1      ILE  30  -4.611   6.942   1.323
  189   HG21  ILE  30          1HG2      ILE  30  -3.428   8.791   4.042
  190   HG22  ILE  30          2HG2      ILE  30  -3.736   7.518   5.222
  191   HG23  ILE  30          3HG2      ILE  30  -2.132   7.691   4.510
  192   HD11  ILE  30          3HD1      ILE  30  -6.311   6.709   3.125
  193   HD12  ILE  30          1HD1      ILE  30  -5.948   8.366   3.606
  194   HD13  ILE  30          2HD1      ILE  30  -6.608   8.037   2.004
  195    H    HIS  31           H        HIS  31  -2.367   4.016   3.467
  196    HA   HIS  31           HA       HIS  31  -0.630   4.438   5.661
  197    HB2  HIS  31           1HB      HIS  31  -2.054   2.650   6.012
  198    HB3  HIS  31           2HB      HIS  31  -1.872   2.045   4.368
  199    HD1  HIS  31           HD1      HIS  31  -0.047   2.127   7.673
  200    HD2  HIS  31           HD2      HIS  31   0.049   0.109   4.042
  201    HE1  HIS  31           HE1      HIS  31   1.589   0.244   7.992
  202    H    GLN  32           H        GLN  32  -0.154   2.901   2.496
  203    HA   GLN  32           HA       GLN  32   2.362   1.904   2.697
  204    HB2  GLN  32           1HB      GLN  32   1.044   3.376   0.428
  205    HB3  GLN  32           2HB      GLN  32   2.656   2.690   0.266
  206    HG2  GLN  32           1HG      GLN  32   1.558   0.501   1.069
  207    HG3  GLN  32           2HG      GLN  32   0.042   1.292   0.641
  208   HE21  GLN  32          1HE2      GLN  32  -0.074   2.174  -1.581
  209   HE22  GLN  32          2HE2      GLN  32   0.678   1.272  -2.848
  210    H    ARG  33           H        ARG  33   1.454   5.282   2.529
  211    HA   ARG  33           HA       ARG  33   3.745   6.575   1.866
  212    HB2  ARG  33           1HB      ARG  33   1.867   7.262   4.134
  213    HB3  ARG  33           2HB      ARG  33   3.069   8.361   3.471
  214    HG2  ARG  33           1HG      ARG  33   1.927   8.085   1.244
  215    HG3  ARG  33           2HG      ARG  33   0.635   7.251   2.108
  216    HD2  ARG  33           1HD      ARG  33  -0.152   9.420   2.051
  217    HD3  ARG  33           2HD      ARG  33   0.644   9.361   3.623
  218    HE   ARG  33           HE       ARG  33   2.459  10.247   1.650
  219   HH11  ARG  33          1HH1      ARG  33  -0.324  11.295   3.461
  220   HH12  ARG  33          2HH1      ARG  33   0.102  12.973   3.393
  221   HH21  ARG  33          1HH2      ARG  33   3.030  12.453   1.554
  222   HH22  ARG  33          2HH2      ARG  33   2.009  13.631   2.307
  223    H    VAL  34           H        VAL  34   3.045   5.005   4.947
  224    HA   VAL  34           HA       VAL  34   5.268   5.905   6.392
  225    HB   VAL  34           HB       VAL  34   4.876   4.127   7.923
  226   HG11  VAL  34          1HG1      VAL  34   3.011   5.915   7.364
  227   HG12  VAL  34          2HG1      VAL  34   2.101   4.471   6.915
  228   HG13  VAL  34          3HG1      VAL  34   2.741   4.639   8.551
  229   HG21  VAL  34          3HG2      VAL  34   4.883   2.221   6.496
  230   HG22  VAL  34          1HG2      VAL  34   3.327   2.241   7.327
  231   HG23  VAL  34          2HG2      VAL  34   3.437   2.772   5.649
  232    H    HIS  35           H        HIS  35   4.883   3.183   4.181
  233    HA   HIS  35           HA       HIS  35   7.444   2.046   4.682
  234    HB2  HIS  35           1HB      HIS  35   5.456   1.724   2.437
  235    HB3  HIS  35           2HB      HIS  35   6.992   0.863   2.466
  236    HD1  HIS  35           HD1      HIS  35   7.332  -0.739   4.626
  237    HD2  HIS  35           HD2      HIS  35   3.453   0.511   3.822
  238    HE1  HIS  35           HE1      HIS  35   5.841  -2.310   5.904
  239    H    MET  36           H        MET  36   6.194   4.363   2.338
  240    HA   MET  36           HA       MET  36   8.232   4.520   0.521
  241    HB2  MET  36           1HB      MET  36   6.360   6.544   1.664
  242    HB3  MET  36           2HB      MET  36   7.669   7.104   0.632
  243    HG2  MET  36           1HG      MET  36   5.834   6.825  -0.788
  244    HG3  MET  36           2HG      MET  36   6.861   5.422  -1.074
  245    HE1  MET  36           3HE      MET  36   3.580   6.431  -1.210
  246    HE2  MET  36           1HE      MET  36   3.957   5.012  -2.188
  247    HE3  MET  36           2HE      MET  36   2.674   4.935  -0.979
  248    H    GLY  37           H        GLY  37  10.353   4.739   0.753
  249    HA2  GLY  37           1HA      GLY  37  11.364   6.665   2.729
  250    HA3  GLY  37           2HA      GLY  37  11.976   5.018   2.761
  251    H    GLU  38           H        GLU  38  12.279   4.437   0.110
  252    HA   GLU  38           HA       GLU  38  14.711   5.753  -0.496
  253    HB2  GLU  38           1HB      GLU  38  13.021   3.681  -1.798
  254    HB3  GLU  38           2HB      GLU  38  14.191   4.518  -2.808
  255    HG2  GLU  38           1HG      GLU  38  15.944   3.899  -1.130
  256    HG3  GLU  38           2HG      GLU  38  14.734   2.888  -0.343
  257    H    LYS  39           H        LYS  39  15.208   7.331  -1.946
  258    HA   LYS  39           HA       LYS  39  13.359   9.308  -2.547
  259    HB2  LYS  39           1HB      LYS  39  15.971   9.311  -2.613
  260    HB3  LYS  39           2HB      LYS  39  15.751   8.872  -4.302
  261    HG2  LYS  39           1HG      LYS  39  15.948  11.176  -4.369
  262    HG3  LYS  39           2HG      LYS  39  14.201  10.922  -4.413
  263    HD2  LYS  39           1HD      LYS  39  14.492  11.093  -1.781
  264    HD3  LYS  39           2HD      LYS  39  15.914  12.028  -2.250
  265    HE2  LYS  39           1HE      LYS  39  13.247  12.600  -3.481
  266    HE3  LYS  39           2HE      LYS  39  13.648  13.241  -1.889
  267    HZ1  LYS  39           3HZ      LYS  39  15.681  14.202  -2.932
  268    HZ2  LYS  39           1HZ      LYS  39  14.229  14.870  -3.487
  269    HZ3  LYS  39           2HZ      LYS  39  15.065  13.753  -4.443
  270    H    CYS  40           H        CYS  40  14.780   6.956  -4.825
  271    HA   CYS  40           HA       CYS  40  14.079   6.207  -6.859
  272    HB2  CYS  40           1HB      CYS  40  11.511   6.376  -5.298
  273    HB3  CYS  40           2HB      CYS  40  11.536   5.783  -6.954
  274    HG   CYS  40           HG       CYS  40  11.661   3.397  -5.932
  275    H    SER  41           H        SER  41  14.667   8.850  -6.973
  276    HA   SER  41           HA       SER  41  12.639  10.558  -7.883
  277    HB2  SER  41           1HB      SER  41  15.572  10.594  -8.636
  278    HB3  SER  41           2HB      SER  41  14.444  11.940  -8.790
  279    HG   SER  41           HG       SER  41  14.980  12.405  -6.822
  280    H    GLY  42           H        GLY  42  11.479  10.555  -9.689
  281    HA2  GLY  42           1HA      GLY  42  10.709   9.903 -11.759
  282    HA3  GLY  42           2HA      GLY  42  12.345  10.285 -12.274
  283    HA   PRO  43           HA       PRO  43  12.184   5.527 -11.318
  284    HB2  PRO  43           1HB      PRO  43   9.695   4.457 -11.149
  285    HB3  PRO  43           2HB      PRO  43  10.577   5.064  -9.743
  286    HG2  PRO  43           1HG      PRO  43   8.430   6.393 -11.350
  287    HG3  PRO  43           2HG      PRO  43   8.642   6.344  -9.591
  288    HD2  PRO  43           1HD      PRO  43   9.357   8.486 -11.085
  289    HD3  PRO  43           2HD      PRO  43  10.225   8.019  -9.608
  290    H    SER  44           H        SER  44   9.251   6.572 -13.068
  291    HA   SER  44           HA       SER  44  10.358   5.495 -15.539
  292    HB2  SER  44           1HB      SER  44   8.004   4.369 -14.107
  293    HB3  SER  44           2HB      SER  44   7.893   4.506 -15.861
  294    HG   SER  44           HG       SER  44  10.233   3.422 -14.814
  295    H    SER  45           H        SER  45   9.127   6.160 -17.446
  296    HA   SER  45           HA       SER  45   8.359   8.894 -17.269
  297    HB2  SER  45           1HB      SER  45   9.425   7.564 -19.258
  298    HB3  SER  45           2HB      SER  45   7.750   7.202 -19.671
  299    HG   SER  45           HG       SER  45   9.150   9.513 -19.978
  300    H    GLY  46           H        GLY  46   6.371   9.849 -17.366
  301    HA2  GLY  46           1HA      GLY  46   4.059  10.018 -17.483
  302    HA3  GLY  46           2HA      GLY  46   3.985   8.309 -17.887
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1  -9.261 -32.691  -2.945
    2    HA2  GLY   1           1HA      GLY   1  -9.854 -31.565  -5.523
    3    HA3  GLY   1           2HA      GLY   1 -10.688 -31.219  -4.015
    4    H    SER   2           H        SER   2  -7.965 -30.378  -6.052
    5    HA   SER   2           HA       SER   2  -7.149 -28.189  -4.352
    6    HB2  SER   2           1HB      SER   2  -6.263 -28.965  -7.141
    7    HB3  SER   2           2HB      SER   2  -5.515 -27.713  -6.151
    8    HG   SER   2           HG       SER   2  -4.796 -30.153  -6.180
    9    H    SER   3           H        SER   3  -9.803 -27.895  -4.978
   10    HA   SER   3           HA       SER   3 -10.059 -26.061  -7.206
   11    HB2  SER   3           1HB      SER   3 -12.064 -26.987  -5.135
   12    HB3  SER   3           2HB      SER   3 -12.446 -25.944  -6.505
   13    HG   SER   3           HG       SER   3 -12.298 -28.601  -6.440
   14    H    GLY   4           H        GLY   4 -10.477 -25.912  -3.670
   15    HA2  GLY   4           1HA      GLY   4  -9.210 -23.775  -2.870
   16    HA3  GLY   4           2HA      GLY   4 -10.450 -22.982  -3.831
   17    H    SER   5           H        SER   5 -11.124 -21.908  -1.894
   18    HA   SER   5           HA       SER   5 -12.502 -23.633   0.046
   19    HB2  SER   5           1HB      SER   5 -12.431 -21.746   1.578
   20    HB3  SER   5           2HB      SER   5 -10.812 -22.046   0.946
   21    HG   SER   5           HG       SER   5 -12.352 -19.833   0.734
   22    H    SER   6           H        SER   6 -13.730 -23.312  -2.415
   23    HA   SER   6           HA       SER   6 -15.681 -22.699  -3.418
   24    HB2  SER   6           1HB      SER   6 -16.589 -23.824  -1.407
   25    HB3  SER   6           2HB      SER   6 -16.590 -22.278  -0.559
   26    HG   SER   6           HG       SER   6 -17.904 -22.456  -3.023
   27    H    GLY   7           H        GLY   7 -13.788 -20.665  -3.317
   28    HA2  GLY   7           1HA      GLY   7 -15.491 -18.370  -3.660
   29    HA3  GLY   7           2HA      GLY   7 -14.409 -18.223  -2.283
   30    H    SER   8           H        SER   8 -14.157 -16.375  -4.195
   31    HA   SER   8           HA       SER   8 -11.824 -17.221  -5.782
   32    HB2  SER   8           1HB      SER   8 -13.999 -16.229  -6.872
   33    HB3  SER   8           2HB      SER   8 -13.326 -14.687  -6.343
   34    HG   SER   8           HG       SER   8 -11.630 -16.444  -7.688
   35    H    GLY   9           H        GLY   9 -11.467 -16.638  -3.086
   36    HA2  GLY   9           1HA      GLY   9  -9.746 -15.529  -1.959
   37    HA3  GLY   9           2HA      GLY   9  -9.621 -14.406  -3.304
   38    H    GLU  10           H        GLU  10  -9.528 -13.540  -0.676
   39    HA   GLU  10           HA       GLU  10 -12.057 -12.692   0.296
   40    HB2  GLU  10           1HB      GLU  10  -9.852 -12.901   1.586
   41    HB3  GLU  10           2HB      GLU  10  -9.434 -11.339   0.895
   42    HG2  GLU  10           1HG      GLU  10 -11.355 -10.320   1.950
   43    HG3  GLU  10           2HG      GLU  10 -11.869 -11.885   2.578
   44    H    LYS  11           H        LYS  11 -12.739 -10.428   0.507
   45    HA   LYS  11           HA       LYS  11 -12.159  -8.934  -1.962
   46    HB2  LYS  11           1HB      LYS  11 -14.556  -9.807  -1.246
   47    HB3  LYS  11           2HB      LYS  11 -14.550  -8.339  -0.277
   48    HG2  LYS  11           1HG      LYS  11 -13.844  -8.182  -3.168
   49    HG3  LYS  11           2HG      LYS  11 -15.537  -8.332  -2.689
   50    HD2  LYS  11           1HD      LYS  11 -15.291  -6.348  -1.259
   51    HD3  LYS  11           2HD      LYS  11 -13.610  -6.193  -1.777
   52    HE2  LYS  11           1HE      LYS  11 -14.349  -5.883  -4.085
   53    HE3  LYS  11           2HE      LYS  11 -16.028  -6.059  -3.578
   54    HZ1  LYS  11           3HZ      LYS  11 -15.075  -3.713  -3.869
   55    HZ2  LYS  11           1HZ      LYS  11 -14.309  -3.981  -2.384
   56    HZ3  LYS  11           2HZ      LYS  11 -15.996  -4.034  -2.487
   57    H    SER  12           H        SER  12 -10.229  -8.450  -0.309
   58    HA   SER  12           HA       SER  12 -10.663  -5.718   0.522
   59    HB2  SER  12           1HB      SER  12 -10.146  -7.926   2.493
   60    HB3  SER  12           2HB      SER  12  -9.552  -6.295   2.809
   61    HG   SER  12           HG       SER  12 -11.939  -5.818   2.169
   62    H    HIS  13           H        HIS  13  -8.795  -4.513   0.547
   63    HA   HIS  13           HA       HIS  13  -6.509  -5.719  -0.740
   64    HB2  HIS  13           1HB      HIS  13  -6.799  -2.874   0.235
   65    HB3  HIS  13           2HB      HIS  13  -5.663  -3.480  -0.968
   66    HD1  HIS  13           HD1      HIS  13  -6.586  -3.942  -3.343
   67    HD2  HIS  13           HD2      HIS  13  -9.388  -2.391  -0.697
   68    HE1  HIS  13           HE1      HIS  13  -8.535  -3.236  -4.766
   69    H    THR  14           H        THR  14  -4.448  -5.922   0.091
   70    HA   THR  14           HA       THR  14  -4.088  -5.337   2.948
   71    HB   THR  14           HB       THR  14  -3.351  -7.946   1.608
   72    HG1  THR  14           HG1      THR  14  -4.821  -8.547   3.560
   73   HG21  THR  14          3HG2      THR  14  -1.750  -7.009   3.367
   74   HG22  THR  14          1HG2      THR  14  -2.370  -8.638   3.632
   75   HG23  THR  14          2HG2      THR  14  -3.052  -7.278   4.525
   76    H    CYS  15           H        CYS  15  -2.147  -4.502   3.476
   77    HA   CYS  15           HA       CYS  15  -0.377  -3.693   1.389
   78    HB2  CYS  15           1HB      CYS  15  -0.857  -2.391   3.496
   79    HB3  CYS  15           2HB      CYS  15   0.129  -3.563   4.364
   80    H    ASP  16           H        ASP  16   0.895  -5.131   0.414
   81    HA   ASP  16           HA       ASP  16   1.832  -7.517   1.634
   82    HB2  ASP  16           1HB      ASP  16   2.653  -6.108  -0.912
   83    HB3  ASP  16           2HB      ASP  16   3.267  -7.686  -0.427
   84    H    GLU  17           H        GLU  17   2.861  -4.320   1.867
   85    HA   GLU  17           HA       GLU  17   5.668  -4.727   2.111
   86    HB2  GLU  17           1HB      GLU  17   4.021  -2.486   3.290
   87    HB3  GLU  17           2HB      GLU  17   5.748  -2.469   2.965
   88    HG2  GLU  17           1HG      GLU  17   4.973  -2.939   0.507
   89    HG3  GLU  17           2HG      GLU  17   3.460  -2.239   1.080
   90    H    CYS  18           H        CYS  18   3.042  -4.375   4.480
   91    HA   CYS  18           HA       CYS  18   4.840  -5.536   6.507
   92    HB2  CYS  18           1HB      CYS  18   3.514  -4.297   8.203
   93    HB3  CYS  18           2HB      CYS  18   4.348  -3.232   7.077
   94    H    GLY  19           H        GLY  19   1.476  -5.278   5.408
   95    HA2  GLY  19           1HA      GLY  19   0.374  -7.509   5.136
   96    HA3  GLY  19           2HA      GLY  19   0.943  -7.850   6.764
   97    H    LYS  20           H        LYS  20  -0.172  -4.663   6.009
   98    HA   LYS  20           HA       LYS  20  -2.270  -4.891   7.967
   99    HB2  LYS  20           1HB      LYS  20  -1.119  -2.676   6.319
  100    HB3  LYS  20           2HB      LYS  20  -2.696  -2.452   7.064
  101    HG2  LYS  20           1HG      LYS  20  -0.415  -3.404   8.731
  102    HG3  LYS  20           2HG      LYS  20  -0.529  -1.697   8.298
  103    HD2  LYS  20           1HD      LYS  20  -2.851  -1.695   9.212
  104    HD3  LYS  20           2HD      LYS  20  -2.579  -3.345   9.776
  105    HE2  LYS  20           1HE      LYS  20  -2.084  -2.086  11.655
  106    HE3  LYS  20           2HE      LYS  20  -0.493  -2.338  10.938
  107    HZ1  LYS  20           3HZ      LYS  20  -2.122   0.110  11.016
  108    HZ2  LYS  20           1HZ      LYS  20  -0.996  -0.104   9.772
  109    HZ3  LYS  20           2HZ      LYS  20  -0.484  -0.097  11.383
  110    H    ASN  21           H        ASN  21  -4.496  -4.173   7.523
  111    HA   ASN  21           HA       ASN  21  -5.370  -4.992   4.829
  112    HB2  ASN  21           1HB      ASN  21  -6.649  -5.470   7.521
  113    HB3  ASN  21           2HB      ASN  21  -7.529  -5.660   6.007
  114   HD21  ASN  21          1HD2      ASN  21  -7.120  -7.401   4.708
  115   HD22  ASN  21          2HD2      ASN  21  -6.124  -8.728   5.191
  116    H    PHE  22           H        PHE  22  -6.841  -3.740   3.769
  117    HA   PHE  22           HA       PHE  22  -8.071  -1.492   5.166
  118    HB2  PHE  22           1HB      PHE  22  -6.490  -1.095   2.621
  119    HB3  PHE  22           2HB      PHE  22  -7.294   0.147   3.575
  120    HD1  PHE  22           HD2      PHE  22  -4.445  -2.169   3.451
  121    HD2  PHE  22           HD1      PHE  22  -6.283   1.058   5.530
  122    HE1  PHE  22           HE2      PHE  22  -2.375  -1.820   4.734
  123    HE2  PHE  22           HE1      PHE  22  -4.216   1.413   6.816
  124    HZ   PHE  22           HZ       PHE  22  -2.258  -0.028   6.419
  125    H    CYS  23           H        CYS  23 -10.161  -1.758   4.761
  126    HA   CYS  23           HA       CYS  23 -11.346  -3.291   2.825
  127    HB2  CYS  23           1HB      CYS  23 -12.427  -0.747   4.056
  128    HB3  CYS  23           2HB      CYS  23 -13.393  -1.939   3.194
  129    HG   CYS  23           HG       CYS  23 -14.060  -2.640   5.656
  130    H    TYR  24           H        TYR  24 -10.548   0.159   2.628
  131    HA   TYR  24           HA       TYR  24 -11.197   0.094  -0.239
  132    HB2  TYR  24           1HB      TYR  24 -10.853   2.705   0.191
  133    HB3  TYR  24           2HB      TYR  24 -12.387   1.900   0.503
  134    HD1  TYR  24           HD2      TYR  24 -12.621   0.909   2.950
  135    HD2  TYR  24           HD1      TYR  24  -9.959   4.041   1.849
  136    HE1  TYR  24           HE2      TYR  24 -12.541   1.656   5.292
  137    HE2  TYR  24           HE1      TYR  24  -9.871   4.796   4.188
  138    HH   TYR  24           HH       TYR  24 -11.094   4.649   6.218
  139    H    ILE  25           H        ILE  25  -9.601   0.109  -1.672
  140    HA   ILE  25           HA       ILE  25  -6.943  -0.177  -1.141
  141    HB   ILE  25           HB       ILE  25  -8.083  -0.421  -3.385
  142   HG12  ILE  25          1HG1      ILE  25  -6.009   0.325  -4.654
  143   HG13  ILE  25          2HG1      ILE  25  -5.422   0.983  -3.130
  144   HG21  ILE  25          1HG2      ILE  25  -8.270   1.443  -4.840
  145   HG22  ILE  25          2HG2      ILE  25  -9.042   1.904  -3.324
  146   HG23  ILE  25          3HG2      ILE  25  -7.426   2.497  -3.707
  147   HD11  ILE  25          3HD1      ILE  25  -6.005  -1.893  -3.777
  148   HD12  ILE  25          1HD1      ILE  25  -4.438  -1.156  -3.442
  149   HD13  ILE  25          2HD1      ILE  25  -5.637  -1.302  -2.157
  150    H    SER  26           H        SER  26  -8.652   2.875  -1.736
  151    HA   SER  26           HA       SER  26  -6.612   4.674  -1.826
  152    HB2  SER  26           1HB      SER  26  -9.246   4.973  -1.736
  153    HB3  SER  26           2HB      SER  26  -8.914   5.355  -0.047
  154    HG   SER  26           HG       SER  26  -7.227   6.814  -1.066
  155    H    ALA  27           H        ALA  27  -8.068   3.333   1.125
  156    HA   ALA  27           HA       ALA  27  -6.574   4.740   3.002
  157    HB1  ALA  27           3HB      ALA  27  -6.990   2.086   3.955
  158    HB2  ALA  27           1HB      ALA  27  -7.852   3.565   4.380
  159    HB3  ALA  27           2HB      ALA  27  -8.399   2.584   3.020
  160    H    LEU  28           H        LEU  28  -5.866   1.612   1.466
  161    HA   LEU  28           HA       LEU  28  -3.503   1.025   2.811
  162    HB2  LEU  28           1HB      LEU  28  -4.343  -0.711   1.539
  163    HB3  LEU  28           2HB      LEU  28  -4.597   0.312   0.127
  164    HG   LEU  28           HG       LEU  28  -2.104   0.375  -0.158
  165   HD11  LEU  28          1HD1      LEU  28  -1.452  -2.019   1.178
  166   HD12  LEU  28          2HD1      LEU  28  -2.214  -0.958   2.362
  167   HD13  LEU  28          3HD1      LEU  28  -0.805  -0.402   1.459
  168   HD21  LEU  28          3HD2      LEU  28  -2.145  -2.266  -0.686
  169   HD22  LEU  28          1HD2      LEU  28  -2.920  -1.050  -1.702
  170   HD23  LEU  28          2HD2      LEU  28  -3.873  -1.953  -0.524
  171    H    ARG  29           H        ARG  29  -3.990   2.859  -0.190
  172    HA   ARG  29           HA       ARG  29  -1.312   3.334  -0.804
  173    HB2  ARG  29           1HB      ARG  29  -3.613   5.229  -1.297
  174    HB3  ARG  29           2HB      ARG  29  -2.097   5.156  -2.185
  175    HG2  ARG  29           1HG      ARG  29  -4.005   2.842  -2.086
  176    HG3  ARG  29           2HG      ARG  29  -4.132   4.128  -3.289
  177    HD2  ARG  29           1HD      ARG  29  -1.691   2.418  -2.826
  178    HD3  ARG  29           2HD      ARG  29  -2.879   2.160  -4.104
  179    HE   ARG  29           HE       ARG  29  -0.832   4.202  -4.009
  180   HH11  ARG  29          1HH1      ARG  29  -3.804   3.119  -5.464
  181   HH12  ARG  29          2HH1      ARG  29  -3.596   4.064  -6.901
  182   HH21  ARG  29          1HH2      ARG  29  -0.547   5.449  -5.897
  183   HH22  ARG  29          2HH2      ARG  29  -1.743   5.388  -7.147
  184    H    ILE  30           H        ILE  30  -3.522   5.092   1.316
  185    HA   ILE  30           HA       ILE  30  -1.824   7.280   1.851
  186    HB   ILE  30           HB       ILE  30  -4.019   6.101   3.559
  187   HG12  ILE  30          1HG1      ILE  30  -4.152   8.571   1.837
  188   HG13  ILE  30          2HG1      ILE  30  -4.548   6.977   1.203
  189   HG21  ILE  30          1HG2      ILE  30  -2.469   8.667   3.782
  190   HG22  ILE  30          2HG2      ILE  30  -4.049   8.443   4.532
  191   HG23  ILE  30          3HG2      ILE  30  -2.696   7.414   5.002
  192   HD11  ILE  30          3HD1      ILE  30  -5.910   8.365   3.499
  193   HD12  ILE  30          1HD1      ILE  30  -6.547   8.162   1.867
  194   HD13  ILE  30          2HD1      ILE  30  -6.298   6.753   2.898
  195    H    HIS  31           H        HIS  31  -2.127   4.091   3.288
  196    HA   HIS  31           HA       HIS  31  -0.406   4.664   5.511
  197    HB2  HIS  31           1HB      HIS  31  -1.813   2.922   6.043
  198    HB3  HIS  31           2HB      HIS  31  -1.763   2.243   4.419
  199    HD1  HIS  31           HD1      HIS  31   0.370   2.465   7.540
  200    HD2  HIS  31           HD2      HIS  31  -0.011   0.171   4.097
  201    HE1  HIS  31           HE1      HIS  31   1.946   0.529   7.844
  202    H    GLN  32           H        GLN  32  -0.048   2.975   2.413
  203    HA   GLN  32           HA       GLN  32   2.472   1.946   2.628
  204    HB2  GLN  32           1HB      GLN  32   1.123   3.258   0.274
  205    HB3  GLN  32           2HB      GLN  32   2.687   2.464   0.142
  206    HG2  GLN  32           1HG      GLN  32   1.490   0.429   1.172
  207    HG3  GLN  32           2HG      GLN  32   0.009   1.266   0.713
  208   HE21  GLN  32          1HE2      GLN  32  -0.067   1.997  -1.591
  209   HE22  GLN  32          2HE2      GLN  32   0.566   0.919  -2.783
  210    H    ARG  33           H        ARG  33   1.560   5.282   2.462
  211    HA   ARG  33           HA       ARG  33   3.822   6.531   1.526
  212    HB2  ARG  33           1HB      ARG  33   2.029   7.368   3.811
  213    HB3  ARG  33           2HB      ARG  33   3.213   8.419   3.046
  214    HG2  ARG  33           1HG      ARG  33   1.987   7.965   0.869
  215    HG3  ARG  33           2HG      ARG  33   0.707   7.269   1.865
  216    HD2  ARG  33           1HD      ARG  33   0.024   9.472   1.592
  217    HD3  ARG  33           2HD      ARG  33   0.816   9.490   3.167
  218    HE   ARG  33           HE       ARG  33   2.361  10.933   2.312
  219   HH11  ARG  33          1HH1      ARG  33   0.797   9.286  -0.326
  220   HH12  ARG  33          2HH1      ARG  33   1.583  10.226  -1.551
  221   HH21  ARG  33          1HH2      ARG  33   3.402  12.178   0.709
  222   HH22  ARG  33          2HH2      ARG  33   3.065  11.871  -0.960
  223    H    VAL  34           H        VAL  34   3.263   5.122   4.704
  224    HA   VAL  34           HA       VAL  34   5.547   6.126   5.997
  225    HB   VAL  34           HB       VAL  34   5.207   4.471   7.669
  226   HG11  VAL  34          1HG1      VAL  34   3.115   5.061   8.348
  227   HG12  VAL  34          2HG1      VAL  34   3.315   6.220   7.033
  228   HG13  VAL  34          3HG1      VAL  34   2.391   4.740   6.772
  229   HG21  VAL  34          3HG2      VAL  34   3.610   2.965   5.601
  230   HG22  VAL  34          1HG2      VAL  34   5.148   2.484   6.317
  231   HG23  VAL  34          2HG2      VAL  34   3.691   2.534   7.309
  232    H    HIS  35           H        HIS  35   5.034   3.209   4.066
  233    HA   HIS  35           HA       HIS  35   7.576   2.062   4.521
  234    HB2  HIS  35           1HB      HIS  35   5.557   1.714   2.306
  235    HB3  HIS  35           2HB      HIS  35   7.058   0.796   2.373
  236    HD1  HIS  35           HD1      HIS  35   7.339  -0.755   4.558
  237    HD2  HIS  35           HD2      HIS  35   3.517   0.686   3.797
  238    HE1  HIS  35           HE1      HIS  35   5.794  -2.196   5.922
  239    H    MET  36           H        MET  36   6.386   4.404   2.193
  240    HA   MET  36           HA       MET  36   8.333   4.422   0.277
  241    HB2  MET  36           1HB      MET  36   7.016   6.818   1.566
  242    HB3  MET  36           2HB      MET  36   7.906   6.860   0.050
  243    HG2  MET  36           1HG      MET  36   6.294   5.295  -0.927
  244    HG3  MET  36           2HG      MET  36   5.394   5.294   0.588
  245    HE1  MET  36           3HE      MET  36   2.991   7.057  -1.670
  246    HE2  MET  36           1HE      MET  36   4.325   6.718  -2.773
  247    HE3  MET  36           2HE      MET  36   3.866   5.530  -1.553
  248    H    GLY  37           H        GLY  37  10.474   4.511   0.375
  249    HA2  GLY  37           1HA      GLY  37  11.896   6.532   1.739
  250    HA3  GLY  37           2HA      GLY  37  11.948   5.053   2.686
  251    H    GLU  38           H        GLU  38  11.998   3.230   0.493
  252    HA   GLU  38           HA       GLU  38  14.315   3.912  -1.104
  253    HB2  GLU  38           1HB      GLU  38  15.668   2.029  -0.322
  254    HB3  GLU  38           2HB      GLU  38  15.347   3.161   0.983
  255    HG2  GLU  38           1HG      GLU  38  15.021   1.123   1.999
  256    HG3  GLU  38           2HG      GLU  38  13.381   1.589   1.553
  257    H    LYS  39           H        LYS  39  14.154   2.999  -3.047
  258    HA   LYS  39           HA       LYS  39  12.472   0.596  -3.329
  259    HB2  LYS  39           1HB      LYS  39  12.574   3.061  -5.062
  260    HB3  LYS  39           2HB      LYS  39  11.901   1.539  -5.630
  261    HG2  LYS  39           1HG      LYS  39  10.091   1.653  -4.209
  262    HG3  LYS  39           2HG      LYS  39  10.912   2.733  -3.081
  263    HD2  LYS  39           1HD      LYS  39   9.417   4.159  -4.125
  264    HD3  LYS  39           2HD      LYS  39  10.887   4.406  -5.070
  265    HE2  LYS  39           1HE      LYS  39   8.989   2.286  -5.936
  266    HE3  LYS  39           2HE      LYS  39   8.548   3.969  -6.223
  267    HZ1  LYS  39           3HZ      LYS  39   9.715   3.617  -8.103
  268    HZ2  LYS  39           1HZ      LYS  39  10.644   2.365  -7.445
  269    HZ3  LYS  39           2HZ      LYS  39  11.041   3.976  -7.116
  270    H    CYS  40           H        CYS  40  13.390  -1.070  -4.348
  271    HA   CYS  40           HA       CYS  40  16.110  -0.869  -5.235
  272    HB2  CYS  40           1HB      CYS  40  14.970  -2.864  -4.061
  273    HB3  CYS  40           2HB      CYS  40  14.331  -3.261  -5.651
  274    HG   CYS  40           HG       CYS  40  17.469  -3.563  -4.467
  275    H    SER  41           H        SER  41  12.994  -1.518  -6.807
  276    HA   SER  41           HA       SER  41  13.582  -2.137  -9.331
  277    HB2  SER  41           1HB      SER  41  11.666  -0.769 -10.089
  278    HB3  SER  41           2HB      SER  41  11.297  -1.650  -8.607
  279    HG   SER  41           HG       SER  41  10.662   0.316  -8.063
  280    H    GLY  42           H        GLY  42  15.067  -1.481 -10.729
  281    HA2  GLY  42           1HA      GLY  42  16.205   1.186 -10.512
  282    HA3  GLY  42           2HA      GLY  42  16.782  -0.116 -11.542
  283    HA   PRO  43           HA       PRO  43  14.955   1.798 -15.032
  284    HB2  PRO  43           1HB      PRO  43  14.267  -0.354 -16.537
  285    HB3  PRO  43           2HB      PRO  43  15.942   0.161 -16.307
  286    HG2  PRO  43           1HG      PRO  43  14.423  -2.016 -14.923
  287    HG3  PRO  43           2HG      PRO  43  16.084  -2.031 -15.545
  288    HD2  PRO  43           1HD      PRO  43  15.513  -1.671 -12.922
  289    HD3  PRO  43           2HD      PRO  43  16.916  -0.917 -13.706
  290    H    SER  44           H        SER  44  12.994   2.398 -15.922
  291    HA   SER  44           HA       SER  44  10.658   1.720 -14.377
  292    HB2  SER  44           1HB      SER  44  10.898   3.503 -16.813
  293    HB3  SER  44           2HB      SER  44   9.529   3.431 -15.703
  294    HG   SER  44           HG       SER  44  10.694   5.096 -14.954
  295    H    SER  45           H        SER  45   8.542   1.555 -15.841
  296    HA   SER  45           HA       SER  45   9.023  -0.558 -17.838
  297    HB2  SER  45           1HB      SER  45   7.040  -1.733 -17.044
  298    HB3  SER  45           2HB      SER  45   8.167  -1.501 -15.708
  299    HG   SER  45           HG       SER  45   6.116  -0.944 -15.016
  300    H    GLY  46           H        GLY  46   8.071  -0.271 -19.757
  301    HA2  GLY  46           1HA      GLY  46   6.474   2.115 -20.164
  302    HA3  GLY  46           2HA      GLY  46   7.081   1.038 -21.413
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1 -14.968 -37.489  -0.933
    2    HA2  GLY   1           1HA      GLY   1 -13.653 -36.351  -2.452
    3    HA3  GLY   1           2HA      GLY   1 -14.647 -37.208  -3.620
    4    H    SER   2           H        SER   2 -16.881 -36.127  -3.948
    5    HA   SER   2           HA       SER   2 -16.340 -33.327  -4.574
    6    HB2  SER   2           1HB      SER   2 -18.338 -33.479  -6.005
    7    HB3  SER   2           2HB      SER   2 -17.189 -34.764  -6.377
    8    HG   SER   2           HG       SER   2 -18.637 -36.174  -5.821
    9    H    SER   3           H        SER   3 -16.648 -33.675  -1.892
   10    HA   SER   3           HA       SER   3 -19.389 -33.180  -1.123
   11    HB2  SER   3           1HB      SER   3 -18.516 -33.049   1.154
   12    HB3  SER   3           2HB      SER   3 -17.858 -34.467   0.338
   13    HG   SER   3           HG       SER   3 -16.009 -33.031  -0.156
   14    H    GLY   4           H        GLY   4 -16.362 -31.332  -1.268
   15    HA2  GLY   4           1HA      GLY   4 -16.485 -29.027  -2.057
   16    HA3  GLY   4           2HA      GLY   4 -17.990 -28.871  -1.164
   17    H    SER   5           H        SER   5 -15.008 -27.767  -1.142
   18    HA   SER   5           HA       SER   5 -14.477 -28.091   1.712
   19    HB2  SER   5           1HB      SER   5 -12.888 -26.969  -0.588
   20    HB3  SER   5           2HB      SER   5 -12.404 -26.685   1.084
   21    HG   SER   5           HG       SER   5 -12.566 -29.123  -0.324
   22    H    SER   6           H        SER   6 -14.429 -26.400   3.170
   23    HA   SER   6           HA       SER   6 -16.147 -24.172   2.524
   24    HB2  SER   6           1HB      SER   6 -16.226 -25.418   4.715
   25    HB3  SER   6           2HB      SER   6 -14.674 -24.683   5.116
   26    HG   SER   6           HG       SER   6 -15.665 -22.648   4.960
   27    H    GLY   7           H        GLY   7 -15.398 -22.392   1.594
   28    HA2  GLY   7           1HA      GLY   7 -13.146 -20.984   2.670
   29    HA3  GLY   7           2HA      GLY   7 -12.789 -21.704   1.107
   30    H    SER   8           H        SER   8 -14.430 -19.183   2.789
   31    HA   SER   8           HA       SER   8 -14.898 -17.814   0.262
   32    HB2  SER   8           1HB      SER   8 -17.208 -17.349   0.659
   33    HB3  SER   8           2HB      SER   8 -17.006 -19.088   0.866
   34    HG   SER   8           HG       SER   8 -17.496 -17.105   2.779
   35    H    GLY   9           H        GLY   9 -15.465 -15.511   0.588
   36    HA2  GLY   9           1HA      GLY   9 -15.390 -14.191   3.039
   37    HA3  GLY   9           2HA      GLY   9 -13.729 -14.317   2.480
   38    H    GLU  10           H        GLU  10 -13.717 -11.993   2.404
   39    HA   GLU  10           HA       GLU  10 -15.057 -10.943  -0.002
   40    HB2  GLU  10           1HB      GLU  10 -15.910 -10.038   2.200
   41    HB3  GLU  10           2HB      GLU  10 -14.323  -9.318   2.433
   42    HG2  GLU  10           1HG      GLU  10 -14.607  -7.998   0.411
   43    HG3  GLU  10           2HG      GLU  10 -16.183  -8.739   0.138
   44    H    LYS  11           H        LYS  11 -13.906  -9.403  -1.242
   45    HA   LYS  11           HA       LYS  11 -11.065  -9.871  -1.284
   46    HB2  LYS  11           1HB      LYS  11 -12.941  -8.271  -3.014
   47    HB3  LYS  11           2HB      LYS  11 -11.198  -8.224  -3.246
   48    HG2  LYS  11           1HG      LYS  11 -11.106 -10.348  -4.062
   49    HG3  LYS  11           2HG      LYS  11 -12.515 -10.882  -3.142
   50    HD2  LYS  11           1HD      LYS  11 -12.920  -8.837  -5.262
   51    HD3  LYS  11           2HD      LYS  11 -12.617 -10.502  -5.763
   52    HE2  LYS  11           1HE      LYS  11 -14.887 -10.579  -5.583
   53    HE3  LYS  11           2HE      LYS  11 -14.457 -10.999  -3.925
   54    HZ1  LYS  11           3HZ      LYS  11 -14.900  -8.808  -3.208
   55    HZ2  LYS  11           1HZ      LYS  11 -16.213  -9.254  -4.177
   56    HZ3  LYS  11           2HZ      LYS  11 -15.022  -8.221  -4.790
   57    H    SER  12           H        SER  12  -9.727  -8.800   0.002
   58    HA   SER  12           HA       SER  12 -10.232  -5.936   0.475
   59    HB2  SER  12           1HB      SER  12  -9.216  -8.011   2.425
   60    HB3  SER  12           2HB      SER  12  -9.124  -6.275   2.718
   61    HG   SER  12           HG       SER  12 -11.549  -7.605   2.111
   62    H    HIS  13           H        HIS  13  -8.394  -4.595   0.681
   63    HA   HIS  13           HA       HIS  13  -6.113  -5.552  -0.843
   64    HB2  HIS  13           1HB      HIS  13  -6.583  -2.780   0.264
   65    HB3  HIS  13           2HB      HIS  13  -5.455  -3.243  -1.006
   66    HD1  HIS  13           HD1      HIS  13  -6.495  -3.840  -3.343
   67    HD2  HIS  13           HD2      HIS  13  -9.182  -2.321  -0.562
   68    HE1  HIS  13           HE1      HIS  13  -8.539  -3.202  -4.662
   69    H    THR  14           H        THR  14  -4.466  -6.478   0.162
   70    HA   THR  14           HA       THR  14  -3.855  -5.680   2.927
   71    HB   THR  14           HB       THR  14  -3.126  -8.207   1.434
   72    HG1  THR  14           HG1      THR  14  -5.346  -7.669   2.507
   73   HG21  THR  14          3HG2      THR  14  -1.423  -7.313   3.124
   74   HG22  THR  14          1HG2      THR  14  -1.991  -8.967   3.349
   75   HG23  THR  14          2HG2      THR  14  -2.637  -7.668   4.352
   76    H    CYS  15           H        CYS  15  -1.982  -4.709   3.401
   77    HA   CYS  15           HA       CYS  15  -0.277  -3.778   1.335
   78    HB2  CYS  15           1HB      CYS  15  -0.717  -2.594   3.505
   79    HB3  CYS  15           2HB      CYS  15   0.289  -3.798   4.304
   80    H    ASP  16           H        ASP  16   1.468  -4.669   0.450
   81    HA   ASP  16           HA       ASP  16   2.365  -7.259   1.390
   82    HB2  ASP  16           1HB      ASP  16   2.008  -6.685  -1.050
   83    HB3  ASP  16           2HB      ASP  16   3.448  -5.675  -0.943
   84    H    GLU  17           H        GLU  17   3.162  -4.079   2.018
   85    HA   GLU  17           HA       GLU  17   6.007  -4.380   2.265
   86    HB2  GLU  17           1HB      GLU  17   4.255  -2.246   3.490
   87    HB3  GLU  17           2HB      GLU  17   5.987  -2.160   3.203
   88    HG2  GLU  17           1HG      GLU  17   4.106  -2.566   0.921
   89    HG3  GLU  17           2HG      GLU  17   4.360  -0.957   1.595
   90    H    CYS  18           H        CYS  18   3.253  -4.368   4.491
   91    HA   CYS  18           HA       CYS  18   5.020  -5.522   6.547
   92    HB2  CYS  18           1HB      CYS  18   3.582  -4.408   8.250
   93    HB3  CYS  18           2HB      CYS  18   4.465  -3.274   7.233
   94    H    GLY  19           H        GLY  19   1.767  -5.365   5.186
   95    HA2  GLY  19           1HA      GLY  19   0.727  -7.589   4.813
   96    HA3  GLY  19           2HA      GLY  19   1.211  -7.975   6.458
   97    H    LYS  20           H        LYS  20   0.233  -4.772   6.212
   98    HA   LYS  20           HA       LYS  20  -1.969  -5.090   7.916
   99    HB2  LYS  20           1HB      LYS  20  -0.921  -2.852   6.233
  100    HB3  LYS  20           2HB      LYS  20  -2.515  -2.693   6.960
  101    HG2  LYS  20           1HG      LYS  20  -0.264  -3.530   8.705
  102    HG3  LYS  20           2HG      LYS  20  -0.337  -1.847   8.180
  103    HD2  LYS  20           1HD      LYS  20  -2.623  -1.683   9.062
  104    HD3  LYS  20           2HD      LYS  20  -2.528  -3.361   9.603
  105    HE2  LYS  20           1HE      LYS  20  -0.589  -1.240  10.496
  106    HE3  LYS  20           2HE      LYS  20  -2.089  -1.585  11.355
  107    HZ1  LYS  20           3HZ      LYS  20  -0.628  -2.930  12.456
  108    HZ2  LYS  20           1HZ      LYS  20   0.321  -3.237  11.089
  109    HZ3  LYS  20           2HZ      LYS  20  -1.173  -4.009  11.273
  110    H    ASN  21           H        ASN  21  -4.208  -4.195   7.331
  111    HA   ASN  21           HA       ASN  21  -5.037  -5.223   4.699
  112    HB2  ASN  21           1HB      ASN  21  -5.594  -6.726   6.692
  113    HB3  ASN  21           2HB      ASN  21  -6.723  -5.469   7.187
  114   HD21  ASN  21          1HD2      ASN  21  -5.912  -7.708   4.606
  115   HD22  ASN  21          2HD2      ASN  21  -7.506  -7.818   3.949
  116    H    PHE  22           H        PHE  22  -6.676  -4.124   3.649
  117    HA   PHE  22           HA       PHE  22  -7.981  -1.884   4.946
  118    HB2  PHE  22           1HB      PHE  22  -6.300  -1.401   2.481
  119    HB3  PHE  22           2HB      PHE  22  -7.198  -0.203   3.407
  120    HD1  PHE  22           HD2      PHE  22  -4.218  -2.327   3.325
  121    HD2  PHE  22           HD1      PHE  22  -6.345   0.666   5.478
  122    HE1  PHE  22           HE2      PHE  22  -2.222  -1.902   4.700
  123    HE2  PHE  22           HE1      PHE  22  -4.353   1.096   6.856
  124    HZ   PHE  22           HZ       PHE  22  -2.288  -0.190   6.469
  125    H    CYS  23           H        CYS  23 -10.033  -2.251   4.435
  126    HA   CYS  23           HA       CYS  23 -10.971  -3.801   2.332
  127    HB2  CYS  23           1HB      CYS  23 -12.170  -2.836   4.461
  128    HB3  CYS  23           2HB      CYS  23 -12.622  -1.529   3.373
  129    HG   CYS  23           HG       CYS  23 -13.860  -3.316   1.525
  130    H    TYR  24           H        TYR  24 -10.455  -0.309   2.504
  131    HA   TYR  24           HA       TYR  24 -11.171  -0.089  -0.337
  132    HB2  TYR  24           1HB      TYR  24 -10.886   2.469   0.369
  133    HB3  TYR  24           2HB      TYR  24 -12.385   1.586   0.637
  134    HD1  TYR  24           HD2      TYR  24 -12.631   0.425   2.952
  135    HD2  TYR  24           HD1      TYR  24  -9.849   3.543   2.150
  136    HE1  TYR  24           HE2      TYR  24 -12.493   0.912   5.359
  137    HE2  TYR  24           HE1      TYR  24  -9.702   4.038   4.555
  138    HH   TYR  24           HH       TYR  24 -10.812   1.971   6.928
  139    H    ILE  25           H        ILE  25  -9.594   0.010  -1.778
  140    HA   ILE  25           HA       ILE  25  -6.913  -0.172  -1.321
  141    HB   ILE  25           HB       ILE  25  -8.101  -0.355  -3.550
  142   HG12  ILE  25          1HG1      ILE  25  -6.103   0.412  -4.834
  143   HG13  ILE  25          2HG1      ILE  25  -5.520   1.215  -3.380
  144   HG21  ILE  25          1HG2      ILE  25  -8.349   1.589  -4.915
  145   HG22  ILE  25          2HG2      ILE  25  -9.171   1.895  -3.385
  146   HG23  ILE  25          3HG2      ILE  25  -7.589   2.609  -3.694
  147   HD11  ILE  25          3HD1      ILE  25  -6.115  -1.488  -2.740
  148   HD12  ILE  25          1HD1      ILE  25  -5.118  -1.454  -4.194
  149   HD13  ILE  25          2HD1      ILE  25  -4.558  -0.659  -2.722
  150    H    SER  26           H        SER  26  -8.756   2.831  -1.782
  151    HA   SER  26           HA       SER  26  -6.833   4.731  -1.821
  152    HB2  SER  26           1HB      SER  26  -9.421   4.766  -0.257
  153    HB3  SER  26           2HB      SER  26  -8.416   6.192  -0.511
  154    HG   SER  26           HG       SER  26  -8.766   6.016  -2.712
  155    H    ALA  27           H        ALA  27  -8.074   3.163   1.116
  156    HA   ALA  27           HA       ALA  27  -6.565   4.545   2.998
  157    HB1  ALA  27           3HB      ALA  27  -8.147   2.130   2.929
  158    HB2  ALA  27           1HB      ALA  27  -6.742   1.949   3.980
  159    HB3  ALA  27           2HB      ALA  27  -7.883   3.267   4.252
  160    H    LEU  28           H        LEU  28  -5.807   1.379   1.530
  161    HA   LEU  28           HA       LEU  28  -3.363   0.896   2.642
  162    HB2  LEU  28           1HB      LEU  28  -4.224  -0.773   1.265
  163    HB3  LEU  28           2HB      LEU  28  -4.452   0.332  -0.089
  164    HG   LEU  28           HG       LEU  28  -1.976   0.417  -0.353
  165   HD11  LEU  28          1HD1      LEU  28  -0.702  -0.322   1.304
  166   HD12  LEU  28          2HD1      LEU  28  -1.221  -1.961   0.910
  167   HD13  LEU  28          3HD1      LEU  28  -2.093  -1.029   2.127
  168   HD21  LEU  28          3HD2      LEU  28  -1.942  -2.209  -0.937
  169   HD22  LEU  28          1HD2      LEU  28  -2.755  -0.998  -1.929
  170   HD23  LEU  28          2HD2      LEU  28  -3.679  -1.955  -0.771
  171    H    ARG  29           H        ARG  29  -3.982   2.828  -0.279
  172    HA   ARG  29           HA       ARG  29  -1.365   3.481  -0.920
  173    HB2  ARG  29           1HB      ARG  29  -3.749   5.316  -1.203
  174    HB3  ARG  29           2HB      ARG  29  -2.266   5.358  -2.147
  175    HG2  ARG  29           1HG      ARG  29  -4.207   3.059  -2.140
  176    HG3  ARG  29           2HG      ARG  29  -4.194   4.357  -3.336
  177    HD2  ARG  29           1HD      ARG  29  -1.884   2.505  -2.761
  178    HD3  ARG  29           2HD      ARG  29  -3.016   2.323  -4.101
  179    HE   ARG  29           HE       ARG  29  -0.864   4.244  -3.881
  180   HH11  ARG  29          1HH1      ARG  29  -3.809   3.337  -5.502
  181   HH12  ARG  29          2HH1      ARG  29  -3.471   4.274  -6.919
  182   HH21  ARG  29          1HH2      ARG  29  -0.408   5.482  -5.742
  183   HH22  ARG  29          2HH2      ARG  29  -1.536   5.493  -7.055
  184    H    ILE  30           H        ILE  30  -3.591   5.106   1.309
  185    HA   ILE  30           HA       ILE  30  -1.886   7.255   1.962
  186    HB   ILE  30           HB       ILE  30  -4.096   6.008   3.600
  187   HG12  ILE  30          1HG1      ILE  30  -4.265   8.579   2.056
  188   HG13  ILE  30          2HG1      ILE  30  -4.541   7.039   1.250
  189   HG21  ILE  30          1HG2      ILE  30  -3.039   8.799   3.906
  190   HG22  ILE  30          2HG2      ILE  30  -4.054   7.873   5.010
  191   HG23  ILE  30          3HG2      ILE  30  -2.355   7.446   4.807
  192   HD11  ILE  30          3HD1      ILE  30  -6.116   8.280   3.479
  193   HD12  ILE  30          1HD1      ILE  30  -6.658   7.845   1.859
  194   HD13  ILE  30          2HD1      ILE  30  -6.278   6.582   3.030
  195    H    HIS  31           H        HIS  31  -2.240   4.012   3.273
  196    HA   HIS  31           HA       HIS  31  -0.541   4.458   5.530
  197    HB2  HIS  31           1HB      HIS  31  -1.950   2.680   5.929
  198    HB3  HIS  31           2HB      HIS  31  -1.851   2.091   4.272
  199    HD1  HIS  31           HD1      HIS  31   0.123   2.103   7.492
  200    HD2  HIS  31           HD2      HIS  31   0.008   0.117   3.844
  201    HE1  HIS  31           HE1      HIS  31   1.732   0.184   7.720
  202    H    GLN  32           H        GLN  32  -0.103   3.212   2.269
  203    HA   GLN  32           HA       GLN  32   2.424   2.102   2.482
  204    HB2  GLN  32           1HB      GLN  32   0.984   3.477   0.238
  205    HB3  GLN  32           2HB      GLN  32   2.645   2.941   0.026
  206    HG2  GLN  32           1HG      GLN  32   1.819   0.657   0.813
  207    HG3  GLN  32           2HG      GLN  32   0.198   1.291   0.536
  208   HE21  GLN  32          1HE2      GLN  32   0.034   2.446  -1.681
  209   HE22  GLN  32          2HE2      GLN  32   0.672   1.555  -3.017
  210    H    ARG  33           H        ARG  33   1.469   5.418   2.594
  211    HA   ARG  33           HA       ARG  33   3.823   6.694   1.807
  212    HB2  ARG  33           1HB      ARG  33   1.818   7.540   3.906
  213    HB3  ARG  33           2HB      ARG  33   3.039   8.588   3.198
  214    HG2  ARG  33           1HG      ARG  33   2.002   8.183   0.972
  215    HG3  ARG  33           2HG      ARG  33   0.711   7.302   1.792
  216    HD2  ARG  33           1HD      ARG  33   0.009   9.576   1.372
  217    HD3  ARG  33           2HD      ARG  33   0.203   9.324   3.106
  218    HE   ARG  33           HE       ARG  33   2.606  10.333   2.226
  219   HH11  ARG  33          1HH1      ARG  33  -0.717  11.368   2.230
  220   HH12  ARG  33          2HH1      ARG  33  -0.328  13.055   2.308
  221   HH21  ARG  33          1HH2      ARG  33   3.132  12.550   2.328
  222   HH22  ARG  33          2HH2      ARG  33   1.862  13.726   2.362
  223    H    VAL  34           H        VAL  34   3.012   5.024   4.749
  224    HA   VAL  34           HA       VAL  34   5.061   6.101   6.388
  225    HB   VAL  34           HB       VAL  34   4.607   4.316   7.918
  226   HG11  VAL  34          1HG1      VAL  34   2.835   6.129   7.384
  227   HG12  VAL  34          2HG1      VAL  34   1.922   4.789   6.686
  228   HG13  VAL  34          3HG1      VAL  34   2.381   4.753   8.389
  229   HG21  VAL  34          3HG2      VAL  34   4.517   2.294   6.909
  230   HG22  VAL  34          1HG2      VAL  34   2.781   2.601   6.947
  231   HG23  VAL  34          2HG2      VAL  34   3.701   2.923   5.477
  232    H    HIS  35           H        HIS  35   4.965   3.548   4.018
  233    HA   HIS  35           HA       HIS  35   7.517   2.441   4.799
  234    HB2  HIS  35           1HB      HIS  35   5.730   1.911   2.418
  235    HB3  HIS  35           2HB      HIS  35   7.231   1.046   2.738
  236    HD1  HIS  35           HD1      HIS  35   7.253  -0.368   5.033
  237    HD2  HIS  35           HD2      HIS  35   3.535   0.898   3.680
  238    HE1  HIS  35           HE1      HIS  35   5.574  -1.780   6.263
  239    H    MET  36           H        MET  36   6.995   5.305   3.701
  240    HA   MET  36           HA       MET  36   8.755   5.307   1.382
  241    HB2  MET  36           1HB      MET  36   7.336   7.574   2.793
  242    HB3  MET  36           2HB      MET  36   8.272   7.733   1.312
  243    HG2  MET  36           1HG      MET  36   5.787   6.068   1.643
  244    HG3  MET  36           2HG      MET  36   5.871   7.655   0.882
  245    HE1  MET  36           3HE      MET  36   5.637   6.280  -2.550
  246    HE2  MET  36           1HE      MET  36   4.639   6.692  -1.155
  247    HE3  MET  36           2HE      MET  36   5.895   7.803  -1.699
  248    H    GLY  37           H        GLY  37  10.825   4.934   1.996
  249    HA2  GLY  37           1HA      GLY  37  11.914   6.306   4.330
  250    HA3  GLY  37           2HA      GLY  37  12.723   5.070   3.377
  251    H    GLU  38           H        GLU  38  13.908   7.499   4.233
  252    HA   GLU  38           HA       GLU  38  13.923   9.379   2.074
  253    HB2  GLU  38           1HB      GLU  38  14.550   9.655   4.632
  254    HB3  GLU  38           2HB      GLU  38  16.156   9.241   4.049
  255    HG2  GLU  38           1HG      GLU  38  14.594  11.395   2.700
  256    HG3  GLU  38           2HG      GLU  38  15.436  11.725   4.213
  257    H    LYS  39           H        LYS  39  16.360   7.092   3.319
  258    HA   LYS  39           HA       LYS  39  17.596   7.105   0.643
  259    HB2  LYS  39           1HB      LYS  39  18.936   8.015   2.629
  260    HB3  LYS  39           2HB      LYS  39  19.012   6.351   3.193
  261    HG2  LYS  39           1HG      LYS  39  20.356   5.676   1.435
  262    HG3  LYS  39           2HG      LYS  39  19.885   7.041   0.420
  263    HD2  LYS  39           1HD      LYS  39  22.086   7.508   1.121
  264    HD3  LYS  39           2HD      LYS  39  21.048   8.520   2.128
  265    HE2  LYS  39           1HE      LYS  39  21.254   6.997   3.970
  266    HE3  LYS  39           2HE      LYS  39  22.109   5.827   2.968
  267    HZ1  LYS  39           3HZ      LYS  39  23.516   8.211   2.798
  268    HZ2  LYS  39           1HZ      LYS  39  23.988   6.789   3.585
  269    HZ3  LYS  39           2HZ      LYS  39  23.159   7.992   4.437
  270    H    CYS  40           H        CYS  40  16.858   5.092   3.468
  271    HA   CYS  40           HA       CYS  40  16.869   2.798   3.707
  272    HB2  CYS  40           1HB      CYS  40  15.118   1.768   2.401
  273    HB3  CYS  40           2HB      CYS  40  14.628   3.408   2.806
  274    HG   CYS  40           HG       CYS  40  15.715   4.227   0.144
  275    H    SER  41           H        SER  41  19.220   3.601   2.415
  276    HA   SER  41           HA       SER  41  19.584   1.621   0.279
  277    HB2  SER  41           1HB      SER  41  20.272   3.984  -0.157
  278    HB3  SER  41           2HB      SER  41  21.467   3.833   1.131
  279    HG   SER  41           HG       SER  41  22.674   2.589  -0.109
  280    H    GLY  42           H        GLY  42  19.721  -0.238   1.566
  281    HA2  GLY  42           1HA      GLY  42  22.102  -1.285   2.220
  282    HA3  GLY  42           2HA      GLY  42  21.716  -0.370   3.670
  283    HA   PRO  43           HA       PRO  43  18.479  -3.971   3.153
  284    HB2  PRO  43           1HB      PRO  43  19.372  -6.060   1.668
  285    HB3  PRO  43           2HB      PRO  43  18.447  -4.720   0.982
  286    HG2  PRO  43           1HG      PRO  43  21.404  -5.187   0.961
  287    HG3  PRO  43           2HG      PRO  43  20.351  -4.622  -0.350
  288    HD2  PRO  43           1HD      PRO  43  21.883  -2.939   1.117
  289    HD3  PRO  43           2HD      PRO  43  20.311  -2.459   0.446
  290    H    SER  44           H        SER  44  19.292  -4.056   5.333
  291    HA   SER  44           HA       SER  44  20.579  -6.589   5.917
  292    HB2  SER  44           1HB      SER  44  21.752  -4.012   6.987
  293    HB3  SER  44           2HB      SER  44  22.327  -5.646   7.315
  294    HG   SER  44           HG       SER  44  23.589  -5.159   5.677
  295    H    SER  45           H        SER  45  20.534  -7.081   8.260
  296    HA   SER  45           HA       SER  45  18.267  -5.729   9.573
  297    HB2  SER  45           1HB      SER  45  18.027  -8.191   8.747
  298    HB3  SER  45           2HB      SER  45  19.014  -8.580  10.156
  299    HG   SER  45           HG       SER  45  16.834  -6.889  10.544
  300    H    GLY  46           H        GLY  46  21.223  -7.613  10.203
  301    HA2  GLY  46           1HA      GLY  46  22.929  -6.966  11.697
  302    HA3  GLY  46           2HA      GLY  46  21.812  -5.835  12.447
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1  -5.532 -28.444 -25.407
    2    HA2  GLY   1           1HA      GLY   1  -3.558 -26.755 -25.487
    3    HA3  GLY   1           2HA      GLY   1  -5.103 -26.175 -24.883
    4    H    SER   2           H        SER   2  -4.605 -24.797 -23.294
    5    HA   SER   2           HA       SER   2  -3.057 -25.845 -21.036
    6    HB2  SER   2           1HB      SER   2  -2.484 -23.365 -22.613
    7    HB3  SER   2           2HB      SER   2  -2.150 -23.375 -20.881
    8    HG   SER   2           HG       SER   2  -0.991 -24.905 -22.931
    9    H    SER   3           H        SER   3  -3.259 -24.290 -19.109
   10    HA   SER   3           HA       SER   3  -6.089 -23.767 -18.744
   11    HB2  SER   3           1HB      SER   3  -4.471 -24.910 -17.054
   12    HB3  SER   3           2HB      SER   3  -3.986 -23.262 -16.656
   13    HG   SER   3           HG       SER   3  -5.652 -23.403 -15.362
   14    H    GLY   4           H        GLY   4  -6.917 -21.770 -17.914
   15    HA2  GLY   4           1HA      GLY   4  -5.273 -19.413 -17.882
   16    HA3  GLY   4           2HA      GLY   4  -6.288 -19.510 -19.313
   17    H    SER   5           H        SER   5  -6.157 -17.917 -16.608
   18    HA   SER   5           HA       SER   5  -9.043 -18.126 -16.047
   19    HB2  SER   5           1HB      SER   5  -6.713 -17.574 -14.229
   20    HB3  SER   5           2HB      SER   5  -8.331 -17.016 -13.806
   21    HG   SER   5           HG       SER   5  -9.038 -19.173 -13.930
   22    H    SER   6           H        SER   6 -10.177 -16.171 -15.607
   23    HA   SER   6           HA       SER   6  -8.873 -13.636 -16.079
   24    HB2  SER   6           1HB      SER   6  -9.412 -14.652 -18.371
   25    HB3  SER   6           2HB      SER   6 -11.107 -14.397 -17.958
   26    HG   SER   6           HG       SER   6  -9.377 -12.243 -17.615
   27    H    GLY   7           H        GLY   7  -9.695 -12.388 -14.542
   28    HA2  GLY   7           1HA      GLY   7 -12.336 -11.602 -14.337
   29    HA3  GLY   7           2HA      GLY   7 -12.161 -12.960 -13.235
   30    H    SER   8           H        SER   8 -12.894 -10.725 -12.064
   31    HA   SER   8           HA       SER   8 -10.453  -9.464 -11.015
   32    HB2  SER   8           1HB      SER   8 -11.784  -7.589 -10.380
   33    HB3  SER   8           2HB      SER   8 -12.284  -8.016 -12.016
   34    HG   SER   8           HG       SER   8 -13.990  -9.278 -10.922
   35    H    GLY   9           H        GLY   9 -10.492  -8.905  -8.675
   36    HA2  GLY   9           1HA      GLY   9 -12.019 -10.865  -7.088
   37    HA3  GLY   9           2HA      GLY   9 -10.283 -10.705  -6.869
   38    H    GLU  10           H        GLU  10 -12.852 -10.126  -5.225
   39    HA   GLU  10           HA       GLU  10 -11.960  -7.480  -4.285
   40    HB2  GLU  10           1HB      GLU  10 -14.194  -6.831  -3.822
   41    HB3  GLU  10           2HB      GLU  10 -14.203  -7.488  -5.453
   42    HG2  GLU  10           1HG      GLU  10 -14.947  -9.676  -4.411
   43    HG3  GLU  10           2HG      GLU  10 -15.228  -8.754  -2.935
   44    H    LYS  11           H        LYS  11 -11.210  -7.501  -2.281
   45    HA   LYS  11           HA       LYS  11 -12.470  -8.794  -0.117
   46    HB2  LYS  11           1HB      LYS  11 -11.504 -10.798  -1.236
   47    HB3  LYS  11           2HB      LYS  11  -9.902 -10.103  -1.029
   48    HG2  LYS  11           1HG      LYS  11 -10.068 -11.583   0.740
   49    HG3  LYS  11           2HG      LYS  11 -10.493 -10.036   1.477
   50    HD2  LYS  11           1HD      LYS  11 -12.200 -11.318   2.285
   51    HD3  LYS  11           2HD      LYS  11 -12.933 -10.787   0.770
   52    HE2  LYS  11           1HE      LYS  11 -11.963 -12.910  -0.250
   53    HE3  LYS  11           2HE      LYS  11 -11.657 -13.435   1.404
   54    HZ1  LYS  11           3HZ      LYS  11 -13.741 -14.132   1.495
   55    HZ2  LYS  11           1HZ      LYS  11 -14.064 -13.531  -0.053
   56    HZ3  LYS  11           2HZ      LYS  11 -14.286 -12.543   1.301
   57    H    SER  12           H        SER  12 -11.533  -8.266   1.883
   58    HA   SER  12           HA       SER  12 -10.431  -5.850   2.256
   59    HB2  SER  12           1HB      SER  12  -9.460  -6.701   4.401
   60    HB3  SER  12           2HB      SER  12 -11.136  -7.186   4.144
   61    HG   SER  12           HG       SER  12  -9.957  -8.969   4.815
   62    H    HIS  13           H        HIS  13  -8.772  -4.956   1.220
   63    HA   HIS  13           HA       HIS  13  -6.569  -6.362   0.168
   64    HB2  HIS  13           1HB      HIS  13  -6.623  -3.417   0.834
   65    HB3  HIS  13           2HB      HIS  13  -5.659  -4.221  -0.401
   66    HD1  HIS  13           HD1      HIS  13  -6.758  -4.659  -2.653
   67    HD2  HIS  13           HD2      HIS  13  -9.364  -3.073   0.168
   68    HE1  HIS  13           HE1      HIS  13  -8.831  -4.030  -3.930
   69    H    THR  14           H        THR  14  -4.419  -6.484   0.835
   70    HA   THR  14           HA       THR  14  -3.867  -5.702   3.616
   71    HB   THR  14           HB       THR  14  -3.184  -8.378   2.382
   72    HG1  THR  14           HG1      THR  14  -5.281  -8.443   3.080
   73   HG21  THR  14          3HG2      THR  14  -1.683  -7.036   4.220
   74   HG22  THR  14          1HG2      THR  14  -1.756  -8.791   4.074
   75   HG23  THR  14          2HG2      THR  14  -2.766  -7.962   5.258
   76    H    CYS  15           H        CYS  15  -1.954  -4.732   3.916
   77    HA   CYS  15           HA       CYS  15  -0.325  -4.081   1.672
   78    HB2  CYS  15           1HB      CYS  15  -0.695  -2.582   3.639
   79    HB3  CYS  15           2HB      CYS  15   0.294  -3.674   4.604
   80    H    ASP  16           H        ASP  16   1.300  -5.196   0.833
   81    HA   ASP  16           HA       ASP  16   2.235  -7.604   2.106
   82    HB2  ASP  16           1HB      ASP  16   1.861  -7.139  -0.435
   83    HB3  ASP  16           2HB      ASP  16   3.474  -6.435  -0.364
   84    H    GLU  17           H        GLU  17   3.125  -4.354   2.194
   85    HA   GLU  17           HA       GLU  17   5.948  -4.651   2.467
   86    HB2  GLU  17           1HB      GLU  17   4.209  -2.393   3.472
   87    HB3  GLU  17           2HB      GLU  17   5.943  -2.339   3.186
   88    HG2  GLU  17           1HG      GLU  17   4.153  -3.043   0.921
   89    HG3  GLU  17           2HG      GLU  17   4.231  -1.364   1.450
   90    H    CYS  18           H        CYS  18   3.256  -4.394   4.750
   91    HA   CYS  18           HA       CYS  18   5.080  -5.313   6.873
   92    HB2  CYS  18           1HB      CYS  18   3.675  -4.022   8.480
   93    HB3  CYS  18           2HB      CYS  18   4.537  -3.007   7.329
   94    H    GLY  19           H        GLY  19   1.737  -5.233   5.699
   95    HA2  GLY  19           1HA      GLY  19   0.651  -7.457   5.548
   96    HA3  GLY  19           2HA      GLY  19   1.275  -7.759   7.163
   97    H    LYS  20           H        LYS  20   0.066  -4.611   6.382
   98    HA   LYS  20           HA       LYS  20  -1.895  -4.754   8.450
   99    HB2  LYS  20           1HB      LYS  20  -0.996  -2.691   6.492
  100    HB3  LYS  20           2HB      LYS  20  -2.559  -2.472   7.269
  101    HG2  LYS  20           1HG      LYS  20  -0.138  -3.051   8.919
  102    HG3  LYS  20           2HG      LYS  20  -0.439  -1.418   8.319
  103    HD2  LYS  20           1HD      LYS  20  -2.539  -1.313   9.454
  104    HD3  LYS  20           2HD      LYS  20  -2.459  -3.026   9.876
  105    HE2  LYS  20           1HE      LYS  20  -0.393  -1.047  10.798
  106    HE3  LYS  20           2HE      LYS  20  -1.878  -1.342  11.701
  107    HZ1  LYS  20           3HZ      LYS  20  -0.891  -3.081  12.620
  108    HZ2  LYS  20           1HZ      LYS  20   0.495  -2.856  11.677
  109    HZ3  LYS  20           2HZ      LYS  20  -0.770  -3.821  11.104
  110    H    ASN  21           H        ASN  21  -4.132  -3.573   7.694
  111    HA   ASN  21           HA       ASN  21  -5.180  -5.027   5.372
  112    HB2  ASN  21           1HB      ASN  21  -5.619  -6.175   7.666
  113    HB3  ASN  21           2HB      ASN  21  -6.792  -4.883   7.903
  114   HD21  ASN  21          1HD2      ASN  21  -5.817  -7.150   5.350
  115   HD22  ASN  21          2HD2      ASN  21  -7.425  -7.591   4.895
  116    H    PHE  22           H        PHE  22  -6.830  -4.007   4.276
  117    HA   PHE  22           HA       PHE  22  -8.043  -1.611   5.354
  118    HB2  PHE  22           1HB      PHE  22  -6.435  -1.421   2.802
  119    HB3  PHE  22           2HB      PHE  22  -7.280  -0.116   3.627
  120    HD1  PHE  22           HD2      PHE  22  -4.356  -2.328   3.707
  121    HD2  PHE  22           HD1      PHE  22  -6.328   0.973   5.533
  122    HE1  PHE  22           HE2      PHE  22  -2.308  -1.805   4.965
  123    HE2  PHE  22           HE1      PHE  22  -4.282   1.501   6.794
  124    HZ   PHE  22           HZ       PHE  22  -2.269   0.111   6.512
  125    H    CYS  23           H        CYS  23 -10.116  -1.976   4.939
  126    HA   CYS  23           HA       CYS  23 -11.168  -3.735   3.084
  127    HB2  CYS  23           1HB      CYS  23 -12.325  -1.321   4.455
  128    HB3  CYS  23           2HB      CYS  23 -13.283  -2.263   3.320
  129    HG   CYS  23           HG       CYS  23 -11.917  -3.411   6.240
  130    H    TYR  24           H        TYR  24 -10.535  -0.271   2.746
  131    HA   TYR  24           HA       TYR  24 -11.232  -0.466  -0.105
  132    HB2  TYR  24           1HB      TYR  24 -10.987   2.170   0.223
  133    HB3  TYR  24           2HB      TYR  24 -12.482   1.318   0.592
  134    HD1  TYR  24           HD2      TYR  24 -12.627   0.405   3.079
  135    HD2  TYR  24           HD1      TYR  24 -10.131   3.609   1.813
  136    HE1  TYR  24           HE2      TYR  24 -12.540   1.242   5.390
  137    HE2  TYR  24           HE1      TYR  24 -10.036   4.455   4.121
  138    HH   TYR  24           HH       TYR  24 -10.595   4.086   6.241
  139    H    ILE  25           H        ILE  25  -9.663  -0.428  -1.567
  140    HA   ILE  25           HA       ILE  25  -6.976  -0.561  -1.034
  141    HB   ILE  25           HB       ILE  25  -8.279  -0.926  -3.264
  142   HG12  ILE  25          1HG1      ILE  25  -6.027  -0.353  -4.504
  143   HG13  ILE  25          2HG1      ILE  25  -5.446  -0.037  -2.872
  144   HG21  ILE  25          1HG2      ILE  25  -8.162   0.837  -4.859
  145   HG22  ILE  25          2HG2      ILE  25  -8.919   1.493  -3.408
  146   HG23  ILE  25          3HG2      ILE  25  -7.228   1.851  -3.759
  147   HD11  ILE  25          3HD1      ILE  25  -6.766  -2.617  -3.647
  148   HD12  ILE  25          1HD1      ILE  25  -5.030  -2.345  -3.794
  149   HD13  ILE  25          2HD1      ILE  25  -5.805  -2.266  -2.211
  150    H    SER  26           H        SER  26  -8.909   2.321  -1.696
  151    HA   SER  26           HA       SER  26  -7.001   4.245  -2.030
  152    HB2  SER  26           1HB      SER  26  -9.235   4.964  -2.187
  153    HB3  SER  26           2HB      SER  26  -9.648   4.321  -0.597
  154    HG   SER  26           HG       SER  26  -8.295   5.952   0.303
  155    H    ALA  27           H        ALA  27  -8.203   2.997   1.073
  156    HA   ALA  27           HA       ALA  27  -6.666   4.616   2.754
  157    HB1  ALA  27           3HB      ALA  27  -8.437   2.437   3.046
  158    HB2  ALA  27           1HB      ALA  27  -6.966   2.037   3.934
  159    HB3  ALA  27           2HB      ALA  27  -7.835   3.530   4.293
  160    H    LEU  28           H        LEU  28  -5.977   1.356   1.500
  161    HA   LEU  28           HA       LEU  28  -3.526   0.948   2.735
  162    HB2  LEU  28           1HB      LEU  28  -4.373  -0.918   1.682
  163    HB3  LEU  28           2HB      LEU  28  -4.768  -0.035   0.208
  164    HG   LEU  28           HG       LEU  28  -2.317   0.070  -0.288
  165   HD11  LEU  28          1HD1      LEU  28  -2.234  -1.615   2.187
  166   HD12  LEU  28          2HD1      LEU  28  -1.239  -0.227   1.750
  167   HD13  LEU  28          3HD1      LEU  28  -1.003  -1.772   0.934
  168   HD21  LEU  28          3HD2      LEU  28  -3.696  -2.595  -0.048
  169   HD22  LEU  28          1HD2      LEU  28  -2.164  -2.370  -0.891
  170   HD23  LEU  28          2HD2      LEU  28  -3.611  -1.536  -1.457
  171    H    ARG  29           H        ARG  29  -4.251   2.561  -0.336
  172    HA   ARG  29           HA       ARG  29  -1.624   3.001  -1.183
  173    HB2  ARG  29           1HB      ARG  29  -3.960   4.857  -1.652
  174    HB3  ARG  29           2HB      ARG  29  -2.526   4.678  -2.653
  175    HG2  ARG  29           1HG      ARG  29  -4.214   2.279  -2.207
  176    HG3  ARG  29           2HG      ARG  29  -4.824   3.542  -3.279
  177    HD2  ARG  29           1HD      ARG  29  -2.381   3.371  -4.276
  178    HD3  ARG  29           2HD      ARG  29  -2.470   1.750  -3.588
  179    HE   ARG  29           HE       ARG  29  -3.977   1.172  -5.218
  180   HH11  ARG  29          1HH1      ARG  29  -3.615   4.634  -5.150
  181   HH12  ARG  29          2HH1      ARG  29  -4.521   4.888  -6.606
  182   HH21  ARG  29          1HH2      ARG  29  -5.170   1.493  -7.135
  183   HH22  ARG  29          2HH2      ARG  29  -5.405   3.101  -7.733
  184    H    ILE  30           H        ILE  30  -3.621   4.720   1.121
  185    HA   ILE  30           HA       ILE  30  -1.908   7.002   1.329
  186    HB   ILE  30           HB       ILE  30  -4.043   6.001   3.217
  187   HG12  ILE  30          1HG1      ILE  30  -4.208   8.298   1.267
  188   HG13  ILE  30          2HG1      ILE  30  -4.703   6.663   0.842
  189   HG21  ILE  30          1HG2      ILE  30  -2.110   8.144   3.443
  190   HG22  ILE  30          2HG2      ILE  30  -3.767   8.741   3.529
  191   HG23  ILE  30          3HG2      ILE  30  -3.220   7.494   4.649
  192   HD11  ILE  30          3HD1      ILE  30  -6.518   8.255   1.586
  193   HD12  ILE  30          1HD1      ILE  30  -6.466   6.686   2.388
  194   HD13  ILE  30          2HD1      ILE  30  -5.837   8.117   3.206
  195    H    HIS  31           H        HIS  31  -2.310   3.995   3.136
  196    HA   HIS  31           HA       HIS  31  -0.483   4.663   5.211
  197    HB2  HIS  31           1HB      HIS  31  -1.879   2.957   5.874
  198    HB3  HIS  31           2HB      HIS  31  -1.860   2.182   4.293
  199    HD1  HIS  31           HD1      HIS  31   0.313   2.577   7.366
  200    HD2  HIS  31           HD2      HIS  31  -0.091   0.109   4.048
  201    HE1  HIS  31           HE1      HIS  31   1.902   0.667   7.751
  202    H    GLN  32           H        GLN  32  -0.190   2.841   2.188
  203    HA   GLN  32           HA       GLN  32   2.321   1.790   2.398
  204    HB2  GLN  32           1HB      GLN  32   0.848   2.969   0.065
  205    HB3  GLN  32           2HB      GLN  32   2.484   2.356  -0.136
  206    HG2  GLN  32           1HG      GLN  32   1.611   0.197   0.912
  207    HG3  GLN  32           2HG      GLN  32   0.003   0.855   0.614
  208   HE21  GLN  32          1HE2      GLN  32  -0.014   1.907  -1.745
  209   HE22  GLN  32          2HE2      GLN  32   0.484   0.807  -2.981
  210    H    ARG  33           H        ARG  33   1.444   5.138   2.027
  211    HA   ARG  33           HA       ARG  33   3.775   6.268   1.081
  212    HB2  ARG  33           1HB      ARG  33   1.901   7.339   3.197
  213    HB3  ARG  33           2HB      ARG  33   3.122   8.295   2.367
  214    HG2  ARG  33           1HG      ARG  33   2.008   8.010   0.267
  215    HG3  ARG  33           2HG      ARG  33   0.866   6.869   0.979
  216    HD2  ARG  33           1HD      ARG  33  -0.134   8.575   2.304
  217    HD3  ARG  33           2HD      ARG  33   1.142   9.722   1.896
  218    HE   ARG  33           HE       ARG  33   0.093   9.145  -0.511
  219   HH11  ARG  33          1HH1      ARG  33  -1.348  10.086   2.515
  220   HH12  ARG  33          2HH1      ARG  33  -2.687  10.899   1.774
  221   HH21  ARG  33          1HH2      ARG  33  -1.665  10.212  -1.499
  222   HH22  ARG  33          2HH2      ARG  33  -2.867  10.969  -0.509
  223    H    VAL  34           H        VAL  34   3.018   5.171   4.343
  224    HA   VAL  34           HA       VAL  34   5.217   6.251   5.689
  225    HB   VAL  34           HB       VAL  34   4.802   4.687   7.434
  226   HG11  VAL  34          1HG1      VAL  34   2.994   6.408   6.748
  227   HG12  VAL  34          2HG1      VAL  34   2.071   4.990   6.249
  228   HG13  VAL  34          3HG1      VAL  34   2.587   5.162   7.927
  229   HG21  VAL  34          3HG2      VAL  34   4.724   2.558   6.640
  230   HG22  VAL  34          1HG2      VAL  34   2.990   2.838   6.801
  231   HG23  VAL  34          2HG2      VAL  34   3.767   3.002   5.226
  232    H    HIS  35           H        HIS  35   4.930   3.437   3.643
  233    HA   HIS  35           HA       HIS  35   7.469   2.320   4.398
  234    HB2  HIS  35           1HB      HIS  35   5.531   1.712   2.166
  235    HB3  HIS  35           2HB      HIS  35   7.063   0.863   2.352
  236    HD1  HIS  35           HD1      HIS  35   7.331  -0.518   4.637
  237    HD2  HIS  35           HD2      HIS  35   3.487   0.756   3.707
  238    HE1  HIS  35           HE1      HIS  35   5.798  -1.895   6.079
  239    H    MET  36           H        MET  36   6.291   4.540   1.987
  240    HA   MET  36           HA       MET  36   8.383   4.428   0.140
  241    HB2  MET  36           1HB      MET  36   6.372   6.490   0.915
  242    HB3  MET  36           2HB      MET  36   7.715   6.982  -0.109
  243    HG2  MET  36           1HG      MET  36   5.979   6.437  -1.577
  244    HG3  MET  36           2HG      MET  36   7.082   5.063  -1.628
  245    HE1  MET  36           3HE      MET  36   3.964   6.280  -1.758
  246    HE2  MET  36           1HE      MET  36   3.333   4.706  -2.246
  247    HE3  MET  36           2HE      MET  36   2.829   5.422  -0.715
  248    H    GLY  37           H        GLY  37  10.205   5.816  -0.167
  249    HA2  GLY  37           1HA      GLY  37  11.147   7.201   2.253
  250    HA3  GLY  37           2HA      GLY  37  12.172   5.991   1.495
  251    H    GLU  38           H        GLU  38  10.160   8.644   0.221
  252    HA   GLU  38           HA       GLU  38  12.172   9.327  -1.711
  253    HB2  GLU  38           1HB      GLU  38  10.620  11.097  -2.390
  254    HB3  GLU  38           2HB      GLU  38   9.800   9.548  -2.254
  255    HG2  GLU  38           1HG      GLU  38   8.362  11.165  -1.319
  256    HG3  GLU  38           2HG      GLU  38   9.044  10.255   0.028
  257    H    LYS  39           H        LYS  39  12.967  11.581  -1.946
  258    HA   LYS  39           HA       LYS  39  13.454  12.845   0.669
  259    HB2  LYS  39           1HB      LYS  39  15.735  13.348  -0.015
  260    HB3  LYS  39           2HB      LYS  39  15.451  11.614  -0.082
  261    HG2  LYS  39           1HG      LYS  39  15.050  13.207  -2.559
  262    HG3  LYS  39           2HG      LYS  39  16.698  12.879  -2.018
  263    HD2  LYS  39           1HD      LYS  39  16.387  10.543  -2.166
  264    HD3  LYS  39           2HD      LYS  39  14.635  10.709  -2.305
  265    HE2  LYS  39           1HE      LYS  39  15.186  10.327  -4.495
  266    HE3  LYS  39           2HE      LYS  39  15.267  12.088  -4.453
  267    HZ1  LYS  39           3HZ      LYS  39  17.265  10.357  -5.220
  268    HZ2  LYS  39           1HZ      LYS  39  17.754  10.941  -3.709
  269    HZ3  LYS  39           2HZ      LYS  39  17.409  12.023  -4.962
  270    H    CYS  40           H        CYS  40  12.931  13.214  -2.760
  271    HA   CYS  40           HA       CYS  40  13.454  15.826  -3.274
  272    HB2  CYS  40           1HB      CYS  40  11.020  14.235  -4.102
  273    HB3  CYS  40           2HB      CYS  40  11.452  15.794  -4.795
  274    HG   CYS  40           HG       CYS  40  14.106  13.944  -5.010
  275    H    SER  41           H        SER  41  10.368  14.657  -1.920
  276    HA   SER  41           HA       SER  41   9.162  17.112  -1.501
  277    HB2  SER  41           1HB      SER  41   7.856  15.133  -1.222
  278    HB3  SER  41           2HB      SER  41   8.929  14.521   0.036
  279    HG   SER  41           HG       SER  41   6.774  15.800   0.473
  280    H    GLY  42           H        GLY  42  11.168  15.250   0.781
  281    HA2  GLY  42           1HA      GLY  42  12.823  16.389   2.126
  282    HA3  GLY  42           2HA      GLY  42  11.761  17.789   2.157
  283    HA   PRO  43           HA       PRO  43  11.055  14.660   5.758
  284    HB2  PRO  43           1HB      PRO  43  12.879  15.510   7.581
  285    HB3  PRO  43           2HB      PRO  43  13.210  14.218   6.420
  286    HG2  PRO  43           1HG      PRO  43  13.977  17.110   6.307
  287    HG3  PRO  43           2HG      PRO  43  14.946  15.679   5.907
  288    HD2  PRO  43           1HD      PRO  43  13.753  17.205   4.015
  289    HD3  PRO  43           2HD      PRO  43  13.986  15.456   3.823
  290    H    SER  44           H        SER  44  12.289  17.979   6.231
  291    HA   SER  44           HA       SER  44  11.380  19.814   7.222
  292    HB2  SER  44           1HB      SER  44   9.464  19.385   5.724
  293    HB3  SER  44           2HB      SER  44   8.763  18.315   6.938
  294    HG   SER  44           HG       SER  44   9.392  21.026   7.458
  295    H    SER  45           H        SER  45  12.486  17.802   8.845
  296    HA   SER  45           HA       SER  45  11.154  16.789  10.958
  297    HB2  SER  45           1HB      SER  45  13.160  16.930  12.242
  298    HB3  SER  45           2HB      SER  45  13.664  16.775  10.559
  299    HG   SER  45           HG       SER  45  13.449  19.228  11.973
  300    H    GLY  46           H        GLY  46  10.311  17.465  12.906
  301    HA2  GLY  46           1HA      GLY  46  10.531  19.788  14.267
  302    HA3  GLY  46           2HA      GLY  46   9.414  20.214  12.978
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1 -22.086  -6.189 -17.459
    2    HA2  GLY   1           1HA      GLY   1 -22.316  -3.819 -17.855
    3    HA3  GLY   1           2HA      GLY   1 -23.255  -4.198 -19.291
    4    H    SER   2           H        SER   2 -25.426  -4.853 -19.070
    5    HA   SER   2           HA       SER   2 -26.867  -3.532 -17.062
    6    HB2  SER   2           1HB      SER   2 -27.585  -4.433 -19.437
    7    HB3  SER   2           2HB      SER   2 -28.087  -5.848 -18.512
    8    HG   SER   2           HG       SER   2 -29.717  -4.169 -18.793
    9    H    SER   3           H        SER   3 -26.238  -7.006 -17.509
   10    HA   SER   3           HA       SER   3 -26.749  -7.372 -14.632
   11    HB2  SER   3           1HB      SER   3 -27.630  -9.140 -16.919
   12    HB3  SER   3           2HB      SER   3 -27.628  -9.667 -15.236
   13    HG   SER   3           HG       SER   3 -29.647  -8.724 -16.130
   14    H    GLY   4           H        GLY   4 -25.600  -9.128 -13.633
   15    HA2  GLY   4           1HA      GLY   4 -23.860 -10.657 -13.416
   16    HA3  GLY   4           2HA      GLY   4 -23.504 -10.454 -15.125
   17    H    SER   5           H        SER   5 -22.631  -9.622 -11.945
   18    HA   SER   5           HA       SER   5 -20.689  -7.652 -12.963
   19    HB2  SER   5           1HB      SER   5 -22.533  -6.968 -11.225
   20    HB3  SER   5           2HB      SER   5 -21.469  -7.770 -10.070
   21    HG   SER   5           HG       SER   5 -19.981  -6.253 -10.356
   22    H    SER   6           H        SER   6 -19.225  -9.366 -13.461
   23    HA   SER   6           HA       SER   6 -18.147 -10.842 -11.171
   24    HB2  SER   6           1HB      SER   6 -17.622 -11.177 -14.135
   25    HB3  SER   6           2HB      SER   6 -16.970 -12.205 -12.858
   26    HG   SER   6           HG       SER   6 -19.439 -12.305 -12.353
   27    H    GLY   7           H        GLY   7 -16.046 -10.656 -10.489
   28    HA2  GLY   7           1HA      GLY   7 -14.032  -9.246 -11.915
   29    HA3  GLY   7           2HA      GLY   7 -14.755  -8.210 -10.694
   30    H    SER   8           H        SER   8 -12.036  -9.051 -10.758
   31    HA   SER   8           HA       SER   8 -11.829 -11.042  -8.630
   32    HB2  SER   8           1HB      SER   8 -10.293 -11.336 -10.477
   33    HB3  SER   8           2HB      SER   8  -9.723  -9.675 -10.322
   34    HG   SER   8           HG       SER   8  -8.474 -11.519  -9.306
   35    H    GLY   9           H        GLY   9 -10.622 -10.634  -6.701
   36    HA2  GLY   9           1HA      GLY   9  -9.333  -8.776  -5.526
   37    HA3  GLY   9           2HA      GLY   9 -10.746  -7.799  -5.894
   38    H    GLU  10           H        GLU  10  -9.276  -9.495  -3.512
   39    HA   GLU  10           HA       GLU  10 -11.337 -10.932  -2.276
   40    HB2  GLU  10           1HB      GLU  10  -8.831 -10.893  -1.720
   41    HB3  GLU  10           2HB      GLU  10  -9.190  -9.463  -0.762
   42    HG2  GLU  10           1HG      GLU  10 -10.565 -10.670   0.716
   43    HG3  GLU  10           2HG      GLU  10 -10.627 -12.065  -0.360
   44    H    LYS  11           H        LYS  11 -12.309 -10.319  -0.120
   45    HA   LYS  11           HA       LYS  11 -13.892  -7.984  -0.455
   46    HB2  LYS  11           1HB      LYS  11 -13.563  -9.853   1.897
   47    HB3  LYS  11           2HB      LYS  11 -14.754  -8.561   1.828
   48    HG2  LYS  11           1HG      LYS  11 -16.033  -9.636   0.252
   49    HG3  LYS  11           2HG      LYS  11 -14.677 -10.589  -0.354
   50    HD2  LYS  11           1HD      LYS  11 -14.682 -11.875   1.755
   51    HD3  LYS  11           2HD      LYS  11 -16.094 -10.958   2.285
   52    HE2  LYS  11           1HE      LYS  11 -16.930 -12.985   1.415
   53    HE3  LYS  11           2HE      LYS  11 -17.241 -11.767   0.179
   54    HZ1  LYS  11           3HZ      LYS  11 -16.097 -14.111  -0.326
   55    HZ2  LYS  11           1HZ      LYS  11 -14.714 -13.179  -0.042
   56    HZ3  LYS  11           2HZ      LYS  11 -15.808 -12.722  -1.247
   57    H    SER  12           H        SER  12 -10.766  -8.303   0.554
   58    HA   SER  12           HA       SER  12 -10.693  -5.623   1.588
   59    HB2  SER  12           1HB      SER  12 -10.375  -7.983   3.401
   60    HB3  SER  12           2HB      SER  12  -9.385  -6.551   3.686
   61    HG   SER  12           HG       SER  12 -11.392  -6.515   4.827
   62    H    HIS  13           H        HIS  13  -8.675  -4.705   1.432
   63    HA   HIS  13           HA       HIS  13  -6.726  -6.232  -0.091
   64    HB2  HIS  13           1HB      HIS  13  -6.756  -3.310   0.694
   65    HB3  HIS  13           2HB      HIS  13  -5.596  -4.062  -0.398
   66    HD1  HIS  13           HD1      HIS  13  -6.392  -4.600  -2.784
   67    HD2  HIS  13           HD2      HIS  13  -9.309  -2.862  -0.390
   68    HE1  HIS  13           HE1      HIS  13  -8.245  -3.943  -4.352
   69    H    THR  14           H        THR  14  -4.476  -6.291   0.468
   70    HA   THR  14           HA       THR  14  -3.905  -5.886   3.324
   71    HB   THR  14           HB       THR  14  -3.159  -8.347   1.731
   72    HG1  THR  14           HG1      THR  14  -4.640  -9.380   3.003
   73   HG21  THR  14          3HG2      THR  14  -1.559  -7.343   3.563
   74   HG22  THR  14          1HG2      THR  14  -1.872  -9.076   3.494
   75   HG23  THR  14          2HG2      THR  14  -2.722  -8.073   4.669
   76    H    CYS  15           H        CYS  15  -1.995  -4.947   3.746
   77    HA   CYS  15           HA       CYS  15  -0.402  -3.993   1.562
   78    HB2  CYS  15           1HB      CYS  15  -0.887  -2.734   3.712
   79    HB3  CYS  15           2HB      CYS  15   0.263  -3.809   4.501
   80    H    ASP  16           H        ASP  16   1.052  -5.210   0.565
   81    HA   ASP  16           HA       ASP  16   2.139  -7.587   1.697
   82    HB2  ASP  16           1HB      ASP  16   3.362  -6.230  -0.679
   83    HB3  ASP  16           2HB      ASP  16   3.136  -7.950  -0.372
   84    H    GLU  17           H        GLU  17   2.979  -4.311   1.934
   85    HA   GLU  17           HA       GLU  17   5.800  -4.586   2.223
   86    HB2  GLU  17           1HB      GLU  17   4.039  -2.395   3.331
   87    HB3  GLU  17           2HB      GLU  17   5.768  -2.309   3.025
   88    HG2  GLU  17           1HG      GLU  17   3.871  -2.883   0.791
   89    HG3  GLU  17           2HG      GLU  17   4.117  -1.231   1.355
   90    H    CYS  18           H        CYS  18   3.104  -4.390   4.518
   91    HA   CYS  18           HA       CYS  18   4.920  -5.412   6.602
   92    HB2  CYS  18           1HB      CYS  18   3.538  -4.187   8.259
   93    HB3  CYS  18           2HB      CYS  18   4.348  -3.113   7.122
   94    H    GLY  19           H        GLY  19   1.636  -5.370   5.309
   95    HA2  GLY  19           1HA      GLY  19   0.566  -7.582   5.104
   96    HA3  GLY  19           2HA      GLY  19   1.151  -7.918   6.726
   97    H    LYS  20           H        LYS  20   0.062  -4.727   6.259
   98    HA   LYS  20           HA       LYS  20  -1.991  -4.970   8.178
   99    HB2  LYS  20           1HB      LYS  20  -1.052  -2.830   6.327
  100    HB3  LYS  20           2HB      LYS  20  -2.637  -2.644   7.064
  101    HG2  LYS  20           1HG      LYS  20  -0.275  -3.288   8.771
  102    HG3  LYS  20           2HG      LYS  20  -0.541  -1.634   8.214
  103    HD2  LYS  20           1HD      LYS  20  -2.874  -1.814   9.148
  104    HD3  LYS  20           2HD      LYS  20  -2.378  -3.337   9.889
  105    HE2  LYS  20           1HE      LYS  20  -0.850  -2.286  11.306
  106    HE3  LYS  20           2HE      LYS  20  -0.808  -0.821  10.326
  107    HZ1  LYS  20           3HZ      LYS  20  -2.468  -1.424  12.522
  108    HZ2  LYS  20           1HZ      LYS  20  -3.434  -1.167  11.158
  109    HZ3  LYS  20           2HZ      LYS  20  -2.342   0.024  11.657
  110    H    ASN  21           H        ASN  21  -4.211  -3.744   7.409
  111    HA   ASN  21           HA       ASN  21  -5.213  -5.121   5.021
  112    HB2  ASN  21           1HB      ASN  21  -5.699  -6.301   7.320
  113    HB3  ASN  21           2HB      ASN  21  -6.929  -5.050   7.474
  114   HD21  ASN  21          1HD2      ASN  21  -5.716  -7.209   4.927
  115   HD22  ASN  21          2HD2      ASN  21  -7.275  -7.740   4.403
  116    H    PHE  22           H        PHE  22  -6.818  -4.052   3.916
  117    HA   PHE  22           HA       PHE  22  -8.073  -1.704   5.047
  118    HB2  PHE  22           1HB      PHE  22  -6.362  -1.407   2.573
  119    HB3  PHE  22           2HB      PHE  22  -7.254  -0.138   3.405
  120    HD1  PHE  22           HD1      PHE  22  -6.448   0.785   5.499
  121    HD2  PHE  22           HD2      PHE  22  -4.269  -2.229   3.429
  122    HE1  PHE  22           HE1      PHE  22  -4.466   1.281   6.870
  123    HE2  PHE  22           HE2      PHE  22  -2.284  -1.739   4.798
  124    HZ   PHE  22           HZ       PHE  22  -2.381   0.017   6.521
  125    H    CYS  23           H        CYS  23 -10.127  -2.074   4.547
  126    HA   CYS  23           HA       CYS  23 -11.108  -3.747   2.585
  127    HB2  CYS  23           1HB      CYS  23 -12.471  -2.896   4.439
  128    HB3  CYS  23           2HB      CYS  23 -12.437  -1.284   3.734
  129    HG   CYS  23           HG       CYS  23 -14.478  -1.578   2.204
  130    H    TYR  24           H        TYR  24 -10.489  -0.266   2.402
  131    HA   TYR  24           HA       TYR  24 -11.084  -0.349  -0.475
  132    HB2  TYR  24           1HB      TYR  24 -10.805   2.268  -0.040
  133    HB3  TYR  24           2HB      TYR  24 -12.323   1.429   0.256
  134    HD1  TYR  24           HD2      TYR  24 -12.587   0.453   2.694
  135    HD2  TYR  24           HD1      TYR  24  -9.931   3.603   1.634
  136    HE1  TYR  24           HE2      TYR  24 -12.548   1.201   5.037
  137    HE2  TYR  24           HE1      TYR  24  -9.884   4.359   3.974
  138    HH   TYR  24           HH       TYR  24 -10.993   2.499   6.528
  139    H    ILE  25           H        ILE  25  -9.517  -0.106  -1.942
  140    HA   ILE  25           HA       ILE  25  -6.831  -0.376  -1.348
  141    HB   ILE  25           HB       ILE  25  -8.029  -0.636  -3.612
  142   HG12  ILE  25          1HG1      ILE  25  -5.875  -0.066  -4.839
  143   HG13  ILE  25          2HG1      ILE  25  -5.277   0.571  -3.311
  144   HG21  ILE  25          1HG2      ILE  25  -8.760   1.810  -3.546
  145   HG22  ILE  25          2HG2      ILE  25  -7.109   2.190  -4.034
  146   HG23  ILE  25          3HG2      ILE  25  -8.129   1.194  -5.073
  147   HD11  ILE  25          3HD1      ILE  25  -6.368  -2.166  -3.245
  148   HD12  ILE  25          1HD1      ILE  25  -4.861  -1.937  -4.131
  149   HD13  ILE  25          2HD1      ILE  25  -4.963  -1.478  -2.431
  150    H    SER  26           H        SER  26  -8.722   2.566  -1.804
  151    HA   SER  26           HA       SER  26  -6.765   4.477  -1.996
  152    HB2  SER  26           1HB      SER  26  -8.989   5.235  -2.165
  153    HB3  SER  26           2HB      SER  26  -9.444   4.514  -0.621
  154    HG   SER  26           HG       SER  26  -7.439   6.449  -0.594
  155    H    ALA  27           H        ALA  27  -8.099   3.104   1.001
  156    HA   ALA  27           HA       ALA  27  -6.612   4.566   2.833
  157    HB1  ALA  27           3HB      ALA  27  -6.884   1.906   3.810
  158    HB2  ALA  27           1HB      ALA  27  -7.811   3.344   4.240
  159    HB3  ALA  27           2HB      ALA  27  -8.336   2.325   2.899
  160    H    LEU  28           H        LEU  28  -5.830   1.398   1.400
  161    HA   LEU  28           HA       LEU  28  -3.399   0.963   2.652
  162    HB2  LEU  28           1HB      LEU  28  -4.263  -0.823   1.433
  163    HB3  LEU  28           2HB      LEU  28  -4.494   0.156  -0.014
  164    HG   LEU  28           HG       LEU  28  -1.994   0.228  -0.247
  165   HD11  LEU  28          1HD1      LEU  28  -2.167  -1.076   2.299
  166   HD12  LEU  28          2HD1      LEU  28  -0.747  -0.474   1.444
  167   HD13  LEU  28          3HD1      LEU  28  -1.326  -2.113   1.146
  168   HD21  LEU  28          3HD2      LEU  28  -2.003  -2.419  -0.714
  169   HD22  LEU  28          1HD2      LEU  28  -2.785  -1.241  -1.768
  170   HD23  LEU  28          2HD2      LEU  28  -3.738  -2.129  -0.578
  171    H    ARG  29           H        ARG  29  -4.051   2.690  -0.381
  172    HA   ARG  29           HA       ARG  29  -1.418   3.260  -1.093
  173    HB2  ARG  29           1HB      ARG  29  -3.796   5.066  -1.554
  174    HB3  ARG  29           2HB      ARG  29  -2.316   4.997  -2.501
  175    HG2  ARG  29           1HG      ARG  29  -3.927   2.518  -2.264
  176    HG3  ARG  29           2HG      ARG  29  -4.541   3.817  -3.289
  177    HD2  ARG  29           1HD      ARG  29  -2.835   3.621  -4.795
  178    HD3  ARG  29           2HD      ARG  29  -1.689   3.045  -3.585
  179    HE   ARG  29           HE       ARG  29  -3.494   1.020  -3.802
  180   HH11  ARG  29          1HH1      ARG  29  -1.501   2.765  -6.063
  181   HH12  ARG  29          2HH1      ARG  29  -1.333   1.425  -7.148
  182   HH21  ARG  29          1HH2      ARG  29  -3.279  -0.751  -5.224
  183   HH22  ARG  29          2HH2      ARG  29  -2.345  -0.574  -6.670
  184    H    ILE  30           H        ILE  30  -3.552   4.821   1.206
  185    HA   ILE  30           HA       ILE  30  -1.892   7.120   1.598
  186    HB   ILE  30           HB       ILE  30  -4.093   6.005   3.341
  187   HG12  ILE  30          1HG1      ILE  30  -4.233   8.373   1.479
  188   HG13  ILE  30          2HG1      ILE  30  -4.648   6.745   0.955
  189   HG21  ILE  30          1HG2      ILE  30  -4.150   8.285   4.308
  190   HG22  ILE  30          2HG2      ILE  30  -2.649   7.423   4.643
  191   HG23  ILE  30          3HG2      ILE  30  -2.689   8.671   3.398
  192   HD11  ILE  30          3HD1      ILE  30  -6.304   8.622   2.194
  193   HD12  ILE  30          1HD1      ILE  30  -6.673   6.941   1.813
  194   HD13  ILE  30          2HD1      ILE  30  -6.014   7.363   3.394
  195    H    HIS  31           H        HIS  31  -2.315   4.019   3.226
  196    HA   HIS  31           HA       HIS  31  -0.619   4.615   5.429
  197    HB2  HIS  31           1HB      HIS  31  -2.003   2.844   5.925
  198    HB3  HIS  31           2HB      HIS  31  -1.881   2.156   4.308
  199    HD1  HIS  31           HD1      HIS  31   0.112   2.429   7.512
  200    HD2  HIS  31           HD2      HIS  31  -0.045   0.144   4.046
  201    HE1  HIS  31           HE1      HIS  31   1.729   0.538   7.879
  202    H    GLN  32           H        GLN  32  -0.115   3.081   2.291
  203    HA   GLN  32           HA       GLN  32   2.422   2.054   2.607
  204    HB2  GLN  32           1HB      GLN  32   1.021   3.273   0.248
  205    HB3  GLN  32           2HB      GLN  32   2.681   2.710   0.109
  206    HG2  GLN  32           1HG      GLN  32   1.833   0.491   1.019
  207    HG3  GLN  32           2HG      GLN  32   0.215   1.114   0.701
  208   HE21  GLN  32          1HE2      GLN  32  -0.089   1.983  -1.554
  209   HE22  GLN  32          2HE2      GLN  32   0.602   1.062  -2.842
  210    H    ARG  33           H        ARG  33   1.432   5.354   2.517
  211    HA   ARG  33           HA       ARG  33   3.724   6.650   1.646
  212    HB2  ARG  33           1HB      ARG  33   1.789   7.492   3.811
  213    HB3  ARG  33           2HB      ARG  33   2.969   8.552   3.053
  214    HG2  ARG  33           1HG      ARG  33   1.878   8.257   0.900
  215    HG3  ARG  33           2HG      ARG  33   0.711   7.155   1.634
  216    HD2  ARG  33           1HD      ARG  33  -0.277   8.870   2.898
  217    HD3  ARG  33           2HD      ARG  33   1.083   9.961   2.634
  218    HE   ARG  33           HE       ARG  33  -0.050   9.359   0.151
  219   HH11  ARG  33          1HH1      ARG  33  -0.862  11.034   3.093
  220   HH12  ARG  33          2HH1      ARG  33  -1.925  12.158   2.313
  221   HH21  ARG  33          1HH2      ARG  33  -1.447  10.833  -0.887
  222   HH22  ARG  33          2HH2      ARG  33  -2.258  12.042   0.049
  223    H    VAL  34           H        VAL  34   3.179   4.873   4.544
  224    HA   VAL  34           HA       VAL  34   5.328   6.067   6.041
  225    HB   VAL  34           HB       VAL  34   4.894   4.425   7.725
  226   HG11  VAL  34          1HG1      VAL  34   3.172   6.288   7.156
  227   HG12  VAL  34          2HG1      VAL  34   2.148   4.938   6.662
  228   HG13  VAL  34          3HG1      VAL  34   2.746   5.033   8.319
  229   HG21  VAL  34          3HG2      VAL  34   4.714   2.372   6.679
  230   HG22  VAL  34          1HG2      VAL  34   3.048   2.676   7.171
  231   HG23  VAL  34          2HG2      VAL  34   3.539   2.957   5.501
  232    H    HIS  35           H        HIS  35   4.932   3.389   3.854
  233    HA   HIS  35           HA       HIS  35   7.414   2.113   4.550
  234    HB2  HIS  35           1HB      HIS  35   5.440   1.727   2.303
  235    HB3  HIS  35           2HB      HIS  35   6.950   0.823   2.391
  236    HD1  HIS  35           HD1      HIS  35   7.218  -0.760   4.528
  237    HD2  HIS  35           HD2      HIS  35   3.405   0.744   3.849
  238    HE1  HIS  35           HE1      HIS  35   5.676  -2.189   5.907
  239    H    MET  36           H        MET  36   6.438   4.683   2.491
  240    HA   MET  36           HA       MET  36   8.886   4.541   0.902
  241    HB2  MET  36           1HB      MET  36   7.916   6.165  -0.529
  242    HB3  MET  36           2HB      MET  36   6.627   5.036  -0.131
  243    HG2  MET  36           1HG      MET  36   5.722   6.585   1.487
  244    HG3  MET  36           2HG      MET  36   7.057   7.699   1.202
  245    HE1  MET  36           3HE      MET  36   3.925   6.633  -2.008
  246    HE2  MET  36           1HE      MET  36   4.993   5.486  -1.198
  247    HE3  MET  36           2HE      MET  36   3.661   6.226  -0.311
  248    H    GLY  37           H        GLY  37  10.379   6.269   0.792
  249    HA2  GLY  37           1HA      GLY  37  10.341   7.997   3.189
  250    HA3  GLY  37           2HA      GLY  37  11.808   7.352   2.469
  251    H    GLU  38           H        GLU  38  11.178   7.861  -0.244
  252    HA   GLU  38           HA       GLU  38  11.384  10.796  -0.250
  253    HB2  GLU  38           1HB      GLU  38  13.275   9.202  -1.122
  254    HB3  GLU  38           2HB      GLU  38  12.257   9.092  -2.551
  255    HG2  GLU  38           1HG      GLU  38  12.288  11.677  -2.473
  256    HG3  GLU  38           2HG      GLU  38  13.697  11.458  -1.437
  257    H    LYS  39           H        LYS  39  10.132  12.018  -1.600
  258    HA   LYS  39           HA       LYS  39   8.070  10.579  -3.138
  259    HB2  LYS  39           1HB      LYS  39   6.488  12.320  -2.586
  260    HB3  LYS  39           2HB      LYS  39   7.180  11.683  -1.100
  261    HG2  LYS  39           1HG      LYS  39   8.827  13.657  -1.285
  262    HG3  LYS  39           2HG      LYS  39   7.648  14.327  -2.415
  263    HD2  LYS  39           1HD      LYS  39   5.916  13.899  -0.584
  264    HD3  LYS  39           2HD      LYS  39   7.293  13.673   0.497
  265    HE2  LYS  39           1HE      LYS  39   7.180  16.111  -1.214
  266    HE3  LYS  39           2HE      LYS  39   6.157  16.028   0.219
  267    HZ1  LYS  39           3HZ      LYS  39   8.552  16.996   0.366
  268    HZ2  LYS  39           1HZ      LYS  39   9.007  15.369   0.465
  269    HZ3  LYS  39           2HZ      LYS  39   7.953  16.024   1.614
  270    H    CYS  40           H        CYS  40   8.101  10.959  -5.247
  271    HA   CYS  40           HA       CYS  40   8.400  13.510  -6.406
  272    HB2  CYS  40           1HB      CYS  40  10.782  13.039  -5.690
  273    HB3  CYS  40           2HB      CYS  40  10.788  11.715  -6.849
  274    HG   CYS  40           HG       CYS  40  10.617  13.247  -9.090
  275    H    SER  41           H        SER  41   7.420  13.464  -8.326
  276    HA   SER  41           HA       SER  41   7.309  10.907  -9.782
  277    HB2  SER  41           1HB      SER  41   5.169  11.622  -8.491
  278    HB3  SER  41           2HB      SER  41   4.987  12.818  -9.774
  279    HG   SER  41           HG       SER  41   4.976  10.001  -9.969
  280    H    GLY  42           H        GLY  42   6.744  14.415 -10.052
  281    HA2  GLY  42           1HA      GLY  42   7.245  15.895 -11.733
  282    HA3  GLY  42           2HA      GLY  42   8.444  14.730 -12.276
  283    HA   PRO  43           HA       PRO  43   4.467  14.923 -14.997
  284    HB2  PRO  43           1HB      PRO  43   5.077  16.942 -16.707
  285    HB3  PRO  43           2HB      PRO  43   4.162  17.190 -15.215
  286    HG2  PRO  43           1HG      PRO  43   7.069  17.661 -15.756
  287    HG3  PRO  43           2HG      PRO  43   5.918  18.675 -14.866
  288    HD2  PRO  43           1HD      PRO  43   7.690  17.050 -13.623
  289    HD3  PRO  43           2HD      PRO  43   6.086  17.406 -12.950
  290    H    SER  44           H        SER  44   4.692  13.303 -16.393
  291    HA   SER  44           HA       SER  44   7.216  12.918 -17.793
  292    HB2  SER  44           1HB      SER  44   4.748  11.193 -17.525
  293    HB3  SER  44           2HB      SER  44   6.141  10.749 -18.511
  294    HG   SER  44           HG       SER  44   6.585   9.842 -16.598
  295    H    SER  45           H        SER  45   6.219  15.126 -18.810
  296    HA   SER  45           HA       SER  45   5.237  14.301 -21.451
  297    HB2  SER  45           1HB      SER  45   3.392  15.277 -19.980
  298    HB3  SER  45           2HB      SER  45   4.254  16.811 -20.091
  299    HG   SER  45           HG       SER  45   2.528  16.341 -21.703
  300    H    GLY  46           H        GLY  46   5.454  16.201 -23.045
  301    HA2  GLY  46           1HA      GLY  46   6.680  18.271 -23.518
  302    HA3  GLY  46           2HA      GLY  46   7.947  17.674 -22.456
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1 -13.746 -27.387 -12.657
    2    HA2  GLY   1           1HA      GLY   1 -13.186 -29.694 -13.791
    3    HA3  GLY   1           2HA      GLY   1 -11.550 -29.091 -13.573
    4    H    SER   2           H        SER   2 -10.840 -30.560 -12.093
    5    HA   SER   2           HA       SER   2 -12.407 -31.198  -9.754
    6    HB2  SER   2           1HB      SER   2  -9.543 -31.930 -10.410
    7    HB3  SER   2           2HB      SER   2 -10.538 -32.648  -9.143
    8    HG   SER   2           HG       SER   2 -11.225 -32.698 -11.893
    9    H    SER   3           H        SER   3 -11.964 -28.471  -9.880
   10    HA   SER   3           HA       SER   3 -10.775 -27.994  -7.329
   11    HB2  SER   3           1HB      SER   3  -9.082 -26.328  -8.192
   12    HB3  SER   3           2HB      SER   3  -8.691 -28.017  -8.513
   13    HG   SER   3           HG       SER   3  -9.415 -25.987 -10.272
   14    H    GLY   4           H        GLY   4 -11.479 -26.094  -6.430
   15    HA2  GLY   4           1HA      GLY   4 -12.256 -23.759  -7.617
   16    HA3  GLY   4           2HA      GLY   4 -13.670 -24.793  -7.757
   17    H    SER   5           H        SER   5 -11.260 -23.995  -5.248
   18    HA   SER   5           HA       SER   5 -13.479 -23.345  -3.440
   19    HB2  SER   5           1HB      SER   5 -12.889 -25.591  -2.819
   20    HB3  SER   5           2HB      SER   5 -11.169 -25.200  -2.829
   21    HG   SER   5           HG       SER   5 -11.505 -23.871  -1.040
   22    H    SER   6           H        SER   6 -12.889 -21.968  -1.664
   23    HA   SER   6           HA       SER   6 -10.382 -20.486  -2.112
   24    HB2  SER   6           1HB      SER   6 -13.165 -19.464  -1.609
   25    HB3  SER   6           2HB      SER   6 -11.758 -18.493  -1.175
   26    HG   SER   6           HG       SER   6 -12.182 -17.907  -3.223
   27    H    GLY   7           H        GLY   7 -12.949 -21.103   0.285
   28    HA2  GLY   7           1HA      GLY   7 -12.425 -22.049   2.434
   29    HA3  GLY   7           2HA      GLY   7 -10.844 -21.288   2.337
   30    H    SER   8           H        SER   8 -14.254 -20.248   2.167
   31    HA   SER   8           HA       SER   8 -15.200 -18.273   2.895
   32    HB2  SER   8           1HB      SER   8 -15.199 -18.148   5.370
   33    HB3  SER   8           2HB      SER   8 -15.487 -19.788   4.788
   34    HG   SER   8           HG       SER   8 -13.321 -20.270   5.235
   35    H    GLY   9           H        GLY   9 -12.824 -17.651   1.633
   36    HA2  GLY   9           1HA      GLY   9 -11.417 -15.793   3.410
   37    HA3  GLY   9           2HA      GLY   9 -10.896 -16.282   1.805
   38    H    GLU  10           H        GLU  10 -11.797 -13.682   3.426
   39    HA   GLU  10           HA       GLU  10 -13.737 -12.560   1.613
   40    HB2  GLU  10           1HB      GLU  10 -13.326 -12.045   4.158
   41    HB3  GLU  10           2HB      GLU  10 -12.145 -10.904   3.531
   42    HG2  GLU  10           1HG      GLU  10 -13.729  -9.542   2.620
   43    HG3  GLU  10           2HG      GLU  10 -14.883 -10.854   2.388
   44    H    LYS  11           H        LYS  11 -13.201 -10.245   0.780
   45    HA   LYS  11           HA       LYS  11 -10.541 -10.309  -0.487
   46    HB2  LYS  11           1HB      LYS  11 -12.154 -10.839  -2.177
   47    HB3  LYS  11           2HB      LYS  11 -13.204  -9.521  -1.671
   48    HG2  LYS  11           1HG      LYS  11 -12.230  -8.640  -3.550
   49    HG3  LYS  11           2HG      LYS  11 -11.163  -8.026  -2.285
   50    HD2  LYS  11           1HD      LYS  11  -9.611  -8.835  -3.762
   51    HD3  LYS  11           2HD      LYS  11  -9.864 -10.270  -2.765
   52    HE2  LYS  11           1HE      LYS  11 -11.661 -10.907  -4.472
   53    HE3  LYS  11           2HE      LYS  11 -10.944  -9.669  -5.503
   54    HZ1  LYS  11           3HZ      LYS  11  -9.083 -11.567  -4.342
   55    HZ2  LYS  11           1HZ      LYS  11  -9.144 -10.926  -5.907
   56    HZ3  LYS  11           2HZ      LYS  11 -10.157 -12.211  -5.479
   57    H    SER  12           H        SER  12  -9.318  -8.557  -0.205
   58    HA   SER  12           HA       SER  12 -10.325  -5.912  -0.054
   59    HB2  SER  12           1HB      SER  12 -11.039  -6.561   2.178
   60    HB3  SER  12           2HB      SER  12  -9.427  -7.171   2.550
   61    HG   SER  12           HG       SER  12  -8.771  -4.891   2.028
   62    H    HIS  13           H        HIS  13  -8.713  -4.400  -0.270
   63    HA   HIS  13           HA       HIS  13  -6.252  -5.222  -1.307
   64    HB2  HIS  13           1HB      HIS  13  -6.708  -2.512  -0.071
   65    HB3  HIS  13           2HB      HIS  13  -5.681  -2.929  -1.439
   66    HD1  HIS  13           HD1      HIS  13  -6.776  -3.063  -3.742
   67    HD2  HIS  13           HD2      HIS  13  -9.466  -2.300  -0.669
   68    HE1  HIS  13           HE1      HIS  13  -8.923  -2.410  -4.875
   69    H    THR  14           H        THR  14  -4.583  -6.103  -0.302
   70    HA   THR  14           HA       THR  14  -4.090  -5.386   2.514
   71    HB   THR  14           HB       THR  14  -3.381  -7.939   1.057
   72    HG1  THR  14           HG1      THR  14  -5.399  -8.299   1.657
   73   HG21  THR  14          3HG2      THR  14  -2.265  -8.692   2.937
   74   HG22  THR  14          1HG2      THR  14  -3.066  -7.539   4.004
   75   HG23  THR  14          2HG2      THR  14  -1.797  -6.992   2.908
   76    H    CYS  15           H        CYS  15  -2.128  -4.630   3.107
   77    HA   CYS  15           HA       CYS  15  -0.337  -3.754   1.047
   78    HB2  CYS  15           1HB      CYS  15  -0.853  -2.468   3.151
   79    HB3  CYS  15           2HB      CYS  15   0.099  -3.655   4.036
   80    H    ASP  16           H        ASP  16   1.179  -4.970   0.155
   81    HA   ASP  16           HA       ASP  16   2.012  -7.455   1.314
   82    HB2  ASP  16           1HB      ASP  16   2.538  -5.985  -1.219
   83    HB3  ASP  16           2HB      ASP  16   3.726  -7.185  -0.718
   84    H    GLU  17           H        GLU  17   3.049  -4.232   1.577
   85    HA   GLU  17           HA       GLU  17   5.824  -4.648   1.991
   86    HB2  GLU  17           1HB      GLU  17   4.080  -2.419   3.052
   87    HB3  GLU  17           2HB      GLU  17   5.833  -2.397   2.928
   88    HG2  GLU  17           1HG      GLU  17   4.242  -2.872   0.464
   89    HG3  GLU  17           2HG      GLU  17   4.315  -1.240   1.127
   90    H    CYS  18           H        CYS  18   3.029  -4.570   4.145
   91    HA   CYS  18           HA       CYS  18   4.737  -5.676   6.273
   92    HB2  CYS  18           1HB      CYS  18   3.384  -4.455   7.932
   93    HB3  CYS  18           2HB      CYS  18   4.211  -3.359   6.830
   94    H    GLY  19           H        GLY  19   1.519  -5.468   4.843
   95    HA2  GLY  19           1HA      GLY  19   0.379  -7.630   4.518
   96    HA3  GLY  19           2HA      GLY  19   0.877  -8.039   6.154
   97    H    LYS  20           H        LYS  20  -0.053  -4.796   5.791
   98    HA   LYS  20           HA       LYS  20  -2.235  -5.061   7.570
   99    HB2  LYS  20           1HB      LYS  20  -1.085  -2.842   5.935
  100    HB3  LYS  20           2HB      LYS  20  -2.684  -2.627   6.637
  101    HG2  LYS  20           1HG      LYS  20  -0.418  -3.535   8.354
  102    HG3  LYS  20           2HG      LYS  20  -0.582  -1.829   7.929
  103    HD2  LYS  20           1HD      LYS  20  -3.076  -2.242   8.699
  104    HD3  LYS  20           2HD      LYS  20  -2.327  -3.549   9.620
  105    HE2  LYS  20           1HE      LYS  20  -1.555  -0.634   9.723
  106    HE3  LYS  20           2HE      LYS  20  -2.482  -1.502  10.945
  107    HZ1  LYS  20           3HZ      LYS  20  -0.419  -3.047  10.963
  108    HZ2  LYS  20           1HZ      LYS  20  -0.370  -1.578  11.802
  109    HZ3  LYS  20           2HZ      LYS  20   0.376  -1.713  10.290
  110    H    ASN  21           H        ASN  21  -4.460  -4.250   7.080
  111    HA   ASN  21           HA       ASN  21  -5.322  -5.101   4.394
  112    HB2  ASN  21           1HB      ASN  21  -6.612  -5.641   7.071
  113    HB3  ASN  21           2HB      ASN  21  -7.461  -5.846   5.542
  114   HD21  ASN  21          1HD2      ASN  21  -7.108  -7.630   4.344
  115   HD22  ASN  21          2HD2      ASN  21  -6.035  -8.907   4.795
  116    H    PHE  22           H        PHE  22  -6.701  -3.792   3.323
  117    HA   PHE  22           HA       PHE  22  -8.042  -1.633   4.767
  118    HB2  PHE  22           1HB      PHE  22  -6.405  -1.099   2.283
  119    HB3  PHE  22           2HB      PHE  22  -7.237   0.084   3.287
  120    HD1  PHE  22           HD2      PHE  22  -4.361  -2.192   3.085
  121    HD2  PHE  22           HD1      PHE  22  -6.268   0.896   5.307
  122    HE1  PHE  22           HE2      PHE  22  -2.315  -1.892   4.418
  123    HE2  PHE  22           HE1      PHE  22  -4.225   1.202   6.643
  124    HZ   PHE  22           HZ       PHE  22  -2.245  -0.194   6.200
  125    H    CYS  23           H        CYS  23 -10.112  -1.910   4.279
  126    HA   CYS  23           HA       CYS  23 -11.151  -3.373   2.172
  127    HB2  CYS  23           1HB      CYS  23 -12.320  -2.481   4.288
  128    HB3  CYS  23           2HB      CYS  23 -12.606  -1.018   3.355
  129    HG   CYS  23           HG       CYS  23 -14.489  -1.938   1.780
  130    H    TYR  24           H        TYR  24 -10.472   0.091   2.361
  131    HA   TYR  24           HA       TYR  24 -11.146   0.334  -0.492
  132    HB2  TYR  24           1HB      TYR  24 -10.895   2.890   0.233
  133    HB3  TYR  24           2HB      TYR  24 -12.399   2.000   0.446
  134    HD1  TYR  24           HD2      TYR  24 -12.776   0.878   2.738
  135    HD2  TYR  24           HD1      TYR  24  -9.869   3.910   2.061
  136    HE1  TYR  24           HE2      TYR  24 -12.722   1.356   5.150
  137    HE2  TYR  24           HE1      TYR  24  -9.806   4.396   4.472
  138    HH   TYR  24           HH       TYR  24 -12.093   3.010   6.686
  139    H    ILE  25           H        ILE  25  -9.494   0.349  -1.849
  140    HA   ILE  25           HA       ILE  25  -6.843   0.206  -1.311
  141    HB   ILE  25           HB       ILE  25  -8.055   0.110  -3.590
  142   HG12  ILE  25          1HG1      ILE  25  -5.892   0.744  -4.769
  143   HG13  ILE  25          2HG1      ILE  25  -5.290   1.256  -3.196
  144   HG21  ILE  25          1HG2      ILE  25  -7.879   2.115  -4.954
  145   HG22  ILE  25          2HG2      ILE  25  -8.886   2.415  -3.539
  146   HG23  ILE  25          3HG2      ILE  25  -7.227   3.009  -3.581
  147   HD11  ILE  25          3HD1      ILE  25  -4.480  -0.851  -3.212
  148   HD12  ILE  25          1HD1      ILE  25  -6.075  -1.195  -2.543
  149   HD13  ILE  25          2HD1      ILE  25  -5.762  -1.458  -4.259
  150    H    SER  26           H        SER  26  -8.665   3.212  -1.831
  151    HA   SER  26           HA       SER  26  -6.745   5.112  -1.796
  152    HB2  SER  26           1HB      SER  26  -9.386   5.132  -0.325
  153    HB3  SER  26           2HB      SER  26  -8.372   6.562  -0.516
  154    HG   SER  26           HG       SER  26  -9.859   6.538  -2.176
  155    H    ALA  27           H        ALA  27  -8.032   3.463   1.069
  156    HA   ALA  27           HA       ALA  27  -6.535   4.867   2.987
  157    HB1  ALA  27           3HB      ALA  27  -7.926   3.692   4.257
  158    HB2  ALA  27           1HB      ALA  27  -8.283   2.584   2.931
  159    HB3  ALA  27           2HB      ALA  27  -6.901   2.282   3.986
  160    H    LEU  28           H        LEU  28  -5.894   1.750   1.390
  161    HA   LEU  28           HA       LEU  28  -3.529   1.073   2.634
  162    HB2  LEU  28           1HB      LEU  28  -4.303  -0.573   1.247
  163    HB3  LEU  28           2HB      LEU  28  -4.684   0.553  -0.054
  164    HG   LEU  28           HG       LEU  28  -2.194   0.748  -0.445
  165   HD11  LEU  28          1HD1      LEU  28  -1.659  -1.853   0.730
  166   HD12  LEU  28          2HD1      LEU  28  -2.023  -0.622   1.939
  167   HD13  LEU  28          3HD1      LEU  28  -0.712  -0.366   0.788
  168   HD21  LEU  28          3HD2      LEU  28  -2.825  -0.558  -2.130
  169   HD22  LEU  28          1HD2      LEU  28  -4.031  -1.371  -1.132
  170   HD23  LEU  28          2HD2      LEU  28  -2.362  -1.942  -1.140
  171    H    ARG  29           H        ARG  29  -3.975   3.131  -0.226
  172    HA   ARG  29           HA       ARG  29  -1.295   3.622  -0.796
  173    HB2  ARG  29           1HB      ARG  29  -3.466   5.686  -1.115
  174    HB3  ARG  29           2HB      ARG  29  -2.031   5.457  -2.105
  175    HG2  ARG  29           1HG      ARG  29  -4.439   3.658  -1.966
  176    HG3  ARG  29           2HG      ARG  29  -3.952   4.690  -3.312
  177    HD2  ARG  29           1HD      ARG  29  -1.722   3.269  -3.094
  178    HD3  ARG  29           2HD      ARG  29  -2.836   2.094  -2.397
  179    HE   ARG  29           HE       ARG  29  -3.947   3.023  -4.782
  180   HH11  ARG  29          1HH1      ARG  29  -1.198   1.181  -3.700
  181   HH12  ARG  29          2HH1      ARG  29  -1.088   0.245  -5.154
  182   HH21  ARG  29          1HH2      ARG  29  -3.813   1.798  -6.701
  183   HH22  ARG  29          2HH2      ARG  29  -2.576   0.598  -6.860
  184    H    ILE  30           H        ILE  30  -3.504   5.364   1.365
  185    HA   ILE  30           HA       ILE  30  -1.726   7.408   2.108
  186    HB   ILE  30           HB       ILE  30  -4.010   6.213   3.682
  187   HG12  ILE  30          1HG1      ILE  30  -4.065   8.832   2.220
  188   HG13  ILE  30          2HG1      ILE  30  -4.349   7.332   1.344
  189   HG21  ILE  30          1HG2      ILE  30  -3.978   8.243   5.000
  190   HG22  ILE  30          2HG2      ILE  30  -2.413   7.439   5.098
  191   HG23  ILE  30          3HG2      ILE  30  -2.613   8.856   4.069
  192   HD11  ILE  30          3HD1      ILE  30  -5.996   8.625   3.466
  193   HD12  ILE  30          1HD1      ILE  30  -6.479   8.011   1.885
  194   HD13  ILE  30          2HD1      ILE  30  -6.107   6.886   3.192
  195    H    HIS  31           H        HIS  31  -2.287   4.185   3.430
  196    HA   HIS  31           HA       HIS  31  -0.613   4.507   5.705
  197    HB2  HIS  31           1HB      HIS  31  -2.076   2.747   5.992
  198    HB3  HIS  31           2HB      HIS  31  -1.917   2.203   4.325
  199    HD1  HIS  31           HD1      HIS  31  -0.151   2.036   7.648
  200    HD2  HIS  31           HD2      HIS  31  -0.004   0.263   3.893
  201    HE1  HIS  31           HE1      HIS  31   1.433   0.097   7.882
  202    H    GLN  32           H        GLN  32  -0.108   3.113   2.485
  203    HA   GLN  32           HA       GLN  32   2.377   2.018   2.720
  204    HB2  GLN  32           1HB      GLN  32   1.092   3.543   0.477
  205    HB3  GLN  32           2HB      GLN  32   2.729   2.923   0.312
  206    HG2  GLN  32           1HG      GLN  32   1.698   0.668   1.028
  207    HG3  GLN  32           2HG      GLN  32   0.163   1.420   0.596
  208   HE21  GLN  32          1HE2      GLN  32   0.113   2.426  -1.602
  209   HE22  GLN  32          2HE2      GLN  32   0.898   1.571  -2.881
  210    H    ARG  33           H        ARG  33   1.545   5.406   2.715
  211    HA   ARG  33           HA       ARG  33   3.895   6.659   2.108
  212    HB2  ARG  33           1HB      ARG  33   1.941   7.338   4.311
  213    HB3  ARG  33           2HB      ARG  33   3.213   8.418   3.756
  214    HG2  ARG  33           1HG      ARG  33   2.206   8.361   1.492
  215    HG3  ARG  33           2HG      ARG  33   0.881   7.398   2.150
  216    HD2  ARG  33           1HD      ARG  33   0.282   9.763   2.012
  217    HD3  ARG  33           2HD      ARG  33   0.315   9.205   3.683
  218    HE   ARG  33           HE       ARG  33   2.083  11.135   2.451
  219   HH11  ARG  33          1HH1      ARG  33   1.518   8.997   5.140
  220   HH12  ARG  33          2HH1      ARG  33   2.590   9.842   6.206
  221   HH21  ARG  33          1HH2      ARG  33   3.497  12.257   3.845
  222   HH22  ARG  33          2HH2      ARG  33   3.715  11.697   5.469
  223    H    VAL  34           H        VAL  34   3.076   4.970   5.083
  224    HA   VAL  34           HA       VAL  34   5.265   5.800   6.638
  225    HB   VAL  34           HB       VAL  34   4.779   3.991   8.106
  226   HG11  VAL  34          1HG1      VAL  34   2.832   5.767   7.215
  227   HG12  VAL  34          2HG1      VAL  34   2.010   4.209   7.314
  228   HG13  VAL  34          3HG1      VAL  34   2.831   4.865   8.730
  229   HG21  VAL  34          3HG2      VAL  34   4.739   2.069   6.800
  230   HG22  VAL  34          1HG2      VAL  34   3.057   2.237   7.305
  231   HG23  VAL  34          2HG2      VAL  34   3.545   2.733   5.684
  232    H    HIS  35           H        HIS  35   4.902   3.227   4.271
  233    HA   HIS  35           HA       HIS  35   7.414   1.987   4.842
  234    HB2  HIS  35           1HB      HIS  35   5.482   1.766   2.537
  235    HB3  HIS  35           2HB      HIS  35   6.997   0.870   2.587
  236    HD1  HIS  35           HD1      HIS  35   7.241  -0.785   4.726
  237    HD2  HIS  35           HD2      HIS  35   3.414   0.556   3.823
  238    HE1  HIS  35           HE1      HIS  35   5.680  -2.355   5.918
  239    H    MET  36           H        MET  36   6.524   4.816   3.227
  240    HA   MET  36           HA       MET  36   8.835   4.807   1.449
  241    HB2  MET  36           1HB      MET  36   6.777   6.982   1.850
  242    HB3  MET  36           2HB      MET  36   7.936   6.854   0.534
  243    HG2  MET  36           1HG      MET  36   5.835   4.772   1.032
  244    HG3  MET  36           2HG      MET  36   5.545   6.196   0.035
  245    HE1  MET  36           3HE      MET  36   5.643   2.896  -1.755
  246    HE2  MET  36           1HE      MET  36   4.705   4.313  -1.282
  247    HE3  MET  36           2HE      MET  36   5.551   4.292  -2.830
  248    H    GLY  37           H        GLY  37   9.712   4.671   3.992
  249    HA2  GLY  37           1HA      GLY  37  10.542   7.435   4.628
  250    HA3  GLY  37           2HA      GLY  37  10.381   6.159   5.826
  251    H    GLU  38           H        GLU  38  12.515   7.823   3.858
  252    HA   GLU  38           HA       GLU  38  14.669   7.467   3.154
  253    HB2  GLU  38           1HB      GLU  38  16.167   6.844   4.942
  254    HB3  GLU  38           2HB      GLU  38  14.878   7.844   5.598
  255    HG2  GLU  38           1HG      GLU  38  13.838   6.019   6.636
  256    HG3  GLU  38           2HG      GLU  38  14.765   4.851   5.697
  257    H    LYS  39           H        LYS  39  12.722   5.319   2.498
  258    HA   LYS  39           HA       LYS  39  12.695   3.258   1.537
  259    HB2  LYS  39           1HB      LYS  39  15.490   4.200   1.150
  260    HB3  LYS  39           2HB      LYS  39  15.156   2.505   0.822
  261    HG2  LYS  39           1HG      LYS  39  14.823   3.429  -1.243
  262    HG3  LYS  39           2HG      LYS  39  13.183   3.468  -0.592
  263    HD2  LYS  39           1HD      LYS  39  14.938   5.819  -0.106
  264    HD3  LYS  39           2HD      LYS  39  14.287   5.591  -1.731
  265    HE2  LYS  39           1HE      LYS  39  12.458   5.389   0.617
  266    HE3  LYS  39           2HE      LYS  39  12.972   6.982   0.063
  267    HZ1  LYS  39           3HZ      LYS  39  11.773   4.963  -1.745
  268    HZ2  LYS  39           1HZ      LYS  39  12.015   6.611  -2.044
  269    HZ3  LYS  39           2HZ      LYS  39  10.851   6.118  -0.921
  270    H    CYS  40           H        CYS  40  12.646   3.213   4.288
  271    HA   CYS  40           HA       CYS  40  14.594   1.418   5.363
  272    HB2  CYS  40           1HB      CYS  40  13.103   1.347   7.335
  273    HB3  CYS  40           2HB      CYS  40  13.445   2.993   6.819
  274    HG   CYS  40           HG       CYS  40  10.840   3.104   7.567
  275    H    SER  41           H        SER  41  14.145  -0.020   3.352
  276    HA   SER  41           HA       SER  41  11.832  -1.720   3.518
  277    HB2  SER  41           1HB      SER  41  14.276  -1.633   1.775
  278    HB3  SER  41           2HB      SER  41  13.230  -3.053   1.760
  279    HG   SER  41           HG       SER  41  12.852  -0.633   0.614
  280    H    GLY  42           H        GLY  42  15.328  -2.435   3.712
  281    HA2  GLY  42           1HA      GLY  42  15.019  -5.015   4.775
  282    HA3  GLY  42           2HA      GLY  42  16.477  -4.040   4.882
  283    HA   PRO  43           HA       PRO  43  14.930  -4.684   9.184
  284    HB2  PRO  43           1HB      PRO  43  17.389  -5.149  10.237
  285    HB3  PRO  43           2HB      PRO  43  16.403  -6.418   9.501
  286    HG2  PRO  43           1HG      PRO  43  18.682  -4.870   8.328
  287    HG3  PRO  43           2HG      PRO  43  18.331  -6.605   8.214
  288    HD2  PRO  43           1HD      PRO  43  17.753  -4.867   6.219
  289    HD3  PRO  43           2HD      PRO  43  16.768  -6.307   6.546
  290    H    SER  44           H        SER  44  14.380  -2.533   9.501
  291    HA   SER  44           HA       SER  44  16.600  -0.723  10.195
  292    HB2  SER  44           1HB      SER  44  15.159  -0.088   8.199
  293    HB3  SER  44           2HB      SER  44  13.835   0.144   9.340
  294    HG   SER  44           HG       SER  44  16.254   1.396   9.919
  295    H    SER  45           H        SER  45  16.741  -0.137  12.252
  296    HA   SER  45           HA       SER  45  14.480  -0.694  14.030
  297    HB2  SER  45           1HB      SER  45  16.889  -1.563  14.431
  298    HB3  SER  45           2HB      SER  45  17.237   0.087  14.949
  299    HG   SER  45           HG       SER  45  14.970  -1.093  16.029
  300    H    GLY  46           H        GLY  46  13.197   1.117  13.630
  301    HA2  GLY  46           1HA      GLY  46  12.743   3.161  14.980
  302    HA3  GLY  46           2HA      GLY  46  14.362   3.679  14.535
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1   5.926 -28.609  -1.496
    2    HA2  GLY   1           1HA      GLY   1   5.036 -26.421  -1.603
    3    HA3  GLY   1           2HA      GLY   1   3.996 -27.328  -2.691
    4    H    SER   2           H        SER   2   4.289 -26.830   0.831
    5    HA   SER   2           HA       SER   2   1.366 -26.722   0.991
    6    HB2  SER   2           1HB      SER   2   3.549 -27.282   2.965
    7    HB3  SER   2           2HB      SER   2   1.989 -26.701   3.547
    8    HG   SER   2           HG       SER   2   2.018 -28.814   1.717
    9    H    SER   3           H        SER   3   0.259 -24.967   1.756
   10    HA   SER   3           HA       SER   3   1.587 -22.692   2.894
   11    HB2  SER   3           1HB      SER   3   1.916 -22.599   0.308
   12    HB3  SER   3           2HB      SER   3   0.216 -22.129   0.280
   13    HG   SER   3           HG       SER   3   2.405 -20.792   1.454
   14    H    GLY   4           H        GLY   4   0.191 -21.405   4.012
   15    HA2  GLY   4           1HA      GLY   4  -2.692 -21.809   3.577
   16    HA3  GLY   4           2HA      GLY   4  -2.019 -22.021   5.186
   17    H    SER   5           H        SER   5  -3.979 -20.252   5.020
   18    HA   SER   5           HA       SER   5  -2.623 -17.634   5.014
   19    HB2  SER   5           1HB      SER   5  -4.228 -17.598   3.246
   20    HB3  SER   5           2HB      SER   5  -5.462 -18.344   4.263
   21    HG   SER   5           HG       SER   5  -5.952 -16.447   5.015
   22    H    SER   6           H        SER   6  -2.672 -16.477   6.842
   23    HA   SER   6           HA       SER   6  -3.877 -17.665   9.189
   24    HB2  SER   6           1HB      SER   6  -1.552 -16.452   8.958
   25    HB3  SER   6           2HB      SER   6  -2.512 -14.998   9.230
   26    HG   SER   6           HG       SER   6  -1.583 -16.206  11.127
   27    H    GLY   7           H        GLY   7  -4.126 -14.578   7.434
   28    HA2  GLY   7           1HA      GLY   7  -6.314 -13.667   9.071
   29    HA3  GLY   7           2HA      GLY   7  -5.679 -12.872   7.638
   30    H    SER   8           H        SER   8  -8.440 -13.189   8.323
   31    HA   SER   8           HA       SER   8  -9.310 -14.839   6.044
   32    HB2  SER   8           1HB      SER   8  -9.974 -16.003   8.056
   33    HB3  SER   8           2HB      SER   8 -10.665 -14.528   8.732
   34    HG   SER   8           HG       SER   8 -12.035 -16.230   7.522
   35    H    GLY   9           H        GLY   9  -9.528 -13.181   4.591
   36    HA2  GLY   9           1HA      GLY   9 -11.555 -11.144   5.282
   37    HA3  GLY   9           2HA      GLY   9 -10.116 -10.750   4.352
   38    H    GLU  10           H        GLU  10 -11.357  -9.996   2.609
   39    HA   GLU  10           HA       GLU  10 -11.996 -11.975   0.672
   40    HB2  GLU  10           1HB      GLU  10 -14.040 -12.170   1.992
   41    HB3  GLU  10           2HB      GLU  10 -14.302 -10.436   1.878
   42    HG2  GLU  10           1HG      GLU  10 -15.665 -11.914   0.339
   43    HG3  GLU  10           2HG      GLU  10 -14.831 -10.546  -0.396
   44    H    LYS  11           H        LYS  11 -11.415 -11.110  -1.197
   45    HA   LYS  11           HA       LYS  11 -10.569  -9.469  -2.594
   46    HB2  LYS  11           1HB      LYS  11 -13.012  -9.880  -3.148
   47    HB3  LYS  11           2HB      LYS  11 -13.372  -8.401  -2.267
   48    HG2  LYS  11           1HG      LYS  11 -11.940  -7.145  -3.811
   49    HG3  LYS  11           2HG      LYS  11 -11.621  -8.632  -4.707
   50    HD2  LYS  11           1HD      LYS  11 -13.339  -7.774  -5.954
   51    HD3  LYS  11           2HD      LYS  11 -14.255  -8.739  -4.795
   52    HE2  LYS  11           1HE      LYS  11 -13.627  -5.912  -4.107
   53    HE3  LYS  11           2HE      LYS  11 -14.879  -6.223  -5.309
   54    HZ1  LYS  11           3HZ      LYS  11 -14.993  -6.507  -2.481
   55    HZ2  LYS  11           1HZ      LYS  11 -15.414  -7.955  -3.248
   56    HZ3  LYS  11           2HZ      LYS  11 -16.251  -6.532  -3.611
   57    H    SER  12           H        SER  12  -9.848  -8.822   0.016
   58    HA   SER  12           HA       SER  12 -10.324  -5.924   0.178
   59    HB2  SER  12           1HB      SER  12 -10.914  -7.152   2.209
   60    HB3  SER  12           2HB      SER  12  -9.295  -7.846   2.281
   61    HG   SER  12           HG       SER  12  -9.737  -5.917   3.621
   62    H    HIS  13           H        HIS  13  -8.620  -4.483   0.295
   63    HA   HIS  13           HA       HIS  13  -6.198  -5.321  -0.994
   64    HB2  HIS  13           1HB      HIS  13  -6.680  -2.625   0.265
   65    HB3  HIS  13           2HB      HIS  13  -5.626  -3.022  -1.088
   66    HD1  HIS  13           HD1      HIS  13  -6.670  -3.108  -3.410
   67    HD2  HIS  13           HD2      HIS  13  -9.437  -2.453  -0.381
   68    HE1  HIS  13           HE1      HIS  13  -8.803  -2.463  -4.576
   69    H    THR  14           H        THR  14  -4.532  -6.207   0.014
   70    HA   THR  14           HA       THR  14  -4.056  -5.511   2.838
   71    HB   THR  14           HB       THR  14  -3.330  -8.058   1.376
   72    HG1  THR  14           HG1      THR  14  -5.585  -7.718   2.047
   73   HG21  THR  14          3HG2      THR  14  -3.057  -7.592   4.328
   74   HG22  THR  14          1HG2      THR  14  -1.750  -7.179   3.219
   75   HG23  THR  14          2HG2      THR  14  -2.319  -8.845   3.330
   76    H    CYS  15           H        CYS  15  -2.082  -4.793   3.455
   77    HA   CYS  15           HA       CYS  15  -0.280  -3.904   1.405
   78    HB2  CYS  15           1HB      CYS  15  -0.822  -2.649   3.540
   79    HB3  CYS  15           2HB      CYS  15   0.180  -3.822   4.388
   80    H    ASP  16           H        ASP  16   1.091  -5.261   0.464
   81    HA   ASP  16           HA       ASP  16   1.951  -7.702   1.648
   82    HB2  ASP  16           1HB      ASP  16   3.658  -7.469  -0.391
   83    HB3  ASP  16           2HB      ASP  16   1.973  -7.926  -0.628
   84    H    GLU  17           H        GLU  17   3.130  -4.471   1.706
   85    HA   GLU  17           HA       GLU  17   5.863  -4.962   2.190
   86    HB2  GLU  17           1HB      GLU  17   4.066  -2.655   2.929
   87    HB3  GLU  17           2HB      GLU  17   5.791  -2.664   3.267
   88    HG2  GLU  17           1HG      GLU  17   4.909  -3.223   0.490
   89    HG3  GLU  17           2HG      GLU  17   4.801  -1.568   1.085
   90    H    CYS  18           H        CYS  18   3.158  -4.395   4.431
   91    HA   CYS  18           HA       CYS  18   4.826  -5.511   6.589
   92    HB2  CYS  18           1HB      CYS  18   3.412  -4.248   8.158
   93    HB3  CYS  18           2HB      CYS  18   4.196  -3.183   6.996
   94    H    GLY  19           H        GLY  19   1.566  -5.435   5.206
   95    HA2  GLY  19           1HA      GLY  19   0.489  -7.641   4.942
   96    HA3  GLY  19           2HA      GLY  19   1.044  -8.005   6.569
   97    H    LYS  20           H        LYS  20  -0.073  -4.810   6.013
   98    HA   LYS  20           HA       LYS  20  -2.197  -5.131   7.898
   99    HB2  LYS  20           1HB      LYS  20  -1.136  -2.865   6.254
  100    HB3  LYS  20           2HB      LYS  20  -2.702  -2.701   7.036
  101    HG2  LYS  20           1HG      LYS  20  -0.414  -3.630   8.682
  102    HG3  LYS  20           2HG      LYS  20  -0.470  -1.931   8.209
  103    HD2  LYS  20           1HD      LYS  20  -2.855  -1.922   9.090
  104    HD3  LYS  20           2HD      LYS  20  -2.483  -3.488   9.814
  105    HE2  LYS  20           1HE      LYS  20  -1.992  -2.061  11.551
  106    HE3  LYS  20           2HE      LYS  20  -0.414  -2.222  10.782
  107    HZ1  LYS  20           3HZ      LYS  20  -2.193  -0.048   9.929
  108    HZ2  LYS  20           1HZ      LYS  20  -0.503  -0.111   9.944
  109    HZ3  LYS  20           2HZ      LYS  20  -1.353   0.112  11.389
  110    H    ASN  21           H        ASN  21  -4.436  -4.311   7.406
  111    HA   ASN  21           HA       ASN  21  -5.293  -5.201   4.731
  112    HB2  ASN  21           1HB      ASN  21  -6.534  -5.732   7.426
  113    HB3  ASN  21           2HB      ASN  21  -7.454  -5.884   5.931
  114   HD21  ASN  21          1HD2      ASN  21  -7.523  -8.103   7.061
  115   HD22  ASN  21          2HD2      ASN  21  -6.341  -9.242   6.520
  116    H    PHE  22           H        PHE  22  -6.712  -3.934   3.648
  117    HA   PHE  22           HA       PHE  22  -8.017  -1.728   5.053
  118    HB2  PHE  22           1HB      PHE  22  -6.408  -1.294   2.531
  119    HB3  PHE  22           2HB      PHE  22  -7.254  -0.069   3.470
  120    HD1  PHE  22           HD2      PHE  22  -4.333  -2.278   3.346
  121    HD2  PHE  22           HD1      PHE  22  -6.320   0.813   5.494
  122    HE1  PHE  22           HE2      PHE  22  -2.293  -1.887   4.665
  123    HE2  PHE  22           HE1      PHE  22  -4.283   1.209   6.815
  124    HZ   PHE  22           HZ       PHE  22  -2.267  -0.143   6.403
  125    H    CYS  23           H        CYS  23 -10.098  -2.035   4.628
  126    HA   CYS  23           HA       CYS  23 -11.184  -3.551   2.584
  127    HB2  CYS  23           1HB      CYS  23 -12.266  -1.396   4.355
  128    HB3  CYS  23           2HB      CYS  23 -13.261  -1.991   3.032
  129    HG   CYS  23           HG       CYS  23 -12.393  -4.721   4.270
  130    H    TYR  24           H        TYR  24 -10.513  -0.082   2.669
  131    HA   TYR  24           HA       TYR  24 -11.271   0.094  -0.168
  132    HB2  TYR  24           1HB      TYR  24 -10.971   2.664   0.483
  133    HB3  TYR  24           2HB      TYR  24 -12.474   1.795   0.775
  134    HD1  TYR  24           HD2      TYR  24 -12.601   0.591   3.129
  135    HD2  TYR  24           HD1      TYR  24 -10.040   3.866   2.223
  136    HE1  TYR  24           HE2      TYR  24 -12.452   1.130   5.524
  137    HE2  TYR  24           HE1      TYR  24  -9.883   4.413   4.615
  138    HH   TYR  24           HH       TYR  24 -11.718   3.783   6.771
  139    H    ILE  25           H        ILE  25  -9.706   0.193  -1.625
  140    HA   ILE  25           HA       ILE  25  -7.026  -0.021  -1.183
  141    HB   ILE  25           HB       ILE  25  -8.147  -0.240  -3.401
  142   HG12  ILE  25          1HG1      ILE  25  -6.223   0.860  -4.689
  143   HG13  ILE  25          2HG1      ILE  25  -5.651   1.428  -3.124
  144   HG21  ILE  25          1HG2      ILE  25  -8.592   1.661  -4.760
  145   HG22  ILE  25          2HG2      ILE  25  -9.382   1.934  -3.208
  146   HG23  ILE  25          3HG2      ILE  25  -7.864   2.751  -3.580
  147   HD11  ILE  25          3HD1      ILE  25  -5.987  -1.194  -2.602
  148   HD12  ILE  25          1HD1      ILE  25  -5.564  -1.251  -4.312
  149   HD13  ILE  25          2HD1      ILE  25  -4.476  -0.477  -3.159
  150    H    SER  26           H        SER  26  -8.828   3.006  -1.652
  151    HA   SER  26           HA       SER  26  -6.890   4.884  -1.700
  152    HB2  SER  26           1HB      SER  26  -9.317   5.107   0.092
  153    HB3  SER  26           2HB      SER  26  -8.424   6.430  -0.657
  154    HG   SER  26           HG       SER  26  -9.391   6.052  -2.509
  155    H    ALA  27           H        ALA  27  -8.171   3.426   1.285
  156    HA   ALA  27           HA       ALA  27  -6.568   4.766   3.114
  157    HB1  ALA  27           3HB      ALA  27  -8.336   2.526   3.142
  158    HB2  ALA  27           1HB      ALA  27  -6.891   2.134   4.074
  159    HB3  ALA  27           2HB      ALA  27  -7.840   3.566   4.477
  160    H    LEU  28           H        LEU  28  -5.977   1.569   1.643
  161    HA   LEU  28           HA       LEU  28  -3.536   0.995   2.767
  162    HB2  LEU  28           1HB      LEU  28  -4.511  -0.684   1.478
  163    HB3  LEU  28           2HB      LEU  28  -4.710   0.375   0.083
  164    HG   LEU  28           HG       LEU  28  -2.221   0.332  -0.197
  165   HD11  LEU  28          1HD1      LEU  28  -2.336  -0.912   2.329
  166   HD12  LEU  28          2HD1      LEU  28  -0.914  -0.579   1.341
  167   HD13  LEU  28          3HD1      LEU  28  -1.754  -2.121   1.184
  168   HD21  LEU  28          3HD2      LEU  28  -2.241  -1.658  -1.416
  169   HD22  LEU  28          1HD2      LEU  28  -3.936  -1.175  -1.365
  170   HD23  LEU  28          2HD2      LEU  28  -3.350  -2.446  -0.292
  171    H    ARG  29           H        ARG  29  -4.161   2.889  -0.172
  172    HA   ARG  29           HA       ARG  29  -1.524   3.378  -0.913
  173    HB2  ARG  29           1HB      ARG  29  -3.836   5.302  -1.213
  174    HB3  ARG  29           2HB      ARG  29  -2.372   5.252  -2.187
  175    HG2  ARG  29           1HG      ARG  29  -4.325   2.973  -2.057
  176    HG3  ARG  29           2HG      ARG  29  -4.437   4.277  -3.240
  177    HD2  ARG  29           1HD      ARG  29  -2.140   2.359  -2.873
  178    HD3  ARG  29           2HD      ARG  29  -3.287   2.387  -4.212
  179    HE   ARG  29           HE       ARG  29  -2.213   4.849  -4.320
  180   HH11  ARG  29          1HH1      ARG  29  -0.796   1.676  -4.110
  181   HH12  ARG  29          2HH1      ARG  29   0.639   2.117  -4.975
  182   HH21  ARG  29          1HH2      ARG  29  -0.328   5.442  -5.460
  183   HH22  ARG  29          2HH2      ARG  29   0.905   4.259  -5.742
  184    H    ILE  30           H        ILE  30  -3.606   5.123   1.352
  185    HA   ILE  30           HA       ILE  30  -1.812   7.245   1.869
  186    HB   ILE  30           HB       ILE  30  -4.013   6.126   3.609
  187   HG12  ILE  30          1HG1      ILE  30  -4.108   8.651   1.976
  188   HG13  ILE  30          2HG1      ILE  30  -4.519   7.095   1.262
  189   HG21  ILE  30          1HG2      ILE  30  -2.013   8.131   4.129
  190   HG22  ILE  30          2HG2      ILE  30  -3.629   8.831   4.174
  191   HG23  ILE  30          3HG2      ILE  30  -3.235   7.459   5.208
  192   HD11  ILE  30          3HD1      ILE  30  -6.384   8.601   2.231
  193   HD12  ILE  30          1HD1      ILE  30  -6.420   6.866   2.541
  194   HD13  ILE  30          2HD1      ILE  30  -5.842   7.973   3.787
  195    H    HIS  31           H        HIS  31  -2.325   4.106   3.409
  196    HA   HIS  31           HA       HIS  31  -0.545   4.529   5.573
  197    HB2  HIS  31           1HB      HIS  31  -1.964   2.769   6.007
  198    HB3  HIS  31           2HB      HIS  31  -1.896   2.166   4.353
  199    HD1  HIS  31           HD1      HIS  31   0.043   2.117   7.581
  200    HD2  HIS  31           HD2      HIS  31   0.012   0.227   3.881
  201    HE1  HIS  31           HE1      HIS  31   1.650   0.195   7.795
  202    H    GLN  32           H        GLN  32  -0.162   2.928   2.426
  203    HA   GLN  32           HA       GLN  32   2.370   1.922   2.635
  204    HB2  GLN  32           1HB      GLN  32   0.980   3.234   0.309
  205    HB3  GLN  32           2HB      GLN  32   2.582   2.524   0.150
  206    HG2  GLN  32           1HG      GLN  32   1.616   0.376   0.992
  207    HG3  GLN  32           2HG      GLN  32   0.024   1.125   0.879
  208   HE21  GLN  32          1HE2      GLN  32  -0.820   1.624  -1.157
  209   HE22  GLN  32          2HE2      GLN  32  -0.206   0.897  -2.599
  210    H    ARG  33           H        ARG  33   1.422   5.273   2.262
  211    HA   ARG  33           HA       ARG  33   3.709   6.513   1.451
  212    HB2  ARG  33           1HB      ARG  33   1.907   7.436   3.697
  213    HB3  ARG  33           2HB      ARG  33   3.014   8.454   2.786
  214    HG2  ARG  33           1HG      ARG  33   1.715   7.827   0.723
  215    HG3  ARG  33           2HG      ARG  33   0.524   7.095   1.800
  216    HD2  ARG  33           1HD      ARG  33  -0.167   9.338   1.226
  217    HD3  ARG  33           2HD      ARG  33   0.257   9.266   2.935
  218    HE   ARG  33           HE       ARG  33   2.550  10.103   1.847
  219   HH11  ARG  33          1HH1      ARG  33  -0.737  11.155   1.386
  220   HH12  ARG  33          2HH1      ARG  33  -0.300  12.794   1.032
  221   HH21  ARG  33          1HH2      ARG  33   3.137  12.258   1.383
  222   HH22  ARG  33          2HH2      ARG  33   1.903  13.420   1.030
  223    H    VAL  34           H        VAL  34   3.089   5.026   4.555
  224    HA   VAL  34           HA       VAL  34   5.278   6.128   5.963
  225    HB   VAL  34           HB       VAL  34   4.882   4.519   7.640
  226   HG11  VAL  34          1HG1      VAL  34   2.130   4.323   7.063
  227   HG12  VAL  34          2HG1      VAL  34   2.944   5.504   8.091
  228   HG13  VAL  34          3HG1      VAL  34   2.688   5.849   6.380
  229   HG21  VAL  34          3HG2      VAL  34   5.047   2.503   6.325
  230   HG22  VAL  34          1HG2      VAL  34   3.542   2.472   7.244
  231   HG23  VAL  34          2HG2      VAL  34   3.517   2.858   5.523
  232    H    HIS  35           H        HIS  35   4.913   3.215   3.998
  233    HA   HIS  35           HA       HIS  35   7.470   2.134   4.563
  234    HB2  HIS  35           1HB      HIS  35   5.539   1.701   2.284
  235    HB3  HIS  35           2HB      HIS  35   7.057   0.820   2.428
  236    HD1  HIS  35           HD1      HIS  35   7.287  -0.595   4.754
  237    HD2  HIS  35           HD2      HIS  35   3.463   0.559   3.608
  238    HE1  HIS  35           HE1      HIS  35   5.721  -2.070   6.056
  239    H    MET  36           H        MET  36   6.273   4.375   2.132
  240    HA   MET  36           HA       MET  36   8.232   4.454   0.264
  241    HB2  MET  36           1HB      MET  36   6.810   6.763   1.586
  242    HB3  MET  36           2HB      MET  36   7.851   6.961   0.182
  243    HG2  MET  36           1HG      MET  36   6.342   5.166  -0.897
  244    HG3  MET  36           2HG      MET  36   5.215   5.574   0.394
  245    HE1  MET  36           3HE      MET  36   5.939   9.250   0.207
  246    HE2  MET  36           1HE      MET  36   4.205   9.052  -0.052
  247    HE3  MET  36           2HE      MET  36   5.050   8.009   1.092
  248    H    GLY  37           H        GLY  37  10.351   4.884   0.164
  249    HA2  GLY  37           1HA      GLY  37  11.609   6.073   2.561
  250    HA3  GLY  37           2HA      GLY  37  12.361   4.811   1.596
  251    H    GLU  38           H        GLU  38  11.968   5.710  -0.960
  252    HA   GLU  38           HA       GLU  38  13.993   7.700  -1.170
  253    HB2  GLU  38           1HB      GLU  38  12.283   6.195  -3.106
  254    HB3  GLU  38           2HB      GLU  38  13.163   7.609  -3.669
  255    HG2  GLU  38           1HG      GLU  38  15.222   6.631  -3.335
  256    HG3  GLU  38           2HG      GLU  38  14.598   5.476  -2.159
  257    H    LYS  39           H        LYS  39  13.245   9.557  -0.144
  258    HA   LYS  39           HA       LYS  39  10.941  10.894  -1.395
  259    HB2  LYS  39           1HB      LYS  39  10.729  10.545   1.022
  260    HB3  LYS  39           2HB      LYS  39  12.245  11.397   1.288
  261    HG2  LYS  39           1HG      LYS  39  11.172  13.413   0.237
  262    HG3  LYS  39           2HG      LYS  39   9.644  12.529   0.293
  263    HD2  LYS  39           1HD      LYS  39   9.946  12.270   2.744
  264    HD3  LYS  39           2HD      LYS  39  11.390  13.279   2.638
  265    HE2  LYS  39           1HE      LYS  39   8.614  14.128   1.817
  266    HE3  LYS  39           2HE      LYS  39   9.385  14.535   3.350
  267    HZ1  LYS  39           3HZ      LYS  39   9.489  16.085   1.193
  268    HZ2  LYS  39           1HZ      LYS  39  10.903  15.185   0.963
  269    HZ3  LYS  39           2HZ      LYS  39  10.688  16.074   2.386
  270    H    CYS  40           H        CYS  40  11.714  12.064  -3.058
  271    HA   CYS  40           HA       CYS  40  14.226  13.191  -3.326
  272    HB2  CYS  40           1HB      CYS  40  12.636  12.972  -5.184
  273    HB3  CYS  40           2HB      CYS  40  11.615  14.211  -4.464
  274    HG   CYS  40           HG       CYS  40  14.199  15.880  -4.611
  275    H    SER  41           H        SER  41  15.134  15.167  -2.870
  276    HA   SER  41           HA       SER  41  14.713  16.422  -0.525
  277    HB2  SER  41           1HB      SER  41  15.841  17.365  -3.119
  278    HB3  SER  41           2HB      SER  41  15.556  18.569  -1.862
  279    HG   SER  41           HG       SER  41  17.673  17.552  -1.829
  280    H    GLY  42           H        GLY  42  13.263  17.471  -3.608
  281    HA2  GLY  42           1HA      GLY  42  11.004  18.198  -3.793
  282    HA3  GLY  42           2HA      GLY  42  11.020  18.588  -2.080
  283    HA   PRO  43           HA       PRO  43  11.782  22.382  -4.825
  284    HB2  PRO  43           1HB      PRO  43   9.393  23.608  -4.424
  285    HB3  PRO  43           2HB      PRO  43   9.682  22.481  -5.754
  286    HG2  PRO  43           1HG      PRO  43   8.350  21.998  -3.117
  287    HG3  PRO  43           2HG      PRO  43   7.869  21.445  -4.732
  288    HD2  PRO  43           1HD      PRO  43   9.155  19.844  -2.968
  289    HD3  PRO  43           2HD      PRO  43   9.377  19.703  -4.723
  290    H    SER  44           H        SER  44   9.849  22.215  -1.832
  291    HA   SER  44           HA       SER  44  11.754  23.585  -0.270
  292    HB2  SER  44           1HB      SER  44  11.029  25.516  -1.634
  293    HB3  SER  44           2HB      SER  44   9.368  25.255  -1.102
  294    HG   SER  44           HG       SER  44  11.556  25.784   0.628
  295    H    SER  45           H        SER  45  11.389  23.073   1.792
  296    HA   SER  45           HA       SER  45   8.722  22.054   2.500
  297    HB2  SER  45           1HB      SER  45  10.765  20.535   2.674
  298    HB3  SER  45           2HB      SER  45  11.279  21.547   4.023
  299    HG   SER  45           HG       SER  45  10.091  20.141   5.082
  300    H    GLY  46           H        GLY  46   7.501  23.308   3.737
  301    HA2  GLY  46           1HA      GLY  46   8.839  25.302   5.454
  302    HA3  GLY  46           2HA      GLY  46   7.243  25.510   4.748
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1 -20.914  -6.883 -22.229
    2    HA2  GLY   1           1HA      GLY   1 -23.198  -6.674 -21.586
    3    HA3  GLY   1           2HA      GLY   1 -23.642  -7.700 -22.942
    4    H    SER   2           H        SER   2 -22.124  -9.901 -22.649
    5    HA   SER   2           HA       SER   2 -23.466 -11.391 -20.724
    6    HB2  SER   2           1HB      SER   2 -21.894 -13.177 -21.210
    7    HB3  SER   2           2HB      SER   2 -22.294 -12.338 -22.709
    8    HG   SER   2           HG       SER   2 -20.264 -11.046 -21.956
    9    H    SER   3           H        SER   3 -23.097 -11.926 -18.639
   10    HA   SER   3           HA       SER   3 -20.615 -11.675 -17.313
   11    HB2  SER   3           1HB      SER   3 -21.241  -9.785 -15.789
   12    HB3  SER   3           2HB      SER   3 -20.960  -9.291 -17.458
   13    HG   SER   3           HG       SER   3 -23.370  -9.613 -17.627
   14    H    GLY   4           H        GLY   4 -20.649 -12.665 -15.329
   15    HA2  GLY   4           1HA      GLY   4 -23.199 -13.196 -14.026
   16    HA3  GLY   4           2HA      GLY   4 -22.349 -14.600 -14.654
   17    H    SER   5           H        SER   5 -21.432 -11.665 -12.844
   18    HA   SER   5           HA       SER   5 -20.002 -13.419 -10.955
   19    HB2  SER   5           1HB      SER   5 -18.529 -11.417 -10.530
   20    HB3  SER   5           2HB      SER   5 -18.389 -12.100 -12.150
   21    HG   SER   5           HG       SER   5 -18.571  -9.880 -12.328
   22    H    SER   6           H        SER   6 -19.862 -12.636  -8.737
   23    HA   SER   6           HA       SER   6 -22.401 -11.507  -7.893
   24    HB2  SER   6           1HB      SER   6 -21.865 -12.295  -5.710
   25    HB3  SER   6           2HB      SER   6 -21.328 -13.552  -6.825
   26    HG   SER   6           HG       SER   6 -19.873 -12.586  -5.011
   27    H    GLY   7           H        GLY   7 -22.636  -9.673  -6.592
   28    HA2  GLY   7           1HA      GLY   7 -20.409  -7.765  -6.837
   29    HA3  GLY   7           2HA      GLY   7 -22.103  -7.335  -6.653
   30    H    SER   8           H        SER   8 -19.276  -8.610  -4.986
   31    HA   SER   8           HA       SER   8 -20.279  -7.442  -2.504
   32    HB2  SER   8           1HB      SER   8 -20.021  -9.395  -1.202
   33    HB3  SER   8           2HB      SER   8 -20.863  -9.942  -2.652
   34    HG   SER   8           HG       SER   8 -18.727 -10.517  -3.462
   35    H    GLY   9           H        GLY   9 -18.592  -7.239  -0.846
   36    HA2  GLY   9           1HA      GLY   9 -15.956  -6.874  -2.117
   37    HA3  GLY   9           2HA      GLY   9 -16.553  -5.942  -0.752
   38    H    GLU  10           H        GLU  10 -16.292  -9.433  -1.433
   39    HA   GLU  10           HA       GLU  10 -15.662 -10.108   1.231
   40    HB2  GLU  10           1HB      GLU  10 -15.030 -12.316   0.297
   41    HB3  GLU  10           2HB      GLU  10 -16.600 -11.757  -0.264
   42    HG2  GLU  10           1HG      GLU  10 -15.150 -10.822  -2.265
   43    HG3  GLU  10           2HG      GLU  10 -14.065 -12.116  -1.759
   44    H    LYS  11           H        LYS  11 -13.622  -9.695  -1.644
   45    HA   LYS  11           HA       LYS  11 -11.176 -10.412  -0.536
   46    HB2  LYS  11           1HB      LYS  11 -10.151  -9.291  -2.362
   47    HB3  LYS  11           2HB      LYS  11 -11.681  -9.916  -2.964
   48    HG2  LYS  11           1HG      LYS  11 -11.522  -7.119  -1.935
   49    HG3  LYS  11           2HG      LYS  11 -10.942  -7.502  -3.557
   50    HD2  LYS  11           1HD      LYS  11 -13.193  -8.598  -3.953
   51    HD3  LYS  11           2HD      LYS  11 -13.719  -7.845  -2.445
   52    HE2  LYS  11           1HE      LYS  11 -14.395  -6.352  -4.118
   53    HE3  LYS  11           2HE      LYS  11 -12.915  -5.648  -3.468
   54    HZ1  LYS  11           3HZ      LYS  11 -11.714  -6.708  -5.338
   55    HZ2  LYS  11           1HZ      LYS  11 -12.833  -5.540  -5.833
   56    HZ3  LYS  11           2HZ      LYS  11 -13.201  -7.183  -5.991
   57    H    SER  12           H        SER  12  -9.325  -8.837  -0.156
   58    HA   SER  12           HA       SER  12 -10.019  -6.279   0.973
   59    HB2  SER  12           1HB      SER  12  -9.164  -6.793   3.237
   60    HB3  SER  12           2HB      SER  12 -10.603  -7.735   2.847
   61    HG   SER  12           HG       SER  12  -9.254  -9.501   2.393
   62    H    HIS  13           H        HIS  13  -8.472  -5.047   0.148
   63    HA   HIS  13           HA       HIS  13  -6.034  -5.891  -0.865
   64    HB2  HIS  13           1HB      HIS  13  -6.501  -3.145   0.294
   65    HB3  HIS  13           2HB      HIS  13  -5.432  -3.590  -1.032
   66    HD1  HIS  13           HD1      HIS  13  -6.595  -4.181  -3.325
   67    HD2  HIS  13           HD2      HIS  13  -9.111  -2.609  -0.417
   68    HE1  HIS  13           HE1      HIS  13  -8.685  -3.494  -4.544
   69    H    THR  14           H        THR  14  -4.048  -6.250  -0.048
   70    HA   THR  14           HA       THR  14  -3.630  -5.708   2.820
   71    HB   THR  14           HB       THR  14  -2.720  -8.139   1.268
   72    HG1  THR  14           HG1      THR  14  -4.305  -8.180   3.599
   73   HG21  THR  14          3HG2      THR  14  -1.675  -6.907   3.663
   74   HG22  THR  14          1HG2      THR  14  -1.061  -8.288   2.754
   75   HG23  THR  14          2HG2      THR  14  -2.287  -8.527   4.000
   76    H    CYS  15           H        CYS  15  -1.686  -4.871   3.420
   77    HA   CYS  15           HA       CYS  15  -0.048  -3.742   1.339
   78    HB2  CYS  15           1HB      CYS  15  -0.602  -2.504   3.422
   79    HB3  CYS  15           2HB      CYS  15   0.346  -3.672   4.338
   80    H    ASP  16           H        ASP  16   1.424  -4.937   0.336
   81    HA   ASP  16           HA       ASP  16   2.534  -7.316   1.416
   82    HB2  ASP  16           1HB      ASP  16   3.296  -5.652  -0.988
   83    HB3  ASP  16           2HB      ASP  16   4.050  -7.194  -0.592
   84    H    GLU  17           H        GLU  17   3.291  -4.041   1.837
   85    HA   GLU  17           HA       GLU  17   6.105  -4.278   2.226
   86    HB2  GLU  17           1HB      GLU  17   4.322  -2.156   3.412
   87    HB3  GLU  17           2HB      GLU  17   6.032  -2.034   3.023
   88    HG2  GLU  17           1HG      GLU  17   4.074  -2.591   0.848
   89    HG3  GLU  17           2HG      GLU  17   4.237  -0.952   1.476
   90    H    CYS  18           H        CYS  18   3.313  -4.207   4.412
   91    HA   CYS  18           HA       CYS  18   5.059  -5.276   6.533
   92    HB2  CYS  18           1HB      CYS  18   3.625  -4.134   8.178
   93    HB3  CYS  18           2HB      CYS  18   4.383  -2.991   7.074
   94    H    GLY  19           H        GLY  19   1.779  -5.198   5.196
   95    HA2  GLY  19           1HA      GLY  19   0.751  -7.413   4.821
   96    HA3  GLY  19           2HA      GLY  19   1.334  -7.852   6.420
   97    H    LYS  20           H        LYS  20   0.118  -4.661   6.011
   98    HA   LYS  20           HA       LYS  20  -1.936  -5.086   7.939
   99    HB2  LYS  20           1HB      LYS  20  -1.000  -2.778   6.290
  100    HB3  LYS  20           2HB      LYS  20  -2.581  -2.677   7.055
  101    HG2  LYS  20           1HG      LYS  20  -0.188  -3.445   8.667
  102    HG3  LYS  20           2HG      LYS  20  -0.497  -1.751   8.281
  103    HD2  LYS  20           1HD      LYS  20  -2.503  -1.722   9.472
  104    HD3  LYS  20           2HD      LYS  20  -2.645  -3.481   9.459
  105    HE2  LYS  20           1HE      LYS  20  -1.050  -3.744  11.131
  106    HE3  LYS  20           2HE      LYS  20  -0.357  -2.146  10.856
  107    HZ1  LYS  20           3HZ      LYS  20  -1.705  -2.335  12.912
  108    HZ2  LYS  20           1HZ      LYS  20  -3.075  -2.598  11.956
  109    HZ3  LYS  20           2HZ      LYS  20  -2.245  -1.128  11.857
  110    H    ASN  21           H        ASN  21  -4.195  -4.027   7.366
  111    HA   ASN  21           HA       ASN  21  -5.114  -5.124   4.796
  112    HB2  ASN  21           1HB      ASN  21  -5.628  -6.581   6.849
  113    HB3  ASN  21           2HB      ASN  21  -6.758  -5.312   7.315
  114   HD21  ASN  21          1HD2      ASN  21  -5.888  -7.136   4.394
  115   HD22  ASN  21          2HD2      ASN  21  -7.514  -7.459   3.909
  116    H    PHE  22           H        PHE  22  -6.644  -3.952   3.721
  117    HA   PHE  22           HA       PHE  22  -7.889  -1.672   5.048
  118    HB2  PHE  22           1HB      PHE  22  -6.350  -1.337   2.468
  119    HB3  PHE  22           2HB      PHE  22  -7.167  -0.077   3.387
  120    HD1  PHE  22           HD2      PHE  22  -4.245  -2.278   3.237
  121    HD2  PHE  22           HD1      PHE  22  -6.177   0.863   5.363
  122    HE1  PHE  22           HE2      PHE  22  -2.165  -1.842   4.477
  123    HE2  PHE  22           HE1      PHE  22  -4.100   1.304   6.605
  124    HZ   PHE  22           HZ       PHE  22  -2.090  -0.050   6.164
  125    H    CYS  23           H        CYS  23  -9.980  -1.970   4.674
  126    HA   CYS  23           HA       CYS  23 -11.182  -3.607   2.852
  127    HB2  CYS  23           1HB      CYS  23 -12.138  -1.057   4.132
  128    HB3  CYS  23           2HB      CYS  23 -13.175  -1.977   3.049
  129    HG   CYS  23           HG       CYS  23 -11.744  -3.635   5.631
  130    H    TYR  24           H        TYR  24 -10.417  -0.169   2.408
  131    HA   TYR  24           HA       TYR  24 -11.012  -0.474  -0.458
  132    HB2  TYR  24           1HB      TYR  24 -10.808   2.179  -0.213
  133    HB3  TYR  24           2HB      TYR  24 -12.310   1.319   0.105
  134    HD1  TYR  24           HD2      TYR  24 -12.876   0.733   2.506
  135    HD2  TYR  24           HD1      TYR  24  -9.754   3.434   1.474
  136    HE1  TYR  24           HE2      TYR  24 -12.920   1.648   4.789
  137    HE2  TYR  24           HE1      TYR  24  -9.789   4.355   3.754
  138    HH   TYR  24           HH       TYR  24 -11.924   3.011   6.246
  139    H    ILE  25           H        ILE  25  -9.433  -0.269  -1.923
  140    HA   ILE  25           HA       ILE  25  -6.757  -0.457  -1.304
  141    HB   ILE  25           HB       ILE  25  -7.858  -0.850  -3.559
  142   HG12  ILE  25          1HG1      ILE  25  -5.761  -0.051  -4.806
  143   HG13  ILE  25          2HG1      ILE  25  -5.228   0.591  -3.256
  144   HG21  ILE  25          1HG2      ILE  25  -7.851   1.029  -5.130
  145   HG22  ILE  25          2HG2      ILE  25  -8.951   1.312  -3.782
  146   HG23  ILE  25          3HG2      ILE  25  -7.382   2.116  -3.822
  147   HD11  ILE  25          3HD1      ILE  25  -4.301  -1.398  -2.931
  148   HD12  ILE  25          1HD1      ILE  25  -5.937  -1.991  -2.649
  149   HD13  ILE  25          2HD1      ILE  25  -5.212  -2.132  -4.251
  150    H    SER  26           H        SER  26  -8.689   2.440  -1.830
  151    HA   SER  26           HA       SER  26  -6.732   4.366  -2.055
  152    HB2  SER  26           1HB      SER  26  -8.388   5.910  -1.646
  153    HB3  SER  26           2HB      SER  26  -9.389   4.495  -1.972
  154    HG   SER  26           HG       SER  26 -10.164   5.226  -0.087
  155    H    ALA  27           H        ALA  27  -8.030   2.894   0.891
  156    HA   ALA  27           HA       ALA  27  -6.658   4.489   2.747
  157    HB1  ALA  27           3HB      ALA  27  -8.343   2.204   2.813
  158    HB2  ALA  27           1HB      ALA  27  -6.924   1.873   3.807
  159    HB3  ALA  27           2HB      ALA  27  -7.915   3.296   4.130
  160    H    LEU  28           H        LEU  28  -5.803   1.315   1.377
  161    HA   LEU  28           HA       LEU  28  -3.431   0.867   2.709
  162    HB2  LEU  28           1HB      LEU  28  -4.121  -0.905   1.416
  163    HB3  LEU  28           2HB      LEU  28  -4.461   0.112   0.017
  164    HG   LEU  28           HG       LEU  28  -1.935   0.371  -0.206
  165   HD11  LEU  28          1HD1      LEU  28  -2.042  -1.179   2.181
  166   HD12  LEU  28          2HD1      LEU  28  -0.634  -0.523   1.347
  167   HD13  LEU  28          3HD1      LEU  28  -1.243  -2.123   0.923
  168   HD21  LEU  28          3HD2      LEU  28  -2.658  -0.932  -1.894
  169   HD22  LEU  28          1HD2      LEU  28  -3.629  -1.952  -0.833
  170   HD23  LEU  28          2HD2      LEU  28  -1.891  -2.221  -0.965
  171    H    ARG  29           H        ARG  29  -3.920   2.671  -0.313
  172    HA   ARG  29           HA       ARG  29  -1.264   3.285  -0.861
  173    HB2  ARG  29           1HB      ARG  29  -3.634   5.089  -1.372
  174    HB3  ARG  29           2HB      ARG  29  -2.102   5.088  -2.235
  175    HG2  ARG  29           1HG      ARG  29  -4.008   2.760  -2.203
  176    HG3  ARG  29           2HG      ARG  29  -3.989   4.008  -3.450
  177    HD2  ARG  29           1HD      ARG  29  -1.753   2.114  -2.743
  178    HD3  ARG  29           2HD      ARG  29  -2.731   2.096  -4.210
  179    HE   ARG  29           HE       ARG  29  -1.575   4.586  -4.131
  180   HH11  ARG  29          1HH1      ARG  29  -0.448   1.293  -4.173
  181   HH12  ARG  29          2HH1      ARG  29   1.027   1.671  -5.001
  182   HH21  ARG  29          1HH2      ARG  29   0.363   5.096  -5.221
  183   HH22  ARG  29          2HH2      ARG  29   1.487   3.835  -5.595
  184    H    ILE  30           H        ILE  30  -3.605   4.995   1.173
  185    HA   ILE  30           HA       ILE  30  -1.962   7.202   1.789
  186    HB   ILE  30           HB       ILE  30  -4.220   5.998   3.393
  187   HG12  ILE  30          1HG1      ILE  30  -4.324   8.471   1.680
  188   HG13  ILE  30          2HG1      ILE  30  -4.624   6.875   1.000
  189   HG21  ILE  30          1HG2      ILE  30  -2.636   8.518   3.717
  190   HG22  ILE  30          2HG2      ILE  30  -4.305   8.421   4.276
  191   HG23  ILE  30          3HG2      ILE  30  -3.091   7.323   4.932
  192   HD11  ILE  30          3HD1      ILE  30  -6.731   7.046   1.630
  193   HD12  ILE  30          1HD1      ILE  30  -6.207   7.078   3.314
  194   HD13  ILE  30          2HD1      ILE  30  -6.399   8.587   2.421
  195    H    HIS  31           H        HIS  31  -2.373   4.044   3.302
  196    HA   HIS  31           HA       HIS  31  -0.772   4.620   5.587
  197    HB2  HIS  31           1HB      HIS  31  -2.150   2.824   6.001
  198    HB3  HIS  31           2HB      HIS  31  -1.969   2.172   4.375
  199    HD1  HIS  31           HD1      HIS  31  -0.040   2.430   7.625
  200    HD2  HIS  31           HD2      HIS  31  -0.147   0.152   4.152
  201    HE1  HIS  31           HE1      HIS  31   1.574   0.540   8.011
  202    H    GLN  32           H        GLN  32  -0.149   3.072   2.466
  203    HA   GLN  32           HA       GLN  32   2.390   2.101   2.848
  204    HB2  GLN  32           1HB      GLN  32   1.081   3.347   0.445
  205    HB3  GLN  32           2HB      GLN  32   2.732   2.744   0.371
  206    HG2  GLN  32           1HG      GLN  32   1.764   0.549   1.268
  207    HG3  GLN  32           2HG      GLN  32   0.196   1.218   0.818
  208   HE21  GLN  32          1HE2      GLN  32   0.176   2.144  -1.473
  209   HE22  GLN  32          2HE2      GLN  32   0.906   1.158  -2.690
  210    H    ARG  33           H        ARG  33   1.364   5.379   2.810
  211    HA   ARG  33           HA       ARG  33   3.644   6.732   1.998
  212    HB2  ARG  33           1HB      ARG  33   1.635   7.466   4.132
  213    HB3  ARG  33           2HB      ARG  33   2.848   8.572   3.500
  214    HG2  ARG  33           1HG      ARG  33   1.872   8.413   1.284
  215    HG3  ARG  33           2HG      ARG  33   0.685   7.249   1.876
  216    HD2  ARG  33           1HD      ARG  33  -0.518   8.837   2.997
  217    HD3  ARG  33           2HD      ARG  33   0.888   9.866   3.266
  218    HE   ARG  33           HE       ARG  33   0.506   9.979   0.579
  219   HH11  ARG  33          1HH1      ARG  33  -1.528  10.551   3.346
  220   HH12  ARG  33          2HH1      ARG  33  -2.503  11.739   2.548
  221   HH21  ARG  33          1HH2      ARG  33  -0.771  11.542  -0.484
  222   HH22  ARG  33          2HH2      ARG  33  -2.073  12.301   0.369
  223    H    VAL  34           H        VAL  34   3.110   4.854   4.827
  224    HA   VAL  34           HA       VAL  34   5.188   6.048   6.411
  225    HB   VAL  34           HB       VAL  34   4.812   4.284   7.991
  226   HG11  VAL  34          1HG1      VAL  34   3.066   6.108   7.643
  227   HG12  VAL  34          2HG1      VAL  34   2.093   4.866   6.853
  228   HG13  VAL  34          3HG1      VAL  34   2.563   4.677   8.543
  229   HG21  VAL  34          3HG2      VAL  34   4.156   2.214   7.468
  230   HG22  VAL  34          1HG2      VAL  34   2.773   2.801   6.543
  231   HG23  VAL  34          2HG2      VAL  34   4.360   2.692   5.783
  232    H    HIS  35           H        HIS  35   5.013   3.633   3.959
  233    HA   HIS  35           HA       HIS  35   7.569   2.443   4.663
  234    HB2  HIS  35           1HB      HIS  35   5.628   1.934   2.405
  235    HB3  HIS  35           2HB      HIS  35   7.170   1.098   2.561
  236    HD1  HIS  35           HD1      HIS  35   7.433  -0.444   4.722
  237    HD2  HIS  35           HD2      HIS  35   3.586   0.903   3.915
  238    HE1  HIS  35           HE1      HIS  35   5.907  -1.912   6.081
  239    H    MET  36           H        MET  36   7.100   5.320   3.686
  240    HA   MET  36           HA       MET  36   8.907   5.270   1.368
  241    HB2  MET  36           1HB      MET  36   7.145   7.500   2.399
  242    HB3  MET  36           2HB      MET  36   8.176   7.594   0.978
  243    HG2  MET  36           1HG      MET  36   6.823   5.549   0.160
  244    HG3  MET  36           2HG      MET  36   5.656   6.047   1.383
  245    HE1  MET  36           3HE      MET  36   4.688   9.629   0.224
  246    HE2  MET  36           1HE      MET  36   4.779   8.489   1.566
  247    HE3  MET  36           2HE      MET  36   6.207   9.410   1.093
  248    H    GLY  37           H        GLY  37  10.445   7.189   1.279
  249    HA2  GLY  37           1HA      GLY  37  11.333   8.176   3.863
  250    HA3  GLY  37           2HA      GLY  37  12.436   7.063   3.068
  251    H    GLU  38           H        GLU  38  11.955   7.905   0.395
  252    HA   GLU  38           HA       GLU  38  12.958  10.673   0.455
  253    HB2  GLU  38           1HB      GLU  38  14.660   8.726   0.013
  254    HB3  GLU  38           2HB      GLU  38  13.947   8.727  -1.593
  255    HG2  GLU  38           1HG      GLU  38  15.277  11.061  -0.239
  256    HG3  GLU  38           2HG      GLU  38  15.954  10.079  -1.536
  257    H    LYS  39           H        LYS  39  11.606   8.127  -1.628
  258    HA   LYS  39           HA       LYS  39  10.770   9.894  -3.682
  259    HB2  LYS  39           1HB      LYS  39  10.260   7.042  -2.979
  260    HB3  LYS  39           2HB      LYS  39   9.165   7.817  -4.116
  261    HG2  LYS  39           1HG      LYS  39  10.778   6.808  -5.458
  262    HG3  LYS  39           2HG      LYS  39  11.262   8.504  -5.399
  263    HD2  LYS  39           1HD      LYS  39  13.066   8.075  -4.012
  264    HD3  LYS  39           2HD      LYS  39  12.376   6.565  -3.412
  265    HE2  LYS  39           1HE      LYS  39  14.165   5.959  -4.837
  266    HE3  LYS  39           2HE      LYS  39  12.684   5.641  -5.739
  267    HZ1  LYS  39           3HZ      LYS  39  14.737   7.668  -6.194
  268    HZ2  LYS  39           1HZ      LYS  39  13.139   8.089  -6.556
  269    HZ3  LYS  39           2HZ      LYS  39  13.853   6.755  -7.311
  270    H    CYS  40           H        CYS  40   9.026  11.150  -3.840
  271    HA   CYS  40           HA       CYS  40   6.519  10.563  -2.664
  272    HB2  CYS  40           1HB      CYS  40   7.917  11.309  -0.662
  273    HB3  CYS  40           2HB      CYS  40   7.916  12.911  -1.389
  274    HG   CYS  40           HG       CYS  40   5.942  13.393   0.260
  275    H    SER  41           H        SER  41   4.904  11.819  -3.513
  276    HA   SER  41           HA       SER  41   5.690  13.578  -5.685
  277    HB2  SER  41           1HB      SER  41   3.942  11.903  -6.087
  278    HB3  SER  41           2HB      SER  41   2.951  12.620  -4.817
  279    HG   SER  41           HG       SER  41   2.543  14.330  -6.072
  280    H    GLY  42           H        GLY  42   6.061  15.650  -5.263
  281    HA2  GLY  42           1HA      GLY  42   5.947  17.722  -4.264
  282    HA3  GLY  42           2HA      GLY  42   4.212  17.483  -4.412
  283    HA   PRO  43           HA       PRO  43   5.375  15.922   0.015
  284    HB2  PRO  43           1HB      PRO  43   7.925  16.363   0.836
  285    HB3  PRO  43           2HB      PRO  43   7.424  14.884   0.008
  286    HG2  PRO  43           1HG      PRO  43   8.793  17.304  -1.101
  287    HG3  PRO  43           2HG      PRO  43   9.122  15.590  -1.415
  288    HD2  PRO  43           1HD      PRO  43   7.708  17.140  -3.127
  289    HD3  PRO  43           2HD      PRO  43   7.390  15.405  -2.925
  290    H    SER  44           H        SER  44   5.189  17.100   1.926
  291    HA   SER  44           HA       SER  44   6.043  19.894   1.921
  292    HB2  SER  44           1HB      SER  44   3.809  20.674   2.609
  293    HB3  SER  44           2HB      SER  44   3.764  19.936   1.008
  294    HG   SER  44           HG       SER  44   3.087  17.974   2.134
  295    H    SER  45           H        SER  45   6.399  20.754   3.947
  296    HA   SER  45           HA       SER  45   6.462  18.796   6.120
  297    HB2  SER  45           1HB      SER  45   8.077  20.231   7.183
  298    HB3  SER  45           2HB      SER  45   8.537  20.070   5.488
  299    HG   SER  45           HG       SER  45   8.634  22.240   6.165
  300    H    GLY  46           H        GLY  46   4.891  18.798   7.576
  301    HA2  GLY  46           1HA      GLY  46   4.053  20.695   9.256
  302    HA3  GLY  46           2HA      GLY  46   3.135  21.107   7.815
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1  -0.068 -20.629 -20.143
    2    HA2  GLY   1           1HA      GLY   1   0.316 -18.482 -18.649
    3    HA3  GLY   1           2HA      GLY   1   0.126 -17.715 -20.218
    4    H    SER   2           H        SER   2  -1.652 -16.754 -18.739
    5    HA   SER   2           HA       SER   2  -4.130 -18.123 -19.451
    6    HB2  SER   2           1HB      SER   2  -3.197 -17.584 -16.673
    7    HB3  SER   2           2HB      SER   2  -4.905 -17.324 -17.024
    8    HG   SER   2           HG       SER   2  -3.499 -19.660 -16.800
    9    H    SER   3           H        SER   3  -6.034 -16.709 -19.236
   10    HA   SER   3           HA       SER   3  -5.399 -14.054 -20.167
   11    HB2  SER   3           1HB      SER   3  -7.961 -15.604 -19.843
   12    HB3  SER   3           2HB      SER   3  -7.971 -13.891 -20.258
   13    HG   SER   3           HG       SER   3  -6.314 -14.782 -21.933
   14    H    GLY   4           H        GLY   4  -6.580 -12.142 -19.293
   15    HA2  GLY   4           1HA      GLY   4  -6.161 -12.007 -16.437
   16    HA3  GLY   4           2HA      GLY   4  -6.605 -10.675 -17.494
   17    H    SER   5           H        SER   5  -7.704 -12.977 -15.237
   18    HA   SER   5           HA       SER   5 -10.482 -12.102 -15.687
   19    HB2  SER   5           1HB      SER   5 -10.244 -14.475 -16.235
   20    HB3  SER   5           2HB      SER   5  -9.527 -14.784 -14.653
   21    HG   SER   5           HG       SER   5 -12.072 -13.599 -14.859
   22    H    SER   6           H        SER   6  -8.165 -13.251 -13.253
   23    HA   SER   6           HA       SER   6  -9.613 -12.771 -10.956
   24    HB2  SER   6           1HB      SER   6  -6.648 -12.255 -11.274
   25    HB3  SER   6           2HB      SER   6  -7.500 -12.654  -9.783
   26    HG   SER   6           HG       SER   6  -6.514 -14.499 -10.639
   27    H    GLY   7           H        GLY   7 -10.306 -11.019  -9.894
   28    HA2  GLY   7           1HA      GLY   7  -9.071  -8.555  -9.677
   29    HA3  GLY   7           2HA      GLY   7 -10.103  -8.445 -11.095
   30    H    SER   8           H        SER   8 -10.205  -9.437  -7.679
   31    HA   SER   8           HA       SER   8 -12.996  -8.509  -7.583
   32    HB2  SER   8           1HB      SER   8 -12.623 -10.886  -6.972
   33    HB3  SER   8           2HB      SER   8 -11.562 -10.362  -5.665
   34    HG   SER   8           HG       SER   8 -14.334  -9.833  -5.951
   35    H    GLY   9           H        GLY   9 -13.558  -6.847  -6.301
   36    HA2  GLY   9           1HA      GLY   9 -11.419  -5.416  -4.940
   37    HA3  GLY   9           2HA      GLY   9 -13.043  -4.819  -5.246
   38    H    GLU  10           H        GLU  10 -14.632  -6.704  -4.107
   39    HA   GLU  10           HA       GLU  10 -14.977  -6.029  -1.549
   40    HB2  GLU  10           1HB      GLU  10 -16.033  -8.193  -1.131
   41    HB3  GLU  10           2HB      GLU  10 -16.450  -7.591  -2.729
   42    HG2  GLU  10           1HG      GLU  10 -15.991  -9.748  -3.252
   43    HG3  GLU  10           2HG      GLU  10 -14.379  -9.061  -3.440
   44    H    LYS  11           H        LYS  11 -12.696  -8.510  -2.636
   45    HA   LYS  11           HA       LYS  11 -11.827  -9.506  -0.221
   46    HB2  LYS  11           1HB      LYS  11 -11.129 -10.084  -2.666
   47    HB3  LYS  11           2HB      LYS  11  -9.853  -8.905  -2.399
   48    HG2  LYS  11           1HG      LYS  11  -9.394 -10.302  -0.249
   49    HG3  LYS  11           2HG      LYS  11 -10.278 -11.561  -1.114
   50    HD2  LYS  11           1HD      LYS  11  -8.086 -10.099  -2.515
   51    HD3  LYS  11           2HD      LYS  11  -7.671 -11.351  -1.342
   52    HE2  LYS  11           1HE      LYS  11  -7.762 -12.476  -3.393
   53    HE3  LYS  11           2HE      LYS  11  -9.305 -12.841  -2.621
   54    HZ1  LYS  11           3HZ      LYS  11 -10.223 -12.129  -4.501
   55    HZ2  LYS  11           1HZ      LYS  11  -8.781 -11.444  -5.061
   56    HZ3  LYS  11           2HZ      LYS  11  -9.792 -10.562  -4.032
   57    H    SER  12           H        SER  12 -10.946  -8.607   1.511
   58    HA   SER  12           HA       SER  12 -10.226  -5.891   1.651
   59    HB2  SER  12           1HB      SER  12  -9.448  -6.396   3.914
   60    HB3  SER  12           2HB      SER  12 -10.983  -7.207   3.603
   61    HG   SER  12           HG       SER  12  -8.415  -8.404   3.408
   62    H    HIS  13           H        HIS  13  -8.496  -4.953   0.811
   63    HA   HIS  13           HA       HIS  13  -6.261  -6.338  -0.191
   64    HB2  HIS  13           1HB      HIS  13  -6.448  -3.408   0.538
   65    HB3  HIS  13           2HB      HIS  13  -5.274  -4.139  -0.552
   66    HD1  HIS  13           HD1      HIS  13  -6.066  -4.724  -2.928
   67    HD2  HIS  13           HD2      HIS  13  -9.022  -3.055  -0.533
   68    HE1  HIS  13           HE1      HIS  13  -7.948  -4.142  -4.490
   69    H    THR  14           H        THR  14  -4.140  -6.500   0.551
   70    HA   THR  14           HA       THR  14  -3.709  -5.843   3.389
   71    HB   THR  14           HB       THR  14  -2.876  -8.413   2.026
   72    HG1  THR  14           HG1      THR  14  -5.173  -7.956   2.877
   73   HG21  THR  14          3HG2      THR  14  -1.515  -7.168   4.010
   74   HG22  THR  14          1HG2      THR  14  -1.574  -8.918   3.802
   75   HG23  THR  14          2HG2      THR  14  -2.657  -8.129   4.950
   76    H    CYS  15           H        CYS  15  -1.891  -4.754   3.779
   77    HA   CYS  15           HA       CYS  15  -0.189  -3.921   1.681
   78    HB2  CYS  15           1HB      CYS  15  -0.685  -2.687   3.850
   79    HB3  CYS  15           2HB      CYS  15   0.457  -3.780   4.626
   80    H    ASP  16           H        ASP  16   1.235  -5.173   0.682
   81    HA   ASP  16           HA       ASP  16   2.286  -7.564   1.820
   82    HB2  ASP  16           1HB      ASP  16   3.877  -7.236  -0.299
   83    HB3  ASP  16           2HB      ASP  16   2.213  -7.793  -0.454
   84    H    GLU  17           H        GLU  17   3.250  -4.275   1.877
   85    HA   GLU  17           HA       GLU  17   6.038  -4.608   2.217
   86    HB2  GLU  17           1HB      GLU  17   4.146  -2.399   3.015
   87    HB3  GLU  17           2HB      GLU  17   5.880  -2.309   3.290
   88    HG2  GLU  17           1HG      GLU  17   4.923  -2.932   0.549
   89    HG3  GLU  17           2HG      GLU  17   4.759  -1.281   1.142
   90    H    CYS  18           H        CYS  18   3.411  -4.152   4.575
   91    HA   CYS  18           HA       CYS  18   5.221  -5.188   6.657
   92    HB2  CYS  18           1HB      CYS  18   3.765  -3.981   8.278
   93    HB3  CYS  18           2HB      CYS  18   4.581  -2.910   7.145
   94    H    GLY  19           H        GLY  19   1.883  -5.209   5.465
   95    HA2  GLY  19           1HA      GLY  19   0.913  -7.496   5.267
   96    HA3  GLY  19           2HA      GLY  19   1.494  -7.762   6.904
   97    H    LYS  20           H        LYS  20   0.365  -4.614   6.448
   98    HA   LYS  20           HA       LYS  20  -1.720  -4.884   8.311
   99    HB2  LYS  20           1HB      LYS  20  -0.818  -2.743   6.439
  100    HB3  LYS  20           2HB      LYS  20  -2.406  -2.584   7.179
  101    HG2  LYS  20           1HG      LYS  20  -0.102  -3.205   8.944
  102    HG3  LYS  20           2HG      LYS  20  -0.243  -1.571   8.292
  103    HD2  LYS  20           1HD      LYS  20  -2.566  -1.482   9.171
  104    HD3  LYS  20           2HD      LYS  20  -2.300  -3.057   9.924
  105    HE2  LYS  20           1HE      LYS  20  -0.451  -0.760  10.459
  106    HE3  LYS  20           2HE      LYS  20  -1.970  -0.920  11.339
  107    HZ1  LYS  20           3HZ      LYS  20  -1.223  -3.206  11.947
  108    HZ2  LYS  20           1HZ      LYS  20  -0.290  -1.963  12.616
  109    HZ3  LYS  20           2HZ      LYS  20   0.292  -2.836  11.290
  110    H    ASN  21           H        ASN  21  -3.994  -3.881   7.637
  111    HA   ASN  21           HA       ASN  21  -4.927  -5.245   5.205
  112    HB2  ASN  21           1HB      ASN  21  -5.385  -6.388   7.550
  113    HB3  ASN  21           2HB      ASN  21  -6.691  -5.209   7.615
  114   HD21  ASN  21          1HD2      ASN  21  -5.258  -7.415   5.227
  115   HD22  ASN  21          2HD2      ASN  21  -6.763  -8.043   4.657
  116    H    PHE  22           H        PHE  22  -6.633  -4.275   4.123
  117    HA   PHE  22           HA       PHE  22  -7.895  -1.913   5.226
  118    HB2  PHE  22           1HB      PHE  22  -6.276  -1.697   2.681
  119    HB3  PHE  22           2HB      PHE  22  -7.197  -0.411   3.455
  120    HD1  PHE  22           HD2      PHE  22  -4.157  -2.438   3.592
  121    HD2  PHE  22           HD1      PHE  22  -6.363   0.712   5.416
  122    HE1  PHE  22           HE2      PHE  22  -2.164  -1.795   4.883
  123    HE2  PHE  22           HE1      PHE  22  -4.373   1.361   6.710
  124    HZ   PHE  22           HZ       PHE  22  -2.270   0.106   6.446
  125    H    CYS  23           H        CYS  23  -9.965  -2.294   4.818
  126    HA   CYS  23           HA       CYS  23 -11.009  -4.082   2.991
  127    HB2  CYS  23           1HB      CYS  23 -12.177  -2.896   4.940
  128    HB3  CYS  23           2HB      CYS  23 -12.465  -1.576   3.814
  129    HG   CYS  23           HG       CYS  23 -13.988  -4.546   4.058
  130    H    TYR  24           H        TYR  24 -10.443  -0.608   2.603
  131    HA   TYR  24           HA       TYR  24 -11.104  -0.871  -0.252
  132    HB2  TYR  24           1HB      TYR  24 -10.961   1.779   0.039
  133    HB3  TYR  24           2HB      TYR  24 -12.429   0.876   0.395
  134    HD1  TYR  24           HD2      TYR  24 -12.788   0.142   2.838
  135    HD2  TYR  24           HD1      TYR  24  -9.982   3.122   1.677
  136    HE1  TYR  24           HE2      TYR  24 -12.772   1.014   5.138
  137    HE2  TYR  24           HE1      TYR  24  -9.957   4.002   3.973
  138    HH   TYR  24           HH       TYR  24 -11.855   2.465   6.550
  139    H    ILE  25           H        ILE  25  -9.527  -0.762  -1.706
  140    HA   ILE  25           HA       ILE  25  -6.847  -0.826  -1.164
  141    HB   ILE  25           HB       ILE  25  -7.970  -1.279  -3.387
  142   HG12  ILE  25          1HG1      ILE  25  -5.961  -0.515  -4.702
  143   HG13  ILE  25          2HG1      ILE  25  -5.434   0.363  -3.270
  144   HG21  ILE  25          1HG2      ILE  25  -9.130   0.916  -3.500
  145   HG22  ILE  25          2HG2      ILE  25  -7.569   1.679  -3.799
  146   HG23  ILE  25          3HG2      ILE  25  -8.220   0.519  -4.957
  147   HD11  ILE  25          3HD1      ILE  25  -5.174  -2.437  -3.926
  148   HD12  ILE  25          1HD1      ILE  25  -4.343  -1.478  -2.701
  149   HD13  ILE  25          2HD1      ILE  25  -5.915  -2.195  -2.344
  150    H    SER  26           H        SER  26  -8.754   2.051  -2.022
  151    HA   SER  26           HA       SER  26  -6.886   3.995  -2.190
  152    HB2  SER  26           1HB      SER  26  -9.612   4.003  -0.932
  153    HB3  SER  26           2HB      SER  26  -8.619   5.460  -0.896
  154    HG   SER  26           HG       SER  26  -8.429   4.812  -3.321
  155    H    ALA  27           H        ALA  27  -8.128   2.607   0.824
  156    HA   ALA  27           HA       ALA  27  -6.744   4.270   2.606
  157    HB1  ALA  27           3HB      ALA  27  -6.952   1.707   3.775
  158    HB2  ALA  27           1HB      ALA  27  -7.990   3.111   4.027
  159    HB3  ALA  27           2HB      ALA  27  -8.379   1.941   2.765
  160    H    LEU  28           H        LEU  28  -5.885   1.013   1.433
  161    HA   LEU  28           HA       LEU  28  -3.478   0.678   2.708
  162    HB2  LEU  28           1HB      LEU  28  -4.183  -1.168   1.527
  163    HB3  LEU  28           2HB      LEU  28  -4.544  -0.232   0.078
  164    HG   LEU  28           HG       LEU  28  -2.074   0.002  -0.279
  165   HD11  LEU  28          1HD1      LEU  28  -0.923  -2.064   0.983
  166   HD12  LEU  28          2HD1      LEU  28  -2.078  -1.568   2.220
  167   HD13  LEU  28          3HD1      LEU  28  -0.897  -0.413   1.602
  168   HD21  LEU  28          3HD2      LEU  28  -3.748  -2.337  -0.612
  169   HD22  LEU  28          1HD2      LEU  28  -2.038  -2.758  -0.527
  170   HD23  LEU  28          2HD2      LEU  28  -2.601  -1.600  -1.732
  171    H    ARG  29           H        ARG  29  -4.050   2.309  -0.396
  172    HA   ARG  29           HA       ARG  29  -1.414   2.919  -1.035
  173    HB2  ARG  29           1HB      ARG  29  -3.812   4.673  -1.589
  174    HB3  ARG  29           2HB      ARG  29  -2.301   4.632  -2.488
  175    HG2  ARG  29           1HG      ARG  29  -4.206   2.312  -2.282
  176    HG3  ARG  29           2HG      ARG  29  -4.190   3.477  -3.608
  177    HD2  ARG  29           1HD      ARG  29  -1.961   1.615  -2.801
  178    HD3  ARG  29           2HD      ARG  29  -2.953   1.510  -4.254
  179    HE   ARG  29           HE       ARG  29  -0.671   3.186  -3.843
  180   HH11  ARG  29          1HH1      ARG  29  -3.688   2.884  -5.554
  181   HH12  ARG  29          2HH1      ARG  29  -3.198   3.909  -6.863
  182   HH21  ARG  29          1HH2      ARG  29  -0.015   4.536  -5.561
  183   HH22  ARG  29          2HH2      ARG  29  -1.108   4.847  -6.866
  184    H    ILE  30           H        ILE  30  -3.733   4.723   0.945
  185    HA   ILE  30           HA       ILE  30  -2.105   6.975   1.407
  186    HB   ILE  30           HB       ILE  30  -4.326   5.820   3.094
  187   HG12  ILE  30          1HG1      ILE  30  -4.333   8.167   1.186
  188   HG13  ILE  30          2HG1      ILE  30  -4.917   6.558   0.779
  189   HG21  ILE  30          1HG2      ILE  30  -4.414   7.962   4.223
  190   HG22  ILE  30          2HG2      ILE  30  -2.814   7.247   4.410
  191   HG23  ILE  30          3HG2      ILE  30  -3.065   8.555   3.254
  192   HD11  ILE  30          3HD1      ILE  30  -6.064   8.524   2.726
  193   HD12  ILE  30          1HD1      ILE  30  -6.825   7.793   1.313
  194   HD13  ILE  30          2HD1      ILE  30  -6.504   6.816   2.746
  195    H    HIS  31           H        HIS  31  -2.438   3.902   3.104
  196    HA   HIS  31           HA       HIS  31  -0.796   4.614   5.316
  197    HB2  HIS  31           1HB      HIS  31  -2.127   2.809   5.838
  198    HB3  HIS  31           2HB      HIS  31  -1.957   2.084   4.242
  199    HD1  HIS  31           HD1      HIS  31  -0.080   2.466   7.497
  200    HD2  HIS  31           HD2      HIS  31   0.009   0.178   4.030
  201    HE1  HIS  31           HE1      HIS  31   1.610   0.655   7.930
  202    H    GLN  32           H        GLN  32  -0.196   2.782   2.332
  203    HA   GLN  32           HA       GLN  32   2.353   1.921   2.670
  204    HB2  GLN  32           1HB      GLN  32   1.010   3.093   0.248
  205    HB3  GLN  32           2HB      GLN  32   2.661   2.491   0.173
  206    HG2  GLN  32           1HG      GLN  32   1.611   0.345   1.229
  207    HG3  GLN  32           2HG      GLN  32   0.115   1.000   0.565
  208   HE21  GLN  32          1HE2      GLN  32   0.415   1.798  -1.780
  209   HE22  GLN  32          2HE2      GLN  32   1.228   0.698  -2.834
  210    H    ARG  33           H        ARG  33   1.307   5.221   2.251
  211    HA   ARG  33           HA       ARG  33   3.556   6.546   1.464
  212    HB2  ARG  33           1HB      ARG  33   1.649   7.374   3.661
  213    HB3  ARG  33           2HB      ARG  33   2.780   8.449   2.848
  214    HG2  ARG  33           1HG      ARG  33   1.628   7.947   0.705
  215    HG3  ARG  33           2HG      ARG  33   0.435   7.020   1.618
  216    HD2  ARG  33           1HD      ARG  33   0.982   9.971   1.692
  217    HD3  ARG  33           2HD      ARG  33  -0.531   9.140   1.336
  218    HE   ARG  33           HE       ARG  33  -0.062   8.401   3.873
  219   HH11  ARG  33          1HH1      ARG  33  -0.031  11.507   2.301
  220   HH12  ARG  33          2HH1      ARG  33  -0.515  12.375   3.720
  221   HH21  ARG  33          1HH2      ARG  33  -0.700   9.533   5.748
  222   HH22  ARG  33          2HH2      ARG  33  -0.895  11.252   5.680
  223    H    VAL  34           H        VAL  34   2.866   5.256   4.678
  224    HA   VAL  34           HA       VAL  34   5.024   6.370   6.060
  225    HB   VAL  34           HB       VAL  34   4.686   4.718   7.738
  226   HG11  VAL  34          1HG1      VAL  34   1.919   4.841   6.653
  227   HG12  VAL  34          2HG1      VAL  34   2.511   5.166   8.283
  228   HG13  VAL  34          3HG1      VAL  34   2.751   6.356   7.003
  229   HG21  VAL  34          3HG2      VAL  34   3.249   2.708   7.293
  230   HG22  VAL  34          1HG2      VAL  34   3.352   3.099   5.576
  231   HG23  VAL  34          2HG2      VAL  34   4.813   2.698   6.479
  232    H    HIS  35           H        HIS  35   4.825   3.543   3.987
  233    HA   HIS  35           HA       HIS  35   7.406   2.520   4.656
  234    HB2  HIS  35           1HB      HIS  35   5.492   1.983   2.389
  235    HB3  HIS  35           2HB      HIS  35   7.065   1.198   2.492
  236    HD1  HIS  35           HD1      HIS  35   7.437  -0.266   4.743
  237    HD2  HIS  35           HD2      HIS  35   3.520   0.752   3.803
  238    HE1  HIS  35           HE1      HIS  35   5.996  -1.835   6.079
  239    H    MET  36           H        MET  36   6.168   4.779   2.288
  240    HA   MET  36           HA       MET  36   8.307   4.859   0.507
  241    HB2  MET  36           1HB      MET  36   6.245   6.861   1.355
  242    HB3  MET  36           2HB      MET  36   7.547   7.354   0.281
  243    HG2  MET  36           1HG      MET  36   5.545   6.743  -0.957
  244    HG3  MET  36           2HG      MET  36   6.890   5.668  -1.331
  245    HE1  MET  36           3HE      MET  36   3.800   5.632  -1.752
  246    HE2  MET  36           1HE      MET  36   4.242   4.002  -2.262
  247    HE3  MET  36           2HE      MET  36   2.987   4.235  -1.044
  248    H    GLY  37           H        GLY  37  10.323   5.649   0.590
  249    HA2  GLY  37           1HA      GLY  37  12.077   7.033   1.269
  250    HA3  GLY  37           2HA      GLY  37  11.039   7.695   2.523
  251    H    GLU  38           H        GLU  38  13.205   5.088   1.662
  252    HA   GLU  38           HA       GLU  38  13.852   4.697   4.452
  253    HB2  GLU  38           1HB      GLU  38  12.420   2.633   2.824
  254    HB3  GLU  38           2HB      GLU  38  13.592   2.120   4.029
  255    HG2  GLU  38           1HG      GLU  38  11.168   3.825   4.549
  256    HG3  GLU  38           2HG      GLU  38  11.324   2.108   4.914
  257    H    LYS  39           H        LYS  39  15.832   3.618   4.777
  258    HA   LYS  39           HA       LYS  39  18.062   3.448   4.229
  259    HB2  LYS  39           1HB      LYS  39  16.989   1.182   3.841
  260    HB3  LYS  39           2HB      LYS  39  16.978   1.573   2.126
  261    HG2  LYS  39           1HG      LYS  39  19.467   1.900   2.296
  262    HG3  LYS  39           2HG      LYS  39  19.363   1.214   3.919
  263    HD2  LYS  39           1HD      LYS  39  18.387  -0.832   2.985
  264    HD3  LYS  39           2HD      LYS  39  18.502  -0.143   1.363
  265    HE2  LYS  39           1HE      LYS  39  21.001   0.110   1.851
  266    HE3  LYS  39           2HE      LYS  39  20.719  -0.972   3.214
  267    HZ1  LYS  39           3HZ      LYS  39  20.779  -1.550   0.375
  268    HZ2  LYS  39           1HZ      LYS  39  19.538  -2.315   1.234
  269    HZ3  LYS  39           2HZ      LYS  39  21.150  -2.544   1.692
  270    H    CYS  40           H        CYS  40  17.006   5.706   3.003
  271    HA   CYS  40           HA       CYS  40  17.134   7.069   1.140
  272    HB2  CYS  40           1HB      CYS  40  19.426   7.617   0.637
  273    HB3  CYS  40           2HB      CYS  40  19.310   7.249   2.354
  274    HG   CYS  40           HG       CYS  40  21.092   5.402   2.387
  275    H    SER  41           H        SER  41  16.049   4.686   0.306
  276    HA   SER  41           HA       SER  41  17.500   3.971  -2.141
  277    HB2  SER  41           1HB      SER  41  16.701   2.157  -0.588
  278    HB3  SER  41           2HB      SER  41  15.049   2.630  -0.982
  279    HG   SER  41           HG       SER  41  16.764   2.141  -3.115
  280    H    GLY  42           H        GLY  42  16.991   5.900  -3.282
  281    HA2  GLY  42           1HA      GLY  42  14.145   6.240  -3.964
  282    HA3  GLY  42           2HA      GLY  42  15.385   7.474  -4.142
  283    HA   PRO  43           HA       PRO  43  15.707   4.230  -7.768
  284    HB2  PRO  43           1HB      PRO  43  13.316   3.114  -8.409
  285    HB3  PRO  43           2HB      PRO  43  14.453   2.368  -7.279
  286    HG2  PRO  43           1HG      PRO  43  12.011   4.002  -6.707
  287    HG3  PRO  43           2HG      PRO  43  12.569   2.513  -5.923
  288    HD2  PRO  43           1HD      PRO  43  12.944   4.963  -4.832
  289    HD3  PRO  43           2HD      PRO  43  14.094   3.630  -4.604
  290    H    SER  44           H        SER  44  15.710   5.169  -9.721
  291    HA   SER  44           HA       SER  44  13.745   7.280 -10.237
  292    HB2  SER  44           1HB      SER  44  16.364   6.699 -11.643
  293    HB3  SER  44           2HB      SER  44  15.328   8.100 -11.917
  294    HG   SER  44           HG       SER  44  16.949   7.481  -9.711
  295    H    SER  45           H        SER  45  12.595   7.406 -12.173
  296    HA   SER  45           HA       SER  45  12.031   4.834 -13.384
  297    HB2  SER  45           1HB      SER  45  10.206   6.402 -12.721
  298    HB3  SER  45           2HB      SER  45  10.768   7.526 -13.958
  299    HG   SER  45           HG       SER  45   9.518   6.435 -15.239
  300    H    GLY  46           H        GLY  46  13.866   4.398 -14.621
  301    HA2  GLY  46           1HA      GLY  46  13.830   5.261 -17.281
  302    HA3  GLY  46           2HA      GLY  46  15.047   6.207 -16.436
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1 -12.880 -12.456 -21.079
    2    HA2  GLY   1           1HA      GLY   1 -14.544 -12.905 -19.512
    3    HA3  GLY   1           2HA      GLY   1 -14.658 -14.357 -20.495
    4    H    SER   2           H        SER   2 -15.085 -15.906 -19.031
    5    HA   SER   2           HA       SER   2 -14.211 -16.033 -16.403
    6    HB2  SER   2           1HB      SER   2 -14.986 -18.232 -18.324
    7    HB3  SER   2           2HB      SER   2 -14.659 -18.522 -16.616
    8    HG   SER   2           HG       SER   2 -16.905 -18.161 -17.122
    9    H    SER   3           H        SER   3 -12.226 -16.144 -15.616
   10    HA   SER   3           HA       SER   3 -10.254 -17.843 -16.983
   11    HB2  SER   3           1HB      SER   3  -9.766 -15.072 -15.866
   12    HB3  SER   3           2HB      SER   3  -8.500 -16.162 -16.430
   13    HG   SER   3           HG       SER   3  -9.925 -16.161 -18.448
   14    H    GLY   4           H        GLY   4 -11.816 -18.669 -14.840
   15    HA2  GLY   4           1HA      GLY   4 -11.275 -20.011 -12.995
   16    HA3  GLY   4           2HA      GLY   4  -9.730 -19.184 -12.874
   17    H    SER   5           H        SER   5  -9.591 -17.227 -11.742
   18    HA   SER   5           HA       SER   5 -11.558 -16.963  -9.645
   19    HB2  SER   5           1HB      SER   5  -9.989 -15.197  -8.789
   20    HB3  SER   5           2HB      SER   5  -9.243 -16.780  -9.006
   21    HG   SER   5           HG       SER   5  -7.843 -15.463  -9.986
   22    H    SER   6           H        SER   6 -13.372 -15.882 -10.037
   23    HA   SER   6           HA       SER   6 -13.326 -13.135 -10.770
   24    HB2  SER   6           1HB      SER   6 -14.592 -13.291 -12.868
   25    HB3  SER   6           2HB      SER   6 -13.031 -14.099 -13.017
   26    HG   SER   6           HG       SER   6 -14.004 -15.983 -13.182
   27    H    GLY   7           H        GLY   7 -15.720 -12.399 -11.240
   28    HA2  GLY   7           1HA      GLY   7 -18.048 -12.792 -10.785
   29    HA3  GLY   7           2HA      GLY   7 -17.570 -14.006  -9.607
   30    H    SER   8           H        SER   8 -16.548 -13.258  -7.621
   31    HA   SER   8           HA       SER   8 -17.290 -10.491  -6.935
   32    HB2  SER   8           1HB      SER   8 -17.914 -13.047  -5.505
   33    HB3  SER   8           2HB      SER   8 -17.668 -11.576  -4.563
   34    HG   SER   8           HG       SER   8 -19.764 -11.457  -5.012
   35    H    GLY   9           H        GLY   9 -15.821  -9.333  -5.801
   36    HA2  GLY   9           1HA      GLY   9 -13.152 -10.354  -5.619
   37    HA3  GLY   9           2HA      GLY   9 -13.697  -8.765  -5.102
   38    H    GLU  10           H        GLU  10 -15.381  -9.104  -3.127
   39    HA   GLU  10           HA       GLU  10 -15.189  -9.257  -0.825
   40    HB2  GLU  10           1HB      GLU  10 -15.701 -11.504  -0.071
   41    HB3  GLU  10           2HB      GLU  10 -16.594 -11.156  -1.545
   42    HG2  GLU  10           1HG      GLU  10 -14.824 -12.379  -2.811
   43    HG3  GLU  10           2HG      GLU  10 -14.133 -12.859  -1.262
   44    H    LYS  11           H        LYS  11 -12.650  -8.779  -1.893
   45    HA   LYS  11           HA       LYS  11 -10.965 -10.376  -0.078
   46    HB2  LYS  11           1HB      LYS  11 -10.441 -10.992  -2.366
   47    HB3  LYS  11           2HB      LYS  11 -10.254  -9.302  -2.813
   48    HG2  LYS  11           1HG      LYS  11  -8.077 -10.132  -2.583
   49    HG3  LYS  11           2HG      LYS  11  -8.378  -9.207  -1.110
   50    HD2  LYS  11           1HD      LYS  11  -8.871 -11.261   0.099
   51    HD3  LYS  11           2HD      LYS  11  -8.642 -12.203  -1.376
   52    HE2  LYS  11           1HE      LYS  11  -6.652 -12.362  -0.044
   53    HE3  LYS  11           2HE      LYS  11  -6.300 -11.385  -1.469
   54    HZ1  LYS  11           3HZ      LYS  11  -5.976 -10.695   1.220
   55    HZ2  LYS  11           1HZ      LYS  11  -7.174  -9.686   0.579
   56    HZ3  LYS  11           2HZ      LYS  11  -5.648  -9.753  -0.147
   57    H    SER  12           H        SER  12 -10.054  -9.212   1.472
   58    HA   SER  12           HA       SER  12 -10.151  -6.325   1.375
   59    HB2  SER  12           1HB      SER  12  -9.339  -6.429   3.686
   60    HB3  SER  12           2HB      SER  12 -10.697  -7.531   3.457
   61    HG   SER  12           HG       SER  12  -9.387  -8.971   4.240
   62    H    HIS  13           H        HIS  13  -8.574  -5.062   0.667
   63    HA   HIS  13           HA       HIS  13  -6.181  -5.984  -0.414
   64    HB2  HIS  13           1HB      HIS  13  -6.564  -3.197   0.674
   65    HB3  HIS  13           2HB      HIS  13  -5.560  -3.703  -0.681
   66    HD1  HIS  13           HD1      HIS  13  -6.601  -3.600  -2.947
   67    HD2  HIS  13           HD2      HIS  13  -9.419  -3.373   0.097
   68    HE1  HIS  13           HE1      HIS  13  -8.784  -3.095  -4.088
   69    H    THR  14           H        THR  14  -4.341  -6.649   0.463
   70    HA   THR  14           HA       THR  14  -3.765  -5.890   3.253
   71    HB   THR  14           HB       THR  14  -2.997  -8.444   1.826
   72    HG1  THR  14           HG1      THR  14  -4.492  -9.388   3.235
   73   HG21  THR  14          3HG2      THR  14  -1.658  -8.997   3.558
   74   HG22  THR  14          1HG2      THR  14  -2.704  -8.223   4.748
   75   HG23  THR  14          2HG2      THR  14  -1.574  -7.253   3.803
   76    H    CYS  15           H        CYS  15  -1.929  -4.828   3.629
   77    HA   CYS  15           HA       CYS  15  -0.226  -4.055   1.481
   78    HB2  CYS  15           1HB      CYS  15  -0.739  -2.654   3.505
   79    HB3  CYS  15           2HB      CYS  15   0.290  -3.733   4.442
   80    H    ASP  16           H        ASP  16   1.241  -5.334   0.587
   81    HA   ASP  16           HA       ASP  16   2.268  -7.664   1.864
   82    HB2  ASP  16           1HB      ASP  16   1.947  -7.188  -0.666
   83    HB3  ASP  16           2HB      ASP  16   3.518  -6.398  -0.559
   84    H    GLU  17           H        GLU  17   3.180  -4.376   1.875
   85    HA   GLU  17           HA       GLU  17   5.969  -4.644   2.264
   86    HB2  GLU  17           1HB      GLU  17   4.184  -2.434   3.291
   87    HB3  GLU  17           2HB      GLU  17   5.918  -2.348   3.019
   88    HG2  GLU  17           1HG      GLU  17   3.825  -2.728   0.890
   89    HG3  GLU  17           2HG      GLU  17   4.662  -1.222   1.259
   90    H    CYS  18           H        CYS  18   3.292  -4.218   4.571
   91    HA   CYS  18           HA       CYS  18   5.079  -5.225   6.688
   92    HB2  CYS  18           1HB      CYS  18   3.724  -3.953   8.291
   93    HB3  CYS  18           2HB      CYS  18   4.417  -2.895   7.067
   94    H    GLY  19           H        GLY  19   1.761  -5.225   5.448
   95    HA2  GLY  19           1HA      GLY  19   0.717  -7.458   5.267
   96    HA3  GLY  19           2HA      GLY  19   1.340  -7.777   6.880
   97    H    LYS  20           H        LYS  20   0.025  -4.661   6.082
   98    HA   LYS  20           HA       LYS  20  -1.946  -4.900   8.151
   99    HB2  LYS  20           1HB      LYS  20  -1.125  -2.739   6.243
  100    HB3  LYS  20           2HB      LYS  20  -2.623  -2.581   7.151
  101    HG2  LYS  20           1HG      LYS  20  -0.104  -3.233   8.603
  102    HG3  LYS  20           2HG      LYS  20  -0.396  -1.576   8.067
  103    HD2  LYS  20           1HD      LYS  20  -2.543  -1.585   9.265
  104    HD3  LYS  20           2HD      LYS  20  -2.216  -3.227   9.822
  105    HE2  LYS  20           1HE      LYS  20  -1.647  -1.696  11.579
  106    HE3  LYS  20           2HE      LYS  20  -0.158  -2.379  10.927
  107    HZ1  LYS  20           3HZ      LYS  20  -1.213   0.211   9.972
  108    HZ2  LYS  20           1HZ      LYS  20   0.360  -0.400   9.843
  109    HZ3  LYS  20           2HZ      LYS  20  -0.227   0.113  11.343
  110    H    ASN  21           H        ASN  21  -4.176  -3.692   7.372
  111    HA   ASN  21           HA       ASN  21  -5.159  -5.081   4.985
  112    HB2  ASN  21           1HB      ASN  21  -5.637  -6.255   7.297
  113    HB3  ASN  21           2HB      ASN  21  -6.895  -5.029   7.421
  114   HD21  ASN  21          1HD2      ASN  21  -5.725  -7.756   5.580
  115   HD22  ASN  21          2HD2      ASN  21  -7.217  -8.105   4.782
  116    H    PHE  22           H        PHE  22  -6.712  -3.999   3.845
  117    HA   PHE  22           HA       PHE  22  -8.013  -1.671   4.985
  118    HB2  PHE  22           1HB      PHE  22  -6.364  -1.332   2.480
  119    HB3  PHE  22           2HB      PHE  22  -7.180  -0.081   3.412
  120    HD1  PHE  22           HD2      PHE  22  -4.326  -2.401   3.356
  121    HD2  PHE  22           HD1      PHE  22  -6.169   0.888   5.331
  122    HE1  PHE  22           HE2      PHE  22  -2.261  -2.019   4.638
  123    HE2  PHE  22           HE1      PHE  22  -4.107   1.276   6.616
  124    HZ   PHE  22           HZ       PHE  22  -2.150  -0.179   6.271
  125    H    CYS  23           H        CYS  23 -10.063  -2.069   4.487
  126    HA   CYS  23           HA       CYS  23 -10.995  -3.736   2.473
  127    HB2  CYS  23           1HB      CYS  23 -12.349  -1.430   3.880
  128    HB3  CYS  23           2HB      CYS  23 -13.192  -2.535   2.800
  129    HG   CYS  23           HG       CYS  23 -11.875  -3.180   5.873
  130    H    TYR  24           H        TYR  24 -10.414  -0.256   2.431
  131    HA   TYR  24           HA       TYR  24 -11.059  -0.230  -0.441
  132    HB2  TYR  24           1HB      TYR  24 -10.954   2.374   0.099
  133    HB3  TYR  24           2HB      TYR  24 -12.413   1.428   0.374
  134    HD1  TYR  24           HD2      TYR  24 -12.590   0.349   2.776
  135    HD2  TYR  24           HD1      TYR  24 -10.155   3.702   1.815
  136    HE1  TYR  24           HE2      TYR  24 -12.579   1.012   5.145
  137    HE2  TYR  24           HE1      TYR  24 -10.136   4.375   4.180
  138    HH   TYR  24           HH       TYR  24 -10.441   3.221   6.424
  139    H    ILE  25           H        ILE  25  -9.460   0.031  -1.851
  140    HA   ILE  25           HA       ILE  25  -6.789  -0.066  -1.269
  141    HB   ILE  25           HB       ILE  25  -7.977  -0.241  -3.555
  142   HG12  ILE  25          1HG1      ILE  25  -5.834   0.459  -4.729
  143   HG13  ILE  25          2HG1      ILE  25  -5.266   1.031  -3.164
  144   HG21  ILE  25          1HG2      ILE  25  -7.254   2.686  -3.600
  145   HG22  ILE  25          2HG2      ILE  25  -7.897   1.743  -4.944
  146   HG23  ILE  25          3HG2      ILE  25  -8.894   2.043  -3.521
  147   HD11  ILE  25          3HD1      ILE  25  -6.250  -1.764  -3.392
  148   HD12  ILE  25          1HD1      ILE  25  -4.660  -1.358  -4.038
  149   HD13  ILE  25          2HD1      ILE  25  -5.016  -1.081  -2.333
  150    H    SER  26           H        SER  26  -8.740   2.851  -1.810
  151    HA   SER  26           HA       SER  26  -6.905   4.836  -1.801
  152    HB2  SER  26           1HB      SER  26  -9.164   5.493  -1.950
  153    HB3  SER  26           2HB      SER  26  -9.587   4.690  -0.438
  154    HG   SER  26           HG       SER  26  -8.631   6.296   0.696
  155    H    ALA  27           H        ALA  27  -8.180   3.254   1.118
  156    HA   ALA  27           HA       ALA  27  -6.711   4.711   2.998
  157    HB1  ALA  27           3HB      ALA  27  -7.943   3.481   4.371
  158    HB2  ALA  27           1HB      ALA  27  -8.459   2.483   3.011
  159    HB3  ALA  27           2HB      ALA  27  -7.021   2.044   3.932
  160    H    LEU  28           H        LEU  28  -5.974   1.543   1.536
  161    HA   LEU  28           HA       LEU  28  -3.540   1.082   2.781
  162    HB2  LEU  28           1HB      LEU  28  -4.387  -0.714   1.594
  163    HB3  LEU  28           2HB      LEU  28  -4.705   0.256   0.158
  164    HG   LEU  28           HG       LEU  28  -2.203   0.374  -0.168
  165   HD11  LEU  28          1HD1      LEU  28  -1.082  -0.225   1.698
  166   HD12  LEU  28          2HD1      LEU  28  -1.221  -1.834   0.992
  167   HD13  LEU  28          3HD1      LEU  28  -2.351  -1.321   2.244
  168   HD21  LEU  28          3HD2      LEU  28  -3.025  -1.058  -1.702
  169   HD22  LEU  28          1HD2      LEU  28  -3.967  -1.959  -0.514
  170   HD23  LEU  28          2HD2      LEU  28  -2.240  -2.273  -0.692
  171    H    ARG  29           H        ARG  29  -4.230   2.886  -0.187
  172    HA   ARG  29           HA       ARG  29  -1.593   3.389  -0.968
  173    HB2  ARG  29           1HB      ARG  29  -3.931   5.261  -1.354
  174    HB3  ARG  29           2HB      ARG  29  -2.483   5.148  -2.344
  175    HG2  ARG  29           1HG      ARG  29  -4.163   2.719  -2.072
  176    HG3  ARG  29           2HG      ARG  29  -4.770   4.044  -3.067
  177    HD2  ARG  29           1HD      ARG  29  -2.306   3.948  -4.037
  178    HD3  ARG  29           2HD      ARG  29  -2.412   2.282  -3.470
  179    HE   ARG  29           HE       ARG  29  -4.673   2.505  -4.866
  180   HH11  ARG  29          1HH1      ARG  29  -1.409   3.440  -5.633
  181   HH12  ARG  29          2HH1      ARG  29  -1.604   3.206  -7.339
  182   HH21  ARG  29          1HH2      ARG  29  -4.942   2.193  -7.110
  183   HH22  ARG  29          2HH2      ARG  29  -3.614   2.497  -8.177
  184    H    ILE  30           H        ILE  30  -3.637   4.951   1.407
  185    HA   ILE  30           HA       ILE  30  -1.965   7.235   1.783
  186    HB   ILE  30           HB       ILE  30  -4.084   6.052   3.581
  187   HG12  ILE  30          1HG1      ILE  30  -4.278   8.527   1.872
  188   HG13  ILE  30          2HG1      ILE  30  -4.714   6.937   1.257
  189   HG21  ILE  30          1HG2      ILE  30  -3.142   7.376   5.129
  190   HG22  ILE  30          2HG2      ILE  30  -2.231   8.295   3.932
  191   HG23  ILE  30          3HG2      ILE  30  -3.923   8.684   4.241
  192   HD11  ILE  30          3HD1      ILE  30  -6.077   7.119   3.652
  193   HD12  ILE  30          1HD1      ILE  30  -6.198   8.737   2.961
  194   HD13  ILE  30          2HD1      ILE  30  -6.748   7.339   2.036
  195    H    HIS  31           H        HIS  31  -2.304   4.109   3.395
  196    HA   HIS  31           HA       HIS  31  -0.483   4.669   5.501
  197    HB2  HIS  31           1HB      HIS  31  -1.833   2.886   6.043
  198    HB3  HIS  31           2HB      HIS  31  -1.800   2.226   4.410
  199    HD1  HIS  31           HD1      HIS  31   0.412   2.485   7.475
  200    HD2  HIS  31           HD2      HIS  31  -0.023   0.189   4.041
  201    HE1  HIS  31           HE1      HIS  31   2.039   0.584   7.727
  202    H    GLN  32           H        GLN  32  -0.145   2.883   2.443
  203    HA   GLN  32           HA       GLN  32   2.385   1.951   2.559
  204    HB2  GLN  32           1HB      GLN  32   0.934   3.273   0.281
  205    HB3  GLN  32           2HB      GLN  32   2.550   2.610   0.073
  206    HG2  GLN  32           1HG      GLN  32   1.612   0.432   0.970
  207    HG3  GLN  32           2HG      GLN  32   0.018   1.156   0.760
  208   HE21  GLN  32          1HE2      GLN  32  -0.597   1.817  -1.382
  209   HE22  GLN  32          2HE2      GLN  32   0.053   0.994  -2.755
  210    H    ARG  33           H        ARG  33   1.439   5.308   2.241
  211    HA   ARG  33           HA       ARG  33   3.697   6.564   1.397
  212    HB2  ARG  33           1HB      ARG  33   1.898   7.397   3.679
  213    HB3  ARG  33           2HB      ARG  33   3.064   8.453   2.895
  214    HG2  ARG  33           1HG      ARG  33   1.855   8.092   0.751
  215    HG3  ARG  33           2HG      ARG  33   0.631   7.196   1.652
  216    HD2  ARG  33           1HD      ARG  33  -0.239   9.361   1.487
  217    HD3  ARG  33           2HD      ARG  33   0.437   9.283   3.114
  218    HE   ARG  33           HE       ARG  33   1.959  10.887   2.520
  219   HH11  ARG  33          1HH1      ARG  33   0.511   9.566  -0.357
  220   HH12  ARG  33          2HH1      ARG  33   1.234  10.732  -1.414
  221   HH21  ARG  33          1HH2      ARG  33   2.917  12.429   1.139
  222   HH22  ARG  33          2HH2      ARG  33   2.603  12.360  -0.562
  223    H    VAL  34           H        VAL  34   3.083   5.333   4.662
  224    HA   VAL  34           HA       VAL  34   5.369   6.300   5.926
  225    HB   VAL  34           HB       VAL  34   5.009   4.698   7.629
  226   HG11  VAL  34          1HG1      VAL  34   2.804   5.109   8.208
  227   HG12  VAL  34          2HG1      VAL  34   3.136   6.392   7.042
  228   HG13  VAL  34          3HG1      VAL  34   2.232   4.960   6.546
  229   HG21  VAL  34          3HG2      VAL  34   3.513   2.718   7.264
  230   HG22  VAL  34          1HG2      VAL  34   3.560   3.083   5.539
  231   HG23  VAL  34          2HG2      VAL  34   5.044   2.659   6.390
  232    H    HIS  35           H        HIS  35   4.897   3.409   3.963
  233    HA   HIS  35           HA       HIS  35   7.430   2.250   4.478
  234    HB2  HIS  35           1HB      HIS  35   5.400   1.889   2.283
  235    HB3  HIS  35           2HB      HIS  35   6.933   1.022   2.273
  236    HD1  HIS  35           HD1      HIS  35   7.346  -0.551   4.435
  237    HD2  HIS  35           HD2      HIS  35   3.447   0.725   3.781
  238    HE1  HIS  35           HE1      HIS  35   5.898  -2.087   5.802
  239    H    MET  36           H        MET  36   6.269   4.576   2.117
  240    HA   MET  36           HA       MET  36   8.232   4.603   0.227
  241    HB2  MET  36           1HB      MET  36   6.957   7.019   1.523
  242    HB3  MET  36           2HB      MET  36   7.817   7.030  -0.011
  243    HG2  MET  36           1HG      MET  36   6.157   5.467  -0.929
  244    HG3  MET  36           2HG      MET  36   5.280   5.533   0.598
  245    HE1  MET  36           3HE      MET  36   3.743   7.545  -2.654
  246    HE2  MET  36           1HE      MET  36   5.469   7.388  -2.986
  247    HE3  MET  36           2HE      MET  36   4.554   5.999  -2.399
  248    H    GLY  37           H        GLY  37  10.354   5.015   0.140
  249    HA2  GLY  37           1HA      GLY  37  12.083   5.040   2.196
  250    HA3  GLY  37           2HA      GLY  37  12.414   5.918   0.710
  251    H    GLU  38           H        GLU  38  10.932   8.074   0.709
  252    HA   GLU  38           HA       GLU  38  12.101   9.974   2.164
  253    HB2  GLU  38           1HB      GLU  38   9.146   9.822   1.552
  254    HB3  GLU  38           2HB      GLU  38   9.965  11.278   2.100
  255    HG2  GLU  38           1HG      GLU  38  11.488  10.968   0.075
  256    HG3  GLU  38           2HG      GLU  38  10.277   9.823  -0.499
  257    H    LYS  39           H        LYS  39  12.707   9.692   4.238
  258    HA   LYS  39           HA       LYS  39  10.866  10.146   6.317
  259    HB2  LYS  39           1HB      LYS  39  10.231   7.807   5.870
  260    HB3  LYS  39           2HB      LYS  39  11.896   7.308   6.140
  261    HG2  LYS  39           1HG      LYS  39  11.765   7.608   8.410
  262    HG3  LYS  39           2HG      LYS  39  10.469   8.800   8.286
  263    HD2  LYS  39           1HD      LYS  39   9.964   5.983   7.430
  264    HD3  LYS  39           2HD      LYS  39   9.968   6.380   9.150
  265    HE2  LYS  39           1HE      LYS  39   8.305   7.821   7.090
  266    HE3  LYS  39           2HE      LYS  39   7.718   6.468   8.056
  267    HZ1  LYS  39           3HZ      LYS  39   7.586   7.728   9.907
  268    HZ2  LYS  39           1HZ      LYS  39   7.432   8.990   8.791
  269    HZ3  LYS  39           2HZ      LYS  39   8.929   8.678   9.514
  270    H    CYS  40           H        CYS  40  11.889  10.694   8.211
  271    HA   CYS  40           HA       CYS  40  14.589  11.414   8.097
  272    HB2  CYS  40           1HB      CYS  40  12.649  12.219   9.664
  273    HB3  CYS  40           2HB      CYS  40  13.227  10.940  10.724
  274    HG   CYS  40           HG       CYS  40  14.205  13.546  11.444
  275    H    SER  41           H        SER  41  16.285  10.107   8.046
  276    HA   SER  41           HA       SER  41  16.132   7.432   9.154
  277    HB2  SER  41           1HB      SER  41  18.371   8.846   7.685
  278    HB3  SER  41           2HB      SER  41  18.378   7.144   8.148
  279    HG   SER  41           HG       SER  41  17.615   7.851   5.918
  280    H    GLY  42           H        GLY  42  17.454   6.608  10.784
  281    HA2  GLY  42           1HA      GLY  42  19.208   6.810  12.402
  282    HA3  GLY  42           2HA      GLY  42  19.047   8.558  12.305
  283    HA   PRO  43           HA       PRO  43  16.889   7.071  16.141
  284    HB2  PRO  43           1HB      PRO  43  18.040   8.896  17.788
  285    HB3  PRO  43           2HB      PRO  43  18.781   7.334  17.417
  286    HG2  PRO  43           1HG      PRO  43  19.354  10.029  16.246
  287    HG3  PRO  43           2HG      PRO  43  20.490   8.763  16.748
  288    HD2  PRO  43           1HD      PRO  43  19.804   9.161  14.159
  289    HD3  PRO  43           2HD      PRO  43  20.199   7.556  14.806
  290    H    SER  44           H        SER  44  15.000   7.942  15.059
  291    HA   SER  44           HA       SER  44  14.502  10.776  15.143
  292    HB2  SER  44           1HB      SER  44  13.556   9.446  13.330
  293    HB3  SER  44           2HB      SER  44  12.671   8.454  14.488
  294    HG   SER  44           HG       SER  44  12.290  11.199  13.897
  295    H    SER  45           H        SER  45  12.807   7.996  16.607
  296    HA   SER  45           HA       SER  45  12.288   9.670  18.970
  297    HB2  SER  45           1HB      SER  45  10.033   8.633  19.138
  298    HB3  SER  45           2HB      SER  45  10.227   9.603  17.678
  299    HG   SER  45           HG       SER  45  10.622   7.651  16.540
  300    H    GLY  46           H        GLY  46  14.408   7.888  18.769
  301    HA2  GLY  46           1HA      GLY  46  14.905   6.578  20.868
  302    HA3  GLY  46           2HA      GLY  46  13.504   5.613  20.424