*HEADER    TRANSCRIPTION                           29-MAR-07   2EOR              
*TITLE     SOLUTION STRUCTURE OF THE C2H2 TYPE ZINC FINGER (REGION 255-          
*TITLE    2 287) 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: P061225-20;                               
*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 2EOR    0                                                

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

15 CYSS SG   201 ZN   ZN   2.19  5.00E+00
15 CYSS CB   201 ZN   ZN   3.25  5.00E+00
18 CYSS SG   201 ZN   ZN   2.19  5.00E+00
18 CYSS CB   201 ZN   ZN   3.25  5.00E+00
31 HIS NE2   201 ZN   ZN   1.90  5.00E+00
35 HIS NE2   201 ZN   ZN   1.90  5.00E+00
15 CYSS SG  18 CYSS SG   3.56  5.00E+00
15 CYSS SG  31 HIS NE2   3.32  5.00E+00
15 CYSS SG  35 HIS NE2   3.32  5.00E+00
18 CYSS SG  31 HIS NE2   3.32  5.00E+00
18 CYSS SG  35 HIS NE2   3.32  5.00E+00
31 HIS NE2  35 HIS NE2   3.00  5.00E+00

15 CYSS SG   201 ZN   ZN   2.39  5.00E+00
15 CYSS CB   201 ZN   ZN   3.51  5.00E+00
18 CYSS SG   201 ZN   ZN   2.39  5.00E+00
18 CYSS CB   201 ZN   ZN   3.51  5.00E+00
31 HIS NE2   201 ZN   ZN   2.10  5.00E+00
35 HIS NE2   201 ZN   ZN   2.10  5.00E+00
15 CYSS SG  18 CYSS SG   3.96  5.00E+00
15 CYSS SG  31 HIS NE2   3.72  5.00E+00
15 CYSS SG  35 HIS NE2   3.72  5.00E+00
18 CYSS SG  31 HIS NE2   3.72  5.00E+00
18 CYSS SG  35 HIS NE2   3.72  5.00E+00
31 HIS NE2  35 HIS NE2   3.60  5.00E+00

 28 LEU  HN     29 GLN  HN      3.12 #SUP  1.00
 28 LEU  HN     30 GLU  HN      4.56 #SUP  0.71  #QF  0.71
 22 PHE  HB3    28 LEU  HN      3.65 #SUP  0.94  #QF  0.44
 13 TYR  HB3    28 LEU  HN      4.73 #SUP  1.00
 13 TYR  HB2    28 LEU  HN      5.14 #SUP  0.96  #QF  0.96
 27 GLN  HB2    28 LEU  HN      3.40 #SUP  0.77  #QF  0.77
 27 GLN  HG3    28 LEU  HN      4.70 #SUP  0.91  #QF  0.86
 28 LEU  HN     29 GLN  QG      5.20 #SUP  0.91  #QF  0.86
 28 LEU  HN     28 LEU  HB3     2.97 #SUP  0.99  #QF  0.99
 28 LEU  HN     28 LEU  HG      4.41 #SUP  1.00
 28 LEU  HN     28 LEU  HB2     3.18 #SUP  1.00
 28 LEU  HN     28 LEU  QD2     4.74 #SUP  0.98  #QF  0.94
 28 LEU  HN     28 LEU  QD1     5.08 #SUP  0.98  #QF  0.94
 26 SER  HN     28 LEU  HN      5.12 #SUP  0.75  #QF  0.75
 28 LEU  HN     31 HIS  HN      5.07 #SUP  0.97  #QF  0.97
 15 CYSS HN     19 GLY  HN      4.67 #SUP  1.00
 17 GLU  HN     19 GLY  HN      4.04 #SUP  0.95  #QF  0.95
 19 GLY  HN     20 LYS  HN      3.65 #SUP  0.99  #QF  0.99
 15 CYSS HB3    19 GLY  HN      3.61 #SUP  0.99  #QF  0.99
 18 CYSS HB3    19 GLY  HN      4.86 #SUP  1.00
 19 GLY  HN     20 LYS  HB2     4.47 #SUP  0.97  #QF  0.97
 29 GLN  QG     29 GLN  HE21    4.07 #SUP  0.95  #QF  0.95
 29 GLN  QG     29 GLN  HE22    4.07 #SUP  1.00
 28 LEU  HB3    29 GLN  HE21    5.07 #SUP  0.78  #QF  0.78
 28 LEU  HB3    29 GLN  HE22    5.07 #SUP  0.90  #QF  0.90
 28 LEU  QD2    29 GLN  HE21    4.85 #SUP  0.92  #QF  0.92
 28 LEU  QD2    29 GLN  HE22    4.85 #SUP  0.97  #QF  0.97
 10 GLU  HA     11 LYS  HN      3.15 #SUP  0.81  #QF  0.70
 11 LYS  HN     12 PRO  QD      4.19 #SUP  1.00
 10 GLU  HG2    11 LYS  HN      5.50 #SUP  0.94  #QF  0.66
 10 GLU  HG3    11 LYS  HN      5.50 #SUP  0.94  #QF  0.66
 10 GLU  HB2    11 LYS  HN      4.26 #SUP  0.91  #QF  0.91
 10 GLU  HB3    11 LYS  HN      4.26 #SUP  0.94  #QF  0.94
 11 LYS  HN     11 LYS  HB2     3.32 #SUP  0.98  #QF  0.98
 11 LYS  HN     11 LYS  HG2     4.60 #SUP  1.00
 11 LYS  HN     11 LYS  HG3     4.60 #SUP  0.90  #QF  0.70
 11 LYS  HN     21 ALA  QB      5.01 #SUP  0.90  #QF  0.70
 13 TYR  HN     14 ASN  HN      4.66 #SUP  1.00
 14 ASN  HN     14 ASN  HD22    5.09 #SUP  1.00
 13 TYR  QD     14 ASN  HN      4.29 #SUP  1.00
 14 ASN  HN     14 ASN  HD21    5.09 #SUP  1.00
 14 ASN  HN     21 ALA  HA      4.76 #SUP  0.99  #QF  0.99
 13 TYR  HA     14 ASN  HN      2.74 #SUP  0.87  #QF  0.87
 13 TYR  HB3    14 ASN  HN      3.98 #SUP  1.00
 13 TYR  HB2    14 ASN  HN      4.25 #SUP  1.00
 14 ASN  HN     14 ASN  HB2     3.30 #SUP  0.98  #QF  0.98
 14 ASN  HN     28 LEU  HB2     4.95 #SUP  0.58  #QF  0.58
 14 ASN  HN     28 LEU  QD2     3.76 #SUP  0.98  #QF  0.98
 14 ASN  HD22   22 PHE  HN      5.50 #SUP  0.94  #QF  0.90
 14 ASN  HD21   21 ALA  QB      4.70 #SUP  1.00
 26 SER  HN     27 GLN  HN      3.91 #SUP  1.00
 14 ASN  HD21   22 PHE  HN      5.50 #SUP  1.00
 25 ASP  HN     27 GLN  HN      4.65 #SUP  0.94  #QF  0.83
 27 GLN  HN     29 GLN  HN      5.06 #SUP  0.94  #QF  0.83
 15 CYSS HA     32 GLN  HE21    4.72 #SUP  0.87  #QF  0.87
 15 CYSS HA     32 GLN  HE22    4.72 #SUP  0.87  #QF  0.87
 26 SER  HB2    27 GLN  HN      4.88 #SUP  0.85  #QF  0.85
 25 ASP  HA     27 GLN  HN      4.36 #SUP  0.88  #QF  0.88
 24 HIST HB3    27 GLN  HN      3.72 #SUP  0.99  #QF  0.99
 32 GLN  QG     32 GLN  HE21    3.88 #SUP  0.97  #QF  0.97
 32 GLN  QG     32 GLN  HE22    3.88 #SUP  0.99  #QF  0.99
 24 HIST HB2    27 GLN  HN      3.53 #SUP  0.96  #QF  0.96
 27 GLN  HN     27 GLN  HB2     3.23 #SUP  1.00  #QF  0.99
 32 GLN  HB2    32 GLN  HE21    5.49 #SUP  0.98  #QF  0.83
 32 GLN  HB3    32 GLN  HE21    5.50 #SUP  0.98  #QF  0.83
 32 GLN  HB2    32 GLN  HE22    5.49 #SUP  0.96  #QF  0.75
 32 GLN  HB3    32 GLN  HE22    5.50 #SUP  0.96  #QF  0.75
 27 GLN  HN     27 GLN  HB3     3.68 #SUP  0.98  #QF  0.98
 28 LEU  HG     32 GLN  HE21    4.81 #SUP  0.99  #QF  0.99
 28 LEU  HG     32 GLN  HE22    4.81 #SUP  1.00
 14 ASN  HD22   21 ALA  QB      4.70 #SUP  0.97  #QF  0.97
 28 LEU  QD2    32 GLN  HE22    4.43 #SUP  0.85  #QF  0.59
 28 LEU  QD1    32 GLN  HE22    4.75 #SUP  0.85  #QF  0.59
 28 LEU  QD2    32 GLN  HE21    4.43 #SUP  0.97  #QF  0.52
 24 HIST HA     27 GLN  HN      5.08 #SUP  0.96  #QF  0.96
 27 GLN  HN     27 GLN  HG3     3.41 #SUP  0.99  #QF  0.99
 27 GLN  HN     28 LEU  HB2     5.50 #SUP  0.85  #QF  0.85
 38 GLU  HN     38 GLU  HB3     3.79 #SUP  0.98  #QF  0.98
 16 GLU  HN     17 GLU  HN      3.35 #SUP  0.99  #QF  0.99
 15 CYSS HA     17 GLU  HN      4.06 #SUP  0.98  #QF  0.98
 15 CYSS HB3    17 GLU  HN      4.46 #SUP  1.00
 15 CYSS HB2    17 GLU  HN      4.60 #SUP  0.99  #QF  0.99
 10 GLU  HN     10 GLU  HG2     5.50 #SUP  0.96  #QF  0.86
 10 GLU  HN     10 GLU  HG3     5.50 #SUP  0.96  #QF  0.86
 16 GLU  HB3    17 GLU  HN      4.58 #SUP  0.82  #QF  0.82
 27 GLN  HB3    27 GLN  HE21    4.71 #SUP  0.99  #QF  0.99
 17 GLU  HN     17 GLU  HG2     4.22 #SUP  1.00
 10 GLU  HN     10 GLU  HB3     4.19 #SUP  0.99  #QF  0.99
 17 GLU  HN     17 GLU  HG3     4.22 #SUP  1.00
 17 GLU  HN     17 GLU  HB2     3.06 #SUP  0.99  #QF  0.99
 17 GLU  HN     17 GLU  HB3     3.65 #SUP  1.00
 36 THR  HN     37 GLY  HN      4.26 #SUP  1.00
 35 HIS  HN     36 THR  HN      3.42 #SUP  0.92  #QF  0.92
 33 ARG  HA     36 THR  HN      4.42 #SUP  0.89  #QF  0.89
 34 ILE  HA     36 THR  HN      5.50 #SUP  1.00  #QF  0.97
 35 HIS  HB3    36 THR  HN      4.30 #SUP  0.95  #QF  0.95
 35 HIS  HB2    36 THR  HN      4.08 #SUP  0.96  #QF  0.96
 36 THR  HN     36 THR  QG2     3.70 #SUP  0.99  #QF  0.99
 31 HIS  HN     32 GLN  HA      5.13 #SUP  1.00
 31 HIS  HN     32 GLN  HN      3.24 #SUP  0.99  #QF  0.99
 30 GLU  HN     31 HIS  HN      3.25 #SUP  0.98  #QF  0.98
 31 HIS  HN     31 HIS  HD2     4.80 #SUP  0.99  #QF  0.99
 22 PHE  QE     31 HIS  HN      5.11 #SUP  1.00
 22 PHE  HZ     31 HIS  HN      5.05 #SUP  1.00
 29 GLN  HA     31 HIS  HN      4.28 #SUP  1.00  #QF  0.27
 28 LEU  HA     31 HIS  HN      3.68 #SUP  1.00
 31 HIS  HN     31 HIS  HB3     2.88 #SUP  0.99  #QF  0.99
 31 HIS  HN     31 HIS  HB2     3.23 #SUP  1.00
 31 HIS  HN     32 GLN  HB2     5.42 #SUP  0.99  #QF  0.56
 30 GLU  HB3    31 HIS  HN      3.41 #SUP  0.91  #QF  0.91
 28 LEU  QD1    31 HIS  HN      4.63 #SUP  1.00
  9 GLY  HN     10 GLU  HN      5.17 #SUP  0.64  #QF  0.64
 37 GLY  HN     38 GLU  HN      4.58 #SUP  0.65  #QF  0.65
 36 THR  QG2    37 GLY  HN      4.94 #SUP  0.99  #QF  0.99
 22 PHE  QD     23 ILE  HN      4.09 #SUP  0.96  #QF  0.96
 23 ILE  HN     24 HIST HD2     5.25 #SUP  0.84  #QF  0.42
 22 PHE  HB3    23 ILE  HN      3.36 #SUP  0.97  #QF  0.97
 22 PHE  HB2    23 ILE  HN      4.08 #SUP  0.99  #QF  0.99
 23 ILE  HN     27 GLN  HB3     4.86 #SUP  0.98  #QF  0.98
 23 ILE  HN     23 ILE  HB      3.19 #SUP  1.00
 23 ILE  HN     23 ILE  HG12    3.82 #SUP  0.99  #QF  0.99
 23 ILE  HN     23 ILE  HG13    3.82 #SUP  1.00
 23 ILE  HN     23 ILE  QD1     4.22 #SUP  1.00
 23 ILE  HN     23 ILE  QG2     3.91 #SUP  1.00
 13 TYR  HN     21 ALA  HA      5.15 #SUP  0.99  #QF  0.99
 13 TYR  HN     22 PHE  HB2     4.52 #SUP  1.00
 12 PRO  HB3    13 TYR  HN      4.65 #SUP  1.00
 13 TYR  HN     22 PHE  HN      3.57 #SUP  0.96  #QF  0.96
 13 TYR  HN     13 TYR  QD      3.34 #SUP  1.00
 13 TYR  HN     14 ASN  HA      5.16 #SUP  1.00
 12 PRO  QD     13 TYR  HN      3.59 #SUP  1.00
 13 TYR  HN     22 PHE  HB3     5.50 #SUP  0.98  #QF  0.98
 13 TYR  HN     13 TYR  HB3     3.83 #SUP  1.00
 13 TYR  HN     13 TYR  HB2     3.17 #SUP  0.99  #QF  0.99
 12 PRO  HG2    13 TYR  HN      4.07 #SUP  0.96  #QF  0.96
 12 PRO  HB2    13 TYR  HN      4.65 #SUP  1.00
 13 TYR  HN     28 LEU  QD2     5.35 #SUP  0.99  #QF  0.99
 28 LEU  HA     30 GLU  HN      4.92 #SUP  0.91  #QF  0.91
 30 GLU  HN     31 HIS  HB3     4.97 #SUP  0.97  #QF  0.97
 30 GLU  HN     31 HIS  HB2     5.50 #SUP  0.99  #QF  0.99
 29 GLN  HB2    30 GLU  HN      3.14 #SUP  1.00  #QF  0.90
 30 GLU  HN     30 GLU  HB3     3.45 #SUP  1.00  #QF  0.90
 25 ASP  HN     26 SER  HN      4.27 #SUP  0.98  #QF  0.98
 24 HIST HN     25 ASP  HN      5.19 #SUP  0.98  #QF  0.98
 13 TYR  QE     25 ASP  HN      4.22 #SUP  0.98  #QF  0.98
 24 HIST HA     25 ASP  HN      3.21 #SUP  0.94  #QF  0.94
 24 HIST HB3    25 ASP  HN      4.13 #SUP  0.99  #QF  0.99
 24 HIST HB2    25 ASP  HN      4.46 #SUP  0.99  #QF  0.99
 35 HIS  HN     35 HIS  HD2     4.21 #SUP  0.99  #QF  0.99
 35 HIS  HN     36 THR  HA      5.28 #SUP  0.99  #QF  0.99
 33 ARG  HA     35 HIS  HN      4.48 #SUP  0.94  #QF  0.94
 32 GLN  HA     35 HIS  HN      3.96 #SUP  0.91  #QF  0.91
 35 HIS  HN     35 HIS  HB3     3.68 #SUP  0.99  #QF  0.99
 34 ILE  HB     35 HIS  HN      4.22 #SUP  1.00
 35 HIS  HN     36 THR  QG2     4.86 #SUP  1.00
 34 ILE  HG12   35 HIS  HN      4.43 #SUP  1.00
 34 ILE  HG13   35 HIS  HN      4.43 #SUP  1.00
 34 ILE  QG2    35 HIS  HN      4.13 #SUP  1.00
 29 GLN  HN     31 HIS  HN      4.79 #SUP  0.94  #QF  0.94
 29 GLN  HN     30 GLU  HN      3.32 #SUP  1.00
 29 GLN  HN     32 GLN  QG      4.95 #SUP  0.93  #QF  0.93
 25 ASP  HN     27 GLN  HB2     5.50 #SUP  0.98  #QF  0.45
 27 GLN  HB2    29 GLN  HN      5.50 #SUP  0.98  #QF  0.45
 29 GLN  HN     29 GLN  QG      3.10 #SUP  0.99  #QF  0.99
 28 LEU  HB3    29 GLN  HN      3.09 #SUP  0.84  #QF  0.84
 29 GLN  HN     29 GLN  HB2     3.11 #SUP  0.99  #QF  0.99
 28 LEU  HG     29 GLN  HN      4.06 #SUP  1.00
 28 LEU  HB2    29 GLN  HN      4.00 #SUP  1.00
 28 LEU  QD2    29 GLN  HN      4.36 #SUP  0.99  #QF  0.98
 28 LEU  QD1    29 GLN  HN      4.81 #SUP  0.99  #QF  0.98
 32 GLN  HN     33 ARG  HN      3.26 #SUP  1.00
 33 ARG  HN     34 ILE  HN      3.31 #SUP  0.94  #QF  0.94
 31 HIS  HN     33 ARG  HN      4.45 #SUP  1.00
 30 GLU  HN     33 ARG  HN      5.50 #SUP  0.95  #QF  0.95
 30 GLU  HA     33 ARG  HN      4.25 #SUP  0.97  #QF  0.97
 33 ARG  HN     33 ARG  QD      4.14 #SUP  1.00
 32 GLN  QG     33 ARG  HN      4.51 #SUP  0.97  #QF  0.97
 32 GLN  HB2    33 ARG  HN      3.81 #SUP  0.98  #QF  0.96
 33 ARG  HN     33 ARG  HG2     3.45 #SUP  0.97  #QF  0.97
 33 ARG  HN     33 ARG  HG3     3.45 #SUP  1.00
 33 ARG  HN     34 ILE  QG2     4.98 #SUP  0.94  #QF  0.94
 15 CYSS HN     22 PHE  HN      5.38 #SUP  1.00
 21 ALA  HN     22 PHE  HN      4.68 #SUP  1.00
 22 PHE  HN     22 PHE  QD      3.17 #SUP  0.99  #QF  0.99
 13 TYR  QD     22 PHE  HN      5.05 #SUP  0.99  #QF  0.99
 14 ASN  HA     22 PHE  HN      3.79 #SUP  0.99  #QF  0.99
 21 ALA  HA     22 PHE  HN      2.76 #SUP  0.90  #QF  0.90
 22 PHE  HN     22 PHE  HB3     4.04 #SUP  1.00
 13 TYR  HB3    22 PHE  HN      4.47 #SUP  1.00
 13 TYR  HB2    22 PHE  HN      3.92 #SUP  0.99  #QF  0.99
 22 PHE  HN     22 PHE  HB2     3.34 #SUP  0.99  #QF  0.99
 11 LYS  HB3    22 PHE  HN      3.97 #SUP  0.85  #QF  0.85
 21 ALA  QB     22 PHE  HN      3.23 #SUP  0.98  #QF  0.98
 22 PHE  HN     28 LEU  QD2     5.33 #SUP  0.92  #QF  0.43
 22 PHE  HN     28 LEU  QD1     5.50 #SUP  0.92  #QF  0.43
 32 GLN  HN     34 ILE  HN      4.93 #SUP  0.99  #QF  0.99
 34 ILE  HN     35 HIS  HN      3.15 #SUP  0.81  #QF  0.81
 31 HIS  HA     34 ILE  HN      4.30 #SUP  0.92  #QF  0.40
 33 ARG  QD     34 ILE  HN      5.22 #SUP  0.87  #QF  0.68
 34 ILE  HN     35 HIS  HB2     5.50 #SUP  0.87  #QF  0.68
 33 ARG  HG2    34 ILE  HN      4.49 #SUP  0.78  #QF  0.78
 33 ARG  HG3    34 ILE  HN      4.49 #SUP  1.00  #QF  0.23
 34 ILE  HN     34 ILE  HG12    3.82 #SUP  1.00
 34 ILE  HN     34 ILE  HG13    3.82 #SUP  1.00
 34 ILE  HN     34 ILE  QG2     3.36 #SUP  1.00
 15 CYSS HN     16 GLU  HN      4.85 #SUP  0.99  #QF  0.99
 14 ASN  HN     15 CYSS HN      4.40 #SUP  0.98  #QF  0.98
 15 CYSS HN     20 LYS  HN      4.46 #SUP  1.00
 15 CYSS HN     22 PHE  QD      4.56 #SUP  1.00
 15 CYSS HN     22 PHE  QE      4.32 #SUP  1.00
 14 ASN  HA     15 CYSS HN      2.75 #SUP  0.98  #QF  0.98
 15 CYSS HN     21 ALA  HA      3.74 #SUP  0.98  #QF  0.98
 15 CYSS HN     20 LYS  HA      5.50 #SUP  0.87  #QF  0.64
 15 CYSS HN     15 CYSS HB3     3.10 #SUP  1.00
 15 CYSS HN     15 CYSS HB2     3.16 #SUP  1.00
 14 ASN  HB3    15 CYSS HN      3.82 #SUP  0.93  #QF  0.93
 15 CYSS HN     20 LYS  HB2     4.93 #SUP  1.00
 15 CYSS HN     20 LYS  HB3     4.22 #SUP  0.98  #QF  0.98
 15 CYSS HN     28 LEU  QD1     3.94 #SUP  0.99  #QF  0.99
 38 GLU  HN     39 LYS  HN      4.41 #SUP  0.98  #QF  0.98
 39 LYS  HN     39 LYS  QG      4.32 #SUP  0.99  #QF  0.98
 39 LYS  HN     39 LYS  QD      4.90 #SUP  0.99  #QF  0.98
 23 ILE  HN     24 HIST HN      3.26 #SUP  1.00
 24 HIST HN     24 HIST HD2     3.93 #SUP  0.86  #QF  0.70
 14 ASN  HA     21 ALA  HN      5.05 #SUP  1.00
 38 GLU  HA     39 LYS  HN      3.19 #SUP  0.93  #QF  0.93
 20 LYS  HA     21 ALA  HN      2.63 #SUP  0.96  #QF  0.96
 22 PHE  HB3    24 HIST HN      3.46 #SUP  0.99  #QF  0.99
 21 ALA  HN     21 ALA  QB      2.82 #SUP  0.93  #QF  0.93
 23 ILE  QD1    24 HIST HN      4.98 #SUP  1.00
 22 PHE  QD     24 HIST HN      4.82 #SUP  1.00
 24 HIST HN     24 HIST HB3     3.76 #SUP  1.00
 24 HIST HN     24 HIST HB2     3.39 #SUP  0.99  #QF  0.99
 24 HIST HN     27 GLN  HB2     3.62 #SUP  0.98  #QF  0.98
 24 HIST HN     27 GLN  HB3     4.48 #SUP  0.99  #QF  0.99
 23 ILE  HB     24 HIST HN      3.54 #SUP  0.99  #QF  0.99
 23 ILE  QG2    24 HIST HN      4.01 #SUP  1.00
 16 GLU  HN     16 GLU  HG2     4.90 #SUP  1.00
 30 GLU  HN     32 GLN  HN      4.70 #SUP  0.97  #QF  0.97
 31 HIS  HD2    32 GLN  HN      4.10 #SUP  1.00
 15 CYSS HA     16 GLU  HN      3.02 #SUP  0.93  #QF  0.93
 29 GLN  HA     32 GLN  HN      3.84 #SUP  0.97  #QF  0.97
 15 CYSS HB3    16 GLU  HN      5.07 #SUP  1.00
 28 LEU  HA     32 GLN  HN      4.27 #SUP  1.00
 31 HIS  HB3    32 GLN  HN      3.37 #SUP  0.99  #QF  0.99
 15 CYSS HB2    16 GLU  HN      4.65 #SUP  1.00
 32 GLN  HN     32 GLN  QG      3.15 #SUP  0.95  #QF  0.95
 32 GLN  HN     32 GLN  HB2     3.05 #SUP  0.98  #QF  0.98
 29 GLN  HB3    32 GLN  HN      5.50 #SUP  0.97  #QF  0.97
 28 LEU  HG     32 GLN  HN      5.00 #SUP  1.00
 16 GLU  HN     28 LEU  QD1     4.55 #SUP  0.97  #QF  0.97
 28 LEU  QD1    32 GLN  HN      4.26 #SUP  1.00
 24 HIST HB3    26 SER  HN      4.09 #SUP  0.91  #QF  0.91
 24 HIST HB2    26 SER  HN      4.51 #SUP  0.97  #QF  0.97
 16 GLU  HN     18 CYSS HN      4.89 #SUP  0.99  #QF  0.99
 15 CYSS HN     18 CYSS HN      5.26 #SUP  1.00
 17 GLU  HN     18 CYSS HN      3.09 #SUP  1.00
 18 CYSS HN     19 GLY  HN      2.77 #SUP  0.99  #QF  0.99
 15 CYSS HA     18 CYSS HN      5.07 #SUP  0.99  #QF  0.99
 18 CYSS HN     19 GLY  HA1     4.89 #SUP  1.00
 15 CYSS HB3    18 CYSS HN      3.46 #SUP  0.93  #QF  0.93
 15 CYSS HB3    20 LYS  HN      3.60 #SUP  1.00
 18 CYSS HN     18 CYSS HB3     3.51 #SUP  0.98  #QF  0.98
 17 GLU  HG2    18 CYSS HN      5.08 #SUP  1.00
 17 GLU  HG3    18 CYSS HN      5.08 #SUP  1.00
 17 GLU  HB2    18 CYSS HN      3.55 #SUP  0.98  #QF  0.98
 20 LYS  HN     20 LYS  HB2     3.25 #SUP  0.99  #QF  0.99
 17 GLU  HB3    18 CYSS HN      3.63 #SUP  0.99  #QF  0.99
 20 LYS  HN     20 LYS  HB3     3.80 #SUP  1.00
 10 GLU  HN     10 GLU  HB2     4.19 #SUP  1.00
 11 LYS  HN     11 LYS  QD      4.61 #SUP  1.00  #QF  0.99
 14 ASN  HN     14 ASN  HB3     4.12 #SUP  1.00
 14 ASN  HB2    15 CYSS HN      4.04 #SUP  1.00
 30 GLU  HN     30 GLU  HB2     3.08 #SUP  0.75  #QF  0.75
 35 HIS  HN     35 HIS  HB2     3.31 #SUP  0.96  #QF  0.96
 38 GLU  HN     38 GLU  HB2     3.79 #SUP  0.90  #QF  0.90
 22 PHE  QE     28 LEU  QD1     3.69 #SUP  1.00
 15 CYSS HA     28 LEU  QD1     3.46 #SUP  0.98  #QF  0.98
 28 LEU  QD1    31 HIS  HB3     4.16 #SUP  1.00
 13 TYR  HB3    28 LEU  QD1     4.46 #SUP  1.00
 15 CYSS HB2    28 LEU  QD1     3.40 #SUP  0.98  #QF  0.94
 28 LEU  QD1    32 GLN  QG      3.58 #SUP  0.98  #QF  0.94
 22 PHE  HB2    28 LEU  QD1     4.78 #SUP  1.00
 28 LEU  QD1    32 GLN  HB2     4.50 #SUP  0.85  #QF  0.85
 28 LEU  HB3    28 LEU  QD1     3.80 #SUP  1.00
 28 LEU  QD1    32 GLN  HE21    4.75 #SUP  0.99  #QF  0.99
 13 TYR  QE     24 HIST HA      4.08 #SUP  0.89  #QF  0.89
 13 TYR  HA     13 TYR  QE      4.94 #SUP  1.00
 12 PRO  HG2    13 TYR  QE      4.02 #SUP  0.96  #QF  0.96
 13 TYR  QE     28 LEU  QD2     4.64 #SUP  0.99  #QF  0.99
 20 LYS  HB3    28 LEU  QD1     4.15 #SUP  0.80  #QF  0.80
 15 CYSS HN     21 ALA  QB      5.06 #SUP  1.00
 13 TYR  HN     21 ALA  QB      4.92 #SUP  0.98  #QF  0.98
 21 ALA  QB     22 PHE  QD      4.71 #SUP  0.38  #QF  0.38
 20 LYS  HA     21 ALA  QB      4.00 #SUP  0.93  #QF  0.93
 14 ASN  HB3    21 ALA  QB      4.37 #SUP  0.97  #QF  0.97
 11 LYS  HB3    21 ALA  QB      3.56 #SUP  0.83  #QF  0.70
 11 LYS  QD     21 ALA  QB      3.82 #SUP  0.83  #QF  0.70
 18 CYSS HN     19 GLY  HA2     4.89 #SUP  1.00
 34 ILE  HA     36 THR  QG2     5.50 #SUP  0.64  #QF  0.28
 35 HIS  HB3    36 THR  QG2     4.91 #SUP  0.98  #QF  0.98
 35 HIS  HB2    36 THR  QG2     4.56 #SUP  0.92  #QF  0.92
 42 GLY  HA1    43 PRO  QD      3.57 #SUP  0.95  #QF  0.95
 18 CYSS HA     35 HIS  HE1     5.02 #SUP  0.91  #QF  0.91
 18 CYSS HB2    35 HIS  HE1     4.27 #SUP  0.93  #QF  0.93
 22 PHE  HZ     31 HIS  HE1     4.97 #SUP  1.00
 17 GLU  HB2    35 HIS  HE1     4.30 #SUP  0.70  #QF  0.35
 22 PHE  HB2    24 HIST HN      4.55 #SUP  1.00
 22 PHE  HB2    28 LEU  HN      4.95 #SUP  1.00
 30 GLU  HA     33 ARG  QD      3.66 #SUP  0.99  #QF  0.99
 13 TYR  HB3    22 PHE  HB2     4.20 #SUP  1.00
 13 TYR  HB2    22 PHE  HB3     4.17 #SUP  0.99  #QF  0.99
 13 TYR  HB2    22 PHE  HB2     3.76 #SUP  1.00
 22 PHE  HB2    28 LEU  HB3     4.18 #SUP  0.69  #QF  0.69
 22 PHE  HB3    27 GLN  HB3     3.85 #SUP  0.99  #QF  0.99
 30 GLU  HB2    33 ARG  QD      5.10 #SUP  0.98  #QF  0.98
 33 ARG  HB2    33 ARG  QD      3.73 #SUP  1.00  #QF  0.93
 22 PHE  HB2    28 LEU  HB2     3.99 #SUP  1.00
 22 PHE  HB3    28 LEU  QD2     5.34 #SUP  0.94  #QF  0.55
 22 PHE  HB3    28 LEU  QD1     5.50 #SUP  0.94  #QF  0.55
 22 PHE  HB2    28 LEU  QD2     4.88 #SUP  0.97  #QF  0.78
 23 ILE  QG2    24 HIST HE1     4.92 #SUP  0.61  #QF  0.61
 39 LYS  QG     39 LYS  QE      4.09 #SUP  1.00  #QF  0.97
 11 LYS  HG2    11 LYS  QE      3.87 #SUP  0.98  #QF  0.98
 11 LYS  HG3    11 LYS  QE      3.87 #SUP  0.96  #QF  0.94
 11 LYS  QE     21 ALA  QB      4.20 #SUP  0.96  #QF  0.94
 14 ASN  HB3    21 ALA  HA      4.83 #SUP  1.00
 14 ASN  HB2    21 ALA  QB      5.25 #SUP  1.00
 23 ILE  QG2    24 HIST HD2     4.30 #SUP  0.97  #QF  0.96
 12 PRO  QD     23 ILE  QG2     4.57 #SUP  0.99  #QF  0.99
 23 ILE  QG2    23 ILE  HG12    3.72 #SUP  0.99  #QF  0.99
 23 ILE  QG2    23 ILE  HG13    3.72 #SUP  1.00
 23 ILE  QG2    23 ILE  QD1     3.17 #SUP  0.98  #QF  0.98
 31 HIS  HE1    34 ILE  QG2     4.32 #SUP  0.97  #QF  0.97
 34 ILE  QG2    34 ILE  HG12    3.80 #SUP  1.00
 34 ILE  QG2    34 ILE  HG13    3.80 #SUP  0.94  #QF  0.94
 22 PHE  QD     28 LEU  HB3     4.62 #SUP  0.99  #QF  0.99
 22 PHE  HB3    28 LEU  HB2     4.08 #SUP  0.88  #QF  0.70
 13 TYR  HB3    28 LEU  HB3     4.15 #SUP  1.00
 28 LEU  HB3    32 GLN  QG      5.30 #SUP  1.00
 28 LEU  HB3    28 LEU  QD2     3.29 #SUP  0.99  #QF  0.99
 28 LEU  HB2    28 LEU  QD2     3.60 #SUP  0.98  #QF  0.93
 28 LEU  HB2    28 LEU  QD1     3.85 #SUP  0.98  #QF  0.93
 12 PRO  HA     13 TYR  HN      3.33 #SUP  1.00
 12 PRO  HA     13 TYR  QD      4.94 #SUP  1.00
 12 PRO  HA     13 TYR  HB2     5.50 #SUP  0.90  #QF  0.90
 12 PRO  HG2    23 ILE  HA      3.98 #SUP  1.00  #QF  0.31
 13 TYR  HN     23 ILE  HA      4.81 #SUP  0.96  #QF  0.96
 13 TYR  QD     23 ILE  HA      4.17 #SUP  0.99  #QF  0.99
 12 PRO  QD     23 ILE  HA      3.30 #SUP  1.00
 23 ILE  HA     23 ILE  HG12    3.95 #SUP  0.98  #QF  0.98
 23 ILE  HA     23 ILE  HG13    3.95 #SUP  1.00
 23 ILE  HA     23 ILE  QG2     3.35 #SUP  1.00
 34 ILE  HA     34 ILE  HB      3.01 #SUP  1.00
 34 ILE  HA     34 ILE  HG13    4.14 #SUP  1.00
 34 ILE  HA     34 ILE  QG2     3.19 #SUP  1.00
 13 TYR  HB3    22 PHE  HB3     4.81 #SUP  1.00  #QF  0.75
 13 TYR  HB2    28 LEU  HB3     4.45 #SUP  1.00
 36 THR  HA     36 THR  QG2     3.19 #SUP  0.93  #QF  0.93
 13 TYR  HB3    28 LEU  HB2     3.85 #SUP  1.00
 13 TYR  HB2    28 LEU  HB2     4.06 #SUP  1.00
 13 TYR  HB2    28 LEU  QD2     3.71 #SUP  1.00
 13 TYR  HB3    28 LEU  HG      4.84 #SUP  1.00
 31 HIS  HE1    34 ILE  QD1     3.41 #SUP  0.97  #QF  0.97
 34 ILE  HN     34 ILE  QD1     4.35 #SUP  1.00
 31 HIS  HA     34 ILE  QD1     4.77 #SUP  0.98  #QF  0.98
 34 ILE  HA     34 ILE  QD1     4.18 #SUP  1.00
 34 ILE  HB     34 ILE  QD1     3.24 #SUP  1.00
 13 TYR  QD     24 HIST HN      4.79 #SUP  0.96  #QF  0.96
 13 TYR  QD     24 HIST HA      4.71 #SUP  0.99  #QF  0.99
 13 TYR  HA     13 TYR  QD      3.62 #SUP  1.00
 12 PRO  QD     13 TYR  QD      3.79 #SUP  1.00
 13 TYR  QD     22 PHE  HB2     4.69 #SUP  1.00
 13 TYR  QD     28 LEU  HB3     4.78 #SUP  0.91  #QF  0.69
 12 PRO  HG2    13 TYR  QD      3.89 #SUP  0.98  #QF  0.98
 13 TYR  QD     28 LEU  HB2     4.57 #SUP  0.99  #QF  0.99
  8 THR  HA      8 THR  QG2     3.69 #SUP  0.73  #QF  0.73
 13 TYR  QD     28 LEU  QD2     3.55 #SUP  1.00
 34 ILE  HN     34 ILE  HB      3.64 #SUP  1.00
 26 SER  HA     29 GLN  HN      4.28 #SUP  0.98  #QF  0.98
 26 SER  HA     30 GLU  HN      4.88 #SUP  0.98  #QF  0.98
 26 SER  HA     29 GLN  HB3     4.48 #SUP  0.99  #QF  0.99
 23 ILE  HA     23 ILE  QD1     4.01 #SUP  1.00
 23 ILE  HB     23 ILE  QD1     3.41 #SUP  1.00
 21 ALA  HA     22 PHE  QD      3.97 #SUP  0.98  #QF  0.98
 13 TYR  HB3    22 PHE  QD      4.73 #SUP  1.00
 13 TYR  HB2    22 PHE  QD      4.43 #SUP  0.97  #QF  0.53
 15 CYSS HB2    22 PHE  QD      4.66 #SUP  0.97  #QF  0.53
 22 PHE  QD     27 GLN  HB3     3.45 #SUP  0.98  #QF  0.98
 22 PHE  QD     28 LEU  HG      4.89 #SUP  0.99  #QF  0.99
 22 PHE  QD     28 LEU  HB2     3.71 #SUP  0.98  #QF  0.98
 22 PHE  QD     28 LEU  QD1     3.37 #SUP  0.99  #QF  0.99
 30 GLU  HN     30 GLU  HG2     4.67 #SUP  1.00
 30 GLU  HN     30 GLU  HG3     4.67 #SUP  1.00
 30 GLU  HA     30 GLU  HG2     4.06 #SUP  1.00
 32 GLN  HA     34 ILE  HN      4.28 #SUP  1.00
 31 HIS  HA     33 ARG  HN      4.66 #SUP  0.98  #QF  0.98
 31 HIS  HD2    32 GLN  HA      3.74 #SUP  1.00
 32 GLN  HA     35 HIS  HD2     3.31 #SUP  0.99  #QF  0.99
 32 GLN  HA     35 HIS  HB2     4.43 #SUP  0.99  #QF  0.99
 32 GLN  HA     32 GLN  QG      3.25 #SUP  1.00
 28 LEU  QD1    32 GLN  HA      4.87 #SUP  1.00
 29 GLN  HA     33 ARG  HN      5.11 #SUP  0.99  #QF  0.23
 31 HIS  HA     32 GLN  HA      5.50 #SUP  0.94  #QF  0.64
 32 GLN  HA     33 ARG  HA      5.50 #SUP  0.94  #QF  0.64
 29 GLN  HA     32 GLN  HA      5.44 #SUP  0.79  #QF  0.79
 28 LEU  HA     32 GLN  QG      5.17 #SUP  1.00  #QF  0.99
 32 GLN  QG     35 HIS  HB2     5.50 #SUP  1.00  #QF  0.99
 31 HIS  HA     31 HIS  HB2     3.02 #SUP  1.00
 29 GLN  HA     32 GLN  HB2     4.00 #SUP  0.88  #QF  0.47
 30 GLU  HA     33 ARG  HG3     4.46 #SUP  0.99  #QF  0.99
 31 HIS  HA     34 ILE  QG2     4.21 #SUP  1.00
 22 PHE  QE     31 HIS  HD2     3.74 #SUP  0.95  #QF  0.95
 29 GLN  HA     32 GLN  QG      3.87 #SUP  0.99  #QF  0.99
 20 LYS  HB2    22 PHE  QE      4.33 #SUP  0.98  #QF  0.97
 20 LYS  HB3    22 PHE  QE      4.03 #SUP  1.00
 16 GLU  HA     19 GLY  HN      4.72 #SUP  0.44  #QF  0.44
 33 ARG  HA     33 ARG  QD      4.54 #SUP  0.96  #QF  0.96
 29 GLN  HA     29 GLN  QG      3.43 #SUP  0.99  #QF  0.99
 16 GLU  HA     16 GLU  HG3     4.01 #SUP  1.00
 30 GLU  HA     30 GLU  HG3     4.06 #SUP  0.97  #QF  0.36
 17 GLU  HA     17 GLU  HG3     4.06 #SUP  1.00
 33 ARG  HA     33 ARG  HG3     3.89 #SUP  0.96  #QF  0.96
 28 LEU  HG     29 GLN  HA      4.11 #SUP  1.00
 33 ARG  HA     36 THR  QG2     4.27 #SUP  0.96  #QF  0.96
 28 LEU  QD2    29 GLN  HA      4.96 #SUP  0.95  #QF  0.83
 28 LEU  QD1    29 GLN  HA      5.27 #SUP  0.95  #QF  0.83
 24 HIST HN     27 GLN  HG2     4.94 #SUP  1.00
 24 HIST HN     27 GLN  HG3     4.98 #SUP  1.00
 22 PHE  QD     27 GLN  HG2     4.73 #SUP  0.99  #QF  0.99
 27 GLN  HN     27 GLN  HG2     3.93 #SUP  0.88  #QF  0.76
 22 PHE  HB3    27 GLN  HG2     5.50 #SUP  1.00
 24 HIST HB2    27 GLN  HG2     4.13 #SUP  0.98  #QF  0.98
 17 GLU  HA     17 GLU  HG2     4.06 #SUP  0.99  #QF  0.99
 24 HIST HB3    27 GLN  HG2     5.24 #SUP  0.99  #QF  0.99
 20 LYS  HA     20 LYS  HG2     3.87 #SUP  1.00  #QF  0.98
 22 PHE  QD     28 LEU  HA      3.89 #SUP  1.00
 22 PHE  QE     28 LEU  HA      4.30 #SUP  1.00
 20 LYS  HA     21 ALA  HA      4.92 #SUP  0.94  #QF  0.94
 28 LEU  HA     31 HIS  HA      5.50 #SUP  0.99  #QF  0.99
 28 LEU  HA     29 GLN  HA      4.92 #SUP  0.98  #QF  0.98
 22 PHE  HB3    28 LEU  HA      4.74 #SUP  1.00
 28 LEU  HA     31 HIS  HB3     3.35 #SUP  0.99  #QF  0.99
 22 PHE  HB2    28 LEU  HA      4.75 #SUP  1.00
 24 HIST HB2    27 GLN  HB2     4.29 #SUP  1.00  #QF  0.99
 24 HIST HB3    27 GLN  HG3     4.07 #SUP  1.00
 24 HIST HB2    27 GLN  HG3     3.78 #SUP  1.00
 28 LEU  HA     28 LEU  HG      3.92 #SUP  1.00
 28 LEU  HA     28 LEU  QD1     3.13 #SUP  1.00
 20 LYS  HB2    31 HIS  HE1     4.89 #SUP  0.91  #QF  0.91
 20 LYS  HB3    31 HIS  HE1     5.14 #SUP  0.99  #QF  0.99
 20 LYS  HB3    21 ALA  HN      4.16 #SUP  1.00
 27 GLN  HA     31 HIS  HN      5.14 #SUP  1.00
 27 GLN  HA     30 GLU  HN      3.98 #SUP  0.99  #QF  0.99
 20 LYS  HB2    22 PHE  HZ      4.70 #SUP  1.00
 15 CYSS HB2    20 LYS  HB3     4.87 #SUP  0.83  #QF  0.83
 15 CYSS HB2    20 LYS  HB2     4.84 #SUP  0.99  #QF  0.99
 27 GLN  HA     27 GLN  HG2     3.20 #SUP  1.00  #QF  0.98
 27 GLN  HA     27 GLN  HG3     3.61 #SUP  1.00
 27 GLN  HA     30 GLU  HB3     3.62 #SUP  0.98  #QF  0.98
 20 LYS  HB2    21 ALA  HN      4.53 #SUP  1.00
 29 GLN  QG     30 GLU  HN      4.77 #SUP  1.00
 26 SER  HA     29 GLN  QG      3.84 #SUP  1.00  #QF  0.27
 11 LYS  HB2    22 PHE  HN      5.02 #SUP  0.90  #QF  0.90
 11 LYS  HB2    12 PRO  QD      4.54 #SUP  1.00
 22 PHE  HZ     31 HIS  HB3     4.39 #SUP  1.00
 22 PHE  HZ     31 HIS  HB2     3.87 #SUP  1.00
 25 ASP  HA     29 GLN  QG      4.72 #SUP  0.82  #QF  0.82
 20 LYS  HD3    22 PHE  HZ      4.58 #SUP  0.97  #QF  0.97
 11 LYS  HB2    21 ALA  QB      3.49 #SUP  1.00  #QF  0.99
 13 TYR  QD     25 ASP  HA      3.73 #SUP  1.00  #QF  0.96
 25 ASP  HA     28 LEU  HN      4.08 #SUP  1.00  #QF  0.96
 22 PHE  HZ     31 HIS  HD2     4.70 #SUP  0.99  #QF  0.99
 13 TYR  QE     25 ASP  HA      4.52 #SUP  0.99  #QF  0.99
 13 TYR  HB3    25 ASP  HA      4.34 #SUP  1.00
 13 TYR  HB2    25 ASP  HA      4.49 #SUP  0.99  #QF  0.99
 25 ASP  HA     28 LEU  HB3     3.38 #SUP  0.97  #QF  0.95
 10 GLU  HA     11 LYS  HB2     5.23 #SUP  0.87  #QF  0.87
 25 ASP  HA     28 LEU  HG      5.27 #SUP  1.00
 25 ASP  HA     28 LEU  HB2     4.30 #SUP  1.00
 20 LYS  HB3    22 PHE  HZ      4.11 #SUP  1.00
 25 ASP  HA     28 LEU  QD2     4.01 #SUP  1.00
 18 CYSS HN     18 CYSS HB2     3.77 #SUP  0.76  #QF  0.76
 18 CYSS HB3    35 HIS  HE1     3.42 #SUP  0.74  #QF  0.66
 31 HIS  HB3    31 HIS  HD2     3.78 #SUP  1.00
 31 HIS  HD2    32 GLN  QG      3.63 #SUP  0.97  #QF  0.96
 28 LEU  QD1    31 HIS  HD2     3.47 #SUP  1.00
 33 ARG  HN     33 ARG  HB2     3.69 #SUP  1.00
 33 ARG  HN     33 ARG  HB3     3.69 #SUP  1.00
 33 ARG  HB3    33 ARG  QD      3.73 #SUP  1.00
 15 CYSS HB2    20 LYS  HN      4.04 #SUP  1.00
 30 GLU  HB2    31 HIS  HN      4.31 #SUP  1.00
 15 CYSS HB3    31 HIS  HD2     4.15 #SUP  1.00
 15 CYSS HB2    31 HIS  HD2     3.36 #SUP  0.95  #QF  0.95
 15 CYSS HB3    22 PHE  QE      4.13 #SUP  1.00
 15 CYSS HB2    22 PHE  QE      3.67 #SUP  0.98  #QF  0.98
 14 ASN  HA     15 CYSS HB3     5.10 #SUP  1.00
 14 ASN  HA     15 CYSS HB2     4.30 #SUP  1.00
 27 GLN  HA     30 GLU  HB2     4.12 #SUP  0.97  #QF  0.97
 15 CYSS HB3    20 LYS  HB2     4.26 #SUP  1.00
 15 CYSS HB3    20 LYS  HB3     4.57 #SUP  1.00
 15 CYSS HB3    28 LEU  QD1     3.90 #SUP  1.00
 20 LYS  HD2    22 PHE  HZ      4.58 #SUP  0.99  #QF  0.99
 22 PHE  QD     27 GLN  HB2     4.01 #SUP  0.99  #QF  0.99
 27 GLN  HB3    27 GLN  HE22    4.71 #SUP  0.86  #QF  0.69
 22 PHE  QE     27 GLN  HB3     4.86 #SUP  1.00
 22 PHE  HB3    27 GLN  HB2     3.79 #SUP  0.98  #QF  0.98
 24 HIST HB3    27 GLN  HB2     4.89 #SUP  1.00
 24 HIST HB2    27 GLN  HB3     4.87 #SUP  0.94  #QF  0.94
 31 HIS  HB2    32 GLN  HN      4.05 #SUP  1.00
 14 ASN  HA     22 PHE  QD      4.49 #SUP  1.00
 22 PHE  QD     31 HIS  HB3     5.11 #SUP  1.00
 31 HIS  HB3    33 ARG  HN      5.50 #SUP  1.00
 22 PHE  QD     31 HIS  HB2     4.96 #SUP  1.00
 22 PHE  QE     31 HIS  HB3     4.37 #SUP  1.00
 22 PHE  QE     31 HIS  HB2     4.12 #SUP  1.00
 35 HIS  HB3    35 HIS  HD2     3.96 #SUP  1.00
 14 ASN  HA     21 ALA  HA      3.24 #SUP  0.99  #QF  0.99
 13 TYR  HA     14 ASN  HA      5.09 #SUP  1.00  #QF  0.86
 14 ASN  HA     15 CYSS HA      5.42 #SUP  1.00  #QF  0.86
 32 GLN  HA     35 HIS  HB3     5.28 #SUP  1.00
 28 LEU  HA     31 HIS  HB2     3.98 #SUP  1.00
 14 ASN  HA     21 ALA  QB      3.78 #SUP  1.00
 14 ASN  HA     28 LEU  QD2     5.00 #SUP  0.98  #QF  0.33
 32 GLN  HN     32 GLN  HB3     3.80 #SUP  1.00
 32 GLN  HB3    33 ARG  HN      4.44 #SUP  0.99  #QF  0.99
 29 GLN  HA     32 GLN  HB3     4.35 #SUP  0.98  #QF  0.98
 28 LEU  QD1    32 GLN  HB3     4.96 #SUP  0.99  #QF  0.99
 29 GLN  HN     29 GLN  HB3     3.74 #SUP  1.00
 29 GLN  HB3    30 GLU  HN      4.03 #SUP  0.99  #QF  0.99
 26 SER  HA     29 GLN  HB2     3.51 #SUP  0.99  #QF  0.73
 28 LEU  HG     32 GLN  HB2     4.87 #SUP  0.87  #QF  0.87
 33 ARG  HA     33 ARG  HG2     3.89 #SUP  0.99  #QF  0.99
 30 GLU  HA     33 ARG  HG2     4.46 #SUP  0.95  #QF  0.95
 13 TYR  QD     28 LEU  HG      5.11 #SUP  1.00  #QF  0.32
 28 LEU  HG     32 GLN  QG      3.96 #SUP  0.98  #QF  0.98
 12 PRO  HG3    13 TYR  QD      4.53 #SUP  1.00
 39 LYS  HA     40 PRO  HD2     3.30 #SUP  0.96  #QF  0.96
 39 LYS  HA     40 PRO  HD3     3.30 #SUP  0.97  #QF  0.97
 34 ILE  HA     34 ILE  HG12    4.14 #SUP  1.00
 40 PRO  HD2    43 PRO  QB      5.50 #SUP  0.99  #QF  0.98
 40 PRO  HD3    43 PRO  QG      4.15 #SUP  0.95  #QF  0.95
 40 PRO  HD2    43 PRO  QG      4.15 #SUP  0.90  #QF  0.90
 11 LYS  HA     12 PRO  QD      2.77 #SUP  0.97  #QF  0.97
 11 LYS  HB3    12 PRO  QD      3.84 #SUP  0.99  #QF  0.99
 11 LYS  QD     12 PRO  QD      4.34 #SUP  0.99  #QF  0.99
 13 TYR  HA     28 LEU  QD2     3.96 #SUP  0.98  #QF  0.98
 28 LEU  HA     28 LEU  QD2     4.42 #SUP  1.00
 13 TYR  HB3    28 LEU  QD2     3.29 #SUP  1.00
 28 LEU  QD2    32 GLN  QG      4.40 #SUP  1.00
 28 LEU  QD2    29 GLN  QG      4.82 #SUP  0.94  #QF  0.94
 20 LYS  HN     20 LYS  HG2     4.71 #SUP  1.00
 20 LYS  HA     20 LYS  HG3     3.87 #SUP  1.00
 42 GLY  HA2    43 PRO  QD      3.57 #SUP  0.75  #QF  0.75
 11 LYS  HA     11 LYS  HG2     4.15 #SUP  1.00
 11 LYS  HA     11 LYS  HG3     4.15 #SUP  1.00
 23 ILE  HB     24 HIST HD2     4.34 #SUP  0.97  #QF  0.97
 23 ILE  QD1    24 HIST HD2     5.01 #SUP  0.98  #QF  0.98
 11 LYS  HA     23 ILE  HA      3.54 #SUP  0.93  #QF  0.93
 11 LYS  HA     11 LYS  QD      4.31 #SUP  1.00  #QF  0.99
 11 LYS  HA     12 PRO  HG3     4.83 #SUP  0.96  #QF  0.96
 11 LYS  HG2    12 PRO  QD      4.87 #SUP  1.00
 11 LYS  HG3    12 PRO  QD      4.87 #SUP  1.00
 11 LYS  HG2    23 ILE  HA      5.19 #SUP  0.84  #QF  0.26
 11 LYS  HG3    23 ILE  HA      5.19 #SUP  0.89  #QF  0.89
 12 PRO  HG3    13 TYR  QE      4.82 #SUP  0.99  #QF  0.99
 12 PRO  HG3    13 TYR  HN      4.95 #SUP  1.00
 12 PRO  QD     13 TYR  QE      5.08 #SUP  0.99  #QF  0.99
 11 LYS  HB3    13 TYR  HB2     5.13 #SUP  0.74  #QF  0.74
 13 TYR  HN     13 TYR  QE      5.46 #SUP  1.00
 15 CYSS HB2    19 GLY  HN      4.44 #SUP  1.00
 15 CYSS HB2    18 CYSS HN      4.41 #SUP  1.00
 16 GLU  HB2    17 GLU  HN      4.58 #SUP  0.99  #QF  0.99
 16 GLU  HN     16 GLU  HG3     4.90 #SUP  1.00
 17 GLU  HB3    18 CYSS HB3     4.87 #SUP  0.68  #QF  0.68
 18 CYSS HB2    20 LYS  HB2     5.12 #SUP  0.60  #QF  0.60
 18 CYSS HB2    19 GLY  HN      5.03 #SUP  1.00
 20 LYS  HN     20 LYS  HG3     4.71 #SUP  1.00
 22 PHE  QD     27 GLN  HA      5.05 #SUP  1.00
 22 PHE  HN     22 PHE  QE      5.20 #SUP  1.00
 21 ALA  HN     22 PHE  QE      5.50 #SUP  0.99  #QF  0.95
 22 PHE  HZ     31 HIS  HA      5.22 #SUP  1.00
 11 LYS  QE     23 ILE  QD1     4.65 #SUP  0.96  #QF  0.96
 24 HIST HD2    27 GLN  HG3     4.71 #SUP  0.97  #QF  0.97
 24 HIST HD2    27 GLN  HB2     5.50 #SUP  0.95  #QF  0.88
 24 HIST HD2    27 GLN  HG2     5.50 #SUP  0.95  #QF  0.88
 26 SER  HB2    29 GLN  HB2     5.43 #SUP  0.98  #QF  0.98
 26 SER  HB3    29 GLN  HB2     5.43 #SUP  0.99  #QF  0.99
 26 SER  HB3    27 GLN  HN      4.88 #SUP  0.98  #QF  0.98
 22 PHE  HB3    27 GLN  HG3     4.86 #SUP  0.99  #QF  0.99
 14 ASN  HA     28 LEU  QD1     4.57 #SUP  1.00
 14 ASN  HN     28 LEU  QD1     4.79 #SUP  0.98  #QF  0.93
 28 LEU  QD1    31 HIS  HB2     4.57 #SUP  1.00
 31 HIS  HD2    32 GLN  HB2     5.25 #SUP  0.93  #QF  0.84
 31 HIS  HD2    32 GLN  HB3     5.50 #SUP  0.93  #QF  0.84
 31 HIS  HA     31 HIS  HD2     5.20 #SUP  1.00
 15 CYSS HN     31 HIS  HD2     5.46 #SUP  1.00
 16 GLU  HA     16 GLU  HG2     4.01 #SUP  1.00
 33 ARG  HB2    34 ILE  HN      4.69 #SUP  1.00
 33 ARG  HB3    34 ILE  HN      4.69 #SUP  1.00
 32 GLN  QG     35 HIS  HD2     4.10 #SUP  0.97  #QF  0.97
 32 GLN  HB3    35 HIS  HD2     4.63 #SUP  0.83  #QF  0.83
 17 GLU  HB2    35 HIS  HD2     4.52 #SUP  0.99  #QF  0.99
 17 GLU  HB3    35 HIS  HD2     4.62 #SUP  0.99  #QF  0.99
 17 GLU  HG2    35 HIS  HD2     5.32 #SUP  0.99  #QF  0.99
 17 GLU  HG3    35 HIS  HD2     5.32 #SUP  0.98  #QF  0.98
 35 HIS  HB2    35 HIS  HD2     3.64 #SUP  0.99  #QF  0.99
 31 HIS  HE1    35 HIS  HD2     5.50 #SUP  0.99  #QF  0.55
 31 HIS  HE1    34 ILE  HB      5.50 #SUP  0.66  #QF  0.50
 40 PRO  QG     43 PRO  QG      4.71 #SUP  0.99  #QF  0.87
 40 PRO  HD3    43 PRO  QB      5.50 #SUP  1.00  #QF  0.98
  7 GLY  QA      8 THR  QG2     5.34 
  8 THR  QG2     9 GLY  QA      5.34 
 10 GLU  HN     10 GLU  QB      3.44 
 10 GLU  HN     10 GLU  QG      4.75 
 10 GLU  QB     11 LYS  HN      3.65 
 11 LYS  HN     11 LYS  QG      4.03 
 11 LYS  HA     11 LYS  QG      3.57 
 11 LYS  QG     11 LYS  QE      3.38 
 11 LYS  QG     12 PRO  QD      4.28 
 11 LYS  QG     13 TYR  HN      5.04 
 11 LYS  QG     23 ILE  HA      4.42 
 12 PRO  QB     13 TYR  HN      3.87 
 12 PRO  QB     13 TYR  QD      4.54 
 12 PRO  QB     13 TYR  QE      4.57 
 12 PRO  QD     23 ILE  QG1     5.34 
 13 TYR  QD     25 ASP  QB      4.47 
 13 TYR  QE     25 ASP  QB      3.61 
 14 ASN  HN     14 ASN  QD2     4.40 
 14 ASN  HB2    14 ASN  QD2     3.46 
 15 CYSS HN     19 GLY  QA      5.07 
 15 CYSS HA     32 GLN  QE2     4.02 
 15 CYSS HB3    19 GLY  QA      4.66 
 16 GLU  HN     16 GLU  QB      3.35 
 16 GLU  HN     16 GLU  QG      4.23 
 16 GLU  HA     16 GLU  QG      3.45 
 16 GLU  QB     17 GLU  HN      3.72 
 17 GLU  HA     17 GLU  QG      3.56 
 17 GLU  QG     18 CYSS HN      4.47 
 17 GLU  QG     35 HIS  HE1     5.34 
 18 CYSS HN     19 GLY  QA      4.07 
 20 LYS  QG     20 LYS  QE      3.29 
 20 LYS  QG     21 ALA  HN      3.43 
 20 LYS  QG     22 PHE  QE      4.69 
 20 LYS  QG     22 PHE  HZ      4.65 
 20 LYS  QD     22 PHE  HZ      3.74 
 20 LYS  QD     31 HIS  HE1     4.50 
 23 ILE  HN     23 ILE  QG1     3.15 
 23 ILE  HN     27 GLN  QE2     5.26 
 23 ILE  HA     23 ILE  QG1     3.36 
 23 ILE  HB     27 GLN  QE2     5.06 
 23 ILE  QG2    23 ILE  QG1     3.14 
 23 ILE  QG2    27 GLN  QE2     5.05 
 23 ILE  QG1    24 HIST HN      4.08 
 23 ILE  QG1    24 HIST HD2     5.24 
 23 ILE  QD1    27 GLN  QE2     4.80 
 24 HIST HN     27 GLN  QE2     4.38 
 24 HIST HA     25 ASP  QB      4.88 
 24 HIST HD2    27 GLN  QE2     5.07 
 25 ASP  HN     25 ASP  QB      3.11 
 25 ASP  QB     26 SER  HN      3.85 
 26 SER  QB     27 GLN  HN      4.01 
 26 SER  QB     29 GLN  HB2     4.64 
 27 GLN  HA     30 GLU  QG      4.88 
 27 GLN  HB2    27 GLN  QE2     3.80 
 27 GLN  HG3    27 GLN  QE2     3.56 
 28 LEU  HB3    29 GLN  QE2     4.26 
 28 LEU  HG     32 GLN  QE2     4.20 
 28 LEU  QD1    32 GLN  QE2     3.98 
 28 LEU  QD2    29 GLN  QE2     4.17 
 28 LEU  QD2    32 GLN  QE2     3.87 
 29 GLN  HA     29 GLN  QE2     4.85 
 29 GLN  QG     29 GLN  QE2     3.31 
 30 GLU  HA     30 GLU  QG      3.51 
 30 GLU  HA     33 ARG  QB      4.78 
 30 GLU  HA     33 ARG  QG      3.78 
 30 GLU  QG     31 HIS  HN      5.00 
 30 GLU  QG     33 ARG  QD      4.70 
 31 HIS  HA     34 ILE  QG1     4.75 
 31 HIS  HE1    34 ILE  QG1     4.71 
 32 GLN  HN     33 ARG  QG      4.60 
 32 GLN  HB2    32 GLN  QE2     4.71 
 32 GLN  QG     32 GLN  QE2     3.18 
 33 ARG  HN     33 ARG  QB      3.24 
 33 ARG  HN     33 ARG  QG      2.72 
 33 ARG  QB     33 ARG  QD      3.12 
 33 ARG  QB     34 ILE  HN      4.12 
 33 ARG  QB     34 ILE  HA      4.26 
 33 ARG  QG     34 ILE  HN      3.76 
 34 ILE  HN     34 ILE  QG1     3.27 
 34 ILE  QG2    34 ILE  QG1     3.19 
 36 THR  HN     37 GLY  QA      5.34 
 36 THR  QG2    37 GLY  QA      5.34 
 38 GLU  HN     38 GLU  QB      3.19 
 38 GLU  HN     38 GLU  QG      4.08 
 38 GLU  HA     38 GLU  QG      3.60 
 38 GLU  QB     39 LYS  HN      3.99 
 39 LYS  HN     39 LYS  QB      3.36 
 39 LYS  HA     40 PRO  QD      2.88 
 39 LYS  QB     40 PRO  QD      3.38 
 40 PRO  QD     43 PRO  QB      4.68 
 40 PRO  QD     43 PRO  QG      3.48 
 42 GLY  QA     43 PRO  QD      3.02 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1  -4.176  -5.378 -21.546
    2    HA2  GLY   1           1HA      GLY   1  -2.411  -6.080 -19.540
    3    HA3  GLY   1           2HA      GLY   1  -2.689  -4.356 -19.339
    4    H    SER   2           H        SER   2  -3.999  -7.528 -18.986
    5    HA   SER   2           HA       SER   2  -6.654  -7.317 -18.722
    6    HB2  SER   2           1HB      SER   2  -4.742  -8.633 -16.786
    7    HB3  SER   2           2HB      SER   2  -6.491  -8.853 -16.716
    8    HG   SER   2           HG       SER   2  -6.195  -9.462 -19.055
    9    H    SER   3           H        SER   3  -4.338  -6.170 -16.288
   10    HA   SER   3           HA       SER   3  -4.538  -4.711 -14.554
   11    HB2  SER   3           1HB      SER   3  -6.615  -3.683 -16.470
   12    HB3  SER   3           2HB      SER   3  -6.385  -2.918 -14.898
   13    HG   SER   3           HG       SER   3  -4.140  -3.402 -16.497
   14    H    GLY   4           H        GLY   4  -5.717  -7.191 -14.141
   15    HA2  GLY   4           1HA      GLY   4  -6.950  -8.127 -12.416
   16    HA3  GLY   4           2HA      GLY   4  -7.567  -6.527 -12.031
   17    H    SER   5           H        SER   5  -7.793  -8.905 -14.681
   18    HA   SER   5           HA       SER   5 -10.556  -8.094 -15.143
   19    HB2  SER   5           1HB      SER   5 -10.429  -9.436 -17.166
   20    HB3  SER   5           2HB      SER   5  -9.006  -8.399 -17.068
   21    HG   SER   5           HG       SER   5  -9.216 -11.158 -16.887
   22    H    SER   6           H        SER   6  -8.719 -11.046 -14.406
   23    HA   SER   6           HA       SER   6 -10.910 -12.066 -12.833
   24    HB2  SER   6           1HB      SER   6 -11.643 -12.799 -15.030
   25    HB3  SER   6           2HB      SER   6 -10.056 -13.491 -15.364
   26    HG   SER   6           HG       SER   6 -12.048 -14.754 -14.350
   27    H    GLY   7           H        GLY   7 -10.157 -13.255 -11.186
   28    HA2  GLY   7           1HA      GLY   7  -8.471 -15.197 -10.825
   29    HA3  GLY   7           2HA      GLY   7  -7.301 -13.948 -11.227
   30    H    THR   8           H        THR   8  -6.306 -14.105  -9.200
   31    HA   THR   8           HA       THR   8  -7.908 -13.045  -6.963
   32    HB   THR   8           HB       THR   8  -6.178 -14.157  -5.478
   33    HG1  THR   8           HG1      THR   8  -4.918 -15.762  -6.414
   34   HG21  THR   8          3HG2      THR   8  -7.156 -16.534  -6.085
   35   HG22  THR   8          1HG2      THR   8  -8.205 -15.581  -7.134
   36   HG23  THR   8          2HG2      THR   8  -8.181 -15.274  -5.398
   37    H    GLY   9           H        GLY   9  -7.442 -10.879  -7.307
   38    HA2  GLY   9           1HA      GLY   9  -4.748 -10.085  -6.504
   39    HA3  GLY   9           2HA      GLY   9  -5.314  -9.506  -8.063
   40    H    GLU  10           H        GLU  10  -6.154  -9.562  -4.616
   41    HA   GLU  10           HA       GLU  10  -6.894  -6.768  -4.751
   42    HB2  GLU  10           1HB      GLU  10  -8.934  -8.336  -5.315
   43    HB3  GLU  10           2HB      GLU  10  -8.968  -8.573  -3.574
   44    HG2  GLU  10           1HG      GLU  10  -8.875  -5.801  -4.651
   45    HG3  GLU  10           2HG      GLU  10 -10.392  -6.697  -4.708
   46    H    LYS  11           H        LYS  11  -7.050  -5.773  -2.693
   47    HA   LYS  11           HA       LYS  11  -6.501  -7.378  -0.334
   48    HB2  LYS  11           1HB      LYS  11  -4.645  -5.091  -0.928
   49    HB3  LYS  11           2HB      LYS  11  -4.447  -6.394   0.236
   50    HG2  LYS  11           1HG      LYS  11  -4.317  -7.949  -1.778
   51    HG3  LYS  11           2HG      LYS  11  -4.117  -6.485  -2.743
   52    HD2  LYS  11           1HD      LYS  11  -1.923  -6.951  -2.329
   53    HD3  LYS  11           2HD      LYS  11  -2.276  -5.977  -0.899
   54    HE2  LYS  11           1HE      LYS  11  -2.363  -7.827   0.495
   55    HE3  LYS  11           2HE      LYS  11  -2.682  -8.940  -0.835
   56    HZ1  LYS  11           3HZ      LYS  11  -0.525  -9.340  -0.998
   57    HZ2  LYS  11           1HZ      LYS  11  -0.230  -8.333   0.330
   58    HZ3  LYS  11           2HZ      LYS  11  -0.188  -7.700  -1.238
   59    HA   PRO  12           HA       PRO  12  -9.066  -4.307   1.502
   60    HB2  PRO  12           1HB      PRO  12  -8.416  -4.705   4.107
   61    HB3  PRO  12           2HB      PRO  12  -9.424  -5.827   3.186
   62    HG2  PRO  12           1HG      PRO  12  -6.506  -5.996   3.832
   63    HG3  PRO  12           2HG      PRO  12  -7.738  -7.271   3.877
   64    HD2  PRO  12           1HD      PRO  12  -5.995  -7.001   1.823
   65    HD3  PRO  12           2HD      PRO  12  -7.646  -7.615   1.600
   66    H    TYR  13           H        TYR  13  -5.770  -4.070   1.260
   67    HA   TYR  13           HA       TYR  13  -5.820  -1.316   2.233
   68    HB2  TYR  13           1HB      TYR  13  -3.848  -3.419   3.126
   69    HB3  TYR  13           2HB      TYR  13  -3.532  -1.693   3.271
   70    HD1  TYR  13           HD2      TYR  13  -4.860  -0.314   4.818
   71    HD2  TYR  13           HD1      TYR  13  -5.391  -4.530   4.594
   72    HE1  TYR  13           HE2      TYR  13  -6.055  -0.272   6.968
   73    HE2  TYR  13           HE1      TYR  13  -6.588  -4.499   6.743
   74    HH   TYR  13           HH       TYR  13  -7.873  -2.872   8.111
   75    H    ASN  14           H        ASN  14  -4.229   0.038   1.293
   76    HA   ASN  14           HA       ASN  14  -2.370  -0.973  -0.638
   77    HB2  ASN  14           1HB      ASN  14  -4.744   0.608  -1.652
   78    HB3  ASN  14           2HB      ASN  14  -3.358   0.094  -2.610
   79   HD21  ASN  14          1HD2      ASN  14  -6.158  -1.008  -0.818
   80   HD22  ASN  14          2HD2      ASN  14  -6.304  -2.534  -1.616
   81    H    CYS  15           H        CYS  15  -0.861   0.562  -1.273
   82    HA   CYS  15           HA       CYS  15  -0.869   2.998   0.329
   83    HB2  CYS  15           1HB      CYS  15   1.116   1.369   0.131
   84    HB3  CYS  15           2HB      CYS  15   1.369   2.076  -1.462
   85    H    GLU  16           H        GLU  16  -1.749   4.757  -0.525
   86    HA   GLU  16           HA       GLU  16  -1.992   5.075  -3.387
   87    HB2  GLU  16           1HB      GLU  16  -2.839   6.823  -1.073
   88    HB3  GLU  16           2HB      GLU  16  -3.142   7.217  -2.759
   89    HG2  GLU  16           1HG      GLU  16  -4.131   4.729  -1.390
   90    HG3  GLU  16           2HG      GLU  16  -5.076   6.202  -1.600
   91    H    GLU  17           H        GLU  17   0.636   5.253  -1.778
   92    HA   GLU  17           HA       GLU  17   1.495   7.905  -2.716
   93    HB2  GLU  17           1HB      GLU  17   2.649   6.045  -0.639
   94    HB3  GLU  17           2HB      GLU  17   3.505   7.460  -1.235
   95    HG2  GLU  17           1HG      GLU  17   2.312   7.806   0.914
   96    HG3  GLU  17           2HG      GLU  17   1.850   8.928  -0.364
   97    H    CYS  18           H        CYS  18   2.332   4.472  -2.759
   98    HA   CYS  18           HA       CYS  18   4.145   5.018  -5.019
   99    HB2  CYS  18           1HB      CYS  18   5.360   2.954  -4.361
  100    HB3  CYS  18           2HB      CYS  18   5.411   4.203  -3.121
  101    H    GLY  19           H        GLY  19   1.899   2.641  -3.627
  102    HA2  GLY  19           1HA      GLY  19   0.110   1.896  -5.183
  103    HA3  GLY  19           2HA      GLY  19   1.383   1.687  -6.377
  104    H    LYS  20           H        LYS  20   1.621   0.808  -2.978
  105    HA   LYS  20           HA       LYS  20   1.956  -1.992  -3.811
  106    HB2  LYS  20           1HB      LYS  20   3.764  -0.617  -2.507
  107    HB3  LYS  20           2HB      LYS  20   2.751  -0.961  -1.112
  108    HG2  LYS  20           1HG      LYS  20   2.948  -3.377  -1.624
  109    HG3  LYS  20           2HG      LYS  20   4.072  -2.970  -2.923
  110    HD2  LYS  20           1HD      LYS  20   4.612  -1.910  -0.193
  111    HD3  LYS  20           2HD      LYS  20   4.930  -3.618  -0.510
  112    HE2  LYS  20           1HE      LYS  20   6.961  -2.598  -0.998
  113    HE3  LYS  20           2HE      LYS  20   6.205  -2.768  -2.582
  114    HZ1  LYS  20           3HZ      LYS  20   7.268  -0.522  -1.877
  115    HZ2  LYS  20           1HZ      LYS  20   5.804  -0.286  -1.061
  116    HZ3  LYS  20           2HZ      LYS  20   5.810  -0.530  -2.735
  117    H    ALA  21           H        ALA  21   0.439  -3.419  -3.294
  118    HA   ALA  21           HA       ALA  21  -1.753  -2.631  -1.572
  119    HB1  ALA  21           3HB      ALA  21  -1.333  -5.201  -3.094
  120    HB2  ALA  21           1HB      ALA  21  -2.827  -4.676  -2.317
  121    HB3  ALA  21           2HB      ALA  21  -2.189  -3.782  -3.698
  122    H    PHE  22           H        PHE  22  -2.427  -3.749   0.283
  123    HA   PHE  22           HA       PHE  22  -0.493  -5.628   1.446
  124    HB2  PHE  22           1HB      PHE  22  -1.669  -3.197   2.805
  125    HB3  PHE  22           2HB      PHE  22  -0.832  -4.488   3.660
  126    HD1  PHE  22           HD2      PHE  22  -0.423  -1.827   1.134
  127    HD2  PHE  22           HD1      PHE  22   1.519  -4.580   3.735
  128    HE1  PHE  22           HE2      PHE  22   1.726  -0.708   0.707
  129    HE2  PHE  22           HE1      PHE  22   3.672  -3.465   3.313
  130    HZ   PHE  22           HZ       PHE  22   3.777  -1.527   1.796
  131    H    ILE  23           H        ILE  23  -1.359  -7.274   2.626
  132    HA   ILE  23           HA       ILE  23  -4.150  -7.802   2.291
  133    HB   ILE  23           HB       ILE  23  -2.258  -9.348   4.054
  134   HG12  ILE  23          1HG1      ILE  23  -2.728  -9.771   1.097
  135   HG13  ILE  23          2HG1      ILE  23  -1.312  -8.962   1.760
  136   HG21  ILE  23          1HG2      ILE  23  -4.665 -10.239   2.473
  137   HG22  ILE  23          2HG2      ILE  23  -3.719 -11.208   3.601
  138   HG23  ILE  23          3HG2      ILE  23  -4.679  -9.853   4.194
  139   HD11  ILE  23          3HD1      ILE  23  -0.453 -10.908   2.643
  140   HD12  ILE  23          1HD1      ILE  23  -2.022 -11.712   2.672
  141   HD13  ILE  23          2HD1      ILE  23  -1.185 -11.466   1.139
  142    H    HIS  24           H        HIS  24  -2.112  -6.697   4.920
  143    HA   HIS  24           HA       HIS  24  -4.534  -6.275   6.535
  144    HB2  HIS  24           1HB      HIS  24  -1.873  -7.371   7.445
  145    HB3  HIS  24           2HB      HIS  24  -3.057  -6.700   8.563
  146    HD2  HIS  24           HD2      HIS  24  -2.604  -9.841   6.271
  147    HE1  HIS  24           HE1      HIS  24  -5.906 -10.494   8.855
  148    HE2  HIS  24           HE2      HIS  24  -4.325 -11.537   7.194
  149    H    ASP  25           H        ASP  25  -4.007  -4.704   8.407
  150    HA   ASP  25           HA       ASP  25  -3.076  -2.278   7.225
  151    HB2  ASP  25           1HB      ASP  25  -4.937  -2.451   8.914
  152    HB3  ASP  25           2HB      ASP  25  -3.711  -2.770  10.138
  153    H    SER  26           H        SER  26  -2.023  -3.856  10.247
  154    HA   SER  26           HA       SER  26   0.204  -2.535  10.872
  155    HB2  SER  26           1HB      SER  26   1.162  -4.586  11.776
  156    HB3  SER  26           2HB      SER  26  -0.582  -4.581  12.040
  157    HG   SER  26           HG       SER  26  -0.755  -6.276  10.809
  158    H    GLN  27           H        GLN  27  -0.022  -4.861   8.223
  159    HA   GLN  27           HA       GLN  27   2.696  -4.875   7.509
  160    HB2  GLN  27           1HB      GLN  27   0.259  -5.325   5.778
  161    HB3  GLN  27           2HB      GLN  27   1.910  -5.727   5.324
  162    HG2  GLN  27           1HG      GLN  27   1.891  -7.148   7.490
  163    HG3  GLN  27           2HG      GLN  27   0.139  -7.018   7.350
  164   HE21  GLN  27          1HE2      GLN  27  -0.917  -8.208   5.853
  165   HE22  GLN  27          2HE2      GLN  27  -0.150  -9.338   4.795
  166    H    LEU  28           H        LEU  28  -0.015  -3.067   6.057
  167    HA   LEU  28           HA       LEU  28   1.529  -1.559   4.276
  168    HB2  LEU  28           1HB      LEU  28  -0.778  -1.608   3.888
  169    HB3  LEU  28           2HB      LEU  28  -1.154  -1.135   5.544
  170    HG   LEU  28           HG       LEU  28  -0.156   1.125   4.981
  171   HD11  LEU  28          1HD1      LEU  28   0.992   0.183   2.905
  172   HD12  LEU  28          2HD1      LEU  28   0.196   1.750   2.755
  173   HD13  LEU  28          3HD1      LEU  28  -0.588   0.300   2.129
  174   HD21  LEU  28          3HD2      LEU  28  -2.462   1.115   5.174
  175   HD22  LEU  28          1HD2      LEU  28  -2.677   0.032   3.799
  176   HD23  LEU  28          2HD2      LEU  28  -2.223   1.716   3.532
  177    H    GLN  29           H        GLN  29   0.307  -0.699   7.509
  178    HA   GLN  29           HA       GLN  29   1.332   1.857   7.701
  179    HB2  GLN  29           1HB      GLN  29   0.938  -0.260   9.811
  180    HB3  GLN  29           2HB      GLN  29   1.436   1.381  10.198
  181    HG2  GLN  29           1HG      GLN  29  -1.150   0.469   8.980
  182    HG3  GLN  29           2HG      GLN  29  -0.896   1.283  10.522
  183   HE21  GLN  29          1HE2      GLN  29  -1.206   1.647   7.107
  184   HE22  GLN  29          2HE2      GLN  29  -1.249   3.374   7.078
  185    H    GLU  30           H        GLU  30   2.923  -1.209   8.531
  186    HA   GLU  30           HA       GLU  30   5.328  -0.110   9.469
  187    HB2  GLU  30           1HB      GLU  30   4.759  -2.426   9.893
  188    HB3  GLU  30           2HB      GLU  30   4.778  -2.783   8.172
  189    HG2  GLU  30           1HG      GLU  30   7.089  -2.673   8.042
  190    HG3  GLU  30           2HG      GLU  30   7.226  -1.740   9.532
  191    H    HIS  31           H        HIS  31   4.030  -0.039   6.388
  192    HA   HIS  31           HA       HIS  31   6.666   0.160   5.104
  193    HB2  HIS  31           1HB      HIS  31   5.455  -1.313   3.794
  194    HB3  HIS  31           2HB      HIS  31   3.926  -0.495   4.103
  195    HD1  HIS  31           HD1      HIS  31   7.082  -0.096   2.057
  196    HD2  HIS  31           HD2      HIS  31   3.177   1.315   2.190
  197    HE1  HIS  31           HE1      HIS  31   6.775   1.234  -0.055
  198    H    GLN  32           H        GLN  32   3.538   1.830   5.327
  199    HA   GLN  32           HA       GLN  32   4.071   4.069   3.822
  200    HB2  GLN  32           1HB      GLN  32   2.408   3.665   6.291
  201    HB3  GLN  32           2HB      GLN  32   2.530   5.249   5.538
  202    HG2  GLN  32           1HG      GLN  32   1.814   4.079   3.383
  203    HG3  GLN  32           2HG      GLN  32   1.350   2.733   4.423
  204   HE21  GLN  32          1HE2      GLN  32  -0.743   3.349   3.330
  205   HE22  GLN  32          2HE2      GLN  32  -1.740   4.494   4.154
  206    H    ARG  33           H        ARG  33   5.457   3.149   6.828
  207    HA   ARG  33           HA       ARG  33   6.202   5.648   7.858
  208    HB2  ARG  33           1HB      ARG  33   8.083   4.301   8.951
  209    HB3  ARG  33           2HB      ARG  33   6.432   3.815   9.312
  210    HG2  ARG  33           1HG      ARG  33   6.579   1.967   7.794
  211    HG3  ARG  33           2HG      ARG  33   8.162   2.505   7.228
  212    HD2  ARG  33           1HD      ARG  33   7.490   1.586  10.021
  213    HD3  ARG  33           2HD      ARG  33   8.369   0.657   8.808
  214    HE   ARG  33           HE       ARG  33  10.246   1.942   9.208
  215   HH11  ARG  33          1HH1      ARG  33   7.493   3.270  10.873
  216   HH12  ARG  33          2HH1      ARG  33   8.435   4.361  11.834
  217   HH21  ARG  33          1HH2      ARG  33  11.499   3.373  10.467
  218   HH22  ARG  33          2HH2      ARG  33  10.714   4.419  11.602
  219    H    ILE  34           H        ILE  34   7.638   3.621   5.385
  220    HA   ILE  34           HA       ILE  34  10.151   4.844   5.204
  221    HB   ILE  34           HB       ILE  34  10.433   3.770   3.146
  222   HG12  ILE  34          1HG1      ILE  34   7.422   3.679   2.852
  223   HG13  ILE  34          2HG1      ILE  34   8.490   4.802   2.018
  224   HG21  ILE  34          1HG2      ILE  34   9.138   2.399   5.260
  225   HG22  ILE  34          2HG2      ILE  34   8.542   1.733   3.740
  226   HG23  ILE  34          3HG2      ILE  34  10.274   1.761   4.072
  227   HD11  ILE  34          3HD1      ILE  34   8.632   1.813   1.735
  228   HD12  ILE  34          1HD1      ILE  34   7.752   2.880   0.641
  229   HD13  ILE  34          2HD1      ILE  34   9.504   3.021   0.792
  230    H    HIS  35           H        HIS  35   7.022   5.798   3.983
  231    HA   HIS  35           HA       HIS  35   8.060   7.831   2.229
  232    HB2  HIS  35           1HB      HIS  35   5.260   7.250   3.212
  233    HB3  HIS  35           2HB      HIS  35   5.653   8.505   2.041
  234    HD1  HIS  35           HD1      HIS  35   7.225   7.331  -0.057
  235    HD2  HIS  35           HD2      HIS  35   4.391   5.044   1.943
  236    HE1  HIS  35           HE1      HIS  35   6.699   5.415  -1.598
  237    H    THR  36           H        THR  36   6.358   7.806   5.351
  238    HA   THR  36           HA       THR  36   6.154  10.502   5.831
  239    HB   THR  36           HB       THR  36   6.003  10.030   8.154
  240    HG1  THR  36           HG1      THR  36   6.723   7.748   8.771
  241   HG21  THR  36          3HG2      THR  36   5.158   7.449   6.851
  242   HG22  THR  36          1HG2      THR  36   4.290   8.965   6.615
  243   HG23  THR  36          2HG2      THR  36   4.421   8.266   8.229
  244    H    GLY  37           H        GLY  37   8.980   8.425   6.259
  245    HA2  GLY  37           1HA      GLY  37  10.569  10.535   7.419
  246    HA3  GLY  37           2HA      GLY  37  11.132   8.936   6.954
  247    H    GLU  38           H        GLU  38  12.979   9.666   5.926
  248    HA   GLU  38           HA       GLU  38  12.624  11.472   3.644
  249    HB2  GLU  38           1HB      GLU  38  14.393  12.021   5.276
  250    HB3  GLU  38           2HB      GLU  38  15.166  10.478   4.944
  251    HG2  GLU  38           1HG      GLU  38  15.129  11.371   2.470
  252    HG3  GLU  38           2HG      GLU  38  15.039  12.934   3.282
  253    H    LYS  39           H        LYS  39  11.861  10.232   1.999
  254    HA   LYS  39           HA       LYS  39  12.348   7.621   1.378
  255    HB2  LYS  39           1HB      LYS  39  11.593   8.072  -0.802
  256    HB3  LYS  39           2HB      LYS  39  10.823   9.300   0.194
  257    HG2  LYS  39           1HG      LYS  39  13.398   9.837  -1.243
  258    HG3  LYS  39           2HG      LYS  39  11.832  10.024  -2.036
  259    HD2  LYS  39           1HD      LYS  39  12.463  11.351   0.587
  260    HD3  LYS  39           2HD      LYS  39  12.857  12.102  -0.961
  261    HE2  LYS  39           1HE      LYS  39  10.421  11.759  -1.580
  262    HE3  LYS  39           2HE      LYS  39  10.146  11.367   0.116
  263    HZ1  LYS  39           3HZ      LYS  39  10.773  13.937  -1.119
  264    HZ2  LYS  39           1HZ      LYS  39  11.421  13.642   0.416
  265    HZ3  LYS  39           2HZ      LYS  39   9.747  13.582   0.179
  266    HA   PRO  40           HA       PRO  40  16.611   7.254   0.347
  267    HB2  PRO  40           1HB      PRO  40  16.492   5.032  -1.207
  268    HB3  PRO  40           2HB      PRO  40  16.311   4.985   0.551
  269    HG2  PRO  40           1HG      PRO  40  14.201   4.942  -1.572
  270    HG3  PRO  40           2HG      PRO  40  14.316   3.977  -0.088
  271    HD2  PRO  40           1HD      PRO  40  12.716   6.152  -0.291
  272    HD3  PRO  40           2HD      PRO  40  13.496   5.679   1.232
  273    H    SER  41           H        SER  41  17.713   6.285  -1.947
  274    HA   SER  41           HA       SER  41  16.944   8.330  -3.916
  275    HB2  SER  41           1HB      SER  41  19.273   8.031  -4.792
  276    HB3  SER  41           2HB      SER  41  19.210   8.622  -3.132
  277    HG   SER  41           HG       SER  41  19.318   5.864  -3.499
  278    H    GLY  42           H        GLY  42  15.350   7.162  -4.998
  279    HA2  GLY  42           1HA      GLY  42  16.043   5.725  -7.228
  280    HA3  GLY  42           2HA      GLY  42  15.811   4.509  -5.980
  281    HA   PRO  43           HA       PRO  43  11.440   4.629  -6.346
  282    HB2  PRO  43           1HB      PRO  43  10.459   5.176  -3.874
  283    HB3  PRO  43           2HB      PRO  43  11.220   3.635  -4.286
  284    HG2  PRO  43           1HG      PRO  43  12.383   6.003  -2.873
  285    HG3  PRO  43           2HG      PRO  43  12.554   4.280  -2.494
  286    HD2  PRO  43           1HD      PRO  43  14.470   5.683  -3.795
  287    HD3  PRO  43           2HD      PRO  43  14.176   3.959  -4.101
  288    H    SER  44           H        SER  44  13.066   7.446  -5.837
  289    HA   SER  44           HA       SER  44  10.874   9.234  -5.373
  290    HB2  SER  44           1HB      SER  44  13.686   9.766  -6.362
  291    HB3  SER  44           2HB      SER  44  12.528  11.011  -5.896
  292    HG   SER  44           HG       SER  44  13.580   8.972  -4.223
  293    H    SER  45           H        SER  45   9.902   7.778  -7.321
  294    HA   SER  45           HA       SER  45  10.208   9.412  -9.755
  295    HB2  SER  45           1HB      SER  45   9.979   6.468  -9.379
  296    HB3  SER  45           2HB      SER  45   9.167   7.170 -10.778
  297    HG   SER  45           HG       SER  45  11.155   6.818 -11.529
  298    H    GLY  46           H        GLY  46   7.891   7.271  -8.084
  299    HA2  GLY  46           1HA      GLY  46   5.834   9.155  -7.916
  300    HA3  GLY  46           2HA      GLY  46   5.607   8.264  -9.413
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1  -0.473  -7.369 -27.074
    2    HA2  GLY   1           1HA      GLY   1  -1.917  -9.227 -28.828
    3    HA3  GLY   1           2HA      GLY   1  -1.262  -9.841 -27.317
    4    H    SER   2           H        SER   2  -2.846 -10.108 -25.901
    5    HA   SER   2           HA       SER   2  -4.726  -7.896 -25.475
    6    HB2  SER   2           1HB      SER   2  -6.624  -9.377 -25.369
    7    HB3  SER   2           2HB      SER   2  -5.799  -9.666 -26.900
    8    HG   SER   2           HG       SER   2  -4.938 -11.535 -26.074
    9    H    SER   3           H        SER   3  -5.396  -7.607 -23.370
   10    HA   SER   3           HA       SER   3  -3.673  -8.572 -21.340
   11    HB2  SER   3           1HB      SER   3  -4.800  -6.362 -21.253
   12    HB3  SER   3           2HB      SER   3  -6.346  -7.182 -21.031
   13    HG   SER   3           HG       SER   3  -4.388  -6.653 -19.218
   14    H    GLY   4           H        GLY   4  -3.980 -10.075 -19.736
   15    HA2  GLY   4           1HA      GLY   4  -6.159 -11.988 -20.228
   16    HA3  GLY   4           2HA      GLY   4  -4.654 -12.344 -19.393
   17    H    SER   5           H        SER   5  -4.522 -10.334 -17.539
   18    HA   SER   5           HA       SER   5  -6.821 -10.986 -15.828
   19    HB2  SER   5           1HB      SER   5  -5.334 -10.422 -13.934
   20    HB3  SER   5           2HB      SER   5  -4.657 -11.701 -14.941
   21    HG   SER   5           HG       SER   5  -3.197 -10.295 -15.765
   22    H    SER   6           H        SER   6  -8.317  -9.445 -15.833
   23    HA   SER   6           HA       SER   6  -7.978  -6.803 -16.641
   24    HB2  SER   6           1HB      SER   6 -10.159  -6.394 -15.435
   25    HB3  SER   6           2HB      SER   6 -10.186  -7.737 -16.577
   26    HG   SER   6           HG       SER   6 -10.389  -7.746 -13.815
   27    H    GLY   7           H        GLY   7  -8.381  -7.988 -13.294
   28    HA2  GLY   7           1HA      GLY   7  -6.999  -5.541 -12.386
   29    HA3  GLY   7           2HA      GLY   7  -8.198  -6.411 -11.440
   30    H    THR   8           H        THR   8  -5.326  -5.657 -10.947
   31    HA   THR   8           HA       THR   8  -4.289  -8.362 -10.402
   32    HB   THR   8           HB       THR   8  -2.839  -7.100 -11.924
   33    HG1  THR   8           HG1      THR   8  -1.463  -7.086  -9.467
   34   HG21  THR   8          3HG2      THR   8  -1.833  -5.041 -11.370
   35   HG22  THR   8          1HG2      THR   8  -2.343  -5.150  -9.687
   36   HG23  THR   8          2HG2      THR   8  -3.534  -4.846 -10.951
   37    H    GLY   9           H        GLY   9  -4.518  -8.922  -8.341
   38    HA2  GLY   9           1HA      GLY   9  -4.217  -8.817  -6.047
   39    HA3  GLY   9           2HA      GLY   9  -3.572  -7.194  -6.240
   40    H    GLU  10           H        GLU  10  -5.674  -8.526  -4.446
   41    HA   GLU  10           HA       GLU  10  -7.718  -6.443  -4.832
   42    HB2  GLU  10           1HB      GLU  10  -8.145  -9.329  -4.052
   43    HB3  GLU  10           2HB      GLU  10  -9.376  -8.085  -3.889
   44    HG2  GLU  10           1HG      GLU  10  -8.096  -8.427  -6.541
   45    HG3  GLU  10           2HG      GLU  10  -9.239  -9.657  -6.004
   46    H    LYS  11           H        LYS  11  -5.263  -7.313  -2.972
   47    HA   LYS  11           HA       LYS  11  -5.827  -7.644  -0.393
   48    HB2  LYS  11           1HB      LYS  11  -3.904  -5.834  -1.760
   49    HB3  LYS  11           2HB      LYS  11  -4.122  -5.615  -0.028
   50    HG2  LYS  11           1HG      LYS  11  -2.270  -7.079  -0.387
   51    HG3  LYS  11           2HG      LYS  11  -3.602  -8.020   0.288
   52    HD2  LYS  11           1HD      LYS  11  -3.357  -7.862  -2.672
   53    HD3  LYS  11           2HD      LYS  11  -2.203  -8.871  -1.796
   54    HE2  LYS  11           1HE      LYS  11  -4.078 -10.059  -0.737
   55    HE3  LYS  11           2HE      LYS  11  -5.211  -9.071  -1.657
   56    HZ1  LYS  11           3HZ      LYS  11  -3.369 -11.158  -2.634
   57    HZ2  LYS  11           1HZ      LYS  11  -3.954  -9.967  -3.683
   58    HZ3  LYS  11           2HZ      LYS  11  -5.033 -11.004  -2.895
   59    HA   PRO  12           HA       PRO  12  -8.814  -4.635   0.835
   60    HB2  PRO  12           1HB      PRO  12  -8.536  -4.902   3.523
   61    HB3  PRO  12           2HB      PRO  12  -9.362  -6.100   2.518
   62    HG2  PRO  12           1HG      PRO  12  -6.564  -6.126   3.584
   63    HG3  PRO  12           2HG      PRO  12  -7.746  -7.446   3.510
   64    HD2  PRO  12           1HD      PRO  12  -5.733  -7.190   1.717
   65    HD3  PRO  12           2HD      PRO  12  -7.312  -7.877   1.287
   66    H    TYR  13           H        TYR  13  -5.543  -4.252   1.005
   67    HA   TYR  13           HA       TYR  13  -5.827  -1.486   1.909
   68    HB2  TYR  13           1HB      TYR  13  -3.885  -3.497   3.037
   69    HB3  TYR  13           2HB      TYR  13  -3.612  -1.762   3.152
   70    HD1  TYR  13           HD2      TYR  13  -5.069  -0.364   4.544
   71    HD2  TYR  13           HD1      TYR  13  -5.570  -4.586   4.372
   72    HE1  TYR  13           HE2      TYR  13  -6.458  -0.276   6.572
   73    HE2  TYR  13           HE1      TYR  13  -6.961  -4.509   6.399
   74    HH   TYR  13           HH       TYR  13  -7.511  -3.179   8.206
   75    H    ASN  14           H        ASN  14  -4.290  -0.053   1.053
   76    HA   ASN  14           HA       ASN  14  -2.196  -1.010  -0.678
   77    HB2  ASN  14           1HB      ASN  14  -4.201   0.741  -2.047
   78    HB3  ASN  14           2HB      ASN  14  -3.030  -0.374  -2.746
   79   HD21  ASN  14          1HD2      ASN  14  -3.601  -2.447  -3.121
   80   HD22  ASN  14          2HD2      ASN  14  -5.178  -3.087  -2.820
   81    H    CYS  15           H        CYS  15  -0.640   0.525  -1.064
   82    HA   CYS  15           HA       CYS  15  -0.770   2.895   0.577
   83    HB2  CYS  15           1HB      CYS  15   1.274   1.355   0.186
   84    HB3  CYS  15           2HB      CYS  15   1.465   2.238  -1.326
   85    H    GLU  16           H        GLU  16  -1.399   4.839  -0.072
   86    HA   GLU  16           HA       GLU  16  -1.908   5.305  -2.898
   87    HB2  GLU  16           1HB      GLU  16  -3.449   5.905  -0.858
   88    HB3  GLU  16           2HB      GLU  16  -2.435   7.338  -0.766
   89    HG2  GLU  16           1HG      GLU  16  -2.989   7.519  -3.318
   90    HG3  GLU  16           2HG      GLU  16  -4.367   6.514  -2.872
   91    H    GLU  17           H        GLU  17   0.822   5.326  -1.468
   92    HA   GLU  17           HA       GLU  17   1.676   8.010  -2.322
   93    HB2  GLU  17           1HB      GLU  17   2.834   6.075  -0.326
   94    HB3  GLU  17           2HB      GLU  17   3.763   7.427  -0.957
   95    HG2  GLU  17           1HG      GLU  17   1.918   8.931  -0.151
   96    HG3  GLU  17           2HG      GLU  17   1.242   7.528   0.674
   97    H    CYS  18           H        CYS  18   2.339   4.567  -2.602
   98    HA   CYS  18           HA       CYS  18   4.152   5.160  -4.849
   99    HB2  CYS  18           1HB      CYS  18   5.154   2.889  -4.351
  100    HB3  CYS  18           2HB      CYS  18   5.462   4.135  -3.146
  101    H    GLY  19           H        GLY  19   1.851   2.755  -3.583
  102    HA2  GLY  19           1HA      GLY  19  -0.034   2.233  -5.120
  103    HA3  GLY  19           2HA      GLY  19   1.178   2.099  -6.386
  104    H    LYS  20           H        LYS  20   1.248   0.859  -3.064
  105    HA   LYS  20           HA       LYS  20   1.614  -1.838  -4.186
  106    HB2  LYS  20           1HB      LYS  20   3.442  -0.744  -2.750
  107    HB3  LYS  20           2HB      LYS  20   2.355  -0.999  -1.391
  108    HG2  LYS  20           1HG      LYS  20   2.493  -3.328  -1.569
  109    HG3  LYS  20           2HG      LYS  20   3.171  -3.248  -3.197
  110    HD2  LYS  20           1HD      LYS  20   5.214  -2.233  -2.274
  111    HD3  LYS  20           2HD      LYS  20   4.534  -2.368  -0.651
  112    HE2  LYS  20           1HE      LYS  20   4.483  -4.776  -0.831
  113    HE3  LYS  20           2HE      LYS  20   5.023  -4.694  -2.507
  114    HZ1  LYS  20           3HZ      LYS  20   6.919  -5.196  -1.251
  115    HZ2  LYS  20           1HZ      LYS  20   6.559  -4.047  -0.062
  116    HZ3  LYS  20           2HZ      LYS  20   7.063  -3.547  -1.597
  117    H    ALA  21           H        ALA  21   0.902  -3.606  -2.592
  118    HA   ALA  21           HA       ALA  21  -1.724  -2.872  -1.468
  119    HB1  ALA  21           3HB      ALA  21  -0.969  -4.962  -3.359
  120    HB2  ALA  21           1HB      ALA  21  -1.925  -5.552  -1.999
  121    HB3  ALA  21           2HB      ALA  21  -2.548  -4.255  -3.019
  122    H    PHE  22           H        PHE  22  -2.490  -4.321   0.267
  123    HA   PHE  22           HA       PHE  22  -0.481  -5.848   1.689
  124    HB2  PHE  22           1HB      PHE  22  -1.702  -3.349   2.875
  125    HB3  PHE  22           2HB      PHE  22  -0.814  -4.555   3.801
  126    HD1  PHE  22           HD2      PHE  22  -0.542  -1.969   1.201
  127    HD2  PHE  22           HD1      PHE  22   1.560  -4.655   3.746
  128    HE1  PHE  22           HE2      PHE  22   1.565  -0.816   0.670
  129    HE2  PHE  22           HE1      PHE  22   3.672  -3.506   3.220
  130    HZ   PHE  22           HZ       PHE  22   3.676  -1.585   1.679
  131    H    ILE  23           H        ILE  23  -1.347  -7.375   3.038
  132    HA   ILE  23           HA       ILE  23  -4.163  -7.900   2.729
  133    HB   ILE  23           HB       ILE  23  -2.067  -9.396   4.307
  134   HG12  ILE  23          1HG1      ILE  23  -3.308 -10.199   1.680
  135   HG13  ILE  23          2HG1      ILE  23  -1.847  -9.221   1.756
  136   HG21  ILE  23          1HG2      ILE  23  -4.527  -9.653   4.973
  137   HG22  ILE  23          2HG2      ILE  23  -4.721 -10.479   3.429
  138   HG23  ILE  23          3HG2      ILE  23  -3.609 -11.120   4.637
  139   HD11  ILE  23          3HD1      ILE  23  -0.904 -11.095   3.221
  140   HD12  ILE  23          1HD1      ILE  23  -2.254 -12.055   2.617
  141   HD13  ILE  23          2HD1      ILE  23  -1.071 -11.392   1.491
  142    H    HIS  24           H        HIS  24  -1.987  -7.041   5.385
  143    HA   HIS  24           HA       HIS  24  -4.361  -6.470   7.037
  144    HB2  HIS  24           1HB      HIS  24  -1.618  -7.359   7.955
  145    HB3  HIS  24           2HB      HIS  24  -2.953  -6.925   9.018
  146    HD2  HIS  24           HD2      HIS  24  -1.572  -9.975   7.203
  147    HE1  HIS  24           HE1      HIS  24  -5.465 -11.006   8.537
  148    HE2  HIS  24           HE2      HIS  24  -3.273 -11.871   7.649
  149    H    ASP  25           H        ASP  25  -4.299  -4.616   8.363
  150    HA   ASP  25           HA       ASP  25  -3.230  -2.324   7.221
  151    HB2  ASP  25           1HB      ASP  25  -5.066  -2.097   8.720
  152    HB3  ASP  25           2HB      ASP  25  -4.184  -2.879  10.029
  153    H    SER  26           H        SER  26  -2.149  -3.826  10.274
  154    HA   SER  26           HA       SER  26   0.008  -2.384  10.923
  155    HB2  SER  26           1HB      SER  26   1.102  -4.494  11.721
  156    HB3  SER  26           2HB      SER  26  -0.585  -4.339  12.210
  157    HG   SER  26           HG       SER  26  -0.219  -6.412  11.416
  158    H    GLN  27           H        GLN  27  -0.063  -4.794   8.333
  159    HA   GLN  27           HA       GLN  27   2.662  -4.651   7.646
  160    HB2  GLN  27           1HB      GLN  27   0.261  -5.367   5.956
  161    HB3  GLN  27           2HB      GLN  27   1.932  -5.614   5.466
  162    HG2  GLN  27           1HG      GLN  27   2.029  -6.921   7.762
  163    HG3  GLN  27           2HG      GLN  27   0.300  -7.078   7.459
  164   HE21  GLN  27          1HE2      GLN  27  -0.414  -8.345   5.784
  165   HE22  GLN  27          2HE2      GLN  27   0.622  -9.407   4.898
  166    H    LEU  28           H        LEU  28  -0.151  -3.115   6.079
  167    HA   LEU  28           HA       LEU  28   1.272  -1.582   4.238
  168    HB2  LEU  28           1HB      LEU  28  -1.028  -1.760   3.886
  169    HB3  LEU  28           2HB      LEU  28  -1.409  -1.267   5.534
  170    HG   LEU  28           HG       LEU  28  -0.700   1.033   4.975
  171   HD11  LEU  28          1HD1      LEU  28  -0.305   1.664   2.675
  172   HD12  LEU  28          2HD1      LEU  28  -0.504  -0.008   2.153
  173   HD13  LEU  28          3HD1      LEU  28   0.865   0.440   3.169
  174   HD21  LEU  28          3HD2      LEU  28  -2.661   0.521   2.860
  175   HD22  LEU  28          1HD2      LEU  28  -2.777   1.534   4.299
  176   HD23  LEU  28          2HD2      LEU  28  -3.063  -0.202   4.418
  177    H    GLN  29           H        GLN  29   0.054  -0.646   7.451
  178    HA   GLN  29           HA       GLN  29   1.013   1.964   7.481
  179    HB2  GLN  29           1HB      GLN  29   0.635   0.014   9.757
  180    HB3  GLN  29           2HB      GLN  29   0.974   1.726   9.979
  181    HG2  GLN  29           1HG      GLN  29  -1.473   0.450   8.805
  182    HG3  GLN  29           2HG      GLN  29  -1.347   1.485  10.227
  183   HE21  GLN  29          1HE2      GLN  29  -2.436   1.432   7.194
  184   HE22  GLN  29          2HE2      GLN  29  -2.281   3.099   6.769
  185    H    GLU  30           H        GLU  30   2.595  -1.022   8.574
  186    HA   GLU  30           HA       GLU  30   4.952   0.148   9.532
  187    HB2  GLU  30           1HB      GLU  30   4.314  -2.177   9.999
  188    HB3  GLU  30           2HB      GLU  30   4.567  -2.590   8.309
  189    HG2  GLU  30           1HG      GLU  30   6.889  -2.310   8.473
  190    HG3  GLU  30           2HG      GLU  30   6.760  -1.460  10.012
  191    H    HIS  31           H        HIS  31   3.796  -0.166   6.357
  192    HA   HIS  31           HA       HIS  31   6.449  -0.020   5.151
  193    HB2  HIS  31           1HB      HIS  31   5.141  -1.429   3.859
  194    HB3  HIS  31           2HB      HIS  31   3.681  -0.478   4.112
  195    HD1  HIS  31           HD1      HIS  31   6.695  -0.731   1.931
  196    HD2  HIS  31           HD2      HIS  31   3.331   1.673   2.339
  197    HE1  HIS  31           HE1      HIS  31   6.597   0.650  -0.168
  198    H    GLN  32           H        GLN  32   3.412   1.846   5.081
  199    HA   GLN  32           HA       GLN  32   4.051   3.999   3.605
  200    HB2  GLN  32           1HB      GLN  32   2.521   3.790   6.172
  201    HB3  GLN  32           2HB      GLN  32   2.767   5.365   5.429
  202    HG2  GLN  32           1HG      GLN  32   1.791   4.369   3.318
  203    HG3  GLN  32           2HG      GLN  32   1.307   2.994   4.310
  204   HE21  GLN  32          1HE2      GLN  32  -0.368   4.850   2.864
  205   HE22  GLN  32          2HE2      GLN  32  -1.396   5.600   4.032
  206    H    ARG  33           H        ARG  33   5.478   3.147   6.644
  207    HA   ARG  33           HA       ARG  33   6.506   5.532   7.556
  208    HB2  ARG  33           1HB      ARG  33   8.134   2.998   7.542
  209    HB3  ARG  33           2HB      ARG  33   8.114   4.276   8.751
  210    HG2  ARG  33           1HG      ARG  33   5.583   3.537   8.962
  211    HG3  ARG  33           2HG      ARG  33   6.236   2.021   8.338
  212    HD2  ARG  33           1HD      ARG  33   7.503   1.639  10.203
  213    HD3  ARG  33           2HD      ARG  33   7.682   3.356  10.564
  214    HE   ARG  33           HE       ARG  33   4.996   2.401  10.889
  215   HH11  ARG  33          1HH1      ARG  33   8.110   2.724  12.412
  216   HH12  ARG  33          2HH1      ARG  33   7.471   2.681  14.022
  217   HH21  ARG  33          1HH2      ARG  33   4.144   2.343  13.004
  218   HH22  ARG  33          2HH2      ARG  33   5.216   2.463  14.358
  219    H    ILE  34           H        ILE  34   7.924   3.351   5.135
  220    HA   ILE  34           HA       ILE  34  10.307   4.621   4.641
  221    HB   ILE  34           HB       ILE  34  10.288   3.672   2.426
  222   HG12  ILE  34          1HG1      ILE  34   7.464   2.740   2.686
  223   HG13  ILE  34          2HG1      ILE  34   7.746   4.405   2.188
  224   HG21  ILE  34          1HG2      ILE  34   9.574   2.186   4.790
  225   HG22  ILE  34          2HG2      ILE  34   8.993   1.376   3.335
  226   HG23  ILE  34          3HG2      ILE  34  10.704   1.771   3.501
  227   HD11  ILE  34          3HD1      ILE  34   9.325   3.361   0.434
  228   HD12  ILE  34          1HD1      ILE  34   8.451   1.869   0.782
  229   HD13  ILE  34          2HD1      ILE  34   7.581   3.281   0.182
  230    H    HIS  35           H        HIS  35   7.111   5.697   3.868
  231    HA   HIS  35           HA       HIS  35   8.019   7.706   1.985
  232    HB2  HIS  35           1HB      HIS  35   5.305   7.056   3.139
  233    HB3  HIS  35           2HB      HIS  35   5.586   8.400   2.037
  234    HD1  HIS  35           HD1      HIS  35   6.823   7.538  -0.322
  235    HD2  HIS  35           HD2      HIS  35   4.572   4.803   1.850
  236    HE1  HIS  35           HE1      HIS  35   6.263   5.695  -1.938
  237    H    THR  36           H        THR  36   6.506   7.656   5.205
  238    HA   THR  36           HA       THR  36   6.345  10.332   5.747
  239    HB   THR  36           HB       THR  36   6.339   9.829   8.053
  240    HG1  THR  36           HG1      THR  36   8.373   8.738   8.119
  241   HG21  THR  36          3HG2      THR  36   4.865   7.973   8.231
  242   HG22  THR  36          1HG2      THR  36   5.533   7.215   6.787
  243   HG23  THR  36          2HG2      THR  36   4.575   8.689   6.646
  244    H    GLY  37           H        GLY  37   9.197   8.251   6.175
  245    HA2  GLY  37           1HA      GLY  37  10.902  10.169   7.289
  246    HA3  GLY  37           2HA      GLY  37  11.424   8.760   6.378
  247    H    GLU  38           H        GLU  38  11.123  12.143   6.399
  248    HA   GLU  38           HA       GLU  38  11.993  12.248   3.586
  249    HB2  GLU  38           1HB      GLU  38   9.797  13.207   3.690
  250    HB3  GLU  38           2HB      GLU  38  10.225  14.172   5.096
  251    HG2  GLU  38           1HG      GLU  38  11.765  15.484   3.749
  252    HG3  GLU  38           2HG      GLU  38  11.382  14.501   2.337
  253    H    LYS  39           H        LYS  39  13.837  13.316   3.162
  254    HA   LYS  39           HA       LYS  39  15.498  14.128   5.344
  255    HB2  LYS  39           1HB      LYS  39  16.403  13.038   3.325
  256    HB3  LYS  39           2HB      LYS  39  15.929  14.435   2.366
  257    HG2  LYS  39           1HG      LYS  39  17.421  15.790   3.941
  258    HG3  LYS  39           2HG      LYS  39  18.076  14.230   4.446
  259    HD2  LYS  39           1HD      LYS  39  19.532  14.764   2.756
  260    HD3  LYS  39           2HD      LYS  39  18.314  13.862   1.851
  261    HE2  LYS  39           1HE      LYS  39  17.245  15.949   1.188
  262    HE3  LYS  39           2HE      LYS  39  18.422  16.865   2.128
  263    HZ1  LYS  39           3HZ      LYS  39  18.636  16.041  -0.514
  264    HZ2  LYS  39           1HZ      LYS  39  19.767  15.134   0.357
  265    HZ3  LYS  39           2HZ      LYS  39  19.809  16.823   0.421
  266    HA   PRO  40           HA       PRO  40  14.370  18.384   5.560
  267    HB2  PRO  40           1HB      PRO  40  16.599  19.332   6.785
  268    HB3  PRO  40           2HB      PRO  40  15.370  18.383   7.629
  269    HG2  PRO  40           1HG      PRO  40  17.999  17.501   6.503
  270    HG3  PRO  40           2HG      PRO  40  17.248  17.080   8.053
  271    HD2  PRO  40           1HD      PRO  40  17.188  15.428   5.907
  272    HD3  PRO  40           2HD      PRO  40  15.873  15.495   7.098
  273    H    SER  41           H        SER  41  15.620  20.598   5.232
  274    HA   SER  41           HA       SER  41  16.599  20.518   2.499
  275    HB2  SER  41           1HB      SER  41  16.449  23.011   2.661
  276    HB3  SER  41           2HB      SER  41  14.927  22.189   3.001
  277    HG   SER  41           HG       SER  41  15.011  23.416   4.725
  278    H    GLY  42           H        GLY  42  18.441  19.316   4.061
  279    HA2  GLY  42           1HA      GLY  42  20.845  19.701   3.681
  280    HA3  GLY  42           2HA      GLY  42  20.583  21.345   4.243
  281    HA   PRO  43           HA       PRO  43  20.211  18.473   8.129
  282    HB2  PRO  43           1HB      PRO  43  21.026  15.904   7.798
  283    HB3  PRO  43           2HB      PRO  43  19.353  16.420   7.554
  284    HG2  PRO  43           1HG      PRO  43  21.504  15.943   5.527
  285    HG3  PRO  43           2HG      PRO  43  19.794  15.476   5.475
  286    HD2  PRO  43           1HD      PRO  43  20.755  17.635   4.154
  287    HD3  PRO  43           2HD      PRO  43  19.110  17.577   4.819
  288    H    SER  44           H        SER  44  21.948  17.054   9.413
  289    HA   SER  44           HA       SER  44  24.526  18.322   8.838
  290    HB2  SER  44           1HB      SER  44  23.615  16.920  11.362
  291    HB3  SER  44           2HB      SER  44  25.087  17.870  11.163
  292    HG   SER  44           HG       SER  44  22.585  19.031  10.622
  293    H    SER  45           H        SER  45  24.355  16.476   7.058
  294    HA   SER  45           HA       SER  45  26.177  14.396   7.970
  295    HB2  SER  45           1HB      SER  45  24.903  12.560   7.191
  296    HB3  SER  45           2HB      SER  45  23.762  13.544   8.107
  297    HG   SER  45           HG       SER  45  22.875  14.270   6.231
  298    H    GLY  46           H        GLY  46  26.909  13.041   6.008
  299    HA2  GLY  46           1HA      GLY  46  28.377  14.418   4.258
  300    HA3  GLY  46           2HA      GLY  46  27.611  12.907   3.791
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1  -2.266 -12.509 -26.945
    2    HA2  GLY   1           1HA      GLY   1  -3.241 -10.643 -25.674
    3    HA3  GLY   1           2HA      GLY   1  -4.818 -11.328 -26.037
    4    H    SER   2           H        SER   2  -2.648 -10.945 -23.643
    5    HA   SER   2           HA       SER   2  -3.315 -13.507 -22.353
    6    HB2  SER   2           1HB      SER   2  -0.901 -13.083 -22.573
    7    HB3  SER   2           2HB      SER   2  -1.086 -11.562 -21.700
    8    HG   SER   2           HG       SER   2  -1.431 -12.638 -19.857
    9    H    SER   3           H        SER   3  -5.348 -12.923 -21.587
   10    HA   SER   3           HA       SER   3  -5.587 -10.580 -19.875
   11    HB2  SER   3           1HB      SER   3  -7.566 -12.571 -20.971
   12    HB3  SER   3           2HB      SER   3  -8.015 -11.419 -19.714
   13    HG   SER   3           HG       SER   3  -7.998  -9.861 -21.137
   14    H    GLY   4           H        GLY   4  -6.076 -14.100 -19.630
   15    HA2  GLY   4           1HA      GLY   4  -5.941 -15.519 -17.831
   16    HA3  GLY   4           2HA      GLY   4  -4.930 -14.301 -17.068
   17    H    SER   5           H        SER   5  -6.657 -15.852 -15.580
   18    HA   SER   5           HA       SER   5  -8.789 -13.945 -14.871
   19    HB2  SER   5           1HB      SER   5 -10.153 -15.747 -14.144
   20    HB3  SER   5           2HB      SER   5  -9.484 -16.261 -15.692
   21    HG   SER   5           HG       SER   5  -9.348 -17.558 -13.449
   22    H    SER   6           H        SER   6  -9.466 -14.269 -12.478
   23    HA   SER   6           HA       SER   6  -7.001 -14.275 -10.868
   24    HB2  SER   6           1HB      SER   6  -9.483 -12.620 -10.779
   25    HB3  SER   6           2HB      SER   6  -8.655 -12.955  -9.259
   26    HG   SER   6           HG       SER   6  -6.804 -12.007 -10.093
   27    H    GLY   7           H        GLY   7  -7.543 -14.707  -8.444
   28    HA2  GLY   7           1HA      GLY   7  -9.549 -16.839  -8.191
   29    HA3  GLY   7           2HA      GLY   7  -7.878 -17.198  -7.782
   30    H    THR   8           H        THR   8  -8.466 -17.679  -5.636
   31    HA   THR   8           HA       THR   8  -9.844 -15.841  -3.966
   32    HB   THR   8           HB       THR   8  -8.019 -18.125  -3.193
   33    HG1  THR   8           HG1      THR   8 -10.180 -18.362  -4.451
   34   HG21  THR   8          3HG2      THR   8  -8.192 -17.151  -1.162
   35   HG22  THR   8          1HG2      THR   8  -9.801 -17.871  -1.167
   36   HG23  THR   8          2HG2      THR   8  -9.589 -16.183  -1.631
   37    H    GLY   9           H        GLY   9  -9.064 -14.442  -2.388
   38    HA2  GLY   9           1HA      GLY   9  -7.204 -13.555  -1.097
   39    HA3  GLY   9           2HA      GLY   9  -6.166 -13.891  -2.475
   40    H    GLU  10           H        GLU  10  -6.985 -11.396  -0.875
   41    HA   GLU  10           HA       GLU  10  -6.976  -9.627  -3.144
   42    HB2  GLU  10           1HB      GLU  10  -9.389 -10.133  -2.899
   43    HB3  GLU  10           2HB      GLU  10  -9.326  -9.543  -1.244
   44    HG2  GLU  10           1HG      GLU  10  -8.768  -7.323  -2.019
   45    HG3  GLU  10           2HG      GLU  10  -8.717  -7.893  -3.686
   46    H    LYS  11           H        LYS  11  -6.469  -7.463  -2.590
   47    HA   LYS  11           HA       LYS  11  -5.403  -7.181   0.140
   48    HB2  LYS  11           1HB      LYS  11  -4.468  -6.187  -2.525
   49    HB3  LYS  11           2HB      LYS  11  -4.053  -5.281  -1.075
   50    HG2  LYS  11           1HG      LYS  11  -2.229  -6.663  -1.343
   51    HG3  LYS  11           2HG      LYS  11  -3.213  -7.559  -0.183
   52    HD2  LYS  11           1HD      LYS  11  -4.208  -8.686  -2.307
   53    HD3  LYS  11           2HD      LYS  11  -2.737  -8.100  -3.087
   54    HE2  LYS  11           1HE      LYS  11  -1.599  -9.198  -0.975
   55    HE3  LYS  11           2HE      LYS  11  -3.080 -10.154  -0.959
   56    HZ1  LYS  11           3HZ      LYS  11  -0.893 -10.149  -2.888
   57    HZ2  LYS  11           1HZ      LYS  11  -2.452 -10.375  -3.505
   58    HZ3  LYS  11           2HZ      LYS  11  -1.844 -11.433  -2.334
   59    HA   PRO  12           HA       PRO  12  -8.843  -4.198   0.190
   60    HB2  PRO  12           1HB      PRO  12  -9.093  -4.225   2.893
   61    HB3  PRO  12           2HB      PRO  12  -9.825  -5.448   1.849
   62    HG2  PRO  12           1HG      PRO  12  -7.288  -5.581   3.432
   63    HG3  PRO  12           2HG      PRO  12  -8.551  -6.810   3.238
   64    HD2  PRO  12           1HD      PRO  12  -6.226  -6.879   1.852
   65    HD3  PRO  12           2HD      PRO  12  -7.755  -7.485   1.183
   66    H    TYR  13           H        TYR  13  -5.643  -4.026   0.901
   67    HA   TYR  13           HA       TYR  13  -5.875  -1.225   1.773
   68    HB2  TYR  13           1HB      TYR  13  -4.067  -3.381   2.827
   69    HB3  TYR  13           2HB      TYR  13  -3.594  -1.688   2.924
   70    HD1  TYR  13           HD2      TYR  13  -4.857  -0.124   4.336
   71    HD2  TYR  13           HD1      TYR  13  -5.815  -4.268   4.223
   72    HE1  TYR  13           HE2      TYR  13  -6.172   0.129   6.399
   73    HE2  TYR  13           HE1      TYR  13  -7.133  -4.026   6.285
   74    HH   TYR  13           HH       TYR  13  -7.364  -2.579   8.164
   75    H    ASN  14           H        ASN  14  -4.070   0.138   1.150
   76    HA   ASN  14           HA       ASN  14  -2.157  -0.813  -0.765
   77    HB2  ASN  14           1HB      ASN  14  -4.512   0.842  -1.665
   78    HB3  ASN  14           2HB      ASN  14  -2.994   0.810  -2.558
   79   HD21  ASN  14          1HD2      ASN  14  -5.797  -0.995  -1.597
   80   HD22  ASN  14          2HD2      ASN  14  -5.580  -2.308  -2.698
   81    H    CYS  15           H        CYS  15  -0.793   0.995  -1.606
   82    HA   CYS  15           HA       CYS  15  -0.608   3.121   0.422
   83    HB2  CYS  15           1HB      CYS  15   1.289   1.381   0.089
   84    HB3  CYS  15           2HB      CYS  15   1.660   2.296  -1.369
   85    H    GLU  16           H        GLU  16  -1.880   4.678  -0.534
   86    HA   GLU  16           HA       GLU  16  -1.924   5.376  -3.231
   87    HB2  GLU  16           1HB      GLU  16  -3.633   6.168  -1.726
   88    HB3  GLU  16           2HB      GLU  16  -2.449   7.054  -0.776
   89    HG2  GLU  16           1HG      GLU  16  -2.036   8.546  -2.652
   90    HG3  GLU  16           2HG      GLU  16  -3.189   7.644  -3.633
   91    H    GLU  17           H        GLU  17   0.552   5.779  -0.968
   92    HA   GLU  17           HA       GLU  17   1.709   8.177  -2.006
   93    HB2  GLU  17           1HB      GLU  17   2.603   6.030  -0.123
   94    HB3  GLU  17           2HB      GLU  17   3.788   7.161  -0.763
   95    HG2  GLU  17           1HG      GLU  17   2.714   7.697   1.485
   96    HG3  GLU  17           2HG      GLU  17   2.798   8.985   0.284
   97    H    CYS  18           H        CYS  18   2.510   4.725  -2.337
   98    HA   CYS  18           HA       CYS  18   4.142   5.410  -4.690
   99    HB2  CYS  18           1HB      CYS  18   5.279   3.245  -4.326
  100    HB3  CYS  18           2HB      CYS  18   5.429   4.316  -2.936
  101    H    GLY  19           H        GLY  19   1.868   2.976  -3.436
  102    HA2  GLY  19           1HA      GLY  19  -0.055   2.513  -4.951
  103    HA3  GLY  19           2HA      GLY  19   1.134   2.386  -6.239
  104    H    LYS  20           H        LYS  20   1.548   1.107  -2.991
  105    HA   LYS  20           HA       LYS  20   1.702  -1.585  -4.155
  106    HB2  LYS  20           1HB      LYS  20   3.641  -0.513  -2.828
  107    HB3  LYS  20           2HB      LYS  20   2.656  -0.827  -1.405
  108    HG2  LYS  20           1HG      LYS  20   2.571  -3.244  -2.195
  109    HG3  LYS  20           2HG      LYS  20   3.868  -2.804  -3.308
  110    HD2  LYS  20           1HD      LYS  20   5.067  -1.890  -1.227
  111    HD3  LYS  20           2HD      LYS  20   3.888  -2.826  -0.305
  112    HE2  LYS  20           1HE      LYS  20   5.602  -4.344  -0.490
  113    HE3  LYS  20           2HE      LYS  20   4.631  -4.763  -1.901
  114    HZ1  LYS  20           3HZ      LYS  20   6.112  -3.650  -3.322
  115    HZ2  LYS  20           1HZ      LYS  20   7.097  -4.535  -2.268
  116    HZ3  LYS  20           2HZ      LYS  20   6.903  -2.870  -2.046
  117    H    ALA  21           H        ALA  21   0.324  -3.157  -3.572
  118    HA   ALA  21           HA       ALA  21  -1.917  -2.455  -1.880
  119    HB1  ALA  21           3HB      ALA  21  -2.972  -3.769  -3.322
  120    HB2  ALA  21           1HB      ALA  21  -1.441  -4.285  -4.028
  121    HB3  ALA  21           2HB      ALA  21  -2.113  -5.153  -2.647
  122    H    PHE  22           H        PHE  22  -2.621  -3.708  -0.081
  123    HA   PHE  22           HA       PHE  22  -0.639  -5.487   1.130
  124    HB2  PHE  22           1HB      PHE  22  -1.812  -3.046   2.472
  125    HB3  PHE  22           2HB      PHE  22  -0.959  -4.324   3.331
  126    HD1  PHE  22           HD2      PHE  22  -0.577  -1.737   0.712
  127    HD2  PHE  22           HD1      PHE  22   1.379  -4.349   3.446
  128    HE1  PHE  22           HE2      PHE  22   1.561  -0.611   0.252
  129    HE2  PHE  22           HE1      PHE  22   3.521  -3.226   2.991
  130    HZ   PHE  22           HZ       PHE  22   3.614  -1.355   1.392
  131    H    ILE  23           H        ILE  23  -1.485  -7.030   2.517
  132    HA   ILE  23           HA       ILE  23  -4.297  -7.575   2.163
  133    HB   ILE  23           HB       ILE  23  -2.316  -9.133   3.823
  134   HG12  ILE  23          1HG1      ILE  23  -3.085  -9.887   1.028
  135   HG13  ILE  23          2HG1      ILE  23  -1.816  -8.693   1.280
  136   HG21  ILE  23          1HG2      ILE  23  -3.927 -10.650   4.137
  137   HG22  ILE  23          2HG2      ILE  23  -5.040  -9.374   3.649
  138   HG23  ILE  23          3HG2      ILE  23  -4.472 -10.550   2.463
  139   HD11  ILE  23          3HD1      ILE  23  -1.858 -11.570   2.121
  140   HD12  ILE  23          1HD1      ILE  23  -0.725 -10.754   1.044
  141   HD13  ILE  23          2HD1      ILE  23  -0.704 -10.407   2.773
  142    H    HIS  24           H        HIS  24  -2.130  -6.806   4.858
  143    HA   HIS  24           HA       HIS  24  -4.511  -6.296   6.519
  144    HB2  HIS  24           1HB      HIS  24  -1.789  -7.339   7.300
  145    HB3  HIS  24           2HB      HIS  24  -2.936  -6.703   8.476
  146    HD2  HIS  24           HD2      HIS  24  -2.519  -9.814   6.136
  147    HE1  HIS  24           HE1      HIS  24  -5.683 -10.563   8.861
  148    HE2  HIS  24           HE2      HIS  24  -4.158 -11.556   7.120
  149    H    ASP  25           H        ASP  25  -4.371  -4.532   8.021
  150    HA   ASP  25           HA       ASP  25  -3.289  -2.188   6.902
  151    HB2  ASP  25           1HB      ASP  25  -3.808  -1.288   9.311
  152    HB3  ASP  25           2HB      ASP  25  -5.127  -1.767   8.246
  153    H    SER  26           H        SER  26  -2.230  -4.202   9.621
  154    HA   SER  26           HA       SER  26  -0.147  -2.662  10.577
  155    HB2  SER  26           1HB      SER  26  -0.072  -5.675  10.335
  156    HB3  SER  26           2HB      SER  26   0.763  -4.677  11.526
  157    HG   SER  26           HG       SER  26  -1.955  -5.349  11.347
  158    H    GLN  27           H        GLN  27  -0.209  -4.831   7.801
  159    HA   GLN  27           HA       GLN  27   2.558  -4.785   7.252
  160    HB2  GLN  27           1HB      GLN  27   0.205  -5.253   5.416
  161    HB3  GLN  27           2HB      GLN  27   1.883  -5.538   4.974
  162    HG2  GLN  27           1HG      GLN  27   1.938  -7.087   7.024
  163    HG3  GLN  27           2HG      GLN  27   0.179  -7.016   6.936
  164   HE21  GLN  27          1HE2      GLN  27  -0.809  -8.406   5.649
  165   HE22  GLN  27          2HE2      GLN  27  -0.056  -9.350   4.413
  166    H    LEU  28           H        LEU  28  -0.110  -3.007   5.687
  167    HA   LEU  28           HA       LEU  28   1.463  -1.401   4.042
  168    HB2  LEU  28           1HB      LEU  28  -0.847  -1.485   3.610
  169    HB3  LEU  28           2HB      LEU  28  -1.254  -1.013   5.258
  170    HG   LEU  28           HG       LEU  28  -0.296   1.250   4.746
  171   HD11  LEU  28          1HD1      LEU  28  -0.155   1.825   2.322
  172   HD12  LEU  28          2HD1      LEU  28  -0.229   0.101   1.963
  173   HD13  LEU  28          3HD1      LEU  28   1.122   0.750   2.892
  174   HD21  LEU  28          3HD2      LEU  28  -2.253   1.918   3.307
  175   HD22  LEU  28          1HD2      LEU  28  -2.656   1.020   4.770
  176   HD23  LEU  28          2HD2      LEU  28  -2.662   0.205   3.205
  177    H    GLN  29           H        GLN  29   0.261  -0.787   7.325
  178    HA   GLN  29           HA       GLN  29   1.247   1.813   7.609
  179    HB2  GLN  29           1HB      GLN  29   0.747  -0.351   9.651
  180    HB3  GLN  29           2HB      GLN  29   1.199   1.292  10.084
  181    HG2  GLN  29           1HG      GLN  29  -1.295   0.390   8.670
  182    HG3  GLN  29           2HG      GLN  29  -1.162   1.096  10.279
  183   HE21  GLN  29          1HE2      GLN  29  -2.415   1.818   7.530
  184   HE22  GLN  29          2HE2      GLN  29  -2.034   3.495   7.370
  185    H    GLU  30           H        GLU  30   2.778  -1.315   8.187
  186    HA   GLU  30           HA       GLU  30   5.154  -0.272   9.339
  187    HB2  GLU  30           1HB      GLU  30   4.302  -2.651   9.518
  188    HB3  GLU  30           2HB      GLU  30   4.879  -2.896   7.875
  189    HG2  GLU  30           1HG      GLU  30   6.588  -3.721   9.217
  190    HG3  GLU  30           2HG      GLU  30   7.148  -2.120   8.736
  191    H    HIS  31           H        HIS  31   3.967  -0.060   6.240
  192    HA   HIS  31           HA       HIS  31   6.644   0.060   5.032
  193    HB2  HIS  31           1HB      HIS  31   5.379  -1.343   3.675
  194    HB3  HIS  31           2HB      HIS  31   3.903  -0.412   3.915
  195    HD1  HIS  31           HD1      HIS  31   7.242  -0.083   2.135
  196    HD2  HIS  31           HD2      HIS  31   3.334   1.303   1.887
  197    HE1  HIS  31           HE1      HIS  31   7.133   1.240  -0.000
  198    H    GLN  32           H        GLN  32   3.636   1.875   5.423
  199    HA   GLN  32           HA       GLN  32   4.285   4.134   3.935
  200    HB2  GLN  32           1HB      GLN  32   2.588   3.836   6.413
  201    HB3  GLN  32           2HB      GLN  32   2.694   5.330   5.492
  202    HG2  GLN  32           1HG      GLN  32   1.983   2.828   4.057
  203    HG3  GLN  32           2HG      GLN  32   0.769   3.594   5.080
  204   HE21  GLN  32          1HE2      GLN  32  -0.466   3.970   3.185
  205   HE22  GLN  32          2HE2      GLN  32  -0.081   5.281   2.126
  206    H    ARG  33           H        ARG  33   5.675   2.987   6.811
  207    HA   ARG  33           HA       ARG  33   6.450   5.428   8.012
  208    HB2  ARG  33           1HB      ARG  33   8.261   3.936   9.066
  209    HB3  ARG  33           2HB      ARG  33   6.579   3.557   9.412
  210    HG2  ARG  33           1HG      ARG  33   6.594   1.730   7.889
  211    HG3  ARG  33           2HG      ARG  33   8.176   2.195   7.260
  212    HD2  ARG  33           1HD      ARG  33   8.600   0.405   8.719
  213    HD3  ARG  33           2HD      ARG  33   9.041   1.851   9.627
  214    HE   ARG  33           HE       ARG  33   6.831   0.055  10.165
  215   HH11  ARG  33          1HH1      ARG  33   8.312   3.144  10.783
  216   HH12  ARG  33          2HH1      ARG  33   7.483   3.387  12.285
  217   HH21  ARG  33          1HH2      ARG  33   5.734   0.363  12.140
  218   HH22  ARG  33          2HH2      ARG  33   6.018   1.804  13.057
  219    H    ILE  34           H        ILE  34   7.703   3.586   5.355
  220    HA   ILE  34           HA       ILE  34  10.304   4.777   5.330
  221    HB   ILE  34           HB       ILE  34  10.722   3.589   3.374
  222   HG12  ILE  34          1HG1      ILE  34   7.736   3.554   2.887
  223   HG13  ILE  34          2HG1      ILE  34   8.926   4.507   2.009
  224   HG21  ILE  34          1HG2      ILE  34   8.824   1.551   3.915
  225   HG22  ILE  34          2HG2      ILE  34  10.520   1.628   4.388
  226   HG23  ILE  34          3HG2      ILE  34   9.279   2.296   5.447
  227   HD11  ILE  34          3HD1      ILE  34   9.974   2.213   1.438
  228   HD12  ILE  34          1HD1      ILE  34   8.394   1.575   1.892
  229   HD13  ILE  34          2HD1      ILE  34   8.529   2.747   0.580
  230    H    HIS  35           H        HIS  35   7.190   5.700   4.189
  231    HA   HIS  35           HA       HIS  35   8.148   7.568   2.215
  232    HB2  HIS  35           1HB      HIS  35   5.452   6.911   3.366
  233    HB3  HIS  35           2HB      HIS  35   5.672   8.345   2.368
  234    HD1  HIS  35           HD1      HIS  35   6.898   7.715  -0.065
  235    HD2  HIS  35           HD2      HIS  35   4.785   4.737   1.916
  236    HE1  HIS  35           HE1      HIS  35   6.381   5.982  -1.813
  237    H    THR  36           H        THR  36   6.983   7.700   5.540
  238    HA   THR  36           HA       THR  36   6.834  10.499   5.783
  239    HB   THR  36           HB       THR  36   6.782  10.181   8.157
  240    HG1  THR  36           HG1      THR  36   7.446   7.455   7.952
  241   HG21  THR  36          3HG2      THR  36   4.977   8.663   8.383
  242   HG22  THR  36          1HG2      THR  36   5.524   7.694   7.015
  243   HG23  THR  36          2HG2      THR  36   4.863   9.307   6.745
  244    H    GLY  37           H        GLY  37   8.621  11.537   4.942
  245    HA2  GLY  37           1HA      GLY  37  10.962  11.547   6.666
  246    HA3  GLY  37           2HA      GLY  37  11.246  11.042   5.007
  247    H    GLU  38           H        GLU  38  11.405  12.552   3.424
  248    HA   GLU  38           HA       GLU  38  11.537  15.321   4.297
  249    HB2  GLU  38           1HB      GLU  38  13.308  14.184   2.866
  250    HB3  GLU  38           2HB      GLU  38  12.150  14.251   1.545
  251    HG2  GLU  38           1HG      GLU  38  13.351  16.146   1.149
  252    HG3  GLU  38           2HG      GLU  38  12.057  16.792   2.156
  253    H    LYS  39           H        LYS  39   8.960  14.548   4.394
  254    HA   LYS  39           HA       LYS  39   7.667  16.408   2.716
  255    HB2  LYS  39           1HB      LYS  39   7.936  14.797   0.955
  256    HB3  LYS  39           2HB      LYS  39   7.351  13.496   1.983
  257    HG2  LYS  39           1HG      LYS  39   5.197  15.010   2.088
  258    HG3  LYS  39           2HG      LYS  39   5.841  15.621   0.563
  259    HD2  LYS  39           1HD      LYS  39   5.570  12.676   1.072
  260    HD3  LYS  39           2HD      LYS  39   4.206  13.634   0.491
  261    HE2  LYS  39           1HE      LYS  39   6.898  13.540  -0.861
  262    HE3  LYS  39           2HE      LYS  39   5.540  12.506  -1.303
  263    HZ1  LYS  39           3HZ      LYS  39   4.250  14.594  -1.676
  264    HZ2  LYS  39           1HZ      LYS  39   5.527  14.353  -2.759
  265    HZ3  LYS  39           2HZ      LYS  39   5.691  15.461  -1.492
  266    HA   PRO  40           HA       PRO  40   4.816  16.042   6.052
  267    HB2  PRO  40           1HB      PRO  40   2.719  17.380   4.965
  268    HB3  PRO  40           2HB      PRO  40   4.179  18.190   5.544
  269    HG2  PRO  40           1HG      PRO  40   3.410  17.441   2.749
  270    HG3  PRO  40           2HG      PRO  40   4.144  18.942   3.344
  271    HD2  PRO  40           1HD      PRO  40   5.587  16.992   2.141
  272    HD3  PRO  40           2HD      PRO  40   6.258  18.028   3.417
  273    H    SER  41           H        SER  41   2.883  14.992   6.666
  274    HA   SER  41           HA       SER  41   2.255  12.677   5.139
  275    HB2  SER  41           1HB      SER  41   0.889  13.839   7.578
  276    HB3  SER  41           2HB      SER  41   0.589  12.232   6.919
  277    HG   SER  41           HG       SER  41   3.180  13.074   7.663
  278    H    GLY  42           H        GLY  42   1.585  13.706   3.137
  279    HA2  GLY  42           1HA      GLY  42  -0.084  14.191   1.632
  280    HA3  GLY  42           2HA      GLY  42  -1.242  13.831   2.904
  281    HA   PRO  43           HA       PRO  43  -0.090  18.529   3.290
  282    HB2  PRO  43           1HB      PRO  43   1.183  19.606   1.148
  283    HB3  PRO  43           2HB      PRO  43   2.043  18.915   2.529
  284    HG2  PRO  43           1HG      PRO  43   1.452  17.693  -0.139
  285    HG3  PRO  43           2HG      PRO  43   2.951  17.641   0.808
  286    HD2  PRO  43           1HD      PRO  43   1.194  15.582   0.748
  287    HD3  PRO  43           2HD      PRO  43   2.175  15.959   2.179
  288    H    SER  44           H        SER  44  -1.065  16.979   0.339
  289    HA   SER  44           HA       SER  44  -2.826  19.234  -0.326
  290    HB2  SER  44           1HB      SER  44  -3.120  18.016  -2.514
  291    HB3  SER  44           2HB      SER  44  -1.475  18.568  -2.197
  292    HG   SER  44           HG       SER  44  -2.474  16.009  -2.405
  293    H    SER  45           H        SER  45  -4.257  18.674   1.443
  294    HA   SER  45           HA       SER  45  -5.697  16.163   1.272
  295    HB2  SER  45           1HB      SER  45  -5.151  17.080   3.481
  296    HB3  SER  45           2HB      SER  45  -6.080  18.535   3.118
  297    HG   SER  45           HG       SER  45  -7.806  16.760   2.691
  298    H    GLY  46           H        GLY  46  -7.596  15.852   0.292
  299    HA2  GLY  46           1HA      GLY  46  -9.862  17.051   0.030
  300    HA3  GLY  46           2HA      GLY  46  -8.911  18.206  -0.892
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1 -19.590  -4.468 -23.662
    2    HA2  GLY   1           1HA      GLY   1 -21.829  -5.046 -21.887
    3    HA3  GLY   1           2HA      GLY   1 -21.184  -6.408 -22.790
    4    H    SER   2           H        SER   2 -21.238  -6.068 -19.927
    5    HA   SER   2           HA       SER   2 -18.343  -5.977 -19.377
    6    HB2  SER   2           1HB      SER   2 -20.694  -5.088 -17.730
    7    HB3  SER   2           2HB      SER   2 -19.180  -5.543 -16.950
    8    HG   SER   2           HG       SER   2 -18.247  -3.795 -17.710
    9    H    SER   3           H        SER   3 -17.418  -7.756 -18.573
   10    HA   SER   3           HA       SER   3 -19.185  -9.935 -17.667
   11    HB2  SER   3           1HB      SER   3 -16.601 -10.068 -19.230
   12    HB3  SER   3           2HB      SER   3 -17.352 -11.476 -18.480
   13    HG   SER   3           HG       SER   3 -17.986 -10.214 -20.793
   14    H    GLY   4           H        GLY   4 -19.058 -10.037 -15.517
   15    HA2  GLY   4           1HA      GLY   4 -17.209  -9.015 -13.809
   16    HA3  GLY   4           2HA      GLY   4 -18.108 -10.484 -13.460
   17    H    SER   5           H        SER   5 -15.529 -10.011 -12.492
   18    HA   SER   5           HA       SER   5 -14.056 -12.143 -13.878
   19    HB2  SER   5           1HB      SER   5 -12.969 -10.083 -14.529
   20    HB3  SER   5           2HB      SER   5 -12.911  -9.536 -12.854
   21    HG   SER   5           HG       SER   5 -11.223 -10.759 -12.509
   22    H    SER   6           H        SER   6 -13.492 -13.751 -12.573
   23    HA   SER   6           HA       SER   6 -14.206 -13.878  -9.886
   24    HB2  SER   6           1HB      SER   6 -12.435 -15.511 -11.656
   25    HB3  SER   6           2HB      SER   6 -12.393 -15.809  -9.919
   26    HG   SER   6           HG       SER   6 -14.285 -16.716 -10.044
   27    H    GLY   7           H        GLY   7 -13.407 -12.815  -8.206
   28    HA2  GLY   7           1HA      GLY   7 -11.000 -12.880  -7.073
   29    HA3  GLY   7           2HA      GLY   7 -10.721 -11.692  -8.338
   30    H    THR   8           H        THR   8 -13.425 -12.311  -6.100
   31    HA   THR   8           HA       THR   8 -13.610  -9.453  -5.579
   32    HB   THR   8           HB       THR   8 -15.636 -10.133  -4.218
   33    HG1  THR   8           HG1      THR   8 -15.653 -12.218  -3.806
   34   HG21  THR   8          3HG2      THR   8 -15.308 -10.461  -7.150
   35   HG22  THR   8          1HG2      THR   8 -16.310  -9.328  -6.244
   36   HG23  THR   8          2HG2      THR   8 -16.827 -11.003  -6.437
   37    H    GLY   9           H        GLY   9 -11.279 -10.701  -4.571
   38    HA2  GLY   9           1HA      GLY   9 -11.418  -9.842  -1.848
   39    HA3  GLY   9           2HA      GLY   9 -11.305 -11.592  -1.968
   40    H    GLU  10           H        GLU  10  -9.679  -8.557  -2.648
   41    HA   GLU  10           HA       GLU  10  -7.131 -10.023  -2.684
   42    HB2  GLU  10           1HB      GLU  10  -6.270  -8.655  -4.449
   43    HB3  GLU  10           2HB      GLU  10  -7.809  -9.311  -4.988
   44    HG2  GLU  10           1HG      GLU  10  -7.279  -6.523  -3.992
   45    HG3  GLU  10           2HG      GLU  10  -7.655  -7.013  -5.644
   46    H    LYS  11           H        LYS  11  -5.257  -8.349  -2.458
   47    HA   LYS  11           HA       LYS  11  -5.040  -7.371  -0.001
   48    HB2  LYS  11           1HB      LYS  11  -3.971  -6.333  -2.586
   49    HB3  LYS  11           2HB      LYS  11  -3.708  -5.378  -1.133
   50    HG2  LYS  11           1HG      LYS  11  -1.798  -6.702  -1.330
   51    HG3  LYS  11           2HG      LYS  11  -2.773  -7.510  -0.100
   52    HD2  LYS  11           1HD      LYS  11  -3.310  -9.267  -1.490
   53    HD3  LYS  11           2HD      LYS  11  -3.077  -8.315  -2.958
   54    HE2  LYS  11           1HE      LYS  11  -0.589  -8.257  -2.202
   55    HE3  LYS  11           2HE      LYS  11  -1.042  -9.644  -1.213
   56    HZ1  LYS  11           3HZ      LYS  11  -1.497 -10.923  -3.066
   57    HZ2  LYS  11           1HZ      LYS  11  -0.142 -10.044  -3.569
   58    HZ3  LYS  11           2HZ      LYS  11  -1.686  -9.589  -4.089
   59    HA   PRO  12           HA       PRO  12  -8.550  -4.481  -0.025
   60    HB2  PRO  12           1HB      PRO  12  -8.882  -4.543   2.668
   61    HB3  PRO  12           2HB      PRO  12  -9.542  -5.779   1.591
   62    HG2  PRO  12           1HG      PRO  12  -7.051  -5.846   3.251
   63    HG3  PRO  12           2HG      PRO  12  -8.268  -7.113   3.006
   64    HD2  PRO  12           1HD      PRO  12  -5.900  -7.094   1.692
   65    HD3  PRO  12           2HD      PRO  12  -7.388  -7.741   0.971
   66    H    TYR  13           H        TYR  13  -5.379  -4.225   0.814
   67    HA   TYR  13           HA       TYR  13  -5.724  -1.429   1.661
   68    HB2  TYR  13           1HB      TYR  13  -3.947  -3.539   2.845
   69    HB3  TYR  13           2HB      TYR  13  -3.495  -1.841   2.942
   70    HD1  TYR  13           HD2      TYR  13  -4.804  -0.279   4.290
   71    HD2  TYR  13           HD1      TYR  13  -5.809  -4.410   4.120
   72    HE1  TYR  13           HE2      TYR  13  -6.235  -0.007   6.272
   73    HE2  TYR  13           HE1      TYR  13  -7.244  -4.149   6.100
   74    HH   TYR  13           HH       TYR  13  -7.588  -2.709   7.947
   75    H    ASN  14           H        ASN  14  -4.211   0.041   0.881
   76    HA   ASN  14           HA       ASN  14  -2.066  -0.899  -0.836
   77    HB2  ASN  14           1HB      ASN  14  -3.955   1.102  -2.027
   78    HB3  ASN  14           2HB      ASN  14  -2.807   0.039  -2.835
   79   HD21  ASN  14          1HD2      ASN  14  -3.454  -1.924  -3.510
   80   HD22  ASN  14          2HD2      ASN  14  -5.050  -2.550  -3.299
   81    H    CYS  15           H        CYS  15  -0.567   0.780  -1.426
   82    HA   CYS  15           HA       CYS  15  -0.541   2.944   0.546
   83    HB2  CYS  15           1HB      CYS  15   1.413   1.290   0.165
   84    HB3  CYS  15           2HB      CYS  15   1.741   2.239  -1.281
   85    H    GLU  16           H        GLU  16  -1.911   4.450  -0.384
   86    HA   GLU  16           HA       GLU  16  -2.002   5.242  -3.038
   87    HB2  GLU  16           1HB      GLU  16  -3.533   5.901  -1.079
   88    HB3  GLU  16           2HB      GLU  16  -2.367   7.178  -0.763
   89    HG2  GLU  16           1HG      GLU  16  -2.706   7.921  -3.144
   90    HG3  GLU  16           2HG      GLU  16  -4.058   6.791  -3.214
   91    H    GLU  17           H        GLU  17   0.491   5.691  -0.780
   92    HA   GLU  17           HA       GLU  17   1.578   8.127  -1.772
   93    HB2  GLU  17           1HB      GLU  17   2.732   5.881  -0.126
   94    HB3  GLU  17           2HB      GLU  17   3.680   7.285  -0.594
   95    HG2  GLU  17           1HG      GLU  17   1.169   7.303   1.063
   96    HG3  GLU  17           2HG      GLU  17   2.815   7.546   1.647
   97    H    CYS  18           H        CYS  18   2.553   4.726  -2.219
   98    HA   CYS  18           HA       CYS  18   4.051   5.551  -4.613
   99    HB2  CYS  18           1HB      CYS  18   5.166   3.295  -4.360
  100    HB3  CYS  18           2HB      CYS  18   5.500   4.451  -3.074
  101    H    GLY  19           H        GLY  19   1.801   3.096  -3.388
  102    HA2  GLY  19           1HA      GLY  19  -0.118   2.626  -4.888
  103    HA3  GLY  19           2HA      GLY  19   1.054   2.539  -6.194
  104    H    LYS  20           H        LYS  20   1.490   1.191  -2.972
  105    HA   LYS  20           HA       LYS  20   1.855  -1.442  -4.178
  106    HB2  LYS  20           1HB      LYS  20   3.487  -0.350  -2.513
  107    HB3  LYS  20           2HB      LYS  20   2.296  -0.750  -1.282
  108    HG2  LYS  20           1HG      LYS  20   2.680  -2.999  -1.440
  109    HG3  LYS  20           2HG      LYS  20   3.219  -2.900  -3.118
  110    HD2  LYS  20           1HD      LYS  20   5.180  -1.499  -2.037
  111    HD3  LYS  20           2HD      LYS  20   4.731  -2.418  -0.598
  112    HE2  LYS  20           1HE      LYS  20   6.302  -3.810  -1.527
  113    HE3  LYS  20           2HE      LYS  20   4.826  -4.453  -2.245
  114    HZ1  LYS  20           3HZ      LYS  20   5.340  -2.852  -4.149
  115    HZ2  LYS  20           1HZ      LYS  20   6.282  -4.251  -4.023
  116    HZ3  LYS  20           2HZ      LYS  20   6.900  -2.767  -3.498
  117    H    ALA  21           H        ALA  21   1.138  -3.301  -2.603
  118    HA   ALA  21           HA       ALA  21  -1.572  -2.743  -1.607
  119    HB1  ALA  21           3HB      ALA  21  -0.734  -4.788  -3.614
  120    HB2  ALA  21           1HB      ALA  21  -2.088  -5.125  -2.534
  121    HB3  ALA  21           2HB      ALA  21  -2.143  -3.727  -3.610
  122    H    PHE  22           H        PHE  22  -2.277  -4.036   0.105
  123    HA   PHE  22           HA       PHE  22  -0.405  -5.992   1.202
  124    HB2  PHE  22           1HB      PHE  22  -1.418  -3.571   2.699
  125    HB3  PHE  22           2HB      PHE  22  -0.666  -4.958   3.479
  126    HD1  PHE  22           HD2      PHE  22  -0.105  -2.108   1.230
  127    HD2  PHE  22           HD1      PHE  22   1.691  -5.295   3.405
  128    HE1  PHE  22           HE2      PHE  22   2.112  -1.111   0.853
  129    HE2  PHE  22           HE1      PHE  22   3.911  -4.302   3.033
  130    HZ   PHE  22           HZ       PHE  22   4.124  -2.208   1.755
  131    H    ILE  23           H        ILE  23  -1.372  -7.251   2.995
  132    HA   ILE  23           HA       ILE  23  -4.156  -7.831   2.377
  133    HB   ILE  23           HB       ILE  23  -2.185  -9.290   4.140
  134   HG12  ILE  23          1HG1      ILE  23  -1.737  -9.321   1.675
  135   HG13  ILE  23          2HG1      ILE  23  -2.056 -10.910   2.362
  136   HG21  ILE  23          1HG2      ILE  23  -4.140 -11.084   3.609
  137   HG22  ILE  23          2HG2      ILE  23  -4.058 -10.109   5.076
  138   HG23  ILE  23          3HG2      ILE  23  -5.079  -9.596   3.733
  139   HD11  ILE  23          3HD1      ILE  23  -3.180 -10.712   0.258
  140   HD12  ILE  23          1HD1      ILE  23  -4.383 -10.742   1.547
  141   HD13  ILE  23          2HD1      ILE  23  -3.962  -9.216   0.768
  142    H    HIS  24           H        HIS  24  -2.173  -7.053   5.222
  143    HA   HIS  24           HA       HIS  24  -4.647  -6.407   6.682
  144    HB2  HIS  24           1HB      HIS  24  -1.901  -7.126   7.726
  145    HB3  HIS  24           2HB      HIS  24  -3.254  -6.633   8.739
  146    HD2  HIS  24           HD2      HIS  24  -2.145  -9.709   6.584
  147    HE1  HIS  24           HE1      HIS  24  -5.444 -10.841   8.999
  148    HE2  HIS  24           HE2      HIS  24  -3.616 -11.646   7.464
  149    H    ASP  25           H        ASP  25  -4.266  -4.649   8.398
  150    HA   ASP  25           HA       ASP  25  -3.453  -2.277   7.020
  151    HB2  ASP  25           1HB      ASP  25  -3.984  -1.208   9.294
  152    HB3  ASP  25           2HB      ASP  25  -5.308  -1.997   8.441
  153    H    SER  26           H        SER  26  -2.340  -3.803  10.048
  154    HA   SER  26           HA       SER  26  -0.247  -2.194  10.698
  155    HB2  SER  26           1HB      SER  26   0.752  -4.072  11.841
  156    HB3  SER  26           2HB      SER  26  -1.001  -4.220  11.969
  157    HG   SER  26           HG       SER  26  -0.882  -6.034  10.929
  158    H    GLN  27           H        GLN  27  -0.221  -4.794   8.295
  159    HA   GLN  27           HA       GLN  27   2.490  -4.747   7.653
  160    HB2  GLN  27           1HB      GLN  27   0.084  -5.389   5.947
  161    HB3  GLN  27           2HB      GLN  27   1.742  -5.649   5.422
  162    HG2  GLN  27           1HG      GLN  27   1.862  -6.976   7.710
  163    HG3  GLN  27           2HG      GLN  27   0.129  -7.118   7.425
  164   HE21  GLN  27          1HE2      GLN  27  -0.593  -8.547   5.964
  165   HE22  GLN  27          2HE2      GLN  27   0.418  -9.537   4.973
  166    H    LEU  28           H        LEU  28  -0.194  -3.013   6.076
  167    HA   LEU  28           HA       LEU  28   1.365  -1.605   4.226
  168    HB2  LEU  28           1HB      LEU  28  -0.942  -1.658   3.837
  169    HB3  LEU  28           2HB      LEU  28  -1.318  -1.098   5.465
  170    HG   LEU  28           HG       LEU  28  -0.380   1.130   4.833
  171   HD11  LEU  28          1HD1      LEU  28  -0.433   1.415   2.229
  172   HD12  LEU  28          2HD1      LEU  28  -0.030  -0.301   2.244
  173   HD13  LEU  28          3HD1      LEU  28   1.029   0.859   3.046
  174   HD21  LEU  28          3HD2      LEU  28  -2.589   1.433   4.686
  175   HD22  LEU  28          1HD2      LEU  28  -2.837  -0.114   3.876
  176   HD23  LEU  28          2HD2      LEU  28  -2.362   1.304   2.941
  177    H    GLN  29           H        GLN  29   0.110  -0.551   7.390
  178    HA   GLN  29           HA       GLN  29   1.188   1.991   7.455
  179    HB2  GLN  29           1HB      GLN  29   0.733   0.021   9.695
  180    HB3  GLN  29           2HB      GLN  29   1.199   1.696   9.965
  181    HG2  GLN  29           1HG      GLN  29  -1.332   0.682   8.700
  182    HG3  GLN  29           2HG      GLN  29  -1.157   1.525  10.238
  183   HE21  GLN  29          1HE2      GLN  29  -1.998   1.870   7.075
  184   HE22  GLN  29          2HE2      GLN  29  -1.804   3.579   6.911
  185    H    GLU  30           H        GLU  30   2.681  -1.041   8.559
  186    HA   GLU  30           HA       GLU  30   5.082   0.036   9.486
  187    HB2  GLU  30           1HB      GLU  30   4.174  -2.357   9.717
  188    HB3  GLU  30           2HB      GLU  30   4.893  -2.649   8.140
  189    HG2  GLU  30           1HG      GLU  30   6.453  -1.602  10.482
  190    HG3  GLU  30           2HG      GLU  30   6.276  -3.319  10.127
  191    H    HIS  31           H        HIS  31   3.895  -0.208   6.313
  192    HA   HIS  31           HA       HIS  31   6.557  -0.068   5.111
  193    HB2  HIS  31           1HB      HIS  31   5.304  -1.499   3.803
  194    HB3  HIS  31           2HB      HIS  31   3.807  -0.613   4.080
  195    HD1  HIS  31           HD1      HIS  31   6.872  -0.623   1.922
  196    HD2  HIS  31           HD2      HIS  31   3.276   1.430   2.264
  197    HE1  HIS  31           HE1      HIS  31   6.672   0.738  -0.183
  198    H    GLN  32           H        GLN  32   3.510   1.771   5.143
  199    HA   GLN  32           HA       GLN  32   4.136   3.922   3.607
  200    HB2  GLN  32           1HB      GLN  32   2.680   3.949   6.256
  201    HB3  GLN  32           2HB      GLN  32   2.666   5.272   5.097
  202    HG2  GLN  32           1HG      GLN  32   1.787   3.504   3.437
  203    HG3  GLN  32           2HG      GLN  32   1.418   2.566   4.883
  204   HE21  GLN  32          1HE2      GLN  32  -0.420   3.641   2.948
  205   HE22  GLN  32          2HE2      GLN  32  -1.469   4.719   3.800
  206    H    ARG  33           H        ARG  33   5.515   3.088   6.669
  207    HA   ARG  33           HA       ARG  33   6.471   5.498   7.606
  208    HB2  ARG  33           1HB      ARG  33   8.133   2.987   7.645
  209    HB3  ARG  33           2HB      ARG  33   8.073   4.272   8.844
  210    HG2  ARG  33           1HG      ARG  33   5.545   3.504   9.002
  211    HG3  ARG  33           2HG      ARG  33   6.232   1.991   8.408
  212    HD2  ARG  33           1HD      ARG  33   6.311   1.804  10.742
  213    HD3  ARG  33           2HD      ARG  33   7.954   2.239  10.272
  214    HE   ARG  33           HE       ARG  33   6.248   4.463  10.985
  215   HH11  ARG  33          1HH1      ARG  33   8.573   2.111  12.072
  216   HH12  ARG  33          2HH1      ARG  33   9.055   3.034  13.457
  217   HH21  ARG  33          1HH2      ARG  33   6.873   5.688  12.805
  218   HH22  ARG  33          2HH2      ARG  33   8.086   5.068  13.874
  219    H    ILE  34           H        ILE  34   8.024   3.316   5.266
  220    HA   ILE  34           HA       ILE  34  10.399   4.528   4.803
  221    HB   ILE  34           HB       ILE  34  10.409   3.658   2.596
  222   HG12  ILE  34          1HG1      ILE  34   7.399   3.411   2.728
  223   HG13  ILE  34          2HG1      ILE  34   8.239   4.735   1.927
  224   HG21  ILE  34          1HG2      ILE  34   8.573   1.610   3.506
  225   HG22  ILE  34          2HG2      ILE  34  10.317   1.535   3.262
  226   HG23  ILE  34          3HG2      ILE  34   9.665   2.137   4.786
  227   HD11  ILE  34          3HD1      ILE  34   7.945   1.901   1.116
  228   HD12  ILE  34          1HD1      ILE  34   7.869   3.374   0.150
  229   HD13  ILE  34          2HD1      ILE  34   9.430   2.742   0.674
  230    H    HIS  35           H        HIS  35   7.251   5.751   3.941
  231    HA   HIS  35           HA       HIS  35   8.274   7.840   2.237
  232    HB2  HIS  35           1HB      HIS  35   5.517   7.428   3.413
  233    HB3  HIS  35           2HB      HIS  35   5.932   8.630   2.195
  234    HD1  HIS  35           HD1      HIS  35   6.042   7.864  -0.212
  235    HD2  HIS  35           HD2      HIS  35   5.574   4.726   2.471
  236    HE1  HIS  35           HE1      HIS  35   5.546   5.841  -1.622
  237    H    THR  36           H        THR  36   6.664   7.757   5.416
  238    HA   THR  36           HA       THR  36   6.610  10.334   6.162
  239    HB   THR  36           HB       THR  36   6.886   9.697   8.457
  240    HG1  THR  36           HG1      THR  36   8.433   7.656   7.339
  241   HG21  THR  36          3HG2      THR  36   5.731   7.282   7.070
  242   HG22  THR  36          1HG2      THR  36   4.888   8.826   7.187
  243   HG23  THR  36          2HG2      THR  36   5.297   7.932   8.651
  244    H    GLY  37           H        GLY  37   8.128  11.751   5.429
  245    HA2  GLY  37           1HA      GLY  37  10.956  11.201   5.910
  246    HA3  GLY  37           2HA      GLY  37  10.300  12.531   4.966
  247    H    GLU  38           H        GLU  38  11.031  14.346   5.868
  248    HA   GLU  38           HA       GLU  38  11.478  14.580   8.694
  249    HB2  GLU  38           1HB      GLU  38  12.683  15.755   6.659
  250    HB3  GLU  38           2HB      GLU  38  11.422  16.958   6.887
  251    HG2  GLU  38           1HG      GLU  38  13.306  17.689   8.108
  252    HG3  GLU  38           2HG      GLU  38  12.126  17.112   9.284
  253    H    LYS  39           H        LYS  39   9.043  13.927   8.892
  254    HA   LYS  39           HA       LYS  39   7.671  16.239   9.853
  255    HB2  LYS  39           1HB      LYS  39   5.751  16.210   8.428
  256    HB3  LYS  39           2HB      LYS  39   7.171  16.316   7.395
  257    HG2  LYS  39           1HG      LYS  39   7.009  13.840   7.069
  258    HG3  LYS  39           2HG      LYS  39   5.464  13.896   7.919
  259    HD2  LYS  39           1HD      LYS  39   4.833  15.705   6.192
  260    HD3  LYS  39           2HD      LYS  39   6.205  15.089   5.268
  261    HE2  LYS  39           1HE      LYS  39   3.915  13.399   6.263
  262    HE3  LYS  39           2HE      LYS  39   4.023  14.074   4.638
  263    HZ1  LYS  39           3HZ      LYS  39   5.945  12.165   5.857
  264    HZ2  LYS  39           1HZ      LYS  39   6.073  12.828   4.305
  265    HZ3  LYS  39           2HZ      LYS  39   4.789  11.793   4.679
  266    HA   PRO  40           HA       PRO  40   5.941  13.205  12.518
  267    HB2  PRO  40           1HB      PRO  40   3.670  14.469  13.302
  268    HB3  PRO  40           2HB      PRO  40   5.278  14.949  13.859
  269    HG2  PRO  40           1HG      PRO  40   3.588  16.143  11.695
  270    HG3  PRO  40           2HG      PRO  40   4.551  16.958  12.942
  271    HD2  PRO  40           1HD      PRO  40   5.414  16.669  10.392
  272    HD3  PRO  40           2HD      PRO  40   6.522  16.682  11.779
  273    H    SER  41           H        SER  41   3.685  12.176  13.007
  274    HA   SER  41           HA       SER  41   2.728  11.106  10.493
  275    HB2  SER  41           1HB      SER  41   2.287  10.398  13.384
  276    HB3  SER  41           2HB      SER  41   1.289   9.689  12.115
  277    HG   SER  41           HG       SER  41   4.047   9.397  12.585
  278    H    GLY  42           H        GLY  42   1.455  12.603   9.487
  279    HA2  GLY  42           1HA      GLY  42  -0.334  14.007   9.114
  280    HA3  GLY  42           2HA      GLY  42  -1.226  12.774   9.995
  281    HA   PRO  43           HA       PRO  43   0.060  16.158  13.221
  282    HB2  PRO  43           1HB      PRO  43   0.987  18.491  12.188
  283    HB3  PRO  43           2HB      PRO  43   2.047  17.146  12.625
  284    HG2  PRO  43           1HG      PRO  43   1.000  17.935   9.934
  285    HG3  PRO  43           2HG      PRO  43   2.632  17.413  10.391
  286    HD2  PRO  43           1HD      PRO  43   0.845  15.750   9.219
  287    HD3  PRO  43           2HD      PRO  43   2.056  15.181  10.386
  288    H    SER  44           H        SER  44  -2.274  16.062  13.184
  289    HA   SER  44           HA       SER  44  -3.968  17.555  11.586
  290    HB2  SER  44           1HB      SER  44  -4.445  15.802  13.498
  291    HB3  SER  44           2HB      SER  44  -4.609  17.247  14.495
  292    HG   SER  44           HG       SER  44  -6.014  17.868  12.492
  293    H    SER  45           H        SER  45  -4.550  19.639  11.459
  294    HA   SER  45           HA       SER  45  -3.041  21.583  12.953
  295    HB2  SER  45           1HB      SER  45  -5.233  21.934  10.893
  296    HB3  SER  45           2HB      SER  45  -4.247  23.238  11.554
  297    HG   SER  45           HG       SER  45  -3.443  21.079   9.916
  298    H    GLY  46           H        GLY  46  -6.527  20.939  12.526
  299    HA2  GLY  46           1HA      GLY  46  -7.320  21.005  15.138
  300    HA3  GLY  46           2HA      GLY  46  -7.241  22.700  14.683
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1   2.536 -16.799 -27.717
    2    HA2  GLY   1           1HA      GLY   1   1.173 -18.062 -25.953
    3    HA3  GLY   1           2HA      GLY   1   2.602 -17.833 -24.957
    4    H    SER   2           H        SER   2   0.047 -16.914 -24.246
    5    HA   SER   2           HA       SER   2   0.445 -13.998 -24.397
    6    HB2  SER   2           1HB      SER   2  -2.022 -13.765 -24.178
    7    HB3  SER   2           2HB      SER   2  -1.547 -14.601 -25.656
    8    HG   SER   2           HG       SER   2  -2.034 -16.176 -23.416
    9    H    SER   3           H        SER   3  -0.968 -12.946 -22.536
   10    HA   SER   3           HA       SER   3   0.242 -13.760 -20.102
   11    HB2  SER   3           1HB      SER   3  -0.233 -11.422 -20.450
   12    HB3  SER   3           2HB      SER   3  -1.949 -11.755 -20.679
   13    HG   SER   3           HG       SER   3  -1.490 -10.996 -18.567
   14    H    GLY   4           H        GLY   4  -3.070 -13.973 -21.357
   15    HA2  GLY   4           1HA      GLY   4  -4.755 -15.453 -20.828
   16    HA3  GLY   4           2HA      GLY   4  -3.594 -16.344 -19.854
   17    H    SER   5           H        SER   5  -6.454 -14.908 -19.646
   18    HA   SER   5           HA       SER   5  -6.158 -13.311 -17.291
   19    HB2  SER   5           1HB      SER   5  -8.021 -12.770 -18.647
   20    HB3  SER   5           2HB      SER   5  -8.540 -14.453 -18.746
   21    HG   SER   5           HG       SER   5  -9.171 -12.580 -16.912
   22    H    SER   6           H        SER   6  -4.973 -14.778 -15.939
   23    HA   SER   6           HA       SER   6  -6.751 -16.526 -14.420
   24    HB2  SER   6           1HB      SER   6  -5.598 -17.979 -16.074
   25    HB3  SER   6           2HB      SER   6  -4.047 -17.452 -15.420
   26    HG   SER   6           HG       SER   6  -5.229 -18.223 -13.327
   27    H    GLY   7           H        GLY   7  -6.680 -15.578 -12.483
   28    HA2  GLY   7           1HA      GLY   7  -5.097 -15.698 -10.483
   29    HA3  GLY   7           2HA      GLY   7  -4.063 -14.672 -11.467
   30    H    THR   8           H        THR   8  -4.785 -13.813  -8.997
   31    HA   THR   8           HA       THR   8  -6.092 -11.344  -9.596
   32    HB   THR   8           HB       THR   8  -8.065 -12.837  -9.296
   33    HG1  THR   8           HG1      THR   8  -7.764 -10.915  -7.211
   34   HG21  THR   8          3HG2      THR   8  -6.959 -13.111  -6.500
   35   HG22  THR   8          1HG2      THR   8  -7.196 -14.402  -7.677
   36   HG23  THR   8          2HG2      THR   8  -8.590 -13.577  -6.980
   37    H    GLY   9           H        GLY   9  -5.632  -9.769  -8.097
   38    HA2  GLY   9           1HA      GLY   9  -4.181 -10.648  -5.679
   39    HA3  GLY   9           2HA      GLY   9  -3.576  -9.346  -6.692
   40    H    GLU  10           H        GLU  10  -6.514 -10.284  -4.908
   41    HA   GLU  10           HA       GLU  10  -7.307  -7.529  -4.595
   42    HB2  GLU  10           1HB      GLU  10  -8.989  -9.301  -4.861
   43    HB3  GLU  10           2HB      GLU  10  -8.442 -10.048  -3.366
   44    HG2  GLU  10           1HG      GLU  10  -9.241  -8.245  -2.063
   45    HG3  GLU  10           2HG      GLU  10  -9.511  -7.245  -3.488
   46    H    LYS  11           H        LYS  11  -7.079  -6.252  -2.836
   47    HA   LYS  11           HA       LYS  11  -6.145  -7.366  -0.319
   48    HB2  LYS  11           1HB      LYS  11  -4.541  -5.377  -1.930
   49    HB3  LYS  11           2HB      LYS  11  -4.271  -5.684  -0.219
   50    HG2  LYS  11           1HG      LYS  11  -4.094  -7.784  -2.368
   51    HG3  LYS  11           2HG      LYS  11  -2.715  -6.893  -1.718
   52    HD2  LYS  11           1HD      LYS  11  -3.140  -7.789   0.493
   53    HD3  LYS  11           2HD      LYS  11  -4.592  -8.606  -0.089
   54    HE2  LYS  11           1HE      LYS  11  -3.041 -10.314  -0.115
   55    HE3  LYS  11           2HE      LYS  11  -2.959  -9.726  -1.775
   56    HZ1  LYS  11           3HZ      LYS  11  -0.840  -9.180  -1.508
   57    HZ2  LYS  11           1HZ      LYS  11  -0.865  -9.981  -0.018
   58    HZ3  LYS  11           2HZ      LYS  11  -1.155  -8.316  -0.088
   59    HA   PRO  12           HA       PRO  12  -8.978  -4.196   0.970
   60    HB2  PRO  12           1HB      PRO  12  -8.669  -4.586   3.639
   61    HB3  PRO  12           2HB      PRO  12  -9.624  -5.665   2.614
   62    HG2  PRO  12           1HG      PRO  12  -6.819  -5.988   3.609
   63    HG3  PRO  12           2HG      PRO  12  -8.119  -7.191   3.518
   64    HD2  PRO  12           1HD      PRO  12  -6.130  -7.054   1.686
   65    HD3  PRO  12           2HD      PRO  12  -7.775  -7.577   1.272
   66    H    TYR  13           H        TYR  13  -5.681  -4.125   1.078
   67    HA   TYR  13           HA       TYR  13  -5.689  -1.386   2.112
   68    HB2  TYR  13           1HB      TYR  13  -3.899  -3.621   3.050
   69    HB3  TYR  13           2HB      TYR  13  -3.445  -1.930   3.224
   70    HD1  TYR  13           HD2      TYR  13  -4.671  -0.463   4.754
   71    HD2  TYR  13           HD1      TYR  13  -5.639  -4.592   4.413
   72    HE1  TYR  13           HE2      TYR  13  -5.949  -0.330   6.851
   73    HE2  TYR  13           HE1      TYR  13  -6.921  -4.471   6.509
   74    HH   TYR  13           HH       TYR  13  -6.888  -1.605   8.519
   75    H    ASN  14           H        ASN  14  -4.041  -0.053   1.280
   76    HA   ASN  14           HA       ASN  14  -2.082  -1.052  -0.552
   77    HB2  ASN  14           1HB      ASN  14  -4.154   0.736  -1.804
   78    HB3  ASN  14           2HB      ASN  14  -2.922  -0.244  -2.595
   79   HD21  ASN  14          1HD2      ASN  14  -3.241  -2.470  -2.798
   80   HD22  ASN  14          2HD2      ASN  14  -4.808  -3.181  -2.640
   81    H    CYS  15           H        CYS  15  -0.495   0.447  -0.999
   82    HA   CYS  15           HA       CYS  15  -0.462   2.773   0.699
   83    HB2  CYS  15           1HB      CYS  15   1.512   1.203   0.147
   84    HB3  CYS  15           2HB      CYS  15   1.625   2.102  -1.362
   85    H    GLU  16           H        GLU  16  -1.358   4.632   0.126
   86    HA   GLU  16           HA       GLU  16  -1.887   5.236  -2.653
   87    HB2  GLU  16           1HB      GLU  16  -2.529   6.667  -0.077
   88    HB3  GLU  16           2HB      GLU  16  -2.915   7.333  -1.657
   89    HG2  GLU  16           1HG      GLU  16  -4.889   6.325  -1.198
   90    HG3  GLU  16           2HG      GLU  16  -4.062   4.974  -1.973
   91    H    GLU  17           H        GLU  17   0.888   5.238  -1.346
   92    HA   GLU  17           HA       GLU  17   1.666   7.979  -2.086
   93    HB2  GLU  17           1HB      GLU  17   2.932   5.963  -0.241
   94    HB3  GLU  17           2HB      GLU  17   3.815   7.360  -0.838
   95    HG2  GLU  17           1HG      GLU  17   1.187   7.645   0.571
   96    HG3  GLU  17           2HG      GLU  17   2.710   7.535   1.451
   97    H    CYS  18           H        CYS  18   2.380   4.567  -2.565
   98    HA   CYS  18           HA       CYS  18   4.084   5.309  -4.854
   99    HB2  CYS  18           1HB      CYS  18   5.168   3.059  -4.518
  100    HB3  CYS  18           2HB      CYS  18   5.468   4.225  -3.234
  101    H    GLY  19           H        GLY  19   1.886   2.794  -3.618
  102    HA2  GLY  19           1HA      GLY  19  -0.053   2.355  -5.147
  103    HA3  GLY  19           2HA      GLY  19   1.149   2.219  -6.422
  104    H    LYS  20           H        LYS  20   1.321   0.948  -3.125
  105    HA   LYS  20           HA       LYS  20   1.598  -1.744  -4.277
  106    HB2  LYS  20           1HB      LYS  20   3.401  -0.557  -2.756
  107    HB3  LYS  20           2HB      LYS  20   2.359  -1.120  -1.456
  108    HG2  LYS  20           1HG      LYS  20   2.588  -3.416  -2.276
  109    HG3  LYS  20           2HG      LYS  20   3.655  -2.842  -3.560
  110    HD2  LYS  20           1HD      LYS  20   5.371  -2.338  -2.083
  111    HD3  LYS  20           2HD      LYS  20   4.281  -2.226  -0.699
  112    HE2  LYS  20           1HE      LYS  20   4.656  -4.829  -2.126
  113    HE3  LYS  20           2HE      LYS  20   5.841  -4.288  -0.939
  114    HZ1  LYS  20           3HZ      LYS  20   3.059  -4.159  -0.112
  115    HZ2  LYS  20           1HZ      LYS  20   4.429  -4.633   0.761
  116    HZ3  LYS  20           2HZ      LYS  20   3.694  -5.714  -0.312
  117    H    ALA  21           H        ALA  21   0.774  -3.545  -2.914
  118    HA   ALA  21           HA       ALA  21  -1.757  -2.774  -1.613
  119    HB1  ALA  21           3HB      ALA  21  -1.103  -5.281  -3.155
  120    HB2  ALA  21           1HB      ALA  21  -2.616  -4.984  -2.298
  121    HB3  ALA  21           2HB      ALA  21  -2.165  -3.971  -3.670
  122    H    PHE  22           H        PHE  22  -2.448  -4.000   0.203
  123    HA   PHE  22           HA       PHE  22  -0.459  -5.744   1.450
  124    HB2  PHE  22           1HB      PHE  22  -1.609  -3.253   2.713
  125    HB3  PHE  22           2HB      PHE  22  -0.827  -4.530   3.639
  126    HD1  PHE  22           HD2      PHE  22  -0.299  -1.955   1.054
  127    HD2  PHE  22           HD1      PHE  22   1.526  -4.717   3.728
  128    HE1  PHE  22           HE2      PHE  22   1.890  -0.915   0.628
  129    HE2  PHE  22           HE1      PHE  22   3.718  -3.682   3.308
  130    HZ   PHE  22           HZ       PHE  22   3.902  -1.779   1.755
  131    H    ILE  23           H        ILE  23  -1.303  -7.245   2.896
  132    HA   ILE  23           HA       ILE  23  -4.053  -7.920   2.485
  133    HB   ILE  23           HB       ILE  23  -2.291  -9.187   4.563
  134   HG12  ILE  23          1HG1      ILE  23  -1.847 -10.789   2.471
  135   HG13  ILE  23          2HG1      ILE  23  -2.054  -9.275   1.596
  136   HG21  ILE  23          1HG2      ILE  23  -3.811 -10.831   4.600
  137   HG22  ILE  23          2HG2      ILE  23  -4.874  -9.659   3.823
  138   HG23  ILE  23          3HG2      ILE  23  -3.992 -10.833   2.846
  139   HD11  ILE  23          3HD1      ILE  23   0.204 -10.237   3.082
  140   HD12  ILE  23          1HD1      ILE  23   0.077  -8.851   1.999
  141   HD13  ILE  23          2HD1      ILE  23  -0.333  -8.677   3.705
  142    H    HIS  24           H        HIS  24  -2.153  -6.931   5.329
  143    HA   HIS  24           HA       HIS  24  -4.686  -6.202   6.649
  144    HB2  HIS  24           1HB      HIS  24  -2.097  -7.212   7.831
  145    HB3  HIS  24           2HB      HIS  24  -3.372  -6.480   8.801
  146    HD2  HIS  24           HD2      HIS  24  -2.695  -9.775   6.806
  147    HE1  HIS  24           HE1      HIS  24  -6.215 -10.278   9.119
  148    HE2  HIS  24           HE2      HIS  24  -4.480 -11.422   7.697
  149    H    ASP  25           H        ASP  25  -4.097  -4.564   8.549
  150    HA   ASP  25           HA       ASP  25  -3.193  -2.192   7.223
  151    HB2  ASP  25           1HB      ASP  25  -3.491  -1.291   9.686
  152    HB3  ASP  25           2HB      ASP  25  -4.892  -1.684   8.693
  153    H    SER  26           H        SER  26  -2.115  -3.723  10.262
  154    HA   SER  26           HA       SER  26   0.107  -2.341  10.849
  155    HB2  SER  26           1HB      SER  26   1.122  -4.468  11.696
  156    HB3  SER  26           2HB      SER  26  -0.554  -4.236  12.196
  157    HG   SER  26           HG       SER  26  -1.201  -5.727  10.690
  158    H    GLN  27           H        GLN  27  -0.160  -4.722   8.263
  159    HA   GLN  27           HA       GLN  27   2.570  -4.777   7.551
  160    HB2  GLN  27           1HB      GLN  27   0.183  -5.273   5.767
  161    HB3  GLN  27           2HB      GLN  27   1.832  -5.811   5.479
  162    HG2  GLN  27           1HG      GLN  27   1.591  -7.063   7.708
  163    HG3  GLN  27           2HG      GLN  27  -0.139  -6.795   7.501
  164   HE21  GLN  27          1HE2      GLN  27   2.659  -7.909   5.622
  165   HE22  GLN  27          2HE2      GLN  27   1.835  -9.215   4.849
  166    H    LEU  28           H        LEU  28  -0.164  -3.044   6.055
  167    HA   LEU  28           HA       LEU  28   1.373  -1.602   4.202
  168    HB2  LEU  28           1HB      LEU  28  -0.930  -1.712   3.798
  169    HB3  LEU  28           2HB      LEU  28  -1.329  -1.166   5.426
  170    HG   LEU  28           HG       LEU  28  -0.517   1.089   4.838
  171   HD11  LEU  28          1HD1      LEU  28   0.140   1.683   2.665
  172   HD12  LEU  28          2HD1      LEU  28  -0.395   0.145   1.990
  173   HD13  LEU  28          3HD1      LEU  28   1.032   0.205   3.026
  174   HD21  LEU  28          3HD2      LEU  28  -2.617  -0.016   2.975
  175   HD22  LEU  28          1HD2      LEU  28  -2.388   1.684   3.386
  176   HD23  LEU  28          2HD2      LEU  28  -2.886   0.536   4.630
  177    H    GLN  29           H        GLN  29   0.111  -0.627   7.385
  178    HA   GLN  29           HA       GLN  29   1.112   1.954   7.459
  179    HB2  GLN  29           1HB      GLN  29   0.723  -0.031   9.701
  180    HB3  GLN  29           2HB      GLN  29   1.101   1.667   9.958
  181    HG2  GLN  29           1HG      GLN  29  -1.388   0.456   8.814
  182    HG3  GLN  29           2HG      GLN  29  -1.214   1.511  10.216
  183   HE21  GLN  29          1HE2      GLN  29  -1.003   1.387   6.709
  184   HE22  GLN  29          2HE2      GLN  29  -1.338   3.061   6.444
  185    H    GLU  30           H        GLU  30   2.665  -1.030   8.628
  186    HA   GLU  30           HA       GLU  30   5.036   0.097   9.543
  187    HB2  GLU  30           1HB      GLU  30   4.470  -2.203  10.032
  188    HB3  GLU  30           2HB      GLU  30   4.537  -2.623   8.326
  189    HG2  GLU  30           1HG      GLU  30   6.882  -2.379   8.257
  190    HG3  GLU  30           2HG      GLU  30   6.918  -1.586   9.831
  191    H    HIS  31           H        HIS  31   3.884  -0.224   6.352
  192    HA   HIS  31           HA       HIS  31   6.544  -0.019   5.166
  193    HB2  HIS  31           1HB      HIS  31   5.286  -1.467   3.869
  194    HB3  HIS  31           2HB      HIS  31   3.797  -0.558   4.109
  195    HD1  HIS  31           HD1      HIS  31   6.810  -0.762   1.931
  196    HD2  HIS  31           HD2      HIS  31   3.422   1.606   2.344
  197    HE1  HIS  31           HE1      HIS  31   6.693   0.616  -0.169
  198    H    GLN  32           H        GLN  32   3.456   1.762   5.039
  199    HA   GLN  32           HA       GLN  32   4.062   3.926   3.566
  200    HB2  GLN  32           1HB      GLN  32   2.545   3.780   6.161
  201    HB3  GLN  32           2HB      GLN  32   2.667   5.276   5.246
  202    HG2  GLN  32           1HG      GLN  32   1.726   4.010   3.281
  203    HG3  GLN  32           2HG      GLN  32   1.381   2.697   4.405
  204   HE21  GLN  32          1HE2      GLN  32  -0.733   3.576   3.182
  205   HE22  GLN  32          2HE2      GLN  32  -1.700   4.609   4.173
  206    H    ARG  33           H        ARG  33   5.452   3.131   6.638
  207    HA   ARG  33           HA       ARG  33   6.399   5.551   7.549
  208    HB2  ARG  33           1HB      ARG  33   8.115   3.081   7.602
  209    HB3  ARG  33           2HB      ARG  33   7.982   4.351   8.811
  210    HG2  ARG  33           1HG      ARG  33   5.502   3.513   8.963
  211    HG3  ARG  33           2HG      ARG  33   6.190   2.037   8.283
  212    HD2  ARG  33           1HD      ARG  33   7.432   1.593  10.147
  213    HD3  ARG  33           2HD      ARG  33   7.592   3.295  10.578
  214    HE   ARG  33           HE       ARG  33   5.488   1.489  11.368
  215   HH11  ARG  33          1HH1      ARG  33   6.441   4.812  10.959
  216   HH12  ARG  33          2HH1      ARG  33   5.278   5.421  12.090
  217   HH21  ARG  33          1HH2      ARG  33   3.953   2.278  12.860
  218   HH22  ARG  33          2HH2      ARG  33   3.864   3.979  13.171
  219    H    ILE  34           H        ILE  34   7.932   3.376   5.191
  220    HA   ILE  34           HA       ILE  34  10.297   4.656   4.725
  221    HB   ILE  34           HB       ILE  34  10.298   3.754   2.490
  222   HG12  ILE  34          1HG1      ILE  34   7.467   2.834   2.700
  223   HG13  ILE  34          2HG1      ILE  34   7.765   4.506   2.237
  224   HG21  ILE  34          1HG2      ILE  34  10.737   1.910   3.688
  225   HG22  ILE  34          2HG2      ILE  34   9.378   2.178   4.779
  226   HG23  ILE  34          3HG2      ILE  34   9.113   1.412   3.213
  227   HD11  ILE  34          3HD1      ILE  34   9.485   3.046   0.638
  228   HD12  ILE  34          1HD1      ILE  34   8.007   2.085   0.685
  229   HD13  ILE  34          2HD1      ILE  34   7.949   3.767   0.158
  230    H    HIS  35           H        HIS  35   7.122   5.780   3.959
  231    HA   HIS  35           HA       HIS  35   8.060   7.817   2.119
  232    HB2  HIS  35           1HB      HIS  35   5.324   7.218   3.256
  233    HB3  HIS  35           2HB      HIS  35   5.651   8.521   2.117
  234    HD1  HIS  35           HD1      HIS  35   6.150   7.857  -0.334
  235    HD2  HIS  35           HD2      HIS  35   5.287   4.648   2.158
  236    HE1  HIS  35           HE1      HIS  35   5.745   5.906  -1.867
  237    H    THR  36           H        THR  36   6.427   7.761   5.286
  238    HA   THR  36           HA       THR  36   6.195  10.322   5.979
  239    HB   THR  36           HB       THR  36   6.635   9.786   8.284
  240    HG1  THR  36           HG1      THR  36   7.536   7.469   8.534
  241   HG21  THR  36          3HG2      THR  36   4.632   8.774   7.219
  242   HG22  THR  36          1HG2      THR  36   5.242   7.835   8.581
  243   HG23  THR  36          2HG2      THR  36   5.567   7.307   6.930
  244    H    GLY  37           H        GLY  37   9.293   8.572   6.271
  245    HA2  GLY  37           1HA      GLY  37  10.642  11.203   6.238
  246    HA3  GLY  37           2HA      GLY  37  11.237   9.823   7.150
  247    H    GLU  38           H        GLU  38  10.679  11.068   3.896
  248    HA   GLU  38           HA       GLU  38  12.798   9.257   2.938
  249    HB2  GLU  38           1HB      GLU  38  10.741   8.540   1.943
  250    HB3  GLU  38           2HB      GLU  38  10.301  10.190   1.524
  251    HG2  GLU  38           1HG      GLU  38  11.027   9.481  -0.500
  252    HG3  GLU  38           2HG      GLU  38  12.556  10.064   0.155
  253    H    LYS  39           H        LYS  39  14.545  10.225   2.155
  254    HA   LYS  39           HA       LYS  39  15.174  12.844   2.290
  255    HB2  LYS  39           1HB      LYS  39  16.945  12.460   0.714
  256    HB3  LYS  39           2HB      LYS  39  16.728  10.992   1.658
  257    HG2  LYS  39           1HG      LYS  39  15.492   9.976  -0.169
  258    HG3  LYS  39           2HG      LYS  39  15.647  11.458  -1.114
  259    HD2  LYS  39           1HD      LYS  39  17.991   9.852  -0.104
  260    HD3  LYS  39           2HD      LYS  39  17.285   9.660  -1.711
  261    HE2  LYS  39           1HE      LYS  39  17.721  12.083  -2.111
  262    HE3  LYS  39           2HE      LYS  39  18.573  12.136  -0.568
  263    HZ1  LYS  39           3HZ      LYS  39  20.020  11.829  -2.553
  264    HZ2  LYS  39           1HZ      LYS  39  19.316  10.308  -2.782
  265    HZ3  LYS  39           2HZ      LYS  39  20.197  10.628  -1.375
  266    HA   PRO  40           HA       PRO  40  12.844  15.115  -0.665
  267    HB2  PRO  40           1HB      PRO  40  14.561  17.158  -1.164
  268    HB3  PRO  40           2HB      PRO  40  13.659  17.009   0.349
  269    HG2  PRO  40           1HG      PRO  40  16.497  16.265  -0.247
  270    HG3  PRO  40           2HG      PRO  40  15.831  17.086   1.176
  271    HD2  PRO  40           1HD      PRO  40  16.448  14.450   1.172
  272    HD3  PRO  40           2HD      PRO  40  15.112  15.117   2.133
  273    H    SER  41           H        SER  41  12.828  15.846  -2.887
  274    HA   SER  41           HA       SER  41  14.386  14.106  -4.594
  275    HB2  SER  41           1HB      SER  41  12.056  15.953  -5.011
  276    HB3  SER  41           2HB      SER  41  12.970  15.361  -6.398
  277    HG   SER  41           HG       SER  41  11.558  13.778  -6.171
  278    H    GLY  42           H        GLY  42  16.426  15.225  -3.950
  279    HA2  GLY  42           1HA      GLY  42  18.219  16.364  -4.923
  280    HA3  GLY  42           2HA      GLY  42  17.088  17.190  -5.985
  281    HA   PRO  43           HA       PRO  43  16.933  19.575  -1.780
  282    HB2  PRO  43           1HB      PRO  43  18.770  18.867   0.090
  283    HB3  PRO  43           2HB      PRO  43  17.165  18.132  -0.007
  284    HG2  PRO  43           1HG      PRO  43  19.786  17.100  -1.021
  285    HG3  PRO  43           2HG      PRO  43  18.494  16.230  -0.174
  286    HD2  PRO  43           1HD      PRO  43  18.821  16.101  -2.859
  287    HD3  PRO  43           2HD      PRO  43  17.226  15.999  -2.086
  288    H    SER  44           H        SER  44  18.035  21.478  -1.321
  289    HA   SER  44           HA       SER  44  20.361  21.975  -2.973
  290    HB2  SER  44           1HB      SER  44  20.040  24.330  -2.330
  291    HB3  SER  44           2HB      SER  44  18.536  23.620  -2.916
  292    HG   SER  44           HG       SER  44  17.676  23.941  -1.028
  293    H    SER  45           H        SER  45  22.335  22.847  -2.212
  294    HA   SER  45           HA       SER  45  24.156  22.928  -0.852
  295    HB2  SER  45           1HB      SER  45  22.069  23.235   1.320
  296    HB3  SER  45           2HB      SER  45  23.793  23.550   1.513
  297    HG   SER  45           HG       SER  45  21.847  25.022   0.166
  298    H    GLY  46           H        GLY  46  23.605  20.437  -1.634
  299    HA2  GLY  46           1HA      GLY  46  24.429  18.866   0.691
  300    HA3  GLY  46           2HA      GLY  46  22.982  18.342  -0.158
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1   0.622  -5.785 -28.411
    2    HA2  GLY   1           1HA      GLY   1  -0.049  -6.851 -26.475
    3    HA3  GLY   1           2HA      GLY   1   1.638  -6.630 -26.034
    4    H    SER   2           H        SER   2  -1.278  -6.325 -24.797
    5    HA   SER   2           HA       SER   2  -0.518  -4.002 -23.163
    6    HB2  SER   2           1HB      SER   2  -3.344  -4.595 -24.069
    7    HB3  SER   2           2HB      SER   2  -2.807  -3.211 -23.118
    8    HG   SER   2           HG       SER   2  -3.099  -2.941 -25.496
    9    H    SER   3           H        SER   3   0.201  -5.318 -21.498
   10    HA   SER   3           HA       SER   3  -1.546  -7.350 -20.398
   11    HB2  SER   3           1HB      SER   3   0.911  -7.689 -20.493
   12    HB3  SER   3           2HB      SER   3   1.120  -6.343 -19.373
   13    HG   SER   3           HG       SER   3  -0.193  -8.809 -18.886
   14    H    GLY   4           H        GLY   4  -3.319  -5.998 -19.786
   15    HA2  GLY   4           1HA      GLY   4  -3.160  -5.121 -17.074
   16    HA3  GLY   4           2HA      GLY   4  -3.263  -3.759 -18.180
   17    H    SER   5           H        SER   5  -5.090  -5.369 -16.160
   18    HA   SER   5           HA       SER   5  -7.536  -4.577 -17.309
   19    HB2  SER   5           1HB      SER   5  -7.259  -6.463 -18.804
   20    HB3  SER   5           2HB      SER   5  -6.925  -7.539 -17.448
   21    HG   SER   5           HG       SER   5  -9.034  -7.856 -17.841
   22    H    SER   6           H        SER   6  -9.099  -4.474 -15.778
   23    HA   SER   6           HA       SER   6  -8.491  -4.648 -13.095
   24    HB2  SER   6           1HB      SER   6 -10.446  -3.434 -14.073
   25    HB3  SER   6           2HB      SER   6 -11.257  -4.987 -14.277
   26    HG   SER   6           HG       SER   6 -11.474  -3.551 -12.213
   27    H    GLY   7           H        GLY   7  -8.005  -6.335 -11.867
   28    HA2  GLY   7           1HA      GLY   7  -9.666  -8.589 -11.571
   29    HA3  GLY   7           2HA      GLY   7  -8.326  -9.014 -12.626
   30    H    THR   8           H        THR   8  -6.468  -9.636 -11.721
   31    HA   THR   8           HA       THR   8  -6.153 -10.380  -9.139
   32    HB   THR   8           HB       THR   8  -4.534 -10.884 -10.958
   33    HG1  THR   8           HG1      THR   8  -2.617 -10.389  -9.430
   34   HG21  THR   8          3HG2      THR   8  -4.278  -8.626 -11.860
   35   HG22  THR   8          1HG2      THR   8  -2.715  -9.299 -11.402
   36   HG23  THR   8          2HG2      THR   8  -3.500  -8.108 -10.365
   37    H    GLY   9           H        GLY   9  -5.800  -9.460  -7.205
   38    HA2  GLY   9           1HA      GLY   9  -4.575  -7.687  -5.975
   39    HA3  GLY   9           2HA      GLY   9  -5.203  -6.564  -7.172
   40    H    GLU  10           H        GLU  10  -6.285  -8.900  -4.718
   41    HA   GLU  10           HA       GLU  10  -8.692  -7.261  -4.321
   42    HB2  GLU  10           1HB      GLU  10  -8.656  -9.873  -4.767
   43    HB3  GLU  10           2HB      GLU  10  -8.360  -9.933  -3.035
   44    HG2  GLU  10           1HG      GLU  10 -10.438  -9.162  -2.508
   45    HG3  GLU  10           2HG      GLU  10 -10.605  -8.255  -4.010
   46    H    LYS  11           H        LYS  11  -5.752  -7.181  -3.196
   47    HA   LYS  11           HA       LYS  11  -5.762  -7.591  -0.462
   48    HB2  LYS  11           1HB      LYS  11  -4.317  -5.616  -2.205
   49    HB3  LYS  11           2HB      LYS  11  -4.094  -5.606  -0.461
   50    HG2  LYS  11           1HG      LYS  11  -2.331  -6.888  -1.365
   51    HG3  LYS  11           2HG      LYS  11  -3.459  -8.032  -0.634
   52    HD2  LYS  11           1HD      LYS  11  -4.199  -8.812  -2.681
   53    HD3  LYS  11           2HD      LYS  11  -3.716  -7.342  -3.531
   54    HE2  LYS  11           1HE      LYS  11  -2.108  -8.842  -4.230
   55    HE3  LYS  11           2HE      LYS  11  -1.309  -8.070  -2.861
   56    HZ1  LYS  11           3HZ      LYS  11  -1.454 -10.691  -3.146
   57    HZ2  LYS  11           1HZ      LYS  11  -2.886 -10.447  -2.279
   58    HZ3  LYS  11           2HZ      LYS  11  -1.408  -9.943  -1.630
   59    HA   PRO  12           HA       PRO  12  -8.813  -4.661   0.901
   60    HB2  PRO  12           1HB      PRO  12  -8.427  -5.045   3.560
   61    HB3  PRO  12           2HB      PRO  12  -9.313  -6.188   2.544
   62    HG2  PRO  12           1HG      PRO  12  -6.474  -6.297   3.488
   63    HG3  PRO  12           2HG      PRO  12  -7.678  -7.597   3.409
   64    HD2  PRO  12           1HD      PRO  12  -5.738  -7.293   1.544
   65    HD3  PRO  12           2HD      PRO  12  -7.345  -7.940   1.154
   66    H    TYR  13           H        TYR  13  -5.537  -4.325   0.934
   67    HA   TYR  13           HA       TYR  13  -5.739  -1.599   1.973
   68    HB2  TYR  13           1HB      TYR  13  -3.778  -3.684   2.919
   69    HB3  TYR  13           2HB      TYR  13  -3.468  -1.960   3.094
   70    HD1  TYR  13           HD2      TYR  13  -4.825  -0.601   4.616
   71    HD2  TYR  13           HD1      TYR  13  -5.423  -4.800   4.284
   72    HE1  TYR  13           HE2      TYR  13  -6.114  -0.577   6.711
   73    HE2  TYR  13           HE1      TYR  13  -6.714  -4.788   6.377
   74    HH   TYR  13           HH       TYR  13  -7.089  -1.830   8.287
   75    H    ASN  14           H        ASN  14  -4.188  -0.154   1.135
   76    HA   ASN  14           HA       ASN  14  -2.203  -1.056  -0.741
   77    HB2  ASN  14           1HB      ASN  14  -4.356   0.719  -1.874
   78    HB3  ASN  14           2HB      ASN  14  -3.105  -0.173  -2.734
   79   HD21  ASN  14          1HD2      ASN  14  -3.335  -2.406  -3.017
   80   HD22  ASN  14          2HD2      ASN  14  -4.872  -3.182  -2.869
   81    H    CYS  15           H        CYS  15  -0.676   0.511  -1.209
   82    HA   CYS  15           HA       CYS  15  -0.701   2.808   0.556
   83    HB2  CYS  15           1HB      CYS  15   1.307   1.253   0.064
   84    HB3  CYS  15           2HB      CYS  15   1.467   2.170  -1.430
   85    H    GLU  16           H        GLU  16  -1.491   4.708  -0.030
   86    HA   GLU  16           HA       GLU  16  -1.969   5.292  -2.833
   87    HB2  GLU  16           1HB      GLU  16  -2.863   6.425  -0.232
   88    HB3  GLU  16           2HB      GLU  16  -2.838   7.507  -1.617
   89    HG2  GLU  16           1HG      GLU  16  -5.008   6.644  -1.547
   90    HG3  GLU  16           2HG      GLU  16  -4.198   5.753  -2.835
   91    H    GLU  17           H        GLU  17   0.768   5.282  -1.487
   92    HA   GLU  17           HA       GLU  17   1.563   8.027  -2.201
   93    HB2  GLU  17           1HB      GLU  17   2.689   6.055  -0.235
   94    HB3  GLU  17           2HB      GLU  17   3.687   7.354  -0.873
   95    HG2  GLU  17           1HG      GLU  17   1.772   8.899  -0.109
   96    HG3  GLU  17           2HG      GLU  17   1.263   7.523   0.867
   97    H    CYS  18           H        CYS  18   2.323   4.609  -2.587
   98    HA   CYS  18           HA       CYS  18   4.083   5.325  -4.841
   99    HB2  CYS  18           1HB      CYS  18   5.180   3.077  -4.397
  100    HB3  CYS  18           2HB      CYS  18   5.475   4.329  -3.195
  101    H    GLY  19           H        GLY  19   1.919   2.788  -3.587
  102    HA2  GLY  19           1HA      GLY  19   0.034   2.242  -5.140
  103    HA3  GLY  19           2HA      GLY  19   1.263   2.123  -6.391
  104    H    LYS  20           H        LYS  20   1.365   0.919  -3.060
  105    HA   LYS  20           HA       LYS  20   1.822  -1.774  -4.148
  106    HB2  LYS  20           1HB      LYS  20   3.608  -0.755  -2.721
  107    HB3  LYS  20           2HB      LYS  20   2.468  -0.742  -1.381
  108    HG2  LYS  20           1HG      LYS  20   2.315  -3.168  -1.466
  109    HG3  LYS  20           2HG      LYS  20   3.423  -3.199  -2.840
  110    HD2  LYS  20           1HD      LYS  20   5.220  -2.383  -1.509
  111    HD3  LYS  20           2HD      LYS  20   4.139  -2.013  -0.164
  112    HE2  LYS  20           1HE      LYS  20   4.996  -3.996   0.572
  113    HE3  LYS  20           2HE      LYS  20   3.616  -4.598  -0.345
  114    HZ1  LYS  20           3HZ      LYS  20   5.561  -4.458  -2.212
  115    HZ2  LYS  20           1HZ      LYS  20   5.125  -5.859  -1.371
  116    HZ3  LYS  20           2HZ      LYS  20   6.431  -4.926  -0.839
  117    H    ALA  21           H        ALA  21   0.993  -3.593  -2.819
  118    HA   ALA  21           HA       ALA  21  -1.631  -2.921  -1.654
  119    HB1  ALA  21           3HB      ALA  21  -1.136  -5.632  -2.762
  120    HB2  ALA  21           1HB      ALA  21  -2.622  -4.683  -2.709
  121    HB3  ALA  21           2HB      ALA  21  -1.373  -4.301  -3.895
  122    H    PHE  22           H        PHE  22  -2.302  -4.016   0.192
  123    HA   PHE  22           HA       PHE  22  -0.372  -5.815   1.468
  124    HB2  PHE  22           1HB      PHE  22  -1.553  -3.329   2.714
  125    HB3  PHE  22           2HB      PHE  22  -0.770  -4.604   3.643
  126    HD1  PHE  22           HD2      PHE  22  -0.262  -1.901   1.221
  127    HD2  PHE  22           HD1      PHE  22   1.611  -4.879   3.618
  128    HE1  PHE  22           HE2      PHE  22   1.922  -0.839   0.828
  129    HE2  PHE  22           HE1      PHE  22   3.798  -3.820   3.229
  130    HZ   PHE  22           HZ       PHE  22   3.956  -1.799   1.832
  131    H    ILE  23           H        ILE  23  -1.276  -7.134   3.154
  132    HA   ILE  23           HA       ILE  23  -4.083  -7.741   2.653
  133    HB   ILE  23           HB       ILE  23  -2.092  -9.265   4.337
  134   HG12  ILE  23          1HG1      ILE  23  -1.463  -9.079   1.921
  135   HG13  ILE  23          2HG1      ILE  23  -1.781 -10.728   2.447
  136   HG21  ILE  23          1HG2      ILE  23  -3.827 -10.490   4.975
  137   HG22  ILE  23          2HG2      ILE  23  -4.911  -9.496   4.004
  138   HG23  ILE  23          3HG2      ILE  23  -4.136 -10.909   3.290
  139   HD11  ILE  23          3HD1      ILE  23  -3.913  -9.085   1.145
  140   HD12  ILE  23          1HD1      ILE  23  -2.714  -9.959   0.192
  141   HD13  ILE  23          2HD1      ILE  23  -3.786 -10.839   1.282
  142    H    HIS  24           H        HIS  24  -1.941  -6.966   5.371
  143    HA   HIS  24           HA       HIS  24  -4.333  -6.417   7.001
  144    HB2  HIS  24           1HB      HIS  24  -1.566  -7.301   7.825
  145    HB3  HIS  24           2HB      HIS  24  -2.769  -6.711   8.968
  146    HD2  HIS  24           HD2      HIS  24  -2.263  -9.795   6.576
  147    HE1  HIS  24           HE1      HIS  24  -5.177 -10.758   9.505
  148    HE2  HIS  24           HE2      HIS  24  -3.729 -11.640   7.642
  149    H    ASP  25           H        ASP  25  -4.341  -4.555   8.321
  150    HA   ASP  25           HA       ASP  25  -3.348  -2.231   7.147
  151    HB2  ASP  25           1HB      ASP  25  -4.337  -1.072   8.898
  152    HB3  ASP  25           2HB      ASP  25  -5.239  -2.586   8.915
  153    H    SER  26           H        SER  26  -2.169  -3.972  10.017
  154    HA   SER  26           HA       SER  26  -0.106  -2.330  10.777
  155    HB2  SER  26           1HB      SER  26   0.869  -4.212  11.874
  156    HB3  SER  26           2HB      SER  26  -0.875  -4.478  11.893
  157    HG   SER  26           HG       SER  26   1.101  -5.923  10.678
  158    H    GLN  27           H        GLN  27  -0.063  -4.822   8.258
  159    HA   GLN  27           HA       GLN  27   2.647  -4.680   7.601
  160    HB2  GLN  27           1HB      GLN  27   0.319  -5.269   5.765
  161    HB3  GLN  27           2HB      GLN  27   2.004  -5.660   5.446
  162    HG2  GLN  27           1HG      GLN  27   2.034  -7.192   7.320
  163    HG3  GLN  27           2HG      GLN  27   0.373  -6.761   7.723
  164   HE21  GLN  27          1HE2      GLN  27   2.194  -7.768   4.843
  165   HE22  GLN  27          2HE2      GLN  27   1.049  -8.954   4.326
  166    H    LEU  28           H        LEU  28  -0.099  -3.042   6.020
  167    HA   LEU  28           HA       LEU  28   1.404  -1.515   4.231
  168    HB2  LEU  28           1HB      LEU  28  -0.909  -1.674   3.852
  169    HB3  LEU  28           2HB      LEU  28  -1.296  -1.118   5.479
  170    HG   LEU  28           HG       LEU  28  -0.504   1.139   4.864
  171   HD11  LEU  28          1HD1      LEU  28  -0.121  -0.142   2.167
  172   HD12  LEU  28          2HD1      LEU  28   1.085   0.679   3.158
  173   HD13  LEU  28          3HD1      LEU  28  -0.222   1.601   2.416
  174   HD21  LEU  28          3HD2      LEU  28  -2.573   0.126   2.924
  175   HD22  LEU  28          1HD2      LEU  28  -2.424   1.750   3.595
  176   HD23  LEU  28          2HD2      LEU  28  -2.889   0.405   4.637
  177    H    GLN  29           H        GLN  29   0.111  -0.599   7.422
  178    HA   GLN  29           HA       GLN  29   1.101   1.987   7.535
  179    HB2  GLN  29           1HB      GLN  29   0.640  -0.033   9.727
  180    HB3  GLN  29           2HB      GLN  29   1.081   1.639  10.045
  181    HG2  GLN  29           1HG      GLN  29  -1.436   0.568   8.828
  182    HG3  GLN  29           2HG      GLN  29  -1.241   1.567  10.267
  183   HE21  GLN  29          1HE2      GLN  29  -1.242   1.521   6.783
  184   HE22  GLN  29          2HE2      GLN  29  -1.406   3.226   6.562
  185    H    GLU  30           H        GLU  30   2.671  -1.047   8.482
  186    HA   GLU  30           HA       GLU  30   5.033   0.115   9.494
  187    HB2  GLU  30           1HB      GLU  30   4.372  -2.201   9.974
  188    HB3  GLU  30           2HB      GLU  30   4.617  -2.625   8.286
  189    HG2  GLU  30           1HG      GLU  30   6.947  -2.352   8.446
  190    HG3  GLU  30           2HG      GLU  30   6.820  -1.520   9.995
  191    H    HIS  31           H        HIS  31   3.852   0.051   6.377
  192    HA   HIS  31           HA       HIS  31   6.526   0.131   5.165
  193    HB2  HIS  31           1HB      HIS  31   5.320  -1.335   3.856
  194    HB3  HIS  31           2HB      HIS  31   3.797  -0.492   4.126
  195    HD1  HIS  31           HD1      HIS  31   6.881  -0.396   1.990
  196    HD2  HIS  31           HD2      HIS  31   3.196   1.499   2.284
  197    HE1  HIS  31           HE1      HIS  31   6.643   0.943  -0.125
  198    H    GLN  32           H        GLN  32   3.453   1.914   5.241
  199    HA   GLN  32           HA       GLN  32   4.071   4.072   3.669
  200    HB2  GLN  32           1HB      GLN  32   2.370   3.762   6.111
  201    HB3  GLN  32           2HB      GLN  32   2.616   5.367   5.434
  202    HG2  GLN  32           1HG      GLN  32   1.845   4.391   3.224
  203    HG3  GLN  32           2HG      GLN  32   1.319   2.987   4.151
  204   HE21  GLN  32          1HE2      GLN  32  -0.820   3.099   4.181
  205   HE22  GLN  32          2HE2      GLN  32  -1.748   4.472   4.667
  206    H    ARG  33           H        ARG  33   5.486   3.199   6.661
  207    HA   ARG  33           HA       ARG  33   6.327   5.724   7.584
  208    HB2  ARG  33           1HB      ARG  33   8.140   4.345   8.750
  209    HB3  ARG  33           2HB      ARG  33   6.467   3.965   9.135
  210    HG2  ARG  33           1HG      ARG  33   6.522   1.954   8.017
  211    HG3  ARG  33           2HG      ARG  33   7.856   2.452   6.974
  212    HD2  ARG  33           1HD      ARG  33   8.091   1.942   9.936
  213    HD3  ARG  33           2HD      ARG  33   8.496   0.769   8.685
  214    HE   ARG  33           HE       ARG  33  10.033   3.087   9.467
  215   HH11  ARG  33          1HH1      ARG  33   9.456   0.675   7.024
  216   HH12  ARG  33          2HH1      ARG  33  11.025   0.837   6.307
  217   HH21  ARG  33          1HH2      ARG  33  12.102   3.310   8.532
  218   HH22  ARG  33          2HH2      ARG  33  12.529   2.336   7.167
  219    H    ILE  34           H        ILE  34   7.721   3.447   5.292
  220    HA   ILE  34           HA       ILE  34  10.271   4.519   5.027
  221    HB   ILE  34           HB       ILE  34  10.468   3.368   2.995
  222   HG12  ILE  34          1HG1      ILE  34   7.453   3.450   2.747
  223   HG13  ILE  34          2HG1      ILE  34   8.578   4.460   1.846
  224   HG21  ILE  34          1HG2      ILE  34   9.326   2.136   5.194
  225   HG22  ILE  34          2HG2      ILE  34   8.372   1.550   3.833
  226   HG23  ILE  34          3HG2      ILE  34  10.122   1.335   3.840
  227   HD11  ILE  34          3HD1      ILE  34   8.484   1.457   1.700
  228   HD12  ILE  34          1HD1      ILE  34   7.710   2.550   0.553
  229   HD13  ILE  34          2HD1      ILE  34   9.467   2.539   0.713
  230    H    HIS  35           H        HIS  35   7.216   5.701   3.873
  231    HA   HIS  35           HA       HIS  35   8.328   7.535   1.962
  232    HB2  HIS  35           1HB      HIS  35   5.575   7.229   3.161
  233    HB3  HIS  35           2HB      HIS  35   5.974   8.494   2.002
  234    HD1  HIS  35           HD1      HIS  35   7.081   7.431  -0.332
  235    HD2  HIS  35           HD2      HIS  35   4.629   4.997   1.977
  236    HE1  HIS  35           HE1      HIS  35   6.332   5.583  -1.865
  237    H    THR  36           H        THR  36   7.632   7.568   5.350
  238    HA   THR  36           HA       THR  36   7.666  10.444   5.592
  239    HB   THR  36           HB       THR  36   7.478  10.102   7.973
  240    HG1  THR  36           HG1      THR  36   8.920   8.349   8.209
  241   HG21  THR  36          3HG2      THR  36   5.500   9.642   6.418
  242   HG22  THR  36          1HG2      THR  36   5.388   9.025   8.066
  243   HG23  THR  36          2HG2      THR  36   5.796   7.934   6.743
  244    H    GLY  37           H        GLY  37   9.813  10.479   4.399
  245    HA2  GLY  37           1HA      GLY  37  11.978  10.370   6.401
  246    HA3  GLY  37           2HA      GLY  37  12.227   9.769   4.769
  247    H    GLU  38           H        GLU  38  13.998  11.547   5.427
  248    HA   GLU  38           HA       GLU  38  13.041  14.180   4.551
  249    HB2  GLU  38           1HB      GLU  38  15.426  13.257   6.113
  250    HB3  GLU  38           2HB      GLU  38  15.479  14.798   5.270
  251    HG2  GLU  38           1HG      GLU  38  14.740  15.502   7.293
  252    HG3  GLU  38           2HG      GLU  38  13.190  15.170   6.521
  253    H    LYS  39           H        LYS  39  12.901  13.765   2.334
  254    HA   LYS  39           HA       LYS  39  15.200  12.788   0.885
  255    HB2  LYS  39           1HB      LYS  39  12.456  13.729   0.091
  256    HB3  LYS  39           2HB      LYS  39  13.701  13.445  -1.118
  257    HG2  LYS  39           1HG      LYS  39  12.463  11.464  -1.039
  258    HG3  LYS  39           2HG      LYS  39  13.928  11.120  -0.116
  259    HD2  LYS  39           1HD      LYS  39  12.161  10.238   1.167
  260    HD3  LYS  39           2HD      LYS  39  12.589  11.761   1.951
  261    HE2  LYS  39           1HE      LYS  39  10.313  11.971   1.887
  262    HE3  LYS  39           2HE      LYS  39  10.731  12.715   0.344
  263    HZ1  LYS  39           3HZ      LYS  39  10.428  10.339  -0.562
  264    HZ2  LYS  39           1HZ      LYS  39   9.052  11.260  -0.218
  265    HZ3  LYS  39           2HZ      LYS  39   9.559  10.062   0.863
  266    HA   PRO  40           HA       PRO  40  17.142  16.642   0.055
  267    HB2  PRO  40           1HB      PRO  40  18.295  16.093  -2.340
  268    HB3  PRO  40           2HB      PRO  40  18.884  15.423  -0.815
  269    HG2  PRO  40           1HG      PRO  40  17.135  14.159  -2.890
  270    HG3  PRO  40           2HG      PRO  40  18.500  13.459  -1.999
  271    HD2  PRO  40           1HD      PRO  40  15.921  12.981  -1.325
  272    HD3  PRO  40           2HD      PRO  40  17.226  13.046  -0.123
  273    H    SER  41           H        SER  41  17.613  17.863  -2.335
  274    HA   SER  41           HA       SER  41  15.192  19.187  -2.857
  275    HB2  SER  41           1HB      SER  41  16.545  20.019  -4.937
  276    HB3  SER  41           2HB      SER  41  17.074  20.478  -3.319
  277    HG   SER  41           HG       SER  41  18.149  18.509  -5.036
  278    H    GLY  42           H        GLY  42  16.193  16.165  -3.853
  279    HA2  GLY  42           1HA      GLY  42  14.061  15.301  -5.186
  280    HA3  GLY  42           2HA      GLY  42  14.858  16.238  -6.442
  281    HA   PRO  43           HA       PRO  43  17.622  12.400  -5.271
  282    HB2  PRO  43           1HB      PRO  43  16.214  10.307  -4.268
  283    HB3  PRO  43           2HB      PRO  43  16.972  11.533  -3.245
  284    HG2  PRO  43           1HG      PRO  43  14.118  11.294  -4.115
  285    HG3  PRO  43           2HG      PRO  43  14.770  11.704  -2.518
  286    HD2  PRO  43           1HD      PRO  43  13.835  13.578  -4.235
  287    HD3  PRO  43           2HD      PRO  43  15.166  13.898  -3.104
  288    H    SER  44           H        SER  44  14.703  12.729  -6.883
  289    HA   SER  44           HA       SER  44  13.638  11.531  -8.553
  290    HB2  SER  44           1HB      SER  44  16.502  11.920  -9.380
  291    HB3  SER  44           2HB      SER  44  15.354  11.137 -10.466
  292    HG   SER  44           HG       SER  44  15.522  13.446 -10.738
  293    H    SER  45           H        SER  45  14.279   9.792  -6.433
  294    HA   SER  45           HA       SER  45  14.189   7.286  -7.803
  295    HB2  SER  45           1HB      SER  45  16.605   7.573  -7.852
  296    HB3  SER  45           2HB      SER  45  16.630   7.909  -6.121
  297    HG   SER  45           HG       SER  45  16.646   5.846  -5.772
  298    H    GLY  46           H        GLY  46  12.996   5.894  -6.651
  299    HA2  GLY  46           1HA      GLY  46  12.832   4.932  -4.286
  300    HA3  GLY  46           2HA      GLY  46  12.462   6.590  -3.836
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1  -4.691  -4.249 -25.370
    2    HA2  GLY   1           1HA      GLY   1  -4.365  -5.979 -23.891
    3    HA3  GLY   1           2HA      GLY   1  -3.462  -4.855 -22.887
    4    H    SER   2           H        SER   2  -4.444  -3.884 -21.151
    5    HA   SER   2           HA       SER   2  -5.827  -4.061 -19.307
    6    HB2  SER   2           1HB      SER   2  -6.690  -2.228 -20.957
    7    HB3  SER   2           2HB      SER   2  -8.033  -3.342 -21.213
    8    HG   SER   2           HG       SER   2  -7.268  -1.981 -18.873
    9    H    SER   3           H        SER   3  -5.480  -6.602 -20.360
   10    HA   SER   3           HA       SER   3  -7.689  -8.067 -21.086
   11    HB2  SER   3           1HB      SER   3  -5.186  -8.767 -20.653
   12    HB3  SER   3           2HB      SER   3  -5.805  -9.231 -19.069
   13    HG   SER   3           HG       SER   3  -5.844 -10.774 -21.025
   14    H    GLY   4           H        GLY   4  -6.513  -7.726 -17.728
   15    HA2  GLY   4           1HA      GLY   4  -7.993  -7.110 -15.933
   16    HA3  GLY   4           2HA      GLY   4  -9.321  -7.819 -16.841
   17    H    SER   5           H        SER   5  -7.454  -8.251 -14.207
   18    HA   SER   5           HA       SER   5  -7.106 -11.120 -14.399
   19    HB2  SER   5           1HB      SER   5  -6.558  -9.124 -12.198
   20    HB3  SER   5           2HB      SER   5  -6.311 -10.859 -12.003
   21    HG   SER   5           HG       SER   5  -5.177  -9.698 -14.253
   22    H    SER   6           H        SER   6  -8.118 -12.646 -13.034
   23    HA   SER   6           HA       SER   6 -10.776 -12.744 -12.874
   24    HB2  SER   6           1HB      SER   6  -8.867 -13.744 -10.750
   25    HB3  SER   6           2HB      SER   6 -10.559 -14.226 -10.868
   26    HG   SER   6           HG       SER   6  -8.513 -15.292 -12.113
   27    H    GLY   7           H        GLY   7  -8.749 -11.312 -10.323
   28    HA2  GLY   7           1HA      GLY   7  -9.232  -9.747  -8.714
   29    HA3  GLY   7           2HA      GLY   7 -10.564  -9.242  -9.743
   30    H    THR   8           H        THR   8  -9.791 -12.107  -7.761
   31    HA   THR   8           HA       THR   8 -12.567 -12.318  -6.956
   32    HB   THR   8           HB       THR   8 -10.214 -14.004  -6.080
   33    HG1  THR   8           HG1      THR   8 -12.120 -14.865  -7.957
   34   HG21  THR   8          3HG2      THR   8 -11.736 -14.745  -4.598
   35   HG22  THR   8          1HG2      THR   8 -12.451 -15.571  -5.981
   36   HG23  THR   8          2HG2      THR   8 -13.082 -14.007  -5.466
   37    H    GLY   9           H        GLY   9  -9.446 -12.091  -5.230
   38    HA2  GLY   9           1HA      GLY   9 -10.846 -10.563  -3.131
   39    HA3  GLY   9           2HA      GLY   9  -9.787 -11.899  -2.705
   40    H    GLU  10           H        GLU  10  -9.871  -8.729  -4.268
   41    HA   GLU  10           HA       GLU  10  -7.076  -8.410  -4.495
   42    HB2  GLU  10           1HB      GLU  10  -8.827  -7.059  -5.694
   43    HB3  GLU  10           2HB      GLU  10  -9.122  -6.211  -4.182
   44    HG2  GLU  10           1HG      GLU  10  -7.690  -4.824  -5.403
   45    HG3  GLU  10           2HG      GLU  10  -6.664  -5.607  -4.202
   46    H    LYS  11           H        LYS  11  -5.693  -6.986  -3.275
   47    HA   LYS  11           HA       LYS  11  -5.693  -7.490  -0.531
   48    HB2  LYS  11           1HB      LYS  11  -4.184  -5.681  -2.347
   49    HB3  LYS  11           2HB      LYS  11  -4.097  -5.346  -0.623
   50    HG2  LYS  11           1HG      LYS  11  -2.270  -6.716  -0.994
   51    HG3  LYS  11           2HG      LYS  11  -3.492  -7.835  -0.385
   52    HD2  LYS  11           1HD      LYS  11  -4.065  -8.242  -2.853
   53    HD3  LYS  11           2HD      LYS  11  -2.522  -7.459  -3.203
   54    HE2  LYS  11           1HE      LYS  11  -1.817  -9.622  -3.083
   55    HE3  LYS  11           2HE      LYS  11  -1.658  -9.179  -1.384
   56    HZ1  LYS  11           3HZ      LYS  11  -3.522 -11.002  -2.655
   57    HZ2  LYS  11           1HZ      LYS  11  -4.184 -10.015  -1.450
   58    HZ3  LYS  11           2HZ      LYS  11  -2.877 -11.027  -1.091
   59    HA   PRO  12           HA       PRO  12  -8.753  -4.571   0.836
   60    HB2  PRO  12           1HB      PRO  12  -8.387  -4.981   3.495
   61    HB3  PRO  12           2HB      PRO  12  -9.267  -6.113   2.460
   62    HG2  PRO  12           1HG      PRO  12  -6.435  -6.235   3.424
   63    HG3  PRO  12           2HG      PRO  12  -7.640  -7.533   3.324
   64    HD2  PRO  12           1HD      PRO  12  -5.686  -7.213   1.477
   65    HD3  PRO  12           2HD      PRO  12  -7.290  -7.854   1.068
   66    H    TYR  13           H        TYR  13  -5.476  -4.239   0.897
   67    HA   TYR  13           HA       TYR  13  -5.683  -1.524   1.965
   68    HB2  TYR  13           1HB      TYR  13  -3.729  -3.622   2.896
   69    HB3  TYR  13           2HB      TYR  13  -3.416  -1.901   3.091
   70    HD1  TYR  13           HD2      TYR  13  -4.777  -0.555   4.622
   71    HD2  TYR  13           HD1      TYR  13  -5.382  -4.749   4.242
   72    HE1  TYR  13           HE2      TYR  13  -6.075  -0.551   6.711
   73    HE2  TYR  13           HE1      TYR  13  -6.683  -4.757   6.329
   74    HH   TYR  13           HH       TYR  13  -7.641  -1.815   7.907
   75    H    ASN  14           H        ASN  14  -4.069  -0.084   1.192
   76    HA   ASN  14           HA       ASN  14  -2.104  -0.967  -0.706
   77    HB2  ASN  14           1HB      ASN  14  -4.097   0.924  -1.885
   78    HB3  ASN  14           2HB      ASN  14  -3.009  -0.202  -2.692
   79   HD21  ASN  14          1HD2      ASN  14  -3.686  -2.230  -3.140
   80   HD22  ASN  14          2HD2      ASN  14  -5.278  -2.813  -2.807
   81    H    CYS  15           H        CYS  15  -0.844   0.861  -1.589
   82    HA   CYS  15           HA       CYS  15  -0.851   3.118   0.301
   83    HB2  CYS  15           1HB      CYS  15   1.166   1.632   0.308
   84    HB3  CYS  15           2HB      CYS  15   1.466   2.108  -1.360
   85    H    GLU  16           H        GLU  16  -1.623   4.939  -0.517
   86    HA   GLU  16           HA       GLU  16  -1.937   5.355  -3.324
   87    HB2  GLU  16           1HB      GLU  16  -2.545   6.902  -0.851
   88    HB3  GLU  16           2HB      GLU  16  -2.470   7.779  -2.372
   89    HG2  GLU  16           1HG      GLU  16  -4.231   6.509  -3.302
   90    HG3  GLU  16           2HG      GLU  16  -4.170   5.336  -1.988
   91    H    GLU  17           H        GLU  17   0.624   5.841  -1.169
   92    HA   GLU  17           HA       GLU  17   1.799   8.139  -2.392
   93    HB2  GLU  17           1HB      GLU  17   3.155   6.020  -0.717
   94    HB3  GLU  17           2HB      GLU  17   3.743   7.646  -1.035
   95    HG2  GLU  17           1HG      GLU  17   1.150   7.117   0.380
   96    HG3  GLU  17           2HG      GLU  17   2.692   7.233   1.226
   97    H    CYS  18           H        CYS  18   2.471   4.650  -2.565
   98    HA   CYS  18           HA       CYS  18   3.988   5.155  -5.041
   99    HB2  CYS  18           1HB      CYS  18   5.164   3.010  -4.551
  100    HB3  CYS  18           2HB      CYS  18   5.448   4.258  -3.342
  101    H    GLY  19           H        GLY  19   1.894   2.777  -3.418
  102    HA2  GLY  19           1HA      GLY  19  -0.121   2.128  -4.725
  103    HA3  GLY  19           2HA      GLY  19   0.961   1.946  -6.097
  104    H    LYS  20           H        LYS  20   1.776   0.936  -2.843
  105    HA   LYS  20           HA       LYS  20   2.050  -1.804  -3.810
  106    HB2  LYS  20           1HB      LYS  20   3.817  -0.462  -2.439
  107    HB3  LYS  20           2HB      LYS  20   2.817  -0.891  -1.057
  108    HG2  LYS  20           1HG      LYS  20   3.128  -3.240  -1.508
  109    HG3  LYS  20           2HG      LYS  20   4.029  -2.867  -2.979
  110    HD2  LYS  20           1HD      LYS  20   5.738  -1.732  -1.620
  111    HD3  LYS  20           2HD      LYS  20   4.843  -2.157  -0.159
  112    HE2  LYS  20           1HE      LYS  20   5.051  -4.585  -1.042
  113    HE3  LYS  20           2HE      LYS  20   6.343  -3.932  -2.048
  114    HZ1  LYS  20           3HZ      LYS  20   6.339  -3.407   0.848
  115    HZ2  LYS  20           1HZ      LYS  20   7.644  -3.462  -0.228
  116    HZ3  LYS  20           2HZ      LYS  20   6.896  -4.896   0.268
  117    H    ALA  21           H        ALA  21   0.579  -3.310  -3.404
  118    HA   ALA  21           HA       ALA  21  -1.647  -2.737  -1.655
  119    HB1  ALA  21           3HB      ALA  21  -2.401  -3.808  -3.540
  120    HB2  ALA  21           1HB      ALA  21  -0.997  -4.872  -3.630
  121    HB3  ALA  21           2HB      ALA  21  -2.252  -5.167  -2.426
  122    H    PHE  22           H        PHE  22  -2.292  -4.002   0.128
  123    HA   PHE  22           HA       PHE  22  -0.296  -5.843   1.229
  124    HB2  PHE  22           1HB      PHE  22  -1.450  -3.441   2.650
  125    HB3  PHE  22           2HB      PHE  22  -0.653  -4.766   3.491
  126    HD1  PHE  22           HD2      PHE  22  -0.194  -1.889   1.289
  127    HD2  PHE  22           HD1      PHE  22   1.736  -5.092   3.323
  128    HE1  PHE  22           HE2      PHE  22   1.985  -0.812   0.910
  129    HE2  PHE  22           HE1      PHE  22   3.918  -4.019   2.948
  130    HZ   PHE  22           HZ       PHE  22   4.045  -1.877   1.739
  131    H    ILE  23           H        ILE  23  -1.162  -7.109   3.077
  132    HA   ILE  23           HA       ILE  23  -3.926  -7.862   2.515
  133    HB   ILE  23           HB       ILE  23  -1.874  -9.249   4.245
  134   HG12  ILE  23          1HG1      ILE  23  -2.845 -10.137   1.535
  135   HG13  ILE  23          2HG1      ILE  23  -1.455  -9.072   1.712
  136   HG21  ILE  23          1HG2      ILE  23  -4.548 -10.207   3.232
  137   HG22  ILE  23          2HG2      ILE  23  -3.397 -11.151   4.175
  138   HG23  ILE  23          3HG2      ILE  23  -4.180  -9.744   4.893
  139   HD11  ILE  23          3HD1      ILE  23  -0.177 -10.710   2.740
  140   HD12  ILE  23          1HD1      ILE  23  -1.588 -11.677   3.171
  141   HD13  ILE  23          2HD1      ILE  23  -1.056 -11.592   1.491
  142    H    HIS  24           H        HIS  24  -1.878  -7.068   5.314
  143    HA   HIS  24           HA       HIS  24  -4.332  -6.455   6.825
  144    HB2  HIS  24           1HB      HIS  24  -1.628  -7.367   7.823
  145    HB3  HIS  24           2HB      HIS  24  -2.938  -6.832   8.871
  146    HD2  HIS  24           HD2      HIS  24  -1.725 -10.001   7.118
  147    HE1  HIS  24           HE1      HIS  24  -5.622 -10.814   8.584
  148    HE2  HIS  24           HE2      HIS  24  -3.498 -11.804   7.662
  149    H    ASP  25           H        ASP  25  -4.237  -4.650   8.300
  150    HA   ASP  25           HA       ASP  25  -3.210  -2.317   7.147
  151    HB2  ASP  25           1HB      ASP  25  -3.666  -1.372   9.535
  152    HB3  ASP  25           2HB      ASP  25  -5.017  -1.945   8.561
  153    H    SER  26           H        SER  26  -2.139  -3.954  10.132
  154    HA   SER  26           HA       SER  26   0.002  -2.426  10.818
  155    HB2  SER  26           1HB      SER  26   0.961  -4.379  11.889
  156    HB3  SER  26           2HB      SER  26  -0.793  -4.440  12.059
  157    HG   SER  26           HG       SER  26   0.634  -5.779  10.008
  158    H    GLN  27           H        GLN  27  -0.179  -4.742   8.190
  159    HA   GLN  27           HA       GLN  27   2.597  -4.775   7.590
  160    HB2  GLN  27           1HB      GLN  27   0.163  -5.477   5.950
  161    HB3  GLN  27           2HB      GLN  27   1.809  -5.686   5.367
  162    HG2  GLN  27           1HG      GLN  27   2.099  -7.041   7.585
  163    HG3  GLN  27           2HG      GLN  27   0.344  -7.173   7.487
  164   HE21  GLN  27          1HE2      GLN  27   0.220  -9.314   7.036
  165   HE22  GLN  27          2HE2      GLN  27   0.820 -10.029   5.582
  166    H    LEU  28           H        LEU  28  -0.147  -2.937   6.304
  167    HA   LEU  28           HA       LEU  28   1.366  -1.542   4.345
  168    HB2  LEU  28           1HB      LEU  28  -0.956  -1.683   3.993
  169    HB3  LEU  28           2HB      LEU  28  -1.317  -1.082   5.610
  170    HG   LEU  28           HG       LEU  28  -0.419   1.141   4.899
  171   HD11  LEU  28          1HD1      LEU  28   0.414   1.541   2.856
  172   HD12  LEU  28          2HD1      LEU  28  -0.754   0.487   2.059
  173   HD13  LEU  28          3HD1      LEU  28   0.682  -0.202   2.816
  174   HD21  LEU  28          3HD2      LEU  28  -2.613   1.475   4.733
  175   HD22  LEU  28          1HD2      LEU  28  -2.884  -0.152   4.108
  176   HD23  LEU  28          2HD2      LEU  28  -2.450   1.155   3.006
  177    H    GLN  29           H        GLN  29   0.198  -0.651   7.582
  178    HA   GLN  29           HA       GLN  29   1.172   1.955   7.655
  179    HB2  GLN  29           1HB      GLN  29   1.125   0.127  10.049
  180    HB3  GLN  29           2HB      GLN  29   0.893   1.870  10.010
  181    HG2  GLN  29           1HG      GLN  29  -1.007  -0.315   9.403
  182    HG3  GLN  29           2HG      GLN  29  -1.261   1.210  10.252
  183   HE21  GLN  29          1HE2      GLN  29  -0.352   3.016   8.410
  184   HE22  GLN  29          2HE2      GLN  29  -1.367   2.984   7.012
  185    H    GLU  30           H        GLU  30   2.765  -1.085   8.536
  186    HA   GLU  30           HA       GLU  30   5.153   0.063   9.498
  187    HB2  GLU  30           1HB      GLU  30   4.321  -2.333   9.796
  188    HB3  GLU  30           2HB      GLU  30   4.951  -2.641   8.184
  189    HG2  GLU  30           1HG      GLU  30   6.636  -3.345   9.633
  190    HG3  GLU  30           2HG      GLU  30   7.172  -1.771   9.049
  191    H    HIS  31           H        HIS  31   3.892  -0.046   6.391
  192    HA   HIS  31           HA       HIS  31   6.532   0.073   5.117
  193    HB2  HIS  31           1HB      HIS  31   5.286  -1.373   3.825
  194    HB3  HIS  31           2HB      HIS  31   3.773  -0.530   4.149
  195    HD1  HIS  31           HD1      HIS  31   6.891  -0.217   2.035
  196    HD2  HIS  31           HD2      HIS  31   3.023   1.286   2.238
  197    HE1  HIS  31           HE1      HIS  31   6.569   1.097  -0.084
  198    H    GLN  32           H        GLN  32   3.508   1.894   5.426
  199    HA   GLN  32           HA       GLN  32   4.101   4.066   3.820
  200    HB2  GLN  32           1HB      GLN  32   2.479   3.834   6.345
  201    HB3  GLN  32           2HB      GLN  32   2.614   5.354   5.470
  202    HG2  GLN  32           1HG      GLN  32   1.662   4.314   3.488
  203    HG3  GLN  32           2HG      GLN  32   1.553   2.774   4.339
  204   HE21  GLN  32          1HE2      GLN  32  -0.726   3.032   3.663
  205   HE22  GLN  32          2HE2      GLN  32  -1.789   3.899   4.713
  206    H    ARG  33           H        ARG  33   5.425   3.185   6.883
  207    HA   ARG  33           HA       ARG  33   6.307   5.664   7.823
  208    HB2  ARG  33           1HB      ARG  33   8.147   4.252   8.926
  209    HB3  ARG  33           2HB      ARG  33   6.477   3.883   9.335
  210    HG2  ARG  33           1HG      ARG  33   6.494   1.887   8.206
  211    HG3  ARG  33           2HG      ARG  33   7.779   2.397   7.109
  212    HD2  ARG  33           1HD      ARG  33   8.176   1.881  10.051
  213    HD3  ARG  33           2HD      ARG  33   8.460   0.678   8.793
  214    HE   ARG  33           HE       ARG  33   9.917   2.954   8.125
  215   HH11  ARG  33          1HH1      ARG  33   9.842   0.536  10.628
  216   HH12  ARG  33          2HH1      ARG  33  11.539   0.640  10.961
  217   HH21  ARG  33          1HH2      ARG  33  12.153   3.101   8.554
  218   HH22  ARG  33          2HH2      ARG  33  12.852   2.101   9.782
  219    H    ILE  34           H        ILE  34   7.498   3.641   5.268
  220    HA   ILE  34           HA       ILE  34  10.116   4.673   5.072
  221    HB   ILE  34           HB       ILE  34  10.293   3.583   3.014
  222   HG12  ILE  34          1HG1      ILE  34   7.278   3.693   2.769
  223   HG13  ILE  34          2HG1      ILE  34   8.407   4.739   1.914
  224   HG21  ILE  34          1HG2      ILE  34   8.306   1.656   3.611
  225   HG22  ILE  34          2HG2      ILE  34  10.032   1.599   3.967
  226   HG23  ILE  34          3HG2      ILE  34   8.913   2.294   5.139
  227   HD11  ILE  34          3HD1      ILE  34   8.077   1.769   1.596
  228   HD12  ILE  34          1HD1      ILE  34   7.684   3.028   0.425
  229   HD13  ILE  34          2HD1      ILE  34   9.367   2.709   0.847
  230    H    HIS  35           H        HIS  35   7.031   5.727   3.752
  231    HA   HIS  35           HA       HIS  35   8.164   7.732   2.049
  232    HB2  HIS  35           1HB      HIS  35   5.339   7.293   3.031
  233    HB3  HIS  35           2HB      HIS  35   5.795   8.520   1.852
  234    HD1  HIS  35           HD1      HIS  35   6.474   7.690  -0.517
  235    HD2  HIS  35           HD2      HIS  35   5.201   4.688   2.057
  236    HE1  HIS  35           HE1      HIS  35   6.068   5.682  -1.975
  237    H    THR  36           H        THR  36   6.448   7.801   5.163
  238    HA   THR  36           HA       THR  36   6.359  10.493   5.649
  239    HB   THR  36           HB       THR  36   6.245  10.028   7.983
  240    HG1  THR  36           HG1      THR  36   8.027   8.787   8.384
  241   HG21  THR  36          3HG2      THR  36   4.590   8.322   8.084
  242   HG22  THR  36          1HG2      THR  36   5.239   7.515   6.658
  243   HG23  THR  36          2HG2      THR  36   4.437   9.078   6.498
  244    H    GLY  37           H        GLY  37   9.106   8.312   6.164
  245    HA2  GLY  37           1HA      GLY  37  10.846  10.014   7.479
  246    HA3  GLY  37           2HA      GLY  37  11.352   8.752   6.366
  247    H    GLU  38           H        GLU  38  11.387   9.310   4.051
  248    HA   GLU  38           HA       GLU  38  12.793  11.728   3.627
  249    HB2  GLU  38           1HB      GLU  38  11.807   9.506   1.905
  250    HB3  GLU  38           2HB      GLU  38  12.255  11.014   1.120
  251    HG2  GLU  38           1HG      GLU  38  14.202   9.775   1.033
  252    HG3  GLU  38           2HG      GLU  38  14.449  10.807   2.440
  253    H    LYS  39           H        LYS  39  11.800  13.636   3.818
  254    HA   LYS  39           HA       LYS  39   9.260  14.017   2.371
  255    HB2  LYS  39           1HB      LYS  39   8.766  15.814   4.044
  256    HB3  LYS  39           2HB      LYS  39   8.804  14.190   4.718
  257    HG2  LYS  39           1HG      LYS  39  10.014  15.275   6.300
  258    HG3  LYS  39           2HG      LYS  39  11.322  14.838   5.199
  259    HD2  LYS  39           1HD      LYS  39  11.743  17.079   5.581
  260    HD3  LYS  39           2HD      LYS  39  10.798  17.133   4.091
  261    HE2  LYS  39           1HE      LYS  39   9.827  18.786   5.412
  262    HE3  LYS  39           2HE      LYS  39   8.763  17.399   5.640
  263    HZ1  LYS  39           3HZ      LYS  39  10.705  17.185   7.584
  264    HZ2  LYS  39           1HZ      LYS  39   9.091  17.641   7.804
  265    HZ3  LYS  39           2HZ      LYS  39  10.278  18.822   7.568
  266    HA   PRO  40           HA       PRO  40  11.380  17.047  -0.025
  267    HB2  PRO  40           1HB      PRO  40   9.228  18.434  -0.929
  268    HB3  PRO  40           2HB      PRO  40   9.661  16.831  -1.535
  269    HG2  PRO  40           1HG      PRO  40   7.603  17.595   0.501
  270    HG3  PRO  40           2HG      PRO  40   7.485  16.423  -0.824
  271    HD2  PRO  40           1HD      PRO  40   7.942  15.682   1.740
  272    HD3  PRO  40           2HD      PRO  40   8.601  14.787   0.356
  273    H    SER  41           H        SER  41  10.655  19.626  -0.476
  274    HA   SER  41           HA       SER  41  11.796  21.155   1.381
  275    HB2  SER  41           1HB      SER  41   9.361  21.794  -0.279
  276    HB3  SER  41           2HB      SER  41  10.144  23.008   0.733
  277    HG   SER  41           HG       SER  41  10.883  22.063  -1.687
  278    H    GLY  42           H        GLY  42   8.237  21.166   1.374
  279    HA2  GLY  42           1HA      GLY  42   8.009  20.392   4.109
  280    HA3  GLY  42           2HA      GLY  42   7.889  22.137   3.934
  281    HA   PRO  43           HA       PRO  43   4.129  20.031   1.665
  282    HB2  PRO  43           1HB      PRO  43   3.495  17.575   2.632
  283    HB3  PRO  43           2HB      PRO  43   4.576  17.815   1.254
  284    HG2  PRO  43           1HG      PRO  43   5.252  17.285   4.122
  285    HG3  PRO  43           2HG      PRO  43   5.972  16.594   2.657
  286    HD2  PRO  43           1HD      PRO  43   7.142  18.601   4.047
  287    HD3  PRO  43           2HD      PRO  43   7.300  18.441   2.286
  288    H    SER  44           H        SER  44   4.564  18.838   5.002
  289    HA   SER  44           HA       SER  44   2.781  20.699   6.143
  290    HB2  SER  44           1HB      SER  44   0.942  19.116   6.748
  291    HB3  SER  44           2HB      SER  44   1.029  19.461   5.020
  292    HG   SER  44           HG       SER  44   0.791  17.244   5.345
  293    H    SER  45           H        SER  45   3.380  20.888   8.194
  294    HA   SER  45           HA       SER  45   4.993  18.784   9.397
  295    HB2  SER  45           1HB      SER  45   4.401  21.631  10.220
  296    HB3  SER  45           2HB      SER  45   5.356  20.520  11.201
  297    HG   SER  45           HG       SER  45   5.934  21.402   8.566
  298    H    GLY  46           H        GLY  46   3.938  17.218  10.429
  299    HA2  GLY  46           1HA      GLY  46   2.602  17.433  12.780
  300    HA3  GLY  46           2HA      GLY  46   1.330  17.655  11.587
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1  10.298  -7.916 -22.254
    2    HA2  GLY   1           1HA      GLY   1   7.575  -7.447 -22.723
    3    HA3  GLY   1           2HA      GLY   1   8.239  -8.884 -21.961
    4    H    SER   2           H        SER   2   6.219  -6.294 -21.529
    5    HA   SER   2           HA       SER   2   6.345  -6.596 -18.601
    6    HB2  SER   2           1HB      SER   2   7.166  -4.347 -19.528
    7    HB3  SER   2           2HB      SER   2   5.482  -4.043 -19.954
    8    HG   SER   2           HG       SER   2   6.671  -4.274 -17.424
    9    H    SER   3           H        SER   3   4.565  -7.495 -17.831
   10    HA   SER   3           HA       SER   3   1.967  -6.746 -18.934
   11    HB2  SER   3           1HB      SER   3   2.951  -8.940 -19.979
   12    HB3  SER   3           2HB      SER   3   2.483  -9.659 -18.438
   13    HG   SER   3           HG       SER   3   0.368  -9.094 -18.835
   14    H    GLY   4           H        GLY   4   0.227  -7.025 -17.500
   15    HA2  GLY   4           1HA      GLY   4   0.849  -6.685 -14.769
   16    HA3  GLY   4           2HA      GLY   4  -0.757  -6.960 -15.427
   17    H    SER   5           H        SER   5  -1.154  -8.219 -13.503
   18    HA   SER   5           HA       SER   5  -0.666 -11.008 -13.943
   19    HB2  SER   5           1HB      SER   5   0.594 -11.519 -11.989
   20    HB3  SER   5           2HB      SER   5   1.432 -10.174 -12.763
   21    HG   SER   5           HG       SER   5   1.018 -10.048 -10.401
   22    H    SER   6           H        SER   6  -1.542 -12.276 -11.921
   23    HA   SER   6           HA       SER   6  -3.746 -10.858 -10.634
   24    HB2  SER   6           1HB      SER   6  -4.439 -11.980 -12.887
   25    HB3  SER   6           2HB      SER   6  -4.342 -13.482 -11.968
   26    HG   SER   6           HG       SER   6  -5.941 -12.767 -10.630
   27    H    GLY   7           H        GLY   7  -4.323 -11.683  -8.661
   28    HA2  GLY   7           1HA      GLY   7  -2.762 -14.022  -7.750
   29    HA3  GLY   7           2HA      GLY   7  -3.134 -12.643  -6.727
   30    H    THR   8           H        THR   8  -3.783 -14.847  -5.566
   31    HA   THR   8           HA       THR   8  -6.134 -16.177  -6.192
   32    HB   THR   8           HB       THR   8  -4.646 -16.943  -4.413
   33    HG1  THR   8           HG1      THR   8  -7.370 -16.510  -3.963
   34   HG21  THR   8          3HG2      THR   8  -5.743 -14.754  -2.664
   35   HG22  THR   8          1HG2      THR   8  -4.223 -14.586  -3.541
   36   HG23  THR   8          2HG2      THR   8  -4.407 -15.856  -2.332
   37    H    GLY   9           H        GLY   9  -5.679 -13.189  -4.336
   38    HA2  GLY   9           1HA      GLY   9  -8.501 -12.551  -4.822
   39    HA3  GLY   9           2HA      GLY   9  -7.917 -12.529  -3.164
   40    H    GLU  10           H        GLU  10  -8.413 -10.314  -2.975
   41    HA   GLU  10           HA       GLU  10  -6.459  -8.568  -4.313
   42    HB2  GLU  10           1HB      GLU  10  -8.769  -8.328  -5.271
   43    HB3  GLU  10           2HB      GLU  10  -9.308  -7.784  -3.688
   44    HG2  GLU  10           1HG      GLU  10  -8.828  -5.970  -5.338
   45    HG3  GLU  10           2HG      GLU  10  -7.977  -5.833  -3.801
   46    H    LYS  11           H        LYS  11  -5.408  -7.155  -3.029
   47    HA   LYS  11           HA       LYS  11  -5.595  -7.469  -0.201
   48    HB2  LYS  11           1HB      LYS  11  -4.000  -5.630  -1.978
   49    HB3  LYS  11           2HB      LYS  11  -3.917  -5.536  -0.224
   50    HG2  LYS  11           1HG      LYS  11  -2.102  -6.865  -0.816
   51    HG3  LYS  11           2HG      LYS  11  -3.329  -8.022  -0.298
   52    HD2  LYS  11           1HD      LYS  11  -3.699  -8.791  -2.430
   53    HD3  LYS  11           2HD      LYS  11  -3.194  -7.275  -3.179
   54    HE2  LYS  11           1HE      LYS  11  -1.270  -9.083  -1.741
   55    HE3  LYS  11           2HE      LYS  11  -1.645  -9.276  -3.453
   56    HZ1  LYS  11           3HZ      LYS  11   0.366  -7.910  -2.952
   57    HZ2  LYS  11           1HZ      LYS  11  -0.655  -6.737  -2.286
   58    HZ3  LYS  11           2HZ      LYS  11  -0.783  -7.139  -3.924
   59    HA   PRO  12           HA       PRO  12  -8.816  -4.446   0.380
   60    HB2  PRO  12           1HB      PRO  12  -8.859  -4.606   3.090
   61    HB3  PRO  12           2HB      PRO  12  -9.596  -5.825   2.044
   62    HG2  PRO  12           1HG      PRO  12  -6.943  -5.872   3.429
   63    HG3  PRO  12           2HG      PRO  12  -8.144  -7.166   3.270
   64    HD2  PRO  12           1HD      PRO  12  -5.931  -7.033   1.715
   65    HD3  PRO  12           2HD      PRO  12  -7.469  -7.701   1.132
   66    H    TYR  13           H        TYR  13  -5.581  -4.126   0.895
   67    HA   TYR  13           HA       TYR  13  -5.903  -1.340   1.759
   68    HB2  TYR  13           1HB      TYR  13  -4.052  -3.397   2.944
   69    HB3  TYR  13           2HB      TYR  13  -3.692  -1.677   3.043
   70    HD1  TYR  13           HD2      TYR  13  -5.109  -0.186   4.381
   71    HD2  TYR  13           HD1      TYR  13  -5.822  -4.379   4.251
   72    HE1  TYR  13           HE2      TYR  13  -6.540   0.001   6.372
   73    HE2  TYR  13           HE1      TYR  13  -7.257  -4.203   6.241
   74    HH   TYR  13           HH       TYR  13  -7.438  -1.311   8.125
   75    H    ASN  14           H        ASN  14  -4.168   0.064   1.115
   76    HA   ASN  14           HA       ASN  14  -2.092  -0.877  -0.618
   77    HB2  ASN  14           1HB      ASN  14  -4.001   0.968  -2.000
   78    HB3  ASN  14           2HB      ASN  14  -2.838  -0.160  -2.692
   79   HD21  ASN  14          1HD2      ASN  14  -3.442  -2.221  -3.117
   80   HD22  ASN  14          2HD2      ASN  14  -5.050  -2.816  -2.903
   81    H    CYS  15           H        CYS  15  -0.627   0.795  -1.250
   82    HA   CYS  15           HA       CYS  15  -0.727   3.085   0.561
   83    HB2  CYS  15           1HB      CYS  15   1.305   1.568   0.370
   84    HB3  CYS  15           2HB      CYS  15   1.568   2.272  -1.222
   85    H    GLU  16           H        GLU  16  -1.707   4.837  -0.208
   86    HA   GLU  16           HA       GLU  16  -2.093   5.380  -2.954
   87    HB2  GLU  16           1HB      GLU  16  -2.320   7.190  -0.545
   88    HB3  GLU  16           2HB      GLU  16  -2.859   7.617  -2.162
   89    HG2  GLU  16           1HG      GLU  16  -3.891   5.244  -0.634
   90    HG3  GLU  16           2HG      GLU  16  -4.654   6.833  -0.617
   91    H    GLU  17           H        GLU  17   0.587   5.820  -0.930
   92    HA   GLU  17           HA       GLU  17   1.695   8.142  -2.168
   93    HB2  GLU  17           1HB      GLU  17   3.106   5.982  -0.593
   94    HB3  GLU  17           2HB      GLU  17   3.729   7.586  -0.950
   95    HG2  GLU  17           1HG      GLU  17   1.586   8.394   0.285
   96    HG3  GLU  17           2HG      GLU  17   1.596   6.767   0.964
   97    H    CYS  18           H        CYS  18   2.601   4.694  -2.332
   98    HA   CYS  18           HA       CYS  18   3.897   5.243  -4.915
   99    HB2  CYS  18           1HB      CYS  18   5.104   3.092  -4.519
  100    HB3  CYS  18           2HB      CYS  18   5.443   4.327  -3.311
  101    H    GLY  19           H        GLY  19   1.869   2.844  -3.243
  102    HA2  GLY  19           1HA      GLY  19  -0.188   2.194  -4.470
  103    HA3  GLY  19           2HA      GLY  19   0.831   2.048  -5.894
  104    H    LYS  20           H        LYS  20   1.493   0.949  -2.594
  105    HA   LYS  20           HA       LYS  20   1.873  -1.758  -3.659
  106    HB2  LYS  20           1HB      LYS  20   3.622  -0.396  -2.238
  107    HB3  LYS  20           2HB      LYS  20   2.656  -0.966  -0.883
  108    HG2  LYS  20           1HG      LYS  20   3.127  -3.224  -1.365
  109    HG3  LYS  20           2HG      LYS  20   3.780  -2.825  -2.956
  110    HD2  LYS  20           1HD      LYS  20   5.014  -1.793  -0.416
  111    HD3  LYS  20           2HD      LYS  20   5.455  -3.357  -1.104
  112    HE2  LYS  20           1HE      LYS  20   5.488  -0.958  -2.867
  113    HE3  LYS  20           2HE      LYS  20   6.793  -1.164  -1.700
  114    HZ1  LYS  20           3HZ      LYS  20   6.762  -3.579  -2.749
  115    HZ2  LYS  20           1HZ      LYS  20   7.668  -2.317  -3.419
  116    HZ3  LYS  20           2HZ      LYS  20   6.166  -2.725  -4.082
  117    H    ALA  21           H        ALA  21   0.332  -3.209  -3.344
  118    HA   ALA  21           HA       ALA  21  -1.885  -2.709  -1.605
  119    HB1  ALA  21           3HB      ALA  21  -1.239  -4.546  -3.732
  120    HB2  ALA  21           1HB      ALA  21  -2.003  -5.383  -2.381
  121    HB3  ALA  21           2HB      ALA  21  -2.815  -4.015  -3.144
  122    H    PHE  22           H        PHE  22  -2.497  -3.832   0.249
  123    HA   PHE  22           HA       PHE  22  -0.513  -5.629   1.444
  124    HB2  PHE  22           1HB      PHE  22  -1.705  -3.194   2.783
  125    HB3  PHE  22           2HB      PHE  22  -0.823  -4.456   3.637
  126    HD1  PHE  22           HD1      PHE  22   1.579  -4.738   3.303
  127    HD2  PHE  22           HD2      PHE  22  -0.573  -1.581   1.428
  128    HE1  PHE  22           HE1      PHE  22   3.698  -3.584   2.820
  129    HE2  PHE  22           HE2      PHE  22   1.542  -0.423   0.941
  130    HZ   PHE  22           HZ       PHE  22   3.682  -1.425   1.637
  131    H    ILE  23           H        ILE  23  -1.346  -7.230   2.729
  132    HA   ILE  23           HA       ILE  23  -4.168  -7.745   2.448
  133    HB   ILE  23           HB       ILE  23  -2.011  -9.321   3.856
  134   HG12  ILE  23          1HG1      ILE  23  -3.408 -10.000   1.273
  135   HG13  ILE  23          2HG1      ILE  23  -1.944  -9.023   1.307
  136   HG21  ILE  23          1HG2      ILE  23  -3.650 -11.171   3.835
  137   HG22  ILE  23          2HG2      ILE  23  -4.153  -9.818   4.846
  138   HG23  ILE  23          3HG2      ILE  23  -4.875 -10.044   3.253
  139   HD11  ILE  23          3HD1      ILE  23  -2.005 -11.686   2.653
  140   HD12  ILE  23          1HD1      ILE  23  -1.771 -11.566   0.909
  141   HD13  ILE  23          2HD1      ILE  23  -0.632 -10.786   2.008
  142    H    HIS  24           H        HIS  24  -1.940  -6.955   5.070
  143    HA   HIS  24           HA       HIS  24  -4.270  -6.564   6.833
  144    HB2  HIS  24           1HB      HIS  24  -1.467  -7.450   7.536
  145    HB3  HIS  24           2HB      HIS  24  -2.669  -6.971   8.731
  146    HD2  HIS  24           HD2      HIS  24  -2.183  -9.849   6.077
  147    HE1  HIS  24           HE1      HIS  24  -4.905 -11.131   9.069
  148    HE2  HIS  24           HE2      HIS  24  -3.543 -11.816   7.064
  149    H    ASP  25           H        ASP  25  -4.486  -4.639   7.848
  150    HA   ASP  25           HA       ASP  25  -3.384  -2.333   6.866
  151    HB2  ASP  25           1HB      ASP  25  -4.080  -1.266   9.031
  152    HB3  ASP  25           2HB      ASP  25  -5.335  -2.231   8.259
  153    H    SER  26           H        SER  26  -2.323  -4.094   9.772
  154    HA   SER  26           HA       SER  26  -0.302  -2.482  10.651
  155    HB2  SER  26           1HB      SER  26   0.632  -4.373  11.737
  156    HB3  SER  26           2HB      SER  26  -1.095  -4.712  11.620
  157    HG   SER  26           HG       SER  26  -0.273  -6.524  10.834
  158    H    GLN  27           H        GLN  27  -0.164  -4.813   7.996
  159    HA   GLN  27           HA       GLN  27   2.586  -4.604   7.463
  160    HB2  GLN  27           1HB      GLN  27   0.255  -5.314   5.682
  161    HB3  GLN  27           2HB      GLN  27   1.930  -5.410   5.157
  162    HG2  GLN  27           1HG      GLN  27   2.196  -6.883   7.305
  163    HG3  GLN  27           2HG      GLN  27   0.456  -7.093   7.117
  164   HE21  GLN  27          1HE2      GLN  27  -0.316  -7.958   5.097
  165   HE22  GLN  27          2HE2      GLN  27   0.684  -9.036   4.190
  166    H    LEU  28           H        LEU  28  -0.175  -2.946   5.938
  167    HA   LEU  28           HA       LEU  28   1.257  -1.368   4.154
  168    HB2  LEU  28           1HB      LEU  28  -1.045  -1.406   3.844
  169    HB3  LEU  28           2HB      LEU  28  -1.376  -1.042   5.537
  170    HG   LEU  28           HG       LEU  28  -0.609   1.272   5.160
  171   HD11  LEU  28          1HD1      LEU  28  -0.738   0.962   2.229
  172   HD12  LEU  28          2HD1      LEU  28   0.714   0.350   3.020
  173   HD13  LEU  28          3HD1      LEU  28   0.248   2.039   3.218
  174   HD21  LEU  28          3HD2      LEU  28  -2.517   1.699   3.326
  175   HD22  LEU  28          1HD2      LEU  28  -2.865   1.312   5.011
  176   HD23  LEU  28          2HD2      LEU  28  -2.918   0.044   3.786
  177    H    GLN  29           H        GLN  29   0.112  -0.489   7.415
  178    HA   GLN  29           HA       GLN  29   1.205   2.050   7.556
  179    HB2  GLN  29           1HB      GLN  29   0.798   0.006   9.742
  180    HB3  GLN  29           2HB      GLN  29   1.227   1.685  10.042
  181    HG2  GLN  29           1HG      GLN  29  -1.320   0.561   8.953
  182    HG3  GLN  29           2HG      GLN  29  -1.074   1.626  10.336
  183   HE21  GLN  29          1HE2      GLN  29  -1.930   1.448   7.109
  184   HE22  GLN  29          2HE2      GLN  29  -1.854   3.130   6.724
  185    H    GLU  30           H        GLU  30   2.682  -1.032   8.541
  186    HA   GLU  30           HA       GLU  30   5.107  -0.016   9.465
  187    HB2  GLU  30           1HB      GLU  30   4.341  -2.351   9.785
  188    HB3  GLU  30           2HB      GLU  30   4.641  -2.664   8.082
  189    HG2  GLU  30           1HG      GLU  30   7.044  -1.955   8.550
  190    HG3  GLU  30           2HG      GLU  30   6.626  -2.108  10.256
  191    H    HIS  31           H        HIS  31   3.879  -0.170   6.291
  192    HA   HIS  31           HA       HIS  31   6.512  -0.028   5.045
  193    HB2  HIS  31           1HB      HIS  31   5.189  -1.317   3.674
  194    HB3  HIS  31           2HB      HIS  31   3.723  -0.424   4.069
  195    HD1  HIS  31           HD1      HIS  31   6.642  -0.426   1.743
  196    HD2  HIS  31           HD2      HIS  31   3.231   1.831   2.473
  197    HE1  HIS  31           HE1      HIS  31   6.408   1.102  -0.241
  198    H    GLN  32           H        GLN  32   3.518   1.913   5.046
  199    HA   GLN  32           HA       GLN  32   4.214   4.113   3.680
  200    HB2  GLN  32           1HB      GLN  32   2.650   3.794   6.207
  201    HB3  GLN  32           2HB      GLN  32   2.980   5.415   5.611
  202    HG2  GLN  32           1HG      GLN  32   2.054   4.461   3.364
  203    HG3  GLN  32           2HG      GLN  32   1.307   3.262   4.419
  204   HE21  GLN  32          1HE2      GLN  32  -0.505   4.525   3.190
  205   HE22  GLN  32          2HE2      GLN  32  -1.224   5.807   4.098
  206    H    ARG  33           H        ARG  33   5.588   3.114   6.707
  207    HA   ARG  33           HA       ARG  33   6.681   5.421   7.715
  208    HB2  ARG  33           1HB      ARG  33   8.250   2.854   7.584
  209    HB3  ARG  33           2HB      ARG  33   8.263   4.076   8.848
  210    HG2  ARG  33           1HG      ARG  33   5.711   3.386   9.023
  211    HG3  ARG  33           2HG      ARG  33   6.337   1.882   8.344
  212    HD2  ARG  33           1HD      ARG  33   7.428   3.246  10.802
  213    HD3  ARG  33           2HD      ARG  33   6.282   1.906  10.825
  214    HE   ARG  33           HE       ARG  33   8.286   0.884   9.377
  215   HH11  ARG  33          1HH1      ARG  33   8.267   2.604  12.403
  216   HH12  ARG  33          2HH1      ARG  33   9.675   1.803  13.017
  217   HH21  ARG  33          1HH2      ARG  33  10.141  -0.178  10.174
  218   HH22  ARG  33          2HH2      ARG  33  10.741   0.222  11.748
  219    H    ILE  34           H        ILE  34   8.031   3.336   5.176
  220    HA   ILE  34           HA       ILE  34  10.450   4.569   4.746
  221    HB   ILE  34           HB       ILE  34  10.396   3.739   2.478
  222   HG12  ILE  34          1HG1      ILE  34   7.567   2.822   2.735
  223   HG13  ILE  34          2HG1      ILE  34   7.858   4.506   2.311
  224   HG21  ILE  34          1HG2      ILE  34   9.106   1.928   4.504
  225   HG22  ILE  34          2HG2      ILE  34   9.678   1.366   2.935
  226   HG23  ILE  34          3HG2      ILE  34  10.816   2.057   4.092
  227   HD11  ILE  34          3HD1      ILE  34   7.524   3.124   0.339
  228   HD12  ILE  34          1HD1      ILE  34   9.151   3.804   0.376
  229   HD13  ILE  34          2HD1      ILE  34   8.891   2.113   0.808
  230    H    HIS  35           H        HIS  35   7.277   5.747   4.018
  231    HA   HIS  35           HA       HIS  35   8.225   7.822   2.233
  232    HB2  HIS  35           1HB      HIS  35   5.505   7.177   3.372
  233    HB3  HIS  35           2HB      HIS  35   5.807   8.575   2.345
  234    HD1  HIS  35           HD1      HIS  35   6.611   8.021  -0.143
  235    HD2  HIS  35           HD2      HIS  35   5.114   4.817   2.038
  236    HE1  HIS  35           HE1      HIS  35   6.102   6.234  -1.837
  237    H    THR  36           H        THR  36   7.271   7.466   5.582
  238    HA   THR  36           HA       THR  36   7.147  10.263   6.150
  239    HB   THR  36           HB       THR  36   6.860   9.677   8.423
  240    HG1  THR  36           HG1      THR  36   7.385   7.526   9.157
  241   HG21  THR  36          3HG2      THR  36   5.739   7.318   6.915
  242   HG22  THR  36          1HG2      THR  36   5.046   8.938   6.848
  243   HG23  THR  36          2HG2      THR  36   5.098   8.064   8.379
  244    H    GLY  37           H        GLY  37   9.614   7.752   6.503
  245    HA2  GLY  37           1HA      GLY  37  11.499   9.166   7.984
  246    HA3  GLY  37           2HA      GLY  37  11.881   7.897   6.830
  247    H    GLU  38           H        GLU  38  11.570   8.738   4.441
  248    HA   GLU  38           HA       GLU  38  12.824  11.397   4.255
  249    HB2  GLU  38           1HB      GLU  38  14.170  10.533   2.357
  250    HB3  GLU  38           2HB      GLU  38  14.551   9.752   3.885
  251    HG2  GLU  38           1HG      GLU  38  14.470   8.161   2.037
  252    HG3  GLU  38           2HG      GLU  38  13.249   7.814   3.260
  253    H    LYS  39           H        LYS  39  12.871  11.949   1.709
  254    HA   LYS  39           HA       LYS  39  10.099  11.586   0.775
  255    HB2  LYS  39           1HB      LYS  39  10.615  13.895   1.481
  256    HB3  LYS  39           2HB      LYS  39  11.933  13.947   0.318
  257    HG2  LYS  39           1HG      LYS  39  10.212  13.513  -1.472
  258    HG3  LYS  39           2HG      LYS  39   8.984  13.797  -0.236
  259    HD2  LYS  39           1HD      LYS  39  10.396  15.990   0.168
  260    HD3  LYS  39           2HD      LYS  39  10.892  15.702  -1.501
  261    HE2  LYS  39           1HE      LYS  39   8.574  15.695  -2.215
  262    HE3  LYS  39           2HE      LYS  39   8.036  15.884  -0.547
  263    HZ1  LYS  39           3HZ      LYS  39   8.781  18.058  -0.467
  264    HZ2  LYS  39           1HZ      LYS  39   8.168  17.948  -2.040
  265    HZ3  LYS  39           2HZ      LYS  39   9.836  17.870  -1.776
  266    HA   PRO  40           HA       PRO  40  11.756   9.680  -2.837
  267    HB2  PRO  40           1HB      PRO  40   9.621  10.007  -4.482
  268    HB3  PRO  40           2HB      PRO  40   9.648   8.828  -3.165
  269    HG2  PRO  40           1HG      PRO  40   8.415  11.555  -3.242
  270    HG3  PRO  40           2HG      PRO  40   7.757  10.048  -2.580
  271    HD2  PRO  40           1HD      PRO  40   8.874  11.959  -1.020
  272    HD3  PRO  40           2HD      PRO  40   8.967  10.230  -0.626
  273    H    SER  41           H        SER  41  12.062  10.144  -5.199
  274    HA   SER  41           HA       SER  41  13.471  12.446  -5.650
  275    HB2  SER  41           1HB      SER  41  13.220  11.990  -8.060
  276    HB3  SER  41           2HB      SER  41  13.548  10.511  -7.157
  277    HG   SER  41           HG       SER  41  11.857   9.892  -8.300
  278    H    GLY  42           H        GLY  42  10.201  11.888  -6.978
  279    HA2  GLY  42           1HA      GLY  42   9.547  14.688  -6.416
  280    HA3  GLY  42           2HA      GLY  42   9.463  14.148  -8.087
  281    HA   PRO  43           HA       PRO  43   5.996  11.912  -5.496
  282    HB2  PRO  43           1HB      PRO  43   5.227  13.278  -3.280
  283    HB3  PRO  43           2HB      PRO  43   6.473  12.024  -3.251
  284    HG2  PRO  43           1HG      PRO  43   6.783  15.001  -3.332
  285    HG3  PRO  43           2HG      PRO  43   7.673  13.809  -2.367
  286    HD2  PRO  43           1HD      PRO  43   8.678  14.890  -4.637
  287    HD3  PRO  43           2HD      PRO  43   9.052  13.233  -4.122
  288    H    SER  44           H        SER  44   3.767  12.317  -5.679
  289    HA   SER  44           HA       SER  44   2.997  15.066  -6.382
  290    HB2  SER  44           1HB      SER  44   3.402  13.660  -8.436
  291    HB3  SER  44           2HB      SER  44   2.071  12.627  -7.913
  292    HG   SER  44           HG       SER  44   1.418  14.267  -9.398
  293    H    SER  45           H        SER  45   1.678  11.797  -5.842
  294    HA   SER  45           HA       SER  45  -0.731  12.956  -4.682
  295    HB2  SER  45           1HB      SER  45  -1.607  10.675  -4.697
  296    HB3  SER  45           2HB      SER  45  -0.932  11.072  -6.276
  297    HG   SER  45           HG       SER  45   0.747   9.751  -5.912
  298    H    GLY  46           H        GLY  46  -0.702  13.481  -2.601
  299    HA2  GLY  46           1HA      GLY  46   1.222  12.523  -0.753
  300    HA3  GLY  46           2HA      GLY  46  -0.214  13.456  -0.356
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1 -14.781   8.888 -11.809
    2    HA2  GLY   1           1HA      GLY   1 -17.072   8.163 -13.502
    3    HA3  GLY   1           2HA      GLY   1 -15.606   8.762 -14.265
    4    H    SER   2           H        SER   2 -13.582   7.545 -13.725
    5    HA   SER   2           HA       SER   2 -14.159   4.687 -13.891
    6    HB2  SER   2           1HB      SER   2 -11.654   6.285 -14.457
    7    HB3  SER   2           2HB      SER   2 -11.736   4.526 -14.557
    8    HG   SER   2           HG       SER   2 -12.277   5.012 -16.553
    9    H    SER   3           H        SER   3 -14.171   3.578 -12.059
   10    HA   SER   3           HA       SER   3 -12.670   4.505  -9.753
   11    HB2  SER   3           1HB      SER   3 -15.040   3.634  -9.606
   12    HB3  SER   3           2HB      SER   3 -14.396   2.030  -9.958
   13    HG   SER   3           HG       SER   3 -13.339   2.021  -8.048
   14    H    GLY   4           H        GLY   4 -12.822   1.609 -11.809
   15    HA2  GLY   4           1HA      GLY   4 -10.598   0.712 -12.471
   16    HA3  GLY   4           2HA      GLY   4 -10.149   0.875 -10.779
   17    H    SER   5           H        SER   5 -11.006  -1.304 -13.053
   18    HA   SER   5           HA       SER   5 -12.904  -2.993 -12.121
   19    HB2  SER   5           1HB      SER   5 -10.193  -3.909 -13.109
   20    HB3  SER   5           2HB      SER   5 -11.697  -4.830 -13.159
   21    HG   SER   5           HG       SER   5 -10.762  -3.002 -14.905
   22    H    SER   6           H        SER   6 -13.272  -3.435 -10.037
   23    HA   SER   6           HA       SER   6 -11.555  -3.497  -7.924
   24    HB2  SER   6           1HB      SER   6 -13.169  -5.002  -6.797
   25    HB3  SER   6           2HB      SER   6 -13.974  -3.685  -7.650
   26    HG   SER   6           HG       SER   6 -14.117  -6.382  -8.065
   27    H    GLY   7           H        GLY   7 -12.508  -6.353  -9.842
   28    HA2  GLY   7           1HA      GLY   7 -11.286  -8.233 -10.390
   29    HA3  GLY   7           2HA      GLY   7  -9.867  -7.454  -9.704
   30    H    THR   8           H        THR   8 -12.611  -9.509  -9.065
   31    HA   THR   8           HA       THR   8 -12.705  -9.867  -6.406
   32    HB   THR   8           HB       THR   8 -12.543 -12.145  -8.389
   33    HG1  THR   8           HG1      THR   8 -14.695 -10.515  -7.488
   34   HG21  THR   8          3HG2      THR   8 -12.774 -12.150  -5.556
   35   HG22  THR   8          1HG2      THR   8 -12.864 -13.518  -6.665
   36   HG23  THR   8          2HG2      THR   8 -14.329 -12.637  -6.230
   37    H    GLY   9           H        GLY   9 -11.438 -10.542  -4.773
   38    HA2  GLY   9           1HA      GLY   9  -9.655 -11.506  -3.664
   39    HA3  GLY   9           2HA      GLY   9  -9.184 -12.271  -5.175
   40    H    GLU  10           H        GLU  10  -8.938  -9.360  -3.231
   41    HA   GLU  10           HA       GLU  10  -6.321  -8.834  -4.332
   42    HB2  GLU  10           1HB      GLU  10  -6.850  -6.486  -4.939
   43    HB3  GLU  10           2HB      GLU  10  -7.657  -7.663  -5.965
   44    HG2  GLU  10           1HG      GLU  10  -9.740  -7.236  -5.038
   45    HG3  GLU  10           2HG      GLU  10  -9.053  -6.506  -3.588
   46    H    LYS  11           H        LYS  11  -5.056  -7.503  -3.023
   47    HA   LYS  11           HA       LYS  11  -5.456  -7.596  -0.302
   48    HB2  LYS  11           1HB      LYS  11  -3.716  -5.977  -2.091
   49    HB3  LYS  11           2HB      LYS  11  -3.860  -5.454  -0.418
   50    HG2  LYS  11           1HG      LYS  11  -1.936  -6.874  -0.658
   51    HG3  LYS  11           2HG      LYS  11  -3.155  -7.699   0.316
   52    HD2  LYS  11           1HD      LYS  11  -2.520  -9.384  -1.116
   53    HD3  LYS  11           2HD      LYS  11  -3.890  -8.696  -1.991
   54    HE2  LYS  11           1HE      LYS  11  -2.273  -7.296  -3.273
   55    HE3  LYS  11           2HE      LYS  11  -0.962  -8.166  -2.480
   56    HZ1  LYS  11           3HZ      LYS  11  -1.489  -9.066  -4.679
   57    HZ2  LYS  11           1HZ      LYS  11  -3.060  -9.423  -4.164
   58    HZ3  LYS  11           2HZ      LYS  11  -1.740 -10.211  -3.459
   59    HA   PRO  12           HA       PRO  12  -8.686  -4.589   0.270
   60    HB2  PRO  12           1HB      PRO  12  -8.758  -4.760   2.978
   61    HB3  PRO  12           2HB      PRO  12  -9.474  -5.980   1.919
   62    HG2  PRO  12           1HG      PRO  12  -6.836  -6.012   3.334
   63    HG3  PRO  12           2HG      PRO  12  -8.025  -7.315   3.156
   64    HD2  PRO  12           1HD      PRO  12  -5.796  -7.158   1.627
   65    HD3  PRO  12           2HD      PRO  12  -7.322  -7.836   1.023
   66    H    TYR  13           H        TYR  13  -5.459  -4.243   0.820
   67    HA   TYR  13           HA       TYR  13  -5.818  -1.482   1.760
   68    HB2  TYR  13           1HB      TYR  13  -3.899  -3.551   2.794
   69    HB3  TYR  13           2HB      TYR  13  -3.524  -1.836   2.914
   70    HD1  TYR  13           HD2      TYR  13  -4.840  -0.373   4.368
   71    HD2  TYR  13           HD1      TYR  13  -5.634  -4.547   4.149
   72    HE1  TYR  13           HE2      TYR  13  -6.170  -0.222   6.431
   73    HE2  TYR  13           HE1      TYR  13  -6.967  -4.408   6.211
   74    HH   TYR  13           HH       TYR  13  -8.136  -2.833   7.544
   75    H    ASN  14           H        ASN  14  -4.212   0.007   1.051
   76    HA   ASN  14           HA       ASN  14  -2.192  -0.834  -0.820
   77    HB2  ASN  14           1HB      ASN  14  -4.181   1.091  -1.961
   78    HB3  ASN  14           2HB      ASN  14  -3.056   0.023  -2.795
   79   HD21  ASN  14          1HD2      ASN  14  -3.689  -1.987  -3.359
   80   HD22  ASN  14          2HD2      ASN  14  -5.273  -2.618  -3.080
   81    H    CYS  15           H        CYS  15  -0.613   0.704  -1.130
   82    HA   CYS  15           HA       CYS  15  -0.636   2.909   0.738
   83    HB2  CYS  15           1HB      CYS  15   1.357   1.372   0.205
   84    HB3  CYS  15           2HB      CYS  15   1.536   2.325  -1.265
   85    H    GLU  16           H        GLU  16  -1.210   4.924   0.282
   86    HA   GLU  16           HA       GLU  16  -1.989   5.664  -2.375
   87    HB2  GLU  16           1HB      GLU  16  -2.540   7.851  -1.347
   88    HB3  GLU  16           2HB      GLU  16  -3.269   6.493  -0.501
   89    HG2  GLU  16           1HG      GLU  16  -1.740   6.655   1.286
   90    HG3  GLU  16           2HG      GLU  16  -0.693   7.752   0.386
   91    H    GLU  17           H        GLU  17   0.920   5.758  -0.646
   92    HA   GLU  17           HA       GLU  17   2.029   8.090  -1.916
   93    HB2  GLU  17           1HB      GLU  17   3.132   5.927  -0.148
   94    HB3  GLU  17           2HB      GLU  17   4.208   7.058  -0.956
   95    HG2  GLU  17           1HG      GLU  17   1.929   7.963   0.772
   96    HG3  GLU  17           2HG      GLU  17   3.531   7.611   1.418
   97    H    CYS  18           H        CYS  18   2.486   4.578  -2.231
   98    HA   CYS  18           HA       CYS  18   3.770   5.062  -4.838
   99    HB2  CYS  18           1HB      CYS  18   4.737   2.751  -4.524
  100    HB3  CYS  18           2HB      CYS  18   5.327   3.967  -3.397
  101    H    GLY  19           H        GLY  19   1.658   2.770  -3.111
  102    HA2  GLY  19           1HA      GLY  19  -0.535   2.422  -4.308
  103    HA3  GLY  19           2HA      GLY  19   0.455   2.080  -5.719
  104    H    LYS  20           H        LYS  20   2.263   0.841  -3.384
  105    HA   LYS  20           HA       LYS  20   1.912  -1.811  -4.014
  106    HB2  LYS  20           1HB      LYS  20   3.700  -0.543  -2.528
  107    HB3  LYS  20           2HB      LYS  20   2.688  -1.125  -1.213
  108    HG2  LYS  20           1HG      LYS  20   2.933  -3.426  -2.394
  109    HG3  LYS  20           2HG      LYS  20   4.332  -2.673  -3.164
  110    HD2  LYS  20           1HD      LYS  20   5.492  -2.494  -1.187
  111    HD3  LYS  20           2HD      LYS  20   4.025  -2.451  -0.206
  112    HE2  LYS  20           1HE      LYS  20   4.846  -4.913  -1.716
  113    HE3  LYS  20           2HE      LYS  20   5.476  -4.562  -0.107
  114    HZ1  LYS  20           3HZ      LYS  20   2.680  -5.102  -0.903
  115    HZ2  LYS  20           1HZ      LYS  20   3.052  -4.343   0.563
  116    HZ3  LYS  20           2HZ      LYS  20   3.621  -5.905   0.252
  117    H    ALA  21           H        ALA  21   0.782  -3.537  -3.155
  118    HA   ALA  21           HA       ALA  21  -1.634  -2.810  -1.679
  119    HB1  ALA  21           3HB      ALA  21  -2.607  -4.224  -3.083
  120    HB2  ALA  21           1HB      ALA  21  -1.040  -4.666  -3.762
  121    HB3  ALA  21           2HB      ALA  21  -1.680  -5.546  -2.373
  122    H    PHE  22           H        PHE  22  -2.395  -4.197   0.063
  123    HA   PHE  22           HA       PHE  22  -0.391  -5.824   1.408
  124    HB2  PHE  22           1HB      PHE  22  -1.634  -3.372   2.667
  125    HB3  PHE  22           2HB      PHE  22  -0.755  -4.605   3.564
  126    HD1  PHE  22           HD2      PHE  22  -0.444  -1.990   0.983
  127    HD2  PHE  22           HD1      PHE  22   1.607  -4.647   3.600
  128    HE1  PHE  22           HE2      PHE  22   1.667  -0.817   0.514
  129    HE2  PHE  22           HE1      PHE  22   3.721  -3.478   3.136
  130    HZ   PHE  22           HZ       PHE  22   3.753  -1.561   1.590
  131    H    ILE  23           H        ILE  23  -1.247  -7.330   2.833
  132    HA   ILE  23           HA       ILE  23  -4.019  -7.973   2.406
  133    HB   ILE  23           HB       ILE  23  -1.940  -9.314   4.139
  134   HG12  ILE  23          1HG1      ILE  23  -3.056 -10.452   1.606
  135   HG13  ILE  23          2HG1      ILE  23  -1.805  -9.217   1.508
  136   HG21  ILE  23          1HG2      ILE  23  -4.684  -9.576   4.309
  137   HG22  ILE  23          2HG2      ILE  23  -4.195 -10.933   3.296
  138   HG23  ILE  23          3HG2      ILE  23  -3.487 -10.729   4.898
  139   HD11  ILE  23          3HD1      ILE  23  -1.314 -11.502   3.320
  140   HD12  ILE  23          1HD1      ILE  23  -1.257 -11.808   1.584
  141   HD13  ILE  23          2HD1      ILE  23  -0.195 -10.595   2.301
  142    H    HIS  24           H        HIS  24  -2.028  -7.092   5.217
  143    HA   HIS  24           HA       HIS  24  -4.507  -6.563   6.715
  144    HB2  HIS  24           1HB      HIS  24  -1.724  -7.247   7.664
  145    HB3  HIS  24           2HB      HIS  24  -2.991  -6.671   8.743
  146    HD2  HIS  24           HD2      HIS  24  -2.212  -9.840   6.551
  147    HE1  HIS  24           HE1      HIS  24  -5.220 -10.808   9.381
  148    HE2  HIS  24           HE2      HIS  24  -3.629 -11.705   7.647
  149    H    ASP  25           H        ASP  25  -4.035  -4.831   8.518
  150    HA   ASP  25           HA       ASP  25  -3.321  -2.417   7.094
  151    HB2  ASP  25           1HB      ASP  25  -4.181  -1.244   9.056
  152    HB3  ASP  25           2HB      ASP  25  -5.322  -2.479   8.531
  153    H    SER  26           H        SER  26  -2.294  -3.991  10.121
  154    HA   SER  26           HA       SER  26  -0.284  -2.276  10.877
  155    HB2  SER  26           1HB      SER  26   0.767  -4.245  11.990
  156    HB3  SER  26           2HB      SER  26  -0.966  -4.126  12.291
  157    HG   SER  26           HG       SER  26  -0.858  -5.570  10.186
  158    H    GLN  27           H        GLN  27  -0.373  -4.367   8.158
  159    HA   GLN  27           HA       GLN  27   2.476  -4.499   7.774
  160    HB2  GLN  27           1HB      GLN  27   0.118  -5.271   6.064
  161    HB3  GLN  27           2HB      GLN  27   1.776  -5.396   5.490
  162    HG2  GLN  27           1HG      GLN  27   2.117  -6.759   7.695
  163    HG3  GLN  27           2HG      GLN  27   0.370  -6.971   7.588
  164   HE21  GLN  27          1HE2      GLN  27  -0.168  -7.330   5.038
  165   HE22  GLN  27          2HE2      GLN  27   0.669  -8.692   4.385
  166    H    LEU  28           H        LEU  28  -0.172  -2.969   5.933
  167    HA   LEU  28           HA       LEU  28   1.405  -1.504   4.180
  168    HB2  LEU  28           1HB      LEU  28  -0.859  -1.613   3.662
  169    HB3  LEU  28           2HB      LEU  28  -1.350  -1.113   5.280
  170    HG   LEU  28           HG       LEU  28  -0.490   1.174   4.749
  171   HD11  LEU  28          1HD1      LEU  28  -0.141   1.737   2.387
  172   HD12  LEU  28          2HD1      LEU  28  -0.263   0.029   1.970
  173   HD13  LEU  28          3HD1      LEU  28   1.065   0.596   2.982
  174   HD21  LEU  28          3HD2      LEU  28  -2.407   1.054   2.662
  175   HD22  LEU  28          1HD2      LEU  28  -2.630   1.574   4.333
  176   HD23  LEU  28          2HD2      LEU  28  -2.872  -0.117   3.896
  177    H    GLN  29           H        GLN  29   0.037  -0.484   7.304
  178    HA   GLN  29           HA       GLN  29   1.031   2.113   7.339
  179    HB2  GLN  29           1HB      GLN  29   0.533   0.210   9.632
  180    HB3  GLN  29           2HB      GLN  29   0.860   1.927   9.829
  181    HG2  GLN  29           1HG      GLN  29  -1.525   0.625   8.558
  182    HG3  GLN  29           2HG      GLN  29  -1.473   1.675   9.973
  183   HE21  GLN  29          1HE2      GLN  29  -1.296   1.530   6.499
  184   HE22  GLN  29          2HE2      GLN  29  -1.554   3.214   6.216
  185    H    GLU  30           H        GLU  30   2.525  -0.887   8.504
  186    HA   GLU  30           HA       GLU  30   4.853   0.278   9.561
  187    HB2  GLU  30           1HB      GLU  30   4.076  -2.057   9.991
  188    HB3  GLU  30           2HB      GLU  30   4.580  -2.482   8.361
  189    HG2  GLU  30           1HG      GLU  30   6.890  -1.658   9.034
  190    HG3  GLU  30           2HG      GLU  30   6.287  -1.681  10.691
  191    H    HIS  31           H        HIS  31   3.827  -0.091   6.351
  192    HA   HIS  31           HA       HIS  31   6.538  -0.007   5.264
  193    HB2  HIS  31           1HB      HIS  31   5.340  -1.443   3.923
  194    HB3  HIS  31           2HB      HIS  31   3.830  -0.565   4.146
  195    HD1  HIS  31           HD1      HIS  31   6.894  -0.676   2.019
  196    HD2  HIS  31           HD2      HIS  31   3.395   1.542   2.342
  197    HE1  HIS  31           HE1      HIS  31   6.758   0.678  -0.096
  198    H    GLN  32           H        GLN  32   3.516   1.868   5.071
  199    HA   GLN  32           HA       GLN  32   4.172   3.960   3.518
  200    HB2  GLN  32           1HB      GLN  32   2.651   3.874   6.101
  201    HB3  GLN  32           2HB      GLN  32   2.892   5.405   5.269
  202    HG2  GLN  32           1HG      GLN  32   1.958   4.112   3.211
  203    HG3  GLN  32           2HG      GLN  32   1.306   3.025   4.435
  204   HE21  GLN  32          1HE2      GLN  32  -0.620   3.988   3.142
  205   HE22  GLN  32          2HE2      GLN  32  -1.384   5.349   3.885
  206    H    ARG  33           H        ARG  33   5.591   3.212   6.589
  207    HA   ARG  33           HA       ARG  33   6.638   5.621   7.409
  208    HB2  ARG  33           1HB      ARG  33   8.242   3.074   7.496
  209    HB3  ARG  33           2HB      ARG  33   8.236   4.399   8.652
  210    HG2  ARG  33           1HG      ARG  33   5.695   3.692   8.888
  211    HG3  ARG  33           2HG      ARG  33   6.340   2.145   8.334
  212    HD2  ARG  33           1HD      ARG  33   6.323   2.269  10.770
  213    HD3  ARG  33           2HD      ARG  33   7.970   2.168  10.150
  214    HE   ARG  33           HE       ARG  33   7.538   4.837  10.415
  215   HH11  ARG  33          1HH1      ARG  33   7.252   2.107  12.556
  216   HH12  ARG  33          2HH1      ARG  33   7.623   3.020  13.981
  217   HH21  ARG  33          1HH2      ARG  33   8.028   6.050  12.284
  218   HH22  ARG  33          2HH2      ARG  33   8.064   5.263  13.825
  219    H    ILE  34           H        ILE  34   8.048   3.332   5.084
  220    HA   ILE  34           HA       ILE  34  10.444   4.526   4.538
  221    HB   ILE  34           HB       ILE  34  10.388   3.540   2.345
  222   HG12  ILE  34          1HG1      ILE  34   7.500   2.799   2.644
  223   HG13  ILE  34          2HG1      ILE  34   7.926   4.388   2.019
  224   HG21  ILE  34          1HG2      ILE  34   8.876   1.379   3.441
  225   HG22  ILE  34          2HG2      ILE  34  10.624   1.543   3.281
  226   HG23  ILE  34          3HG2      ILE  34   9.811   2.146   4.725
  227   HD11  ILE  34          3HD1      ILE  34   8.326   1.703   0.810
  228   HD12  ILE  34          1HD1      ILE  34   7.717   3.190   0.086
  229   HD13  ILE  34          2HD1      ILE  34   9.442   3.005   0.400
  230    H    HIS  35           H        HIS  35   7.284   5.706   3.781
  231    HA   HIS  35           HA       HIS  35   8.269   7.672   1.881
  232    HB2  HIS  35           1HB      HIS  35   5.511   7.118   2.986
  233    HB3  HIS  35           2HB      HIS  35   5.863   8.405   1.837
  234    HD1  HIS  35           HD1      HIS  35   6.858   7.549  -0.533
  235    HD2  HIS  35           HD2      HIS  35   5.007   4.695   1.852
  236    HE1  HIS  35           HE1      HIS  35   6.346   5.622  -2.065
  237    H    THR  36           H        THR  36   6.538   7.738   4.998
  238    HA   THR  36           HA       THR  36   6.420  10.365   5.568
  239    HB   THR  36           HB       THR  36   6.466   9.879   7.882
  240    HG1  THR  36           HG1      THR  36   7.533   8.081   8.726
  241   HG21  THR  36          3HG2      THR  36   5.015   8.007   8.089
  242   HG22  THR  36          1HG2      THR  36   5.667   7.255   6.634
  243   HG23  THR  36          2HG2      THR  36   4.691   8.719   6.509
  244    H    GLY  37           H        GLY  37   9.335   8.368   5.804
  245    HA2  GLY  37           1HA      GLY  37  11.550   8.928   6.034
  246    HA3  GLY  37           2HA      GLY  37  11.123  10.389   5.155
  247    H    GLU  38           H        GLU  38  10.106   9.300   8.377
  248    HA   GLU  38           HA       GLU  38  11.668  11.444   9.599
  249    HB2  GLU  38           1HB      GLU  38   9.578  12.549   9.183
  250    HB3  GLU  38           2HB      GLU  38   8.669  11.184   9.816
  251    HG2  GLU  38           1HG      GLU  38   9.643  11.615  12.043
  252    HG3  GLU  38           2HG      GLU  38  10.445  13.039  11.384
  253    H    LYS  39           H        LYS  39  12.380  10.975  11.618
  254    HA   LYS  39           HA       LYS  39  11.208   8.717  13.058
  255    HB2  LYS  39           1HB      LYS  39  12.990   7.698  11.772
  256    HB3  LYS  39           2HB      LYS  39  14.128   8.930  12.303
  257    HG2  LYS  39           1HG      LYS  39  13.716   8.101  14.659
  258    HG3  LYS  39           2HG      LYS  39  12.889   6.726  13.922
  259    HD2  LYS  39           1HD      LYS  39  15.052   6.471  12.529
  260    HD3  LYS  39           2HD      LYS  39  15.781   7.500  13.764
  261    HE2  LYS  39           1HE      LYS  39  15.353   5.929  15.468
  262    HE3  LYS  39           2HE      LYS  39  14.232   5.019  14.456
  263    HZ1  LYS  39           3HZ      LYS  39  16.008   4.217  13.140
  264    HZ2  LYS  39           1HZ      LYS  39  16.474   3.995  14.751
  265    HZ3  LYS  39           2HZ      LYS  39  17.123   5.272  13.851
  266    HA   PRO  40           HA       PRO  40  11.800  11.443  16.473
  267    HB2  PRO  40           1HB      PRO  40  11.494   9.637  18.477
  268    HB3  PRO  40           2HB      PRO  40  10.140  10.244  17.515
  269    HG2  PRO  40           1HG      PRO  40  11.651   7.673  17.250
  270    HG3  PRO  40           2HG      PRO  40   9.904   7.959  17.153
  271    HD2  PRO  40           1HD      PRO  40  11.454   7.652  14.954
  272    HD3  PRO  40           2HD      PRO  40  10.019   8.696  14.972
  273    H    SER  41           H        SER  41  12.969  11.116  18.793
  274    HA   SER  41           HA       SER  41  15.756  10.538  18.107
  275    HB2  SER  41           1HB      SER  41  14.546  12.083  20.411
  276    HB3  SER  41           2HB      SER  41  16.275  11.821  20.187
  277    HG   SER  41           HG       SER  41  14.500  13.400  18.698
  278    H    GLY  42           H        GLY  42  15.779   8.291  18.309
  279    HA2  GLY  42           1HA      GLY  42  15.958   6.275  19.393
  280    HA3  GLY  42           2HA      GLY  42  16.488   7.229  20.770
  281    HA   PRO  43           HA       PRO  43  11.694   6.696  21.225
  282    HB2  PRO  43           1HB      PRO  43  10.526   4.894  19.564
  283    HB3  PRO  43           2HB      PRO  43  10.678   6.610  19.166
  284    HG2  PRO  43           1HG      PRO  43  12.370   4.304  18.282
  285    HG3  PRO  43           2HG      PRO  43  11.759   5.672  17.334
  286    HD2  PRO  43           1HD      PRO  43  14.298   5.565  18.269
  287    HD3  PRO  43           2HD      PRO  43  13.412   7.092  18.085
  288    H    SER  44           H        SER  44  13.113   3.689  19.920
  289    HA   SER  44           HA       SER  44  13.411   2.470  22.447
  290    HB2  SER  44           1HB      SER  44  10.833   2.474  21.997
  291    HB3  SER  44           2HB      SER  44  11.207   1.149  20.896
  292    HG   SER  44           HG       SER  44  11.478  -0.110  22.551
  293    H    SER  45           H        SER  45  14.664   0.661  22.315
  294    HA   SER  45           HA       SER  45  16.331  -0.564  21.296
  295    HB2  SER  45           1HB      SER  45  15.449  -2.475  20.204
  296    HB3  SER  45           2HB      SER  45  14.186  -1.959  21.322
  297    HG   SER  45           HG       SER  45  13.577  -0.666  19.231
  298    H    GLY  46           H        GLY  46  16.307   1.966  20.172
  299    HA2  GLY  46           1HA      GLY  46  16.671   1.424  17.291
  300    HA3  GLY  46           2HA      GLY  46  16.277   3.000  17.962
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1  -0.633   9.257 -23.773
    2    HA2  GLY   1           1HA      GLY   1  -1.114   9.712 -20.893
    3    HA3  GLY   1           2HA      GLY   1  -2.091   8.607 -21.848
    4    H    SER   2           H        SER   2  -1.579   6.537 -21.676
    5    HA   SER   2           HA       SER   2  -0.447   4.624 -21.188
    6    HB2  SER   2           1HB      SER   2   0.878   5.574 -23.190
    7    HB3  SER   2           2HB      SER   2   2.093   6.027 -21.995
    8    HG   SER   2           HG       SER   2   2.145   3.827 -23.111
    9    H    SER   3           H        SER   3  -0.897   6.303 -19.022
   10    HA   SER   3           HA       SER   3   1.364   6.868 -17.459
   11    HB2  SER   3           1HB      SER   3  -0.817   7.828 -16.943
   12    HB3  SER   3           2HB      SER   3  -1.466   6.227 -16.593
   13    HG   SER   3           HG       SER   3  -0.729   6.454 -14.652
   14    H    GLY   4           H        GLY   4  -0.784   4.031 -17.476
   15    HA2  GLY   4           1HA      GLY   4   0.385   1.847 -17.315
   16    HA3  GLY   4           2HA      GLY   4   1.331   2.566 -16.020
   17    H    SER   5           H        SER   5  -0.782   0.291 -16.375
   18    HA   SER   5           HA       SER   5  -2.844   1.033 -14.516
   19    HB2  SER   5           1HB      SER   5  -2.976  -0.706 -16.434
   20    HB3  SER   5           2HB      SER   5  -2.193  -1.801 -15.294
   21    HG   SER   5           HG       SER   5  -4.767  -0.787 -15.303
   22    H    SER   6           H        SER   6  -3.264  -0.437 -12.587
   23    HA   SER   6           HA       SER   6  -1.110  -1.736 -11.290
   24    HB2  SER   6           1HB      SER   6  -0.502   0.774 -11.148
   25    HB3  SER   6           2HB      SER   6  -1.814   0.879  -9.975
   26    HG   SER   6           HG       SER   6   0.556   0.302  -9.359
   27    H    GLY   7           H        GLY   7  -1.856  -2.998  -9.668
   28    HA2  GLY   7           1HA      GLY   7  -3.311  -3.341  -7.760
   29    HA3  GLY   7           2HA      GLY   7  -4.537  -2.398  -8.594
   30    H    THR   8           H        THR   8  -2.791  -5.463  -8.618
   31    HA   THR   8           HA       THR   8  -5.093  -6.660 -10.017
   32    HB   THR   8           HB       THR   8  -3.528  -8.309 -11.018
   33    HG1  THR   8           HG1      THR   8  -1.836  -7.799  -9.370
   34   HG21  THR   8          3HG2      THR   8  -4.232  -6.008 -12.048
   35   HG22  THR   8          1HG2      THR   8  -2.986  -6.980 -12.829
   36   HG23  THR   8          2HG2      THR   8  -2.530  -5.607 -11.819
   37    H    GLY   9           H        GLY   9  -4.826  -6.448  -7.202
   38    HA2  GLY   9           1HA      GLY   9  -4.639  -9.311  -6.532
   39    HA3  GLY   9           2HA      GLY   9  -3.851  -8.116  -5.512
   40    H    GLU  10           H        GLU  10  -5.457  -9.554  -4.118
   41    HA   GLU  10           HA       GLU  10  -8.068  -8.203  -4.038
   42    HB2  GLU  10           1HB      GLU  10  -7.146 -10.937  -3.313
   43    HB3  GLU  10           2HB      GLU  10  -8.437 -10.237  -2.347
   44    HG2  GLU  10           1HG      GLU  10  -9.491  -9.723  -4.688
   45    HG3  GLU  10           2HG      GLU  10  -8.428 -11.028  -5.213
   46    H    LYS  11           H        LYS  11  -5.343  -7.404  -2.896
   47    HA   LYS  11           HA       LYS  11  -5.583  -7.525  -0.062
   48    HB2  LYS  11           1HB      LYS  11  -3.826  -6.108  -2.005
   49    HB3  LYS  11           2HB      LYS  11  -3.903  -5.477  -0.365
   50    HG2  LYS  11           1HG      LYS  11  -2.162  -6.915  -0.133
   51    HG3  LYS  11           2HG      LYS  11  -3.490  -8.014   0.248
   52    HD2  LYS  11           1HD      LYS  11  -3.364  -9.082  -1.805
   53    HD3  LYS  11           2HD      LYS  11  -2.550  -7.719  -2.577
   54    HE2  LYS  11           1HE      LYS  11  -1.187  -9.162  -0.350
   55    HE3  LYS  11           2HE      LYS  11  -1.228  -9.898  -1.952
   56    HZ1  LYS  11           3HZ      LYS  11   0.459  -7.866  -1.017
   57    HZ2  LYS  11           1HZ      LYS  11  -0.502  -7.217  -2.249
   58    HZ3  LYS  11           2HZ      LYS  11   0.438  -8.591  -2.545
   59    HA   PRO  12           HA       PRO  12  -8.723  -4.357   0.210
   60    HB2  PRO  12           1HB      PRO  12  -8.968  -4.473   2.911
   61    HB3  PRO  12           2HB      PRO  12  -9.696  -5.666   1.828
   62    HG2  PRO  12           1HG      PRO  12  -7.155  -5.837   3.403
   63    HG3  PRO  12           2HG      PRO  12  -8.413  -7.066   3.170
   64    HD2  PRO  12           1HD      PRO  12  -6.090  -7.077   1.779
   65    HD3  PRO  12           2HD      PRO  12  -7.617  -7.668   1.093
   66    H    TYR  13           H        TYR  13  -5.520  -4.204   0.950
   67    HA   TYR  13           HA       TYR  13  -5.761  -1.414   1.848
   68    HB2  TYR  13           1HB      TYR  13  -4.017  -3.587   2.975
   69    HB3  TYR  13           2HB      TYR  13  -3.540  -1.897   3.100
   70    HD1  TYR  13           HD2      TYR  13  -4.786  -0.353   4.513
   71    HD2  TYR  13           HD1      TYR  13  -5.901  -4.449   4.234
   72    HE1  TYR  13           HE2      TYR  13  -6.190  -0.100   6.516
   73    HE2  TYR  13           HE1      TYR  13  -7.310  -4.208   6.236
   74    HH   TYR  13           HH       TYR  13  -8.358  -1.415   7.420
   75    H    ASN  14           H        ASN  14  -4.240   0.018   1.037
   76    HA   ASN  14           HA       ASN  14  -2.095  -0.938  -0.656
   77    HB2  ASN  14           1HB      ASN  14  -4.114   0.916  -1.907
   78    HB3  ASN  14           2HB      ASN  14  -2.827   0.006  -2.693
   79   HD21  ASN  14          1HD2      ASN  14  -3.063  -2.276  -2.892
   80   HD22  ASN  14          2HD2      ASN  14  -4.636  -2.991  -2.920
   81    H    CYS  15           H        CYS  15  -0.569   0.682  -1.186
   82    HA   CYS  15           HA       CYS  15  -0.590   2.912   0.683
   83    HB2  CYS  15           1HB      CYS  15   1.407   1.353   0.277
   84    HB3  CYS  15           2HB      CYS  15   1.626   2.223  -1.238
   85    H    GLU  16           H        GLU  16  -1.420   4.794   0.089
   86    HA   GLU  16           HA       GLU  16  -1.958   5.459  -2.629
   87    HB2  GLU  16           1HB      GLU  16  -3.141   6.216  -0.404
   88    HB3  GLU  16           2HB      GLU  16  -1.958   7.515  -0.456
   89    HG2  GLU  16           1HG      GLU  16  -2.785   7.875  -2.867
   90    HG3  GLU  16           2HG      GLU  16  -4.174   6.910  -2.369
   91    H    GLU  17           H        GLU  17   0.779   5.781  -0.644
   92    HA   GLU  17           HA       GLU  17   1.882   8.145  -1.793
   93    HB2  GLU  17           1HB      GLU  17   3.035   5.895  -0.160
   94    HB3  GLU  17           2HB      GLU  17   4.049   7.180  -0.800
   95    HG2  GLU  17           1HG      GLU  17   3.564   7.866   1.363
   96    HG3  GLU  17           2HG      GLU  17   2.441   8.786   0.364
   97    H    CYS  18           H        CYS  18   2.584   4.682  -2.250
   98    HA   CYS  18           HA       CYS  18   3.910   5.367  -4.787
   99    HB2  CYS  18           1HB      CYS  18   4.942   3.073  -4.574
  100    HB3  CYS  18           2HB      CYS  18   5.438   4.232  -3.345
  101    H    GLY  19           H        GLY  19   1.736   2.985  -3.289
  102    HA2  GLY  19           1HA      GLY  19  -0.363   2.579  -4.559
  103    HA3  GLY  19           2HA      GLY  19   0.653   2.447  -5.987
  104    H    LYS  20           H        LYS  20   1.562   1.111  -2.885
  105    HA   LYS  20           HA       LYS  20   1.765  -1.519  -4.065
  106    HB2  LYS  20           1HB      LYS  20   2.642  -0.229  -1.532
  107    HB3  LYS  20           2HB      LYS  20   2.418  -1.973  -1.512
  108    HG2  LYS  20           1HG      LYS  20   3.912  -2.005  -3.587
  109    HG3  LYS  20           2HG      LYS  20   4.337  -0.350  -3.143
  110    HD2  LYS  20           1HD      LYS  20   5.063  -1.144  -0.934
  111    HD3  LYS  20           2HD      LYS  20   4.662  -2.798  -1.405
  112    HE2  LYS  20           1HE      LYS  20   6.392  -2.891  -2.976
  113    HE3  LYS  20           2HE      LYS  20   6.570  -1.138  -3.018
  114    HZ1  LYS  20           3HZ      LYS  20   7.936  -1.160  -1.266
  115    HZ2  LYS  20           1HZ      LYS  20   8.136  -2.805  -1.607
  116    HZ3  LYS  20           2HZ      LYS  20   7.030  -2.315  -0.426
  117    H    ALA  21           H        ALA  21   1.074  -3.390  -2.487
  118    HA   ALA  21           HA       ALA  21  -1.666  -2.854  -1.550
  119    HB1  ALA  21           3HB      ALA  21  -0.912  -4.473  -3.732
  120    HB2  ALA  21           1HB      ALA  21  -1.441  -5.555  -2.444
  121    HB3  ALA  21           2HB      ALA  21  -2.514  -4.280  -3.021
  122    H    PHE  22           H        PHE  22  -2.408  -4.123   0.189
  123    HA   PHE  22           HA       PHE  22  -0.543  -5.945   1.475
  124    HB2  PHE  22           1HB      PHE  22  -1.523  -3.408   2.796
  125    HB3  PHE  22           2HB      PHE  22  -0.766  -4.740   3.662
  126    HD1  PHE  22           HD2      PHE  22  -0.226  -2.039   1.237
  127    HD2  PHE  22           HD1      PHE  22   1.591  -5.108   3.560
  128    HE1  PHE  22           HE2      PHE  22   1.990  -1.079   0.766
  129    HE2  PHE  22           HE1      PHE  22   3.810  -4.152   3.094
  130    HZ   PHE  22           HZ       PHE  22   4.012  -2.136   1.694
  131    H    ILE  23           H        ILE  23  -1.513  -7.320   3.007
  132    HA   ILE  23           HA       ILE  23  -4.366  -7.660   2.607
  133    HB   ILE  23           HB       ILE  23  -2.382  -9.349   4.135
  134   HG12  ILE  23          1HG1      ILE  23  -3.727  -9.907   1.487
  135   HG13  ILE  23          2HG1      ILE  23  -2.119  -9.206   1.629
  136   HG21  ILE  23          1HG2      ILE  23  -5.307  -9.724   3.558
  137   HG22  ILE  23          2HG2      ILE  23  -4.240 -11.069   3.959
  138   HG23  ILE  23          3HG2      ILE  23  -4.482  -9.761   5.117
  139   HD11  ILE  23          3HD1      ILE  23  -2.992 -11.921   2.585
  140   HD12  ILE  23          1HD1      ILE  23  -1.943 -11.562   1.213
  141   HD13  ILE  23          2HD1      ILE  23  -1.396 -11.221   2.855
  142    H    HIS  24           H        HIS  24  -2.129  -6.988   5.261
  143    HA   HIS  24           HA       HIS  24  -4.448  -6.388   6.976
  144    HB2  HIS  24           1HB      HIS  24  -1.663  -7.301   7.711
  145    HB3  HIS  24           2HB      HIS  24  -2.837  -6.718   8.888
  146    HD2  HIS  24           HD2      HIS  24  -2.571  -9.721   6.327
  147    HE1  HIS  24           HE1      HIS  24  -5.105 -10.814   9.549
  148    HE2  HIS  24           HE2      HIS  24  -3.914 -11.609   7.477
  149    H    ASP  25           H        ASP  25  -4.447  -4.490   8.192
  150    HA   ASP  25           HA       ASP  25  -3.341  -2.223   6.990
  151    HB2  ASP  25           1HB      ASP  25  -4.007  -1.064   9.139
  152    HB3  ASP  25           2HB      ASP  25  -5.293  -1.955   8.329
  153    H    SER  26           H        SER  26  -2.357  -3.929   9.951
  154    HA   SER  26           HA       SER  26  -0.274  -2.304  10.745
  155    HB2  SER  26           1HB      SER  26   0.710  -4.387  11.764
  156    HB3  SER  26           2HB      SER  26  -0.988  -4.115  12.157
  157    HG   SER  26           HG       SER  26  -1.237  -5.526  10.113
  158    H    GLN  27           H        GLN  27  -0.403  -4.585   8.116
  159    HA   GLN  27           HA       GLN  27   2.413  -4.727   7.675
  160    HB2  GLN  27           1HB      GLN  27   0.068  -5.383   5.887
  161    HB3  GLN  27           2HB      GLN  27   1.746  -5.702   5.466
  162    HG2  GLN  27           1HG      GLN  27   1.960  -7.201   7.363
  163    HG3  GLN  27           2HG      GLN  27   0.298  -6.854   7.840
  164   HE21  GLN  27          1HE2      GLN  27  -0.423  -8.936   7.644
  165   HE22  GLN  27          2HE2      GLN  27  -0.575  -9.747   6.127
  166    H    LEU  28           H        LEU  28  -0.224  -3.007   6.009
  167    HA   LEU  28           HA       LEU  28   1.401  -1.643   4.172
  168    HB2  LEU  28           1HB      LEU  28  -0.913  -1.750   3.735
  169    HB3  LEU  28           2HB      LEU  28  -1.318  -1.069   5.309
  170    HG   LEU  28           HG       LEU  28  -0.353   1.098   4.550
  171   HD11  LEU  28          1HD1      LEU  28   0.488   1.446   2.469
  172   HD12  LEU  28          2HD1      LEU  28  -0.498   0.183   1.734
  173   HD13  LEU  28          3HD1      LEU  28   0.938  -0.248   2.662
  174   HD21  LEU  28          3HD2      LEU  28  -2.763   0.643   4.459
  175   HD22  LEU  28          1HD2      LEU  28  -2.573   0.002   2.827
  176   HD23  LEU  28          2HD2      LEU  28  -2.243   1.704   3.149
  177    H    GLN  29           H        GLN  29   0.088  -0.595   7.308
  178    HA   GLN  29           HA       GLN  29   1.108   1.979   7.360
  179    HB2  GLN  29           1HB      GLN  29   0.797   0.079   9.691
  180    HB3  GLN  29           2HB      GLN  29   0.962   1.826   9.811
  181    HG2  GLN  29           1HG      GLN  29  -1.290   0.423   8.393
  182    HG3  GLN  29           2HG      GLN  29  -1.361   1.012  10.053
  183   HE21  GLN  29          1HE2      GLN  29  -2.424   1.707   7.138
  184   HE22  GLN  29          2HE2      GLN  29  -2.422   3.434   7.177
  185    H    GLU  30           H        GLU  30   2.632  -1.015   8.528
  186    HA   GLU  30           HA       GLU  30   4.999   0.114   9.479
  187    HB2  GLU  30           1HB      GLU  30   4.344  -2.196   9.949
  188    HB3  GLU  30           2HB      GLU  30   4.566  -2.617   8.257
  189    HG2  GLU  30           1HG      GLU  30   6.462  -3.384   9.473
  190    HG3  GLU  30           2HG      GLU  30   6.963  -2.017   8.480
  191    H    HIS  31           H        HIS  31   3.881  -0.265   6.277
  192    HA   HIS  31           HA       HIS  31   6.552  -0.089   5.117
  193    HB2  HIS  31           1HB      HIS  31   5.336  -1.526   3.792
  194    HB3  HIS  31           2HB      HIS  31   3.822  -0.670   4.068
  195    HD1  HIS  31           HD1      HIS  31   6.716  -0.858   1.771
  196    HD2  HIS  31           HD2      HIS  31   3.426   1.602   2.394
  197    HE1  HIS  31           HE1      HIS  31   6.536   0.561  -0.297
  198    H    GLN  32           H        GLN  32   3.480   1.713   4.920
  199    HA   GLN  32           HA       GLN  32   4.092   3.846   3.425
  200    HB2  GLN  32           1HB      GLN  32   2.611   3.757   6.043
  201    HB3  GLN  32           2HB      GLN  32   2.749   5.246   5.117
  202    HG2  GLN  32           1HG      GLN  32   1.683   4.138   3.205
  203    HG3  GLN  32           2HG      GLN  32   1.508   2.673   4.169
  204   HE21  GLN  32          1HE2      GLN  32  -0.237   5.023   2.973
  205   HE22  GLN  32          2HE2      GLN  32  -1.405   5.263   4.223
  206    H    ARG  33           H        ARG  33   5.453   3.141   6.552
  207    HA   ARG  33           HA       ARG  33   6.471   5.561   7.356
  208    HB2  ARG  33           1HB      ARG  33   8.098   3.030   7.495
  209    HB3  ARG  33           2HB      ARG  33   8.066   4.368   8.635
  210    HG2  ARG  33           1HG      ARG  33   5.526   3.644   8.842
  211    HG3  ARG  33           2HG      ARG  33   6.192   2.096   8.318
  212    HD2  ARG  33           1HD      ARG  33   6.337   1.961  10.628
  213    HD3  ARG  33           2HD      ARG  33   7.953   2.493  10.166
  214    HE   ARG  33           HE       ARG  33   7.563   4.501  11.212
  215   HH11  ARG  33          1HH1      ARG  33   4.571   2.750  10.895
  216   HH12  ARG  33          2HH1      ARG  33   3.679   3.831  11.913
  217   HH21  ARG  33          1HH2      ARG  33   6.400   5.932  12.554
  218   HH22  ARG  33          2HH2      ARG  33   4.720   5.641  12.856
  219    H    ILE  34           H        ILE  34   7.965   3.261   5.092
  220    HA   ILE  34           HA       ILE  34  10.356   4.430   4.566
  221    HB   ILE  34           HB       ILE  34  10.293   3.510   2.341
  222   HG12  ILE  34          1HG1      ILE  34   7.418   2.742   2.581
  223   HG13  ILE  34          2HG1      ILE  34   7.802   4.390   2.096
  224   HG21  ILE  34          1HG2      ILE  34   9.757   1.216   2.840
  225   HG22  ILE  34          2HG2      ILE  34  10.468   1.968   4.268
  226   HG23  ILE  34          3HG2      ILE  34   8.725   1.711   4.182
  227   HD11  ILE  34          3HD1      ILE  34   9.425   2.756   0.523
  228   HD12  ILE  34          1HD1      ILE  34   7.844   1.975   0.552
  229   HD13  ILE  34          2HD1      ILE  34   7.991   3.652   0.023
  230    H    HIS  35           H        HIS  35   7.230   5.696   3.800
  231    HA   HIS  35           HA       HIS  35   8.300   7.705   1.986
  232    HB2  HIS  35           1HB      HIS  35   5.486   7.209   2.980
  233    HB3  HIS  35           2HB      HIS  35   5.932   8.443   1.805
  234    HD1  HIS  35           HD1      HIS  35   6.750   7.577  -0.549
  235    HD2  HIS  35           HD2      HIS  35   5.192   4.661   1.968
  236    HE1  HIS  35           HE1      HIS  35   6.297   5.589  -2.022
  237    H    THR  36           H        THR  36   6.945   7.458   5.229
  238    HA   THR  36           HA       THR  36   7.685  10.275   5.687
  239    HB   THR  36           HB       THR  36   5.279   9.949   5.922
  240    HG1  THR  36           HG1      THR  36   5.122  10.884   7.951
  241   HG21  THR  36          3HG2      THR  36   6.105   7.525   7.242
  242   HG22  THR  36          1HG2      THR  36   4.506   7.992   6.663
  243   HG23  THR  36          2HG2      THR  36   5.029   8.458   8.282
  244    H    GLY  37           H        GLY  37   9.555   8.150   5.880
  245    HA2  GLY  37           1HA      GLY  37  10.195   8.366   8.741
  246    HA3  GLY  37           2HA      GLY  37  10.223   6.784   7.978
  247    H    GLU  38           H        GLU  38  11.317   7.616   5.479
  248    HA   GLU  38           HA       GLU  38  14.021   8.437   6.318
  249    HB2  GLU  38           1HB      GLU  38  13.189   6.315   4.342
  250    HB3  GLU  38           2HB      GLU  38  14.819   6.972   4.401
  251    HG2  GLU  38           1HG      GLU  38  13.580   5.857   6.874
  252    HG3  GLU  38           2HG      GLU  38  14.250   4.773   5.657
  253    H    LYS  39           H        LYS  39  15.050   9.947   5.111
  254    HA   LYS  39           HA       LYS  39  13.833  11.880   3.720
  255    HB2  LYS  39           1HB      LYS  39  15.980  12.242   2.472
  256    HB3  LYS  39           2HB      LYS  39  16.163  12.080   4.213
  257    HG2  LYS  39           1HG      LYS  39  16.896   9.783   3.949
  258    HG3  LYS  39           2HG      LYS  39  16.653   9.891   2.203
  259    HD2  LYS  39           1HD      LYS  39  18.475  11.284   1.905
  260    HD3  LYS  39           2HD      LYS  39  18.444  11.853   3.576
  261    HE2  LYS  39           1HE      LYS  39  20.255  10.462   3.666
  262    HE3  LYS  39           2HE      LYS  39  18.977   9.322   4.085
  263    HZ1  LYS  39           3HZ      LYS  39  19.583   8.101   2.359
  264    HZ2  LYS  39           1HZ      LYS  39  20.757   9.235   1.912
  265    HZ3  LYS  39           2HZ      LYS  39  19.183   9.365   1.309
  266    HA   PRO  40           HA       PRO  40  12.271  10.409  -0.110
  267    HB2  PRO  40           1HB      PRO  40  12.584  12.599  -1.684
  268    HB3  PRO  40           2HB      PRO  40  11.365  12.499  -0.408
  269    HG2  PRO  40           1HG      PRO  40  14.054  13.815  -0.360
  270    HG3  PRO  40           2HG      PRO  40  12.506  14.409   0.270
  271    HD2  PRO  40           1HD      PRO  40  14.399  13.305   1.860
  272    HD3  PRO  40           2HD      PRO  40  12.662  13.149   2.194
  273    H    SER  41           H        SER  41  15.493  10.889   0.399
  274    HA   SER  41           HA       SER  41  17.334  10.033  -0.654
  275    HB2  SER  41           1HB      SER  41  15.614   8.326  -1.545
  276    HB3  SER  41           2HB      SER  41  15.640   9.279  -3.029
  277    HG   SER  41           HG       SER  41  17.162   7.622  -3.158
  278    H    GLY  42           H        GLY  42  16.827  12.712  -0.783
  279    HA2  GLY  42           1HA      GLY  42  18.295  14.213  -2.047
  280    HA3  GLY  42           2HA      GLY  42  17.764  13.385  -3.503
  281    HA   PRO  43           HA       PRO  43  13.978  16.017  -2.051
  282    HB2  PRO  43           1HB      PRO  43  14.389  17.710   0.031
  283    HB3  PRO  43           2HB      PRO  43  13.829  16.047   0.242
  284    HG2  PRO  43           1HG      PRO  43  16.589  17.168   0.537
  285    HG3  PRO  43           2HG      PRO  43  15.739  16.003   1.568
  286    HD2  PRO  43           1HD      PRO  43  17.586  15.251  -0.263
  287    HD3  PRO  43           2HD      PRO  43  16.193  14.235   0.161
  288    H    SER  44           H        SER  44  13.593  17.699  -3.349
  289    HA   SER  44           HA       SER  44  14.173  19.341  -4.874
  290    HB2  SER  44           1HB      SER  44  14.221  21.469  -3.817
  291    HB3  SER  44           2HB      SER  44  13.280  20.430  -2.748
  292    HG   SER  44           HG       SER  44  15.355  20.095  -1.618
  293    H    SER  45           H        SER  45  16.311  17.533  -4.611
  294    HA   SER  45           HA       SER  45  18.797  18.359  -3.976
  295    HB2  SER  45           1HB      SER  45  19.656  17.026  -5.858
  296    HB3  SER  45           2HB      SER  45  18.328  16.196  -5.046
  297    HG   SER  45           HG       SER  45  18.521  16.974  -7.612
  298    H    GLY  46           H        GLY  46  20.571  19.288  -5.261
  299    HA2  GLY  46           1HA      GLY  46  19.589  21.474  -6.992
  300    HA3  GLY  46           2HA      GLY  46  20.918  21.666  -5.859
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1  -5.716 -18.235 -26.466
    2    HA2  GLY   1           1HA      GLY   1  -7.976 -18.575 -24.598
    3    HA3  GLY   1           2HA      GLY   1  -6.473 -19.482 -24.522
    4    H    SER   2           H        SER   2  -8.179 -16.981 -23.181
    5    HA   SER   2           HA       SER   2  -5.732 -15.683 -22.176
    6    HB2  SER   2           1HB      SER   2  -7.377 -14.249 -23.467
    7    HB3  SER   2           2HB      SER   2  -8.514 -14.501 -22.143
    8    HG   SER   2           HG       SER   2  -7.312 -12.574 -21.880
    9    H    SER   3           H        SER   3  -6.592 -18.100 -21.071
   10    HA   SER   3           HA       SER   3  -8.176 -17.622 -18.727
   11    HB2  SER   3           1HB      SER   3  -7.804 -19.847 -20.059
   12    HB3  SER   3           2HB      SER   3  -6.381 -20.007 -19.030
   13    HG   SER   3           HG       SER   3  -8.211 -19.401 -17.358
   14    H    GLY   4           H        GLY   4  -7.529 -17.241 -16.666
   15    HA2  GLY   4           1HA      GLY   4  -5.219 -17.753 -15.367
   16    HA3  GLY   4           2HA      GLY   4  -4.811 -16.319 -16.297
   17    H    SER   5           H        SER   5  -6.430 -17.561 -13.539
   18    HA   SER   5           HA       SER   5  -6.640 -14.970 -12.368
   19    HB2  SER   5           1HB      SER   5  -9.095 -14.955 -12.065
   20    HB3  SER   5           2HB      SER   5  -8.642 -14.851 -13.766
   21    HG   SER   5           HG       SER   5  -9.074 -17.388 -12.691
   22    H    SER   6           H        SER   6  -6.127 -15.300 -10.319
   23    HA   SER   6           HA       SER   6  -7.393 -17.402  -8.786
   24    HB2  SER   6           1HB      SER   6  -4.403 -17.372  -9.248
   25    HB3  SER   6           2HB      SER   6  -5.194 -18.305  -7.978
   26    HG   SER   6           HG       SER   6  -5.833 -18.546 -10.729
   27    H    GLY   7           H        GLY   7  -7.255 -17.089  -6.541
   28    HA2  GLY   7           1HA      GLY   7  -5.946 -15.803  -4.779
   29    HA3  GLY   7           2HA      GLY   7  -6.283 -14.406  -5.790
   30    H    THR   8           H        THR   8  -7.061 -15.274  -2.970
   31    HA   THR   8           HA       THR   8  -9.967 -14.877  -3.280
   32    HB   THR   8           HB       THR   8 -10.236 -15.967  -1.071
   33    HG1  THR   8           HG1      THR   8  -7.898 -15.528  -0.540
   34   HG21  THR   8          3HG2      THR   8 -10.691 -17.503  -2.712
   35   HG22  THR   8          1HG2      THR   8  -9.328 -18.298  -1.926
   36   HG23  THR   8          2HG2      THR   8  -9.079 -17.390  -3.418
   37    H    GLY   9           H        GLY   9 -10.395 -12.792  -2.908
   38    HA2  GLY   9           1HA      GLY   9 -10.657 -10.856  -1.681
   39    HA3  GLY   9           2HA      GLY   9  -9.854 -11.657  -0.338
   40    H    GLU  10           H        GLU  10  -9.347  -9.853  -3.315
   41    HA   GLU  10           HA       GLU  10  -6.578  -9.690  -3.318
   42    HB2  GLU  10           1HB      GLU  10  -8.040  -8.872  -5.140
   43    HB3  GLU  10           2HB      GLU  10  -8.525  -7.522  -4.123
   44    HG2  GLU  10           1HG      GLU  10  -6.193  -6.752  -4.066
   45    HG3  GLU  10           2HG      GLU  10  -5.747  -8.077  -5.139
   46    H    LYS  11           H        LYS  11  -5.121  -8.080  -2.579
   47    HA   LYS  11           HA       LYS  11  -5.192  -7.437   0.068
   48    HB2  LYS  11           1HB      LYS  11  -3.745  -6.314  -2.274
   49    HB3  LYS  11           2HB      LYS  11  -3.702  -5.383  -0.782
   50    HG2  LYS  11           1HG      LYS  11  -1.796  -6.713  -0.687
   51    HG3  LYS  11           2HG      LYS  11  -2.959  -7.555   0.340
   52    HD2  LYS  11           1HD      LYS  11  -2.108  -9.289  -0.925
   53    HD3  LYS  11           2HD      LYS  11  -3.543  -8.842  -1.851
   54    HE2  LYS  11           1HE      LYS  11  -2.024  -7.341  -3.214
   55    HE3  LYS  11           2HE      LYS  11  -0.671  -8.143  -2.419
   56    HZ1  LYS  11           3HZ      LYS  11  -1.306 -10.214  -3.351
   57    HZ2  LYS  11           1HZ      LYS  11  -1.308  -9.091  -4.616
   58    HZ3  LYS  11           2HZ      LYS  11  -2.769  -9.595  -3.930
   59    HA   PRO  12           HA       PRO  12  -8.568  -4.443  -0.039
   60    HB2  PRO  12           1HB      PRO  12  -8.962  -4.468   2.647
   61    HB3  PRO  12           2HB      PRO  12  -9.605  -5.713   1.570
   62    HG2  PRO  12           1HG      PRO  12  -7.153  -5.775   3.287
   63    HG3  PRO  12           2HG      PRO  12  -8.372  -7.037   3.031
   64    HD2  PRO  12           1HD      PRO  12  -5.975  -7.050   1.771
   65    HD3  PRO  12           2HD      PRO  12  -7.450  -7.697   1.024
   66    H    TYR  13           H        TYR  13  -5.415  -4.196   0.868
   67    HA   TYR  13           HA       TYR  13  -5.767  -1.397   1.708
   68    HB2  TYR  13           1HB      TYR  13  -3.988  -3.514   2.872
   69    HB3  TYR  13           2HB      TYR  13  -3.516  -1.821   2.961
   70    HD1  TYR  13           HD2      TYR  13  -4.817  -0.237   4.303
   71    HD2  TYR  13           HD1      TYR  13  -5.822  -4.369   4.185
   72    HE1  TYR  13           HE2      TYR  13  -6.224   0.054   6.300
   73    HE2  TYR  13           HE1      TYR  13  -7.233  -4.090   6.180
   74    HH   TYR  13           HH       TYR  13  -8.165  -1.071   7.363
   75    H    ASN  14           H        ASN  14  -4.207   0.077   0.980
   76    HA   ASN  14           HA       ASN  14  -2.103  -0.850  -0.792
   77    HB2  ASN  14           1HB      ASN  14  -4.285   0.993  -1.793
   78    HB3  ASN  14           2HB      ASN  14  -2.841   0.524  -2.686
   79   HD21  ASN  14          1HD2      ASN  14  -5.697  -0.813  -1.091
   80   HD22  ASN  14          2HD2      ASN  14  -5.898  -2.141  -2.177
   81    H    CYS  15           H        CYS  15  -0.628   0.868  -1.420
   82    HA   CYS  15           HA       CYS  15  -0.563   2.993   0.603
   83    HB2  CYS  15           1HB      CYS  15   1.369   1.354   0.341
   84    HB3  CYS  15           2HB      CYS  15   1.708   2.147  -1.194
   85    H    GLU  16           H        GLU  16  -1.905   4.513  -0.357
   86    HA   GLU  16           HA       GLU  16  -1.956   5.315  -2.999
   87    HB2  GLU  16           1HB      GLU  16  -3.506   6.026  -1.120
   88    HB3  GLU  16           2HB      GLU  16  -2.282   7.205  -0.670
   89    HG2  GLU  16           1HG      GLU  16  -2.459   8.202  -2.917
   90    HG3  GLU  16           2HG      GLU  16  -3.749   7.061  -3.293
   91    H    GLU  17           H        GLU  17   0.538   5.722  -0.722
   92    HA   GLU  17           HA       GLU  17   1.702   8.116  -1.683
   93    HB2  GLU  17           1HB      GLU  17   3.092   5.796  -0.334
   94    HB3  GLU  17           2HB      GLU  17   3.680   7.449  -0.445
   95    HG2  GLU  17           1HG      GLU  17   1.369   6.404   1.156
   96    HG3  GLU  17           2HG      GLU  17   2.836   7.192   1.734
   97    H    CYS  18           H        CYS  18   2.558   4.704  -2.268
   98    HA   CYS  18           HA       CYS  18   3.988   5.568  -4.693
   99    HB2  CYS  18           1HB      CYS  18   5.096   3.282  -4.500
  100    HB3  CYS  18           2HB      CYS  18   5.524   4.463  -3.266
  101    H    GLY  19           H        GLY  19   1.842   3.044  -3.407
  102    HA2  GLY  19           1HA      GLY  19  -0.149   2.614  -4.856
  103    HA3  GLY  19           2HA      GLY  19   0.994   2.502  -6.187
  104    H    LYS  20           H        LYS  20   1.430   1.181  -2.946
  105    HA   LYS  20           HA       LYS  20   1.802  -1.461  -4.128
  106    HB2  LYS  20           1HB      LYS  20   3.406  -0.354  -2.440
  107    HB3  LYS  20           2HB      LYS  20   2.198  -0.761  -1.228
  108    HG2  LYS  20           1HG      LYS  20   2.597  -3.007  -1.381
  109    HG3  LYS  20           2HG      LYS  20   3.159  -2.905  -3.051
  110    HD2  LYS  20           1HD      LYS  20   4.755  -1.559  -0.927
  111    HD3  LYS  20           2HD      LYS  20   4.839  -3.317  -1.058
  112    HE2  LYS  20           1HE      LYS  20   6.567  -2.643  -2.435
  113    HE3  LYS  20           2HE      LYS  20   5.242  -2.849  -3.580
  114    HZ1  LYS  20           3HZ      LYS  20   4.888  -0.518  -3.640
  115    HZ2  LYS  20           1HZ      LYS  20   6.548  -0.765  -3.855
  116    HZ3  LYS  20           2HZ      LYS  20   5.956  -0.243  -2.358
  117    H    ALA  21           H        ALA  21   1.076  -3.292  -2.490
  118    HA   ALA  21           HA       ALA  21  -1.647  -2.727  -1.545
  119    HB1  ALA  21           3HB      ALA  21  -1.018  -4.227  -3.856
  120    HB2  ALA  21           1HB      ALA  21  -1.586  -5.361  -2.630
  121    HB3  ALA  21           2HB      ALA  21  -2.594  -3.993  -3.100
  122    H    PHE  22           H        PHE  22  -2.247  -3.784   0.290
  123    HA   PHE  22           HA       PHE  22  -0.436  -5.835   1.355
  124    HB2  PHE  22           1HB      PHE  22  -1.436  -3.391   2.825
  125    HB3  PHE  22           2HB      PHE  22  -0.694  -4.774   3.622
  126    HD1  PHE  22           HD1      PHE  22   1.676  -5.239   3.359
  127    HD2  PHE  22           HD2      PHE  22  -0.128  -1.843   1.535
  128    HE1  PHE  22           HE1      PHE  22   3.904  -4.265   2.978
  129    HE2  PHE  22           HE2      PHE  22   2.097  -0.864   1.150
  130    HZ   PHE  22           HZ       PHE  22   4.116  -2.076   1.870
  131    H    ILE  23           H        ILE  23  -1.385  -7.303   2.826
  132    HA   ILE  23           HA       ILE  23  -4.192  -7.753   2.340
  133    HB   ILE  23           HB       ILE  23  -2.239  -9.306   4.041
  134   HG12  ILE  23          1HG1      ILE  23  -3.330  -9.999   1.312
  135   HG13  ILE  23          2HG1      ILE  23  -1.792  -9.178   1.551
  136   HG21  ILE  23          1HG2      ILE  23  -4.480  -9.714   4.803
  137   HG22  ILE  23          2HG2      ILE  23  -5.042  -9.959   3.150
  138   HG23  ILE  23          3HG2      ILE  23  -3.931 -11.115   3.884
  139   HD11  ILE  23          3HD1      ILE  23  -1.275 -11.444   1.261
  140   HD12  ILE  23          1HD1      ILE  23  -1.130 -11.148   2.994
  141   HD13  ILE  23          2HD1      ILE  23  -2.558 -11.962   2.354
  142    H    HIS  24           H        HIS  24  -2.151  -6.977   5.129
  143    HA   HIS  24           HA       HIS  24  -4.599  -6.362   6.651
  144    HB2  HIS  24           1HB      HIS  24  -1.904  -7.313   7.633
  145    HB3  HIS  24           2HB      HIS  24  -3.180  -6.726   8.695
  146    HD2  HIS  24           HD2      HIS  24  -2.395  -9.837   6.454
  147    HE1  HIS  24           HE1      HIS  24  -5.751 -10.719   8.895
  148    HE2  HIS  24           HE2      HIS  24  -4.025 -11.652   7.316
  149    H    ASP  25           H        ASP  25  -4.429  -4.579   8.186
  150    HA   ASP  25           HA       ASP  25  -3.430  -2.241   7.005
  151    HB2  ASP  25           1HB      ASP  25  -5.280  -2.113   8.538
  152    HB3  ASP  25           2HB      ASP  25  -4.314  -2.799   9.841
  153    H    SER  26           H        SER  26  -2.379  -3.590  10.136
  154    HA   SER  26           HA       SER  26  -0.180  -2.156  10.660
  155    HB2  SER  26           1HB      SER  26   0.848  -4.225  11.650
  156    HB3  SER  26           2HB      SER  26  -0.826  -3.950  12.131
  157    HG   SER  26           HG       SER  26  -0.789  -6.041  11.545
  158    H    GLN  27           H        GLN  27  -0.355  -4.741   8.262
  159    HA   GLN  27           HA       GLN  27   2.362  -4.859   7.597
  160    HB2  GLN  27           1HB      GLN  27  -0.129  -5.462   6.011
  161    HB3  GLN  27           2HB      GLN  27   1.485  -5.720   5.362
  162    HG2  GLN  27           1HG      GLN  27   1.853  -7.108   7.521
  163    HG3  GLN  27           2HG      GLN  27   0.091  -7.141   7.584
  164   HE21  GLN  27          1HE2      GLN  27  -1.053  -8.173   5.916
  165   HE22  GLN  27          2HE2      GLN  27  -0.297  -9.345   4.897
  166    H    LEU  28           H        LEU  28  -0.267  -2.922   6.200
  167    HA   LEU  28           HA       LEU  28   1.351  -1.642   4.255
  168    HB2  LEU  28           1HB      LEU  28  -0.953  -1.648   3.839
  169    HB3  LEU  28           2HB      LEU  28  -1.334  -1.050   5.453
  170    HG   LEU  28           HG       LEU  28  -0.361   1.145   4.807
  171   HD11  LEU  28          1HD1      LEU  28   0.513   1.592   2.767
  172   HD12  LEU  28          2HD1      LEU  28  -0.519   0.424   1.943
  173   HD13  LEU  28          3HD1      LEU  28   0.900  -0.128   2.831
  174   HD21  LEU  28          3HD2      LEU  28  -2.838   0.017   4.113
  175   HD22  LEU  28          1HD2      LEU  28  -2.324   0.979   2.727
  176   HD23  LEU  28          2HD2      LEU  28  -2.447   1.725   4.321
  177    H    GLN  29           H        GLN  29   0.086  -0.523   7.393
  178    HA   GLN  29           HA       GLN  29   1.200   1.997   7.450
  179    HB2  GLN  29           1HB      GLN  29   0.757   0.045   9.711
  180    HB3  GLN  29           2HB      GLN  29   1.207   1.727   9.954
  181    HG2  GLN  29           1HG      GLN  29  -1.301   0.938  10.027
  182    HG3  GLN  29           2HG      GLN  29  -0.843   2.510   9.374
  183   HE21  GLN  29          1HE2      GLN  29  -0.739   2.759   7.092
  184   HE22  GLN  29          2HE2      GLN  29  -1.668   1.738   6.053
  185    H    GLU  30           H        GLU  30   2.671  -1.052   8.534
  186    HA   GLU  30           HA       GLU  30   5.079  -0.019   9.475
  187    HB2  GLU  30           1HB      GLU  30   4.552  -2.288   9.956
  188    HB3  GLU  30           2HB      GLU  30   4.394  -2.686   8.251
  189    HG2  GLU  30           1HG      GLU  30   6.437  -3.608   8.984
  190    HG3  GLU  30           2HG      GLU  30   6.838  -2.197   8.005
  191    H    HIS  31           H        HIS  31   3.907  -0.276   6.272
  192    HA   HIS  31           HA       HIS  31   6.563  -0.087   5.082
  193    HB2  HIS  31           1HB      HIS  31   5.271  -1.477   3.756
  194    HB3  HIS  31           2HB      HIS  31   3.801  -0.547   4.029
  195    HD1  HIS  31           HD1      HIS  31   6.887  -0.630   1.904
  196    HD2  HIS  31           HD2      HIS  31   3.359   1.540   2.239
  197    HE1  HIS  31           HE1      HIS  31   6.756   0.768  -0.183
  198    H    GLN  32           H        GLN  32   3.511   1.757   4.960
  199    HA   GLN  32           HA       GLN  32   4.170   3.939   3.546
  200    HB2  GLN  32           1HB      GLN  32   2.623   3.747   6.117
  201    HB3  GLN  32           2HB      GLN  32   2.807   5.282   5.278
  202    HG2  GLN  32           1HG      GLN  32   1.922   3.961   3.224
  203    HG3  GLN  32           2HG      GLN  32   1.327   2.833   4.440
  204   HE21  GLN  32          1HE2      GLN  32  -0.723   3.555   3.370
  205   HE22  GLN  32          2HE2      GLN  32  -1.520   4.931   4.043
  206    H    ARG  33           H        ARG  33   5.497   3.075   6.636
  207    HA   ARG  33           HA       ARG  33   6.499   5.447   7.590
  208    HB2  ARG  33           1HB      ARG  33   8.156   2.936   7.598
  209    HB3  ARG  33           2HB      ARG  33   8.063   4.190   8.827
  210    HG2  ARG  33           1HG      ARG  33   5.553   3.412   8.955
  211    HG3  ARG  33           2HG      ARG  33   6.221   1.925   8.279
  212    HD2  ARG  33           1HD      ARG  33   7.694   1.651  10.121
  213    HD3  ARG  33           2HD      ARG  33   7.356   3.275  10.717
  214    HE   ARG  33           HE       ARG  33   5.068   1.514  10.600
  215   HH11  ARG  33          1HH1      ARG  33   7.700   2.738  12.521
  216   HH12  ARG  33          2HH1      ARG  33   6.947   2.354  14.034
  217   HH21  ARG  33          1HH2      ARG  33   4.066   1.003  12.585
  218   HH22  ARG  33          2HH2      ARG  33   4.880   1.367  14.068
  219    H    ILE  34           H        ILE  34   8.004   3.294   5.195
  220    HA   ILE  34           HA       ILE  34  10.392   4.567   4.774
  221    HB   ILE  34           HB       ILE  34  10.421   3.666   2.540
  222   HG12  ILE  34          1HG1      ILE  34   7.586   2.746   2.713
  223   HG13  ILE  34          2HG1      ILE  34   7.891   4.418   2.254
  224   HG21  ILE  34          1HG2      ILE  34  10.851   1.854   3.811
  225   HG22  ILE  34          2HG2      ILE  34   9.402   2.066   4.792
  226   HG23  ILE  34          3HG2      ILE  34   9.288   1.313   3.201
  227   HD11  ILE  34          3HD1      ILE  34   8.988   1.987   0.860
  228   HD12  ILE  34          1HD1      ILE  34   7.636   2.976   0.310
  229   HD13  ILE  34          2HD1      ILE  34   9.258   3.666   0.390
  230    H    HIS  35           H        HIS  35   7.245   5.748   4.080
  231    HA   HIS  35           HA       HIS  35   8.200   7.772   2.218
  232    HB2  HIS  35           1HB      HIS  35   5.441   7.208   3.323
  233    HB3  HIS  35           2HB      HIS  35   5.806   8.466   2.146
  234    HD1  HIS  35           HD1      HIS  35   5.925   7.781  -0.270
  235    HD2  HIS  35           HD2      HIS  35   5.794   4.530   2.313
  236    HE1  HIS  35           HE1      HIS  35   5.620   5.765  -1.742
  237    H    THR  36           H        THR  36   6.467   7.723   5.335
  238    HA   THR  36           HA       THR  36   6.315  10.323   5.993
  239    HB   THR  36           HB       THR  36   6.414   9.765   8.298
  240    HG1  THR  36           HG1      THR  36   7.361   7.665   8.903
  241   HG21  THR  36          3HG2      THR  36   4.960   7.892   8.458
  242   HG22  THR  36          1HG2      THR  36   5.587   7.190   6.968
  243   HG23  THR  36          2HG2      THR  36   4.614   8.660   6.909
  244    H    GLY  37           H        GLY  37   7.837  11.755   5.302
  245    HA2  GLY  37           1HA      GLY  37   9.709  13.039   6.169
  246    HA3  GLY  37           2HA      GLY  37  10.495  11.517   6.562
  247    H    GLU  38           H        GLU  38   9.137  13.185   3.716
  248    HA   GLU  38           HA       GLU  38  11.444  12.192   2.175
  249    HB2  GLU  38           1HB      GLU  38   9.952  12.552   0.166
  250    HB3  GLU  38           2HB      GLU  38   9.479  11.245   1.241
  251    HG2  GLU  38           1HG      GLU  38   8.288  13.991   1.437
  252    HG3  GLU  38           2HG      GLU  38   7.638  12.749   0.368
  253    H    LYS  39           H        LYS  39  12.779  13.632   1.278
  254    HA   LYS  39           HA       LYS  39  12.213  16.464   1.672
  255    HB2  LYS  39           1HB      LYS  39  14.685  14.889   1.012
  256    HB3  LYS  39           2HB      LYS  39  14.645  16.632   0.780
  257    HG2  LYS  39           1HG      LYS  39  15.582  16.341   2.893
  258    HG3  LYS  39           2HG      LYS  39  13.900  16.767   3.216
  259    HD2  LYS  39           1HD      LYS  39  13.464  14.251   3.305
  260    HD3  LYS  39           2HD      LYS  39  15.218  14.070   3.390
  261    HE2  LYS  39           1HE      LYS  39  13.870  15.956   5.262
  262    HE3  LYS  39           2HE      LYS  39  13.754  14.225   5.572
  263    HZ1  LYS  39           3HZ      LYS  39  15.632  15.080   6.737
  264    HZ2  LYS  39           1HZ      LYS  39  16.237  15.834   5.348
  265    HZ3  LYS  39           2HZ      LYS  39  16.213  14.146   5.452
  266    HA   PRO  40           HA       PRO  40  11.104  17.221  -2.520
  267    HB2  PRO  40           1HB      PRO  40  11.724  19.860  -2.663
  268    HB3  PRO  40           2HB      PRO  40  10.314  19.251  -1.788
  269    HG2  PRO  40           1HG      PRO  40  12.995  20.060  -0.730
  270    HG3  PRO  40           2HG      PRO  40  11.383  20.407  -0.078
  271    HD2  PRO  40           1HD      PRO  40  12.967  18.449   0.918
  272    HD3  PRO  40           2HD      PRO  40  11.196  18.331   0.905
  273    H    SER  41           H        SER  41  12.226  18.977  -4.272
  274    HA   SER  41           HA       SER  41  14.600  17.571  -5.070
  275    HB2  SER  41           1HB      SER  41  13.083  19.886  -6.282
  276    HB3  SER  41           2HB      SER  41  14.537  19.202  -7.009
  277    HG   SER  41           HG       SER  41  12.046  17.935  -6.555
  278    H    GLY  42           H        GLY  42  15.745  18.253  -3.031
  279    HA2  GLY  42           1HA      GLY  42  17.557  19.383  -2.169
  280    HA3  GLY  42           2HA      GLY  42  17.634  20.290  -3.673
  281    HA   PRO  43           HA       PRO  43  14.607  22.592  -0.641
  282    HB2  PRO  43           1HB      PRO  43  14.931  21.961   1.980
  283    HB3  PRO  43           2HB      PRO  43  13.770  21.139   0.930
  284    HG2  PRO  43           1HG      PRO  43  16.508  20.270   1.775
  285    HG3  PRO  43           2HG      PRO  43  15.016  19.317   1.663
  286    HD2  PRO  43           1HD      PRO  43  16.938  19.245  -0.243
  287    HD3  PRO  43           2HD      PRO  43  15.215  19.042  -0.617
  288    H    SER  44           H        SER  44  17.840  21.648   0.401
  289    HA   SER  44           HA       SER  44  18.571  24.462   0.602
  290    HB2  SER  44           1HB      SER  44  19.192  22.530   2.847
  291    HB3  SER  44           2HB      SER  44  19.567  24.253   2.792
  292    HG   SER  44           HG       SER  44  17.568  23.437   3.961
  293    H    SER  45           H        SER  45  20.853  24.833   0.510
  294    HA   SER  45           HA       SER  45  22.209  22.861  -1.104
  295    HB2  SER  45           1HB      SER  45  22.839  25.674  -0.243
  296    HB3  SER  45           2HB      SER  45  24.066  24.671  -1.016
  297    HG   SER  45           HG       SER  45  23.145  25.507  -2.742
  298    H    GLY  46           H        GLY  46  23.101  21.174  -0.095
  299    HA2  GLY  46           1HA      GLY  46  25.383  21.170   1.340
  300    HA3  GLY  46           2HA      GLY  46  24.168  21.418   2.586
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1 -10.262  -0.871 -32.202
    2    HA2  GLY   1           1HA      GLY   1  -9.520  -0.530 -29.912
    3    HA3  GLY   1           2HA      GLY   1 -11.271  -0.677 -29.902
    4    H    SER   2           H        SER   2  -8.519  -1.715 -28.441
    5    HA   SER   2           HA       SER   2  -9.872  -4.119 -27.419
    6    HB2  SER   2           1HB      SER   2  -7.600  -5.190 -27.232
    7    HB3  SER   2           2HB      SER   2  -8.161  -4.952 -28.887
    8    HG   SER   2           HG       SER   2  -6.469  -3.769 -29.210
    9    H    SER   3           H        SER   3 -10.054  -4.162 -25.277
   10    HA   SER   3           HA       SER   3  -8.281  -2.420 -23.691
   11    HB2  SER   3           1HB      SER   3 -10.699  -1.657 -23.894
   12    HB3  SER   3           2HB      SER   3 -11.136  -3.088 -22.961
   13    HG   SER   3           HG       SER   3  -9.458  -2.210 -21.426
   14    H    GLY   4           H        GLY   4  -7.425  -3.235 -21.822
   15    HA2  GLY   4           1HA      GLY   4  -8.000  -6.084 -21.287
   16    HA3  GLY   4           2HA      GLY   4  -6.411  -5.357 -21.100
   17    H    SER   5           H        SER   5  -7.382  -6.760 -19.022
   18    HA   SER   5           HA       SER   5  -7.795  -4.668 -17.027
   19    HB2  SER   5           1HB      SER   5 -10.053  -5.380 -17.413
   20    HB3  SER   5           2HB      SER   5  -9.587  -7.080 -17.363
   21    HG   SER   5           HG       SER   5  -9.067  -6.791 -15.156
   22    H    SER   6           H        SER   6  -6.734  -5.030 -15.150
   23    HA   SER   6           HA       SER   6  -4.764  -7.068 -15.067
   24    HB2  SER   6           1HB      SER   6  -4.871  -4.684 -13.921
   25    HB3  SER   6           2HB      SER   6  -5.566  -5.604 -12.586
   26    HG   SER   6           HG       SER   6  -3.182  -6.446 -13.828
   27    H    GLY   7           H        GLY   7  -4.494  -8.620 -13.272
   28    HA2  GLY   7           1HA      GLY   7  -7.061  -9.942 -12.730
   29    HA3  GLY   7           2HA      GLY   7  -5.480 -10.710 -12.688
   30    H    THR   8           H        THR   8  -4.512 -10.970 -10.773
   31    HA   THR   8           HA       THR   8  -5.734 -10.791  -8.368
   32    HB   THR   8           HB       THR   8  -3.568 -11.897  -8.667
   33    HG1  THR   8           HG1      THR   8  -2.573 -10.781  -6.675
   34   HG21  THR   8          3HG2      THR   8  -2.128  -9.304  -8.364
   35   HG22  THR   8          1HG2      THR   8  -2.688  -9.778  -9.967
   36   HG23  THR   8          2HG2      THR   8  -1.579 -10.820  -9.077
   37    H    GLY   9           H        GLY   9  -5.582  -9.357  -6.544
   38    HA2  GLY   9           1HA      GLY   9  -4.556  -7.028  -6.017
   39    HA3  GLY   9           2HA      GLY   9  -5.540  -6.545  -7.391
   40    H    GLU  10           H        GLU  10  -6.288  -8.829  -4.782
   41    HA   GLU  10           HA       GLU  10  -8.726  -7.297  -4.248
   42    HB2  GLU  10           1HB      GLU  10  -8.695  -9.830  -4.724
   43    HB3  GLU  10           2HB      GLU  10  -8.066  -9.994  -3.091
   44    HG2  GLU  10           1HG      GLU  10 -10.268 -10.239  -2.645
   45    HG3  GLU  10           2HG      GLU  10 -10.164  -8.483  -2.527
   46    H    LYS  11           H        LYS  11  -5.709  -7.169  -3.188
   47    HA   LYS  11           HA       LYS  11  -5.668  -7.497  -0.453
   48    HB2  LYS  11           1HB      LYS  11  -4.239  -5.714  -2.356
   49    HB3  LYS  11           2HB      LYS  11  -4.117  -5.327  -0.645
   50    HG2  LYS  11           1HG      LYS  11  -2.283  -6.675  -0.966
   51    HG3  LYS  11           2HG      LYS  11  -3.485  -7.830  -0.386
   52    HD2  LYS  11           1HD      LYS  11  -4.000  -8.371  -2.771
   53    HD3  LYS  11           2HD      LYS  11  -2.641  -7.348  -3.241
   54    HE2  LYS  11           1HE      LYS  11  -2.335  -9.632  -1.313
   55    HE3  LYS  11           2HE      LYS  11  -2.212  -9.856  -3.057
   56    HZ1  LYS  11           3HZ      LYS  11  -0.066  -9.381  -2.721
   57    HZ2  LYS  11           1HZ      LYS  11  -0.340  -8.655  -1.217
   58    HZ3  LYS  11           2HZ      LYS  11  -0.572  -7.769  -2.639
   59    HA   PRO  12           HA       PRO  12  -8.780  -4.596   0.858
   60    HB2  PRO  12           1HB      PRO  12  -8.446  -5.011   3.521
   61    HB3  PRO  12           2HB      PRO  12  -9.315  -6.140   2.474
   62    HG2  PRO  12           1HG      PRO  12  -6.495  -6.268   3.471
   63    HG3  PRO  12           2HG      PRO  12  -7.701  -7.563   3.354
   64    HD2  PRO  12           1HD      PRO  12  -5.725  -7.244   1.531
   65    HD3  PRO  12           2HD      PRO  12  -7.326  -7.882   1.103
   66    H    TYR  13           H        TYR  13  -5.502  -4.274   0.966
   67    HA   TYR  13           HA       TYR  13  -5.716  -1.559   2.034
   68    HB2  TYR  13           1HB      TYR  13  -3.776  -3.663   2.981
   69    HB3  TYR  13           2HB      TYR  13  -3.462  -1.943   3.183
   70    HD1  TYR  13           HD2      TYR  13  -4.836  -0.598   4.703
   71    HD2  TYR  13           HD1      TYR  13  -5.447  -4.790   4.306
   72    HE1  TYR  13           HE2      TYR  13  -6.156  -0.597   6.779
   73    HE2  TYR  13           HE1      TYR  13  -6.769  -4.800   6.380
   74    HH   TYR  13           HH       TYR  13  -7.616  -1.816   8.033
   75    H    ASN  14           H        ASN  14  -4.201  -0.096   1.203
   76    HA   ASN  14           HA       ASN  14  -2.232  -1.021  -0.714
   77    HB2  ASN  14           1HB      ASN  14  -4.609   0.663  -1.519
   78    HB3  ASN  14           2HB      ASN  14  -3.141   0.543  -2.485
   79   HD21  ASN  14          1HD2      ASN  14  -5.978  -1.098  -1.359
   80   HD22  ASN  14          2HD2      ASN  14  -5.868  -2.453  -2.425
   81    H    CYS  15           H        CYS  15  -0.909   0.799  -1.561
   82    HA   CYS  15           HA       CYS  15  -0.638   2.867   0.509
   83    HB2  CYS  15           1HB      CYS  15   1.280   1.264  -0.007
   84    HB3  CYS  15           2HB      CYS  15   1.440   2.111  -1.542
   85    H    GLU  16           H        GLU  16  -1.283   4.849   0.024
   86    HA   GLU  16           HA       GLU  16  -1.814   5.576  -2.733
   87    HB2  GLU  16           1HB      GLU  16  -3.234   6.102  -0.574
   88    HB3  GLU  16           2HB      GLU  16  -2.152   7.482  -0.456
   89    HG2  GLU  16           1HG      GLU  16  -2.806   7.909  -2.916
   90    HG3  GLU  16           2HG      GLU  16  -4.163   6.839  -2.569
   91    H    GLU  17           H        GLU  17   0.964   5.296  -1.539
   92    HA   GLU  17           HA       GLU  17   1.940   7.998  -2.195
   93    HB2  GLU  17           1HB      GLU  17   2.994   5.902  -0.314
   94    HB3  GLU  17           2HB      GLU  17   4.040   7.169  -0.939
   95    HG2  GLU  17           1HG      GLU  17   1.451   7.872   0.370
   96    HG3  GLU  17           2HG      GLU  17   2.867   7.481   1.344
   97    H    CYS  18           H        CYS  18   2.404   4.545  -2.684
   98    HA   CYS  18           HA       CYS  18   4.103   5.174  -5.008
   99    HB2  CYS  18           1HB      CYS  18   5.246   2.996  -4.619
  100    HB3  CYS  18           2HB      CYS  18   5.496   4.154  -3.316
  101    H    GLY  19           H        GLY  19   1.886   2.781  -3.589
  102    HA2  GLY  19           1HA      GLY  19  -0.082   2.249  -5.015
  103    HA3  GLY  19           2HA      GLY  19   1.060   2.084  -6.340
  104    H    LYS  20           H        LYS  20   1.498   0.915  -3.041
  105    HA   LYS  20           HA       LYS  20   1.720  -1.806  -4.123
  106    HB2  LYS  20           1HB      LYS  20   3.579  -0.588  -2.732
  107    HB3  LYS  20           2HB      LYS  20   2.583  -1.047  -1.357
  108    HG2  LYS  20           1HG      LYS  20   2.739  -3.400  -2.056
  109    HG3  LYS  20           2HG      LYS  20   3.794  -2.915  -3.385
  110    HD2  LYS  20           1HD      LYS  20   5.272  -1.859  -1.581
  111    HD3  LYS  20           2HD      LYS  20   4.325  -2.804  -0.430
  112    HE2  LYS  20           1HE      LYS  20   6.056  -4.250  -0.844
  113    HE3  LYS  20           2HE      LYS  20   4.897  -4.777  -2.063
  114    HZ1  LYS  20           3HZ      LYS  20   6.274  -2.834  -3.339
  115    HZ2  LYS  20           1HZ      LYS  20   6.577  -4.492  -3.479
  116    HZ3  LYS  20           2HZ      LYS  20   7.479  -3.556  -2.397
  117    H    ALA  21           H        ALA  21   0.606  -3.523  -3.224
  118    HA   ALA  21           HA       ALA  21  -1.708  -2.765  -1.582
  119    HB1  ALA  21           3HB      ALA  21  -2.014  -5.406  -2.496
  120    HB2  ALA  21           1HB      ALA  21  -2.861  -3.961  -3.051
  121    HB3  ALA  21           2HB      ALA  21  -1.377  -4.476  -3.853
  122    H    PHE  22           H        PHE  22  -2.356  -4.082   0.183
  123    HA   PHE  22           HA       PHE  22  -0.352  -5.962   1.201
  124    HB2  PHE  22           1HB      PHE  22  -1.471  -3.590   2.700
  125    HB3  PHE  22           2HB      PHE  22  -0.663  -4.938   3.494
  126    HD1  PHE  22           HD2      PHE  22  -0.196  -2.198   1.060
  127    HD2  PHE  22           HD1      PHE  22   1.682  -5.079   3.567
  128    HE1  PHE  22           HE2      PHE  22   1.979  -1.118   0.665
  129    HE2  PHE  22           HE1      PHE  22   3.860  -4.004   3.177
  130    HZ   PHE  22           HZ       PHE  22   4.011  -2.021   1.724
  131    H    ILE  23           H        ILE  23  -1.252  -7.060   3.261
  132    HA   ILE  23           HA       ILE  23  -3.998  -7.886   2.646
  133    HB   ILE  23           HB       ILE  23  -1.824  -9.239   4.242
  134   HG12  ILE  23          1HG1      ILE  23  -1.926  -9.224   1.634
  135   HG13  ILE  23          2HG1      ILE  23  -1.632 -10.740   2.477
  136   HG21  ILE  23          1HG2      ILE  23  -3.630 -11.147   4.147
  137   HG22  ILE  23          2HG2      ILE  23  -3.650  -9.941   5.433
  138   HG23  ILE  23          3HG2      ILE  23  -4.745  -9.783   4.059
  139   HD11  ILE  23          3HD1      ILE  23  -3.462 -10.410   0.532
  140   HD12  ILE  23          1HD1      ILE  23  -3.566 -11.639   1.792
  141   HD13  ILE  23          2HD1      ILE  23  -4.454 -10.124   1.961
  142    H    HIS  24           H        HIS  24  -1.939  -7.104   5.443
  143    HA   HIS  24           HA       HIS  24  -4.379  -6.537   6.988
  144    HB2  HIS  24           1HB      HIS  24  -1.589  -7.278   7.873
  145    HB3  HIS  24           2HB      HIS  24  -2.825  -6.696   8.984
  146    HD2  HIS  24           HD2      HIS  24  -1.947  -9.898   6.946
  147    HE1  HIS  24           HE1      HIS  24  -5.254 -10.766   9.457
  148    HE2  HIS  24           HE2      HIS  24  -3.484 -11.724   7.942
  149    H    ASP  25           H        ASP  25  -4.167  -4.743   8.591
  150    HA   ASP  25           HA       ASP  25  -3.387  -2.356   7.260
  151    HB2  ASP  25           1HB      ASP  25  -5.289  -2.584   8.906
  152    HB3  ASP  25           2HB      ASP  25  -4.081  -2.649  10.186
  153    H    SER  26           H        SER  26  -2.183  -3.907  10.237
  154    HA   SER  26           HA       SER  26  -0.135  -2.203  10.871
  155    HB2  SER  26           1HB      SER  26  -0.062  -5.225  11.058
  156    HB3  SER  26           2HB      SER  26   0.966  -4.112  11.960
  157    HG   SER  26           HG       SER  26  -0.597  -3.844  13.328
  158    H    GLN  27           H        GLN  27  -0.146  -4.748   8.431
  159    HA   GLN  27           HA       GLN  27   2.582  -4.715   7.794
  160    HB2  GLN  27           1HB      GLN  27   0.128  -5.440   6.209
  161    HB3  GLN  27           2HB      GLN  27   1.740  -5.547   5.514
  162    HG2  GLN  27           1HG      GLN  27   2.206  -6.939   7.708
  163    HG3  GLN  27           2HG      GLN  27   0.465  -7.198   7.621
  164   HE21  GLN  27          1HE2      GLN  27  -0.236  -7.691   5.241
  165   HE22  GLN  27          2HE2      GLN  27   0.681  -8.937   4.471
  166    H    LEU  28           H        LEU  28  -0.108  -3.090   6.104
  167    HA   LEU  28           HA       LEU  28   1.428  -1.648   4.290
  168    HB2  LEU  28           1HB      LEU  28  -0.884  -1.734   3.914
  169    HB3  LEU  28           2HB      LEU  28  -1.255  -1.144   5.532
  170    HG   LEU  28           HG       LEU  28  -0.256   1.068   4.811
  171   HD11  LEU  28          1HD1      LEU  28   0.918   0.934   2.904
  172   HD12  LEU  28          2HD1      LEU  28  -0.657   1.116   2.133
  173   HD13  LEU  28          3HD1      LEU  28   0.041  -0.489   2.341
  174   HD21  LEU  28          3HD2      LEU  28  -2.783  -0.112   3.744
  175   HD22  LEU  28          1HD2      LEU  28  -2.327   1.532   3.296
  176   HD23  LEU  28          2HD2      LEU  28  -2.553   1.112   4.994
  177    H    GLN  29           H        GLN  29   0.236  -0.643   7.488
  178    HA   GLN  29           HA       GLN  29   1.225   1.935   7.543
  179    HB2  GLN  29           1HB      GLN  29   0.840  -0.096   9.731
  180    HB3  GLN  29           2HB      GLN  29   1.408   1.533  10.071
  181    HG2  GLN  29           1HG      GLN  29  -1.234   0.697   8.919
  182    HG3  GLN  29           2HG      GLN  29  -0.920   1.529  10.441
  183   HE21  GLN  29          1HE2      GLN  29  -1.812   1.896   7.257
  184   HE22  GLN  29          2HE2      GLN  29  -1.582   3.601   7.107
  185    H    GLU  30           H        GLU  30   2.873  -1.068   8.479
  186    HA   GLU  30           HA       GLU  30   5.271   0.088   9.345
  187    HB2  GLU  30           1HB      GLU  30   4.699  -2.241   9.803
  188    HB3  GLU  30           2HB      GLU  30   4.799  -2.620   8.089
  189    HG2  GLU  30           1HG      GLU  30   7.090  -2.527   8.057
  190    HG3  GLU  30           2HG      GLU  30   7.174  -1.458   9.456
  191    H    HIS  31           H        HIS  31   3.943  -0.046   6.250
  192    HA   HIS  31           HA       HIS  31   6.557   0.202   4.940
  193    HB2  HIS  31           1HB      HIS  31   5.278  -1.363   3.757
  194    HB3  HIS  31           2HB      HIS  31   3.796  -0.430   3.939
  195    HD1  HIS  31           HD1      HIS  31   7.128  -0.145   2.129
  196    HD2  HIS  31           HD2      HIS  31   3.163   1.037   1.751
  197    HE1  HIS  31           HE1      HIS  31   6.973   0.981  -0.114
  198    H    GLN  32           H        GLN  32   3.382   1.810   5.046
  199    HA   GLN  32           HA       GLN  32   3.917   4.025   3.512
  200    HB2  GLN  32           1HB      GLN  32   2.208   3.711   5.973
  201    HB3  GLN  32           2HB      GLN  32   2.271   5.217   5.066
  202    HG2  GLN  32           1HG      GLN  32   1.664   3.777   3.030
  203    HG3  GLN  32           2HG      GLN  32   1.205   2.555   4.215
  204   HE21  GLN  32          1HE2      GLN  32  -0.830   3.096   2.859
  205   HE22  GLN  32          2HE2      GLN  32  -1.893   4.257   3.570
  206    H    ARG  33           H        ARG  33   5.285   3.186   6.531
  207    HA   ARG  33           HA       ARG  33   5.945   5.776   7.476
  208    HB2  ARG  33           1HB      ARG  33   7.662   4.529   8.846
  209    HB3  ARG  33           2HB      ARG  33   5.999   3.988   9.042
  210    HG2  ARG  33           1HG      ARG  33   6.384   2.059   7.707
  211    HG3  ARG  33           2HG      ARG  33   7.969   2.651   7.206
  212    HD2  ARG  33           1HD      ARG  33   7.248   2.053  10.067
  213    HD3  ARG  33           2HD      ARG  33   7.985   0.871   8.986
  214    HE   ARG  33           HE       ARG  33   9.437   3.345   9.153
  215   HH11  ARG  33          1HH1      ARG  33   8.941   0.214  10.593
  216   HH12  ARG  33          2HH1      ARG  33  10.508   0.161  11.331
  217   HH21  ARG  33          1HH2      ARG  33  11.502   3.287  10.119
  218   HH22  ARG  33          2HH2      ARG  33  11.964   1.910  11.062
  219    H    ILE  34           H        ILE  34   7.573   3.473   5.365
  220    HA   ILE  34           HA       ILE  34  10.091   4.652   5.237
  221    HB   ILE  34           HB       ILE  34  10.510   3.374   3.342
  222   HG12  ILE  34          1HG1      ILE  34   7.550   3.480   2.721
  223   HG13  ILE  34          2HG1      ILE  34   8.815   4.379   1.891
  224   HG21  ILE  34          1HG2      ILE  34  10.092   1.401   4.274
  225   HG22  ILE  34          2HG2      ILE  34   9.045   2.235   5.422
  226   HG23  ILE  34          3HG2      ILE  34   8.365   1.548   3.947
  227   HD11  ILE  34          3HD1      ILE  34   9.809   2.110   1.309
  228   HD12  ILE  34          1HD1      ILE  34   8.264   1.437   1.827
  229   HD13  ILE  34          2HD1      ILE  34   8.323   2.583   0.487
  230    H    HIS  35           H        HIS  35   7.078   5.695   3.919
  231    HA   HIS  35           HA       HIS  35   8.247   7.472   1.967
  232    HB2  HIS  35           1HB      HIS  35   5.427   7.051   2.953
  233    HB3  HIS  35           2HB      HIS  35   5.846   8.307   1.792
  234    HD1  HIS  35           HD1      HIS  35   6.683   7.489  -0.568
  235    HD2  HIS  35           HD2      HIS  35   5.224   4.500   1.921
  236    HE1  HIS  35           HE1      HIS  35   6.297   5.502  -2.060
  237    H    THR  36           H        THR  36   7.296   7.601   5.286
  238    HA   THR  36           HA       THR  36   7.285  10.510   5.357
  239    HB   THR  36           HB       THR  36   6.460  10.379   7.532
  240    HG1  THR  36           HG1      THR  36   7.058   7.654   7.878
  241   HG21  THR  36          3HG2      THR  36   5.510   7.828   6.224
  242   HG22  THR  36          1HG2      THR  36   4.863   9.439   5.919
  243   HG23  THR  36          2HG2      THR  36   4.684   8.704   7.512
  244    H    GLY  37           H        GLY  37   9.725   9.626   4.509
  245    HA2  GLY  37           1HA      GLY  37  11.682   9.048   6.372
  246    HA3  GLY  37           2HA      GLY  37  11.958   9.987   4.913
  247    H    GLU  38           H        GLU  38  13.581  10.825   6.639
  248    HA   GLU  38           HA       GLU  38  12.366  13.218   7.842
  249    HB2  GLU  38           1HB      GLU  38  14.143  11.185   9.108
  250    HB3  GLU  38           2HB      GLU  38  14.351  12.869   9.569
  251    HG2  GLU  38           1HG      GLU  38  12.846  12.238  11.140
  252    HG3  GLU  38           2HG      GLU  38  11.733  12.745   9.870
  253    H    LYS  39           H        LYS  39  13.100  14.843   6.635
  254    HA   LYS  39           HA       LYS  39  15.962  15.257   6.428
  255    HB2  LYS  39           1HB      LYS  39  15.600  14.003   4.409
  256    HB3  LYS  39           2HB      LYS  39  14.192  14.974   3.997
  257    HG2  LYS  39           1HG      LYS  39  15.948  16.935   4.053
  258    HG3  LYS  39           2HG      LYS  39  17.081  15.616   3.750
  259    HD2  LYS  39           1HD      LYS  39  15.749  14.943   1.796
  260    HD3  LYS  39           2HD      LYS  39  14.651  16.293   2.092
  261    HE2  LYS  39           1HE      LYS  39  16.329  17.886   1.604
  262    HE3  LYS  39           2HE      LYS  39  17.604  16.670   1.667
  263    HZ1  LYS  39           3HZ      LYS  39  15.619  16.020  -0.273
  264    HZ2  LYS  39           1HZ      LYS  39  17.293  16.179  -0.461
  265    HZ3  LYS  39           2HZ      LYS  39  16.296  17.541  -0.573
  266    HA   PRO  40           HA       PRO  40  14.663  19.414   7.081
  267    HB2  PRO  40           1HB      PRO  40  16.925  20.691   6.293
  268    HB3  PRO  40           2HB      PRO  40  16.803  19.806   7.818
  269    HG2  PRO  40           1HG      PRO  40  17.999  18.938   5.215
  270    HG3  PRO  40           2HG      PRO  40  18.620  18.715   6.861
  271    HD2  PRO  40           1HD      PRO  40  17.347  16.747   5.506
  272    HD3  PRO  40           2HD      PRO  40  17.246  16.911   7.271
  273    H    SER  41           H        SER  41  15.222  21.643   5.743
  274    HA   SER  41           HA       SER  41  14.136  21.138   3.054
  275    HB2  SER  41           1HB      SER  41  12.660  22.433   4.552
  276    HB3  SER  41           2HB      SER  41  13.930  23.640   4.748
  277    HG   SER  41           HG       SER  41  13.402  24.465   2.891
  278    H    GLY  42           H        GLY  42  16.663  20.738   2.869
  279    HA2  GLY  42           1HA      GLY  42  17.673  22.653   1.121
  280    HA3  GLY  42           2HA      GLY  42  18.361  23.001   2.700
  281    HA   PRO  43           HA       PRO  43  21.500  20.013   2.078
  282    HB2  PRO  43           1HB      PRO  43  21.797  18.945   4.556
  283    HB3  PRO  43           2HB      PRO  43  22.324  20.582   4.146
  284    HG2  PRO  43           1HG      PRO  43  19.826  19.686   5.532
  285    HG3  PRO  43           2HG      PRO  43  20.894  21.048   5.920
  286    HD2  PRO  43           1HD      PRO  43  18.557  21.363   4.590
  287    HD3  PRO  43           2HD      PRO  43  19.968  22.399   4.299
  288    H    SER  44           H        SER  44  21.955  17.787   1.859
  289    HA   SER  44           HA       SER  44  19.858  15.888   2.580
  290    HB2  SER  44           1HB      SER  44  19.929  14.934   0.240
  291    HB3  SER  44           2HB      SER  44  19.149  16.510   0.377
  292    HG   SER  44           HG       SER  44  20.523  16.687  -1.321
  293    H    SER  45           H        SER  45  20.761  14.154   3.453
  294    HA   SER  45           HA       SER  45  23.522  13.470   2.682
  295    HB2  SER  45           1HB      SER  45  22.190  12.953   5.351
  296    HB3  SER  45           2HB      SER  45  23.873  12.627   4.936
  297    HG   SER  45           HG       SER  45  22.836  15.226   4.666
  298    H    GLY  46           H        GLY  46  20.699  11.927   4.238
  299    HA2  GLY  46           1HA      GLY  46  19.589  10.125   2.941
  300    HA3  GLY  46           2HA      GLY  46  21.204   9.571   2.525
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1  -6.451   7.341 -23.928
    2    HA2  GLY   1           1HA      GLY   1  -6.532   4.827 -23.904
    3    HA3  GLY   1           2HA      GLY   1  -5.619   4.919 -25.403
    4    H    SER   2           H        SER   2  -5.307   4.241 -22.252
    5    HA   SER   2           HA       SER   2  -2.449   4.539 -22.316
    6    HB2  SER   2           1HB      SER   2  -3.528   6.774 -21.456
    7    HB3  SER   2           2HB      SER   2  -3.748   5.864 -19.961
    8    HG   SER   2           HG       SER   2  -1.253   5.997 -21.283
    9    H    SER   3           H        SER   3  -1.452   3.668 -20.268
   10    HA   SER   3           HA       SER   3  -2.542   1.132 -19.699
   11    HB2  SER   3           1HB      SER   3  -0.384   2.666 -18.228
   12    HB3  SER   3           2HB      SER   3  -0.719   0.944 -18.041
   13    HG   SER   3           HG       SER   3   0.218   2.295 -20.349
   14    H    GLY   4           H        GLY   4  -2.643   0.439 -17.240
   15    HA2  GLY   4           1HA      GLY   4  -3.774   2.337 -15.426
   16    HA3  GLY   4           2HA      GLY   4  -5.014   1.346 -16.179
   17    H    SER   5           H        SER   5  -5.627  -0.274 -14.928
   18    HA   SER   5           HA       SER   5  -4.312  -1.125 -12.629
   19    HB2  SER   5           1HB      SER   5  -6.743  -1.510 -13.254
   20    HB3  SER   5           2HB      SER   5  -6.186  -2.853 -14.252
   21    HG   SER   5           HG       SER   5  -5.615  -3.957 -12.483
   22    H    SER   6           H        SER   6  -2.944  -2.796 -12.143
   23    HA   SER   6           HA       SER   6  -1.845  -4.313 -14.417
   24    HB2  SER   6           1HB      SER   6  -0.318  -3.099 -12.102
   25    HB3  SER   6           2HB      SER   6   0.379  -4.187 -13.303
   26    HG   SER   6           HG       SER   6   0.726  -1.975 -13.814
   27    H    GLY   7           H        GLY   7  -2.828  -6.245 -14.058
   28    HA2  GLY   7           1HA      GLY   7  -2.761  -8.393 -13.135
   29    HA3  GLY   7           2HA      GLY   7  -1.924  -7.740 -11.734
   30    H    THR   8           H        THR   8  -3.470  -9.223 -10.635
   31    HA   THR   8           HA       THR   8  -5.982  -7.790 -10.078
   32    HB   THR   8           HB       THR   8  -5.678 -10.798 -10.178
   33    HG1  THR   8           HG1      THR   8  -6.861  -8.931 -11.968
   34   HG21  THR   8          3HG2      THR   8  -7.322  -9.783  -8.520
   35   HG22  THR   8          1HG2      THR   8  -7.983 -10.937  -9.679
   36   HG23  THR   8          2HG2      THR   8  -8.220  -9.207  -9.924
   37    H    GLY   9           H        GLY   9  -5.444  -6.879  -8.154
   38    HA2  GLY   9           1HA      GLY   9  -4.351  -8.653  -6.067
   39    HA3  GLY   9           2HA      GLY   9  -4.192  -6.903  -6.083
   40    H    GLU  10           H        GLU  10  -5.704  -9.360  -4.569
   41    HA   GLU  10           HA       GLU  10  -8.243  -7.970  -4.167
   42    HB2  GLU  10           1HB      GLU  10  -7.241 -10.728  -3.650
   43    HB3  GLU  10           2HB      GLU  10  -8.529 -10.117  -2.621
   44    HG2  GLU  10           1HG      GLU  10  -9.762  -9.547  -4.768
   45    HG3  GLU  10           2HG      GLU  10  -8.561 -10.543  -5.588
   46    H    LYS  11           H        LYS  11  -5.473  -7.220  -3.081
   47    HA   LYS  11           HA       LYS  11  -5.554  -7.549  -0.267
   48    HB2  LYS  11           1HB      LYS  11  -4.024  -5.800  -2.152
   49    HB3  LYS  11           2HB      LYS  11  -3.971  -5.455  -0.428
   50    HG2  LYS  11           1HG      LYS  11  -2.108  -6.797  -0.807
   51    HG3  LYS  11           2HG      LYS  11  -3.309  -7.904  -0.138
   52    HD2  LYS  11           1HD      LYS  11  -3.914  -8.417  -2.575
   53    HD3  LYS  11           2HD      LYS  11  -2.394  -7.620  -2.986
   54    HE2  LYS  11           1HE      LYS  11  -1.154  -9.201  -1.654
   55    HE3  LYS  11           2HE      LYS  11  -2.647  -9.937  -1.072
   56    HZ1  LYS  11           3HZ      LYS  11  -2.038 -11.360  -2.745
   57    HZ2  LYS  11           1HZ      LYS  11  -1.389 -10.139  -3.720
   58    HZ3  LYS  11           2HZ      LYS  11  -3.066 -10.314  -3.589
   59    HA   PRO  12           HA       PRO  12  -8.789  -4.595   0.541
   60    HB2  PRO  12           1HB      PRO  12  -8.694  -4.812   3.245
   61    HB3  PRO  12           2HB      PRO  12  -9.462  -6.022   2.211
   62    HG2  PRO  12           1HG      PRO  12  -6.743  -6.052   3.461
   63    HG3  PRO  12           2HG      PRO  12  -7.929  -7.363   3.333
   64    HD2  PRO  12           1HD      PRO  12  -5.799  -7.159   1.674
   65    HD3  PRO  12           2HD      PRO  12  -7.353  -7.841   1.153
   66    H    TYR  13           H        TYR  13  -5.539  -4.226   0.895
   67    HA   TYR  13           HA       TYR  13  -5.864  -1.474   1.865
   68    HB2  TYR  13           1HB      TYR  13  -3.899  -3.531   2.843
   69    HB3  TYR  13           2HB      TYR  13  -3.549  -1.810   2.965
   70    HD1  TYR  13           HD2      TYR  13  -4.872  -0.375   4.449
   71    HD2  TYR  13           HD1      TYR  13  -5.560  -4.569   4.247
   72    HE1  TYR  13           HE2      TYR  13  -6.152  -0.261   6.547
   73    HE2  TYR  13           HE1      TYR  13  -6.843  -4.466   6.343
   74    HH   TYR  13           HH       TYR  13  -8.229  -2.377   7.551
   75    H    ASN  14           H        ASN  14  -4.124  -0.032   1.210
   76    HA   ASN  14           HA       ASN  14  -2.236  -0.887  -0.774
   77    HB2  ASN  14           1HB      ASN  14  -4.271   1.090  -1.766
   78    HB3  ASN  14           2HB      ASN  14  -3.123   0.126  -2.692
   79   HD21  ASN  14          1HD2      ASN  14  -3.581  -2.032  -3.120
   80   HD22  ASN  14          2HD2      ASN  14  -5.173  -2.681  -2.949
   81    H    CYS  15           H        CYS  15  -0.772   0.788  -1.398
   82    HA   CYS  15           HA       CYS  15  -0.647   2.937   0.584
   83    HB2  CYS  15           1HB      CYS  15   1.296   1.330   0.128
   84    HB3  CYS  15           2HB      CYS  15   1.511   2.199  -1.387
   85    H    GLU  16           H        GLU  16  -1.493   4.823   0.017
   86    HA   GLU  16           HA       GLU  16  -2.039   5.551  -2.674
   87    HB2  GLU  16           1HB      GLU  16  -3.435   6.361  -0.858
   88    HB3  GLU  16           2HB      GLU  16  -2.065   7.195  -0.139
   89    HG2  GLU  16           1HG      GLU  16  -1.933   8.651  -2.105
   90    HG3  GLU  16           2HG      GLU  16  -3.331   7.829  -2.795
   91    H    GLU  17           H        GLU  17   0.767   5.698  -0.806
   92    HA   GLU  17           HA       GLU  17   1.900   8.059  -1.990
   93    HB2  GLU  17           1HB      GLU  17   3.042   5.847  -0.290
   94    HB3  GLU  17           2HB      GLU  17   4.034   7.149  -0.931
   95    HG2  GLU  17           1HG      GLU  17   1.593   7.665   0.734
   96    HG3  GLU  17           2HG      GLU  17   3.186   7.404   1.441
   97    H    CYS  18           H        CYS  18   2.456   4.561  -2.332
   98    HA   CYS  18           HA       CYS  18   3.787   5.114  -4.903
   99    HB2  CYS  18           1HB      CYS  18   4.929   2.924  -4.589
  100    HB3  CYS  18           2HB      CYS  18   5.334   4.102  -3.344
  101    H    GLY  19           H        GLY  19   1.722   2.762  -3.209
  102    HA2  GLY  19           1HA      GLY  19  -0.406   2.246  -4.403
  103    HA3  GLY  19           2HA      GLY  19   0.584   2.040  -5.841
  104    H    LYS  20           H        LYS  20   1.784   0.930  -2.789
  105    HA   LYS  20           HA       LYS  20   1.835  -1.785  -3.776
  106    HB2  LYS  20           1HB      LYS  20   3.616  -0.458  -2.332
  107    HB3  LYS  20           2HB      LYS  20   2.659  -1.080  -0.994
  108    HG2  LYS  20           1HG      LYS  20   3.152  -3.303  -1.522
  109    HG3  LYS  20           2HG      LYS  20   3.703  -2.887  -3.146
  110    HD2  LYS  20           1HD      LYS  20   5.585  -1.617  -2.088
  111    HD3  LYS  20           2HD      LYS  20   5.077  -2.278  -0.532
  112    HE2  LYS  20           1HE      LYS  20   6.868  -3.624  -1.404
  113    HE3  LYS  20           2HE      LYS  20   5.374  -4.558  -1.457
  114    HZ1  LYS  20           3HZ      LYS  20   6.945  -4.513  -3.500
  115    HZ2  LYS  20           1HZ      LYS  20   6.205  -3.027  -3.826
  116    HZ3  LYS  20           2HZ      LYS  20   5.272  -4.435  -3.733
  117    H    ALA  21           H        ALA  21   0.335  -3.268  -3.393
  118    HA   ALA  21           HA       ALA  21  -1.856  -2.704  -1.604
  119    HB1  ALA  21           3HB      ALA  21  -2.910  -3.916  -3.136
  120    HB2  ALA  21           1HB      ALA  21  -1.381  -4.428  -3.851
  121    HB3  ALA  21           2HB      ALA  21  -2.081  -5.343  -2.515
  122    H    PHE  22           H        PHE  22  -2.393  -3.779   0.268
  123    HA   PHE  22           HA       PHE  22  -0.457  -5.734   1.299
  124    HB2  PHE  22           1HB      PHE  22  -1.512  -3.289   2.721
  125    HB3  PHE  22           2HB      PHE  22  -0.758  -4.637   3.567
  126    HD1  PHE  22           HD1      PHE  22   1.619  -5.098   3.305
  127    HD2  PHE  22           HD2      PHE  22  -0.215  -1.757   1.411
  128    HE1  PHE  22           HE1      PHE  22   3.838  -4.114   2.901
  129    HE2  PHE  22           HE2      PHE  22   2.000  -0.768   1.002
  130    HZ   PHE  22           HZ       PHE  22   4.030  -1.946   1.747
  131    H    ILE  23           H        ILE  23  -1.282  -7.229   2.813
  132    HA   ILE  23           HA       ILE  23  -4.068  -7.844   2.417
  133    HB   ILE  23           HB       ILE  23  -2.003  -9.239   4.124
  134   HG12  ILE  23          1HG1      ILE  23  -3.067 -10.221   1.493
  135   HG13  ILE  23          2HG1      ILE  23  -1.730  -9.078   1.539
  136   HG21  ILE  23          1HG2      ILE  23  -3.845 -11.121   3.521
  137   HG22  ILE  23          2HG2      ILE  23  -3.846 -10.178   5.010
  138   HG23  ILE  23          3HG2      ILE  23  -4.871  -9.694   3.659
  139   HD11  ILE  23          3HD1      ILE  23  -1.831 -11.910   2.459
  140   HD12  ILE  23          1HD1      ILE  23  -0.650 -11.103   1.428
  141   HD13  ILE  23          2HD1      ILE  23  -0.664 -10.792   3.164
  142    H    HIS  24           H        HIS  24  -2.012  -7.008   5.192
  143    HA   HIS  24           HA       HIS  24  -4.460  -6.420   6.723
  144    HB2  HIS  24           1HB      HIS  24  -1.741  -7.350   7.644
  145    HB3  HIS  24           2HB      HIS  24  -2.944  -6.689   8.748
  146    HD2  HIS  24           HD2      HIS  24  -2.018 -10.009   7.116
  147    HE1  HIS  24           HE1      HIS  24  -5.862 -10.516   8.838
  148    HE2  HIS  24           HE2      HIS  24  -3.850 -11.675   7.861
  149    H    ASP  25           H        ASP  25  -4.182  -4.674   8.375
  150    HA   ASP  25           HA       ASP  25  -3.225  -2.311   7.105
  151    HB2  ASP  25           1HB      ASP  25  -5.110  -1.969   8.450
  152    HB3  ASP  25           2HB      ASP  25  -4.448  -2.913   9.782
  153    H    SER  26           H        SER  26  -2.220  -4.032  10.058
  154    HA   SER  26           HA       SER  26  -0.114  -2.443  10.828
  155    HB2  SER  26           1HB      SER  26   0.765  -4.352  12.010
  156    HB3  SER  26           2HB      SER  26  -0.996  -4.443  12.065
  157    HG   SER  26           HG       SER  26   0.026  -5.700   9.882
  158    H    GLN  27           H        GLN  27  -0.375  -4.358   8.013
  159    HA   GLN  27           HA       GLN  27   2.476  -4.596   7.576
  160    HB2  GLN  27           1HB      GLN  27   0.101  -5.262   5.833
  161    HB3  GLN  27           2HB      GLN  27   1.773  -5.544   5.366
  162    HG2  GLN  27           1HG      GLN  27   2.051  -7.055   7.262
  163    HG3  GLN  27           2HG      GLN  27   0.377  -6.770   7.734
  164   HE21  GLN  27          1HE2      GLN  27   2.499  -8.318   5.474
  165   HE22  GLN  27          2HE2      GLN  27   1.309  -9.323   4.727
  166    H    LEU  28           H        LEU  28  -0.233  -2.811   6.125
  167    HA   LEU  28           HA       LEU  28   1.342  -1.406   4.241
  168    HB2  LEU  28           1HB      LEU  28  -0.977  -1.569   3.829
  169    HB3  LEU  28           2HB      LEU  28  -1.379  -0.921   5.418
  170    HG   LEU  28           HG       LEU  28  -0.423   1.274   4.656
  171   HD11  LEU  28          1HD1      LEU  28   0.279   1.647   2.525
  172   HD12  LEU  28          2HD1      LEU  28  -0.739   0.378   1.846
  173   HD13  LEU  28          3HD1      LEU  28   0.755  -0.044   2.682
  174   HD21  LEU  28          3HD2      LEU  28  -2.402   1.628   2.988
  175   HD22  LEU  28          1HD2      LEU  28  -2.723   1.276   4.686
  176   HD23  LEU  28          2HD2      LEU  28  -2.850  -0.005   3.481
  177    H    GLN  29           H        GLN  29   0.122  -0.544   7.460
  178    HA   GLN  29           HA       GLN  29   1.082   2.083   7.532
  179    HB2  GLN  29           1HB      GLN  29   0.592   0.095   9.750
  180    HB3  GLN  29           2HB      GLN  29   1.007   1.780  10.037
  181    HG2  GLN  29           1HG      GLN  29  -1.444   0.730   8.645
  182    HG3  GLN  29           2HG      GLN  29  -1.364   1.504  10.227
  183   HE21  GLN  29          1HE2      GLN  29  -1.617   1.955   6.863
  184   HE22  GLN  29          2HE2      GLN  29  -1.640   3.682   6.858
  185    H    GLU  30           H        GLU  30   2.626  -0.972   8.405
  186    HA   GLU  30           HA       GLU  30   4.992   0.204   9.456
  187    HB2  GLU  30           1HB      GLU  30   4.161  -2.134   9.917
  188    HB3  GLU  30           2HB      GLU  30   4.707  -2.572   8.305
  189    HG2  GLU  30           1HG      GLU  30   6.930  -2.394   8.857
  190    HG3  GLU  30           2HG      GLU  30   6.619  -1.289  10.195
  191    H    HIS  31           H        HIS  31   3.817   0.079   6.353
  192    HA   HIS  31           HA       HIS  31   6.492   0.033   5.138
  193    HB2  HIS  31           1HB      HIS  31   5.237  -1.447   3.887
  194    HB3  HIS  31           2HB      HIS  31   3.745  -0.539   4.113
  195    HD1  HIS  31           HD1      HIS  31   6.827  -0.664   1.983
  196    HD2  HIS  31           HD2      HIS  31   3.241   1.423   2.204
  197    HE1  HIS  31           HE1      HIS  31   6.653   0.604  -0.181
  198    H    GLN  32           H        GLN  32   3.484   1.916   5.213
  199    HA   GLN  32           HA       GLN  32   4.156   3.999   3.548
  200    HB2  GLN  32           1HB      GLN  32   2.456   3.831   6.008
  201    HB3  GLN  32           2HB      GLN  32   2.729   5.392   5.246
  202    HG2  GLN  32           1HG      GLN  32   1.896   4.387   3.108
  203    HG3  GLN  32           2HG      GLN  32   1.430   2.966   4.042
  204   HE21  GLN  32          1HE2      GLN  32  -0.744   3.164   3.722
  205   HE22  GLN  32          2HE2      GLN  32  -1.690   4.452   4.380
  206    H    ARG  33           H        ARG  33   5.570   3.167   6.543
  207    HA   ARG  33           HA       ARG  33   6.465   5.689   7.418
  208    HB2  ARG  33           1HB      ARG  33   8.297   4.262   8.545
  209    HB3  ARG  33           2HB      ARG  33   6.624   3.992   9.013
  210    HG2  ARG  33           1HG      ARG  33   6.502   1.967   7.879
  211    HG3  ARG  33           2HG      ARG  33   7.903   2.339   6.872
  212    HD2  ARG  33           1HD      ARG  33   8.001   1.873   9.850
  213    HD3  ARG  33           2HD      ARG  33   8.360   0.650   8.632
  214    HE   ARG  33           HE       ARG  33  10.052   2.825   9.461
  215   HH11  ARG  33          1HH1      ARG  33   9.326   0.555   6.923
  216   HH12  ARG  33          2HH1      ARG  33  10.914   0.621   6.232
  217   HH21  ARG  33          1HH2      ARG  33  12.146   2.920   8.561
  218   HH22  ARG  33          2HH2      ARG  33  12.517   1.965   7.165
  219    H    ILE  34           H        ILE  34   7.762   3.386   5.106
  220    HA   ILE  34           HA       ILE  34  10.338   4.391   4.805
  221    HB   ILE  34           HB       ILE  34  10.468   3.244   2.758
  222   HG12  ILE  34          1HG1      ILE  34   7.447   3.330   2.596
  223   HG13  ILE  34          2HG1      ILE  34   8.536   4.369   1.685
  224   HG21  ILE  34          1HG2      ILE  34   8.435   1.398   3.571
  225   HG22  ILE  34          2HG2      ILE  34  10.186   1.260   3.711
  226   HG23  ILE  34          3HG2      ILE  34   9.258   2.044   4.990
  227   HD11  ILE  34          3HD1      ILE  34   9.517   2.268   0.701
  228   HD12  ILE  34          1HD1      ILE  34   8.163   1.404   1.429
  229   HD13  ILE  34          2HD1      ILE  34   7.864   2.655   0.222
  230    H    HIS  35           H        HIS  35   7.303   5.689   3.775
  231    HA   HIS  35           HA       HIS  35   8.455   7.502   1.843
  232    HB2  HIS  35           1HB      HIS  35   5.671   7.288   3.002
  233    HB3  HIS  35           2HB      HIS  35   6.135   8.443   1.756
  234    HD1  HIS  35           HD1      HIS  35   6.467   7.545  -0.628
  235    HD2  HIS  35           HD2      HIS  35   5.451   4.618   2.140
  236    HE1  HIS  35           HE1      HIS  35   5.880   5.511  -1.985
  237    H    THR  36           H        THR  36   7.393   7.587   5.183
  238    HA   THR  36           HA       THR  36   8.256  10.402   5.343
  239    HB   THR  36           HB       THR  36   5.869  10.083   5.884
  240    HG1  THR  36           HG1      THR  36   7.746  11.012   7.734
  241   HG21  THR  36          3HG2      THR  36   6.527   7.730   6.970
  242   HG22  THR  36          1HG2      THR  36   5.074   8.616   7.434
  243   HG23  THR  36          2HG2      THR  36   6.526   8.716   8.432
  244    H    GLY  37           H        GLY  37  10.453   9.767   5.658
  245    HA2  GLY  37           1HA      GLY  37  10.963   8.866   8.417
  246    HA3  GLY  37           2HA      GLY  37  11.844   8.146   7.078
  247    H    GLU  38           H        GLU  38  13.333   9.446   5.894
  248    HA   GLU  38           HA       GLU  38  14.542  11.508   7.559
  249    HB2  GLU  38           1HB      GLU  38  15.874   9.622   6.536
  250    HB3  GLU  38           2HB      GLU  38  15.592  10.367   4.969
  251    HG2  GLU  38           1HG      GLU  38  16.724  12.399   5.745
  252    HG3  GLU  38           2HG      GLU  38  17.037  11.618   7.294
  253    H    LYS  39           H        LYS  39  12.888  13.102   7.173
  254    HA   LYS  39           HA       LYS  39  13.335  14.539   4.652
  255    HB2  LYS  39           1HB      LYS  39  10.724  13.690   5.844
  256    HB3  LYS  39           2HB      LYS  39  10.806  15.196   4.939
  257    HG2  LYS  39           1HG      LYS  39  11.415  14.090   2.953
  258    HG3  LYS  39           2HG      LYS  39  11.773  12.588   3.809
  259    HD2  LYS  39           1HD      LYS  39   9.520  12.094   4.134
  260    HD3  LYS  39           2HD      LYS  39   9.017  13.764   3.866
  261    HE2  LYS  39           1HE      LYS  39   8.383  12.467   1.954
  262    HE3  LYS  39           2HE      LYS  39   9.713  13.527   1.490
  263    HZ1  LYS  39           3HZ      LYS  39   9.641  10.906   0.982
  264    HZ2  LYS  39           1HZ      LYS  39  10.500  10.908   2.440
  265    HZ3  LYS  39           2HZ      LYS  39  11.071  11.799   1.120
  266    HA   PRO  40           HA       PRO  40  13.914  18.069   7.203
  267    HB2  PRO  40           1HB      PRO  40  13.162  20.040   5.494
  268    HB3  PRO  40           2HB      PRO  40  14.675  19.142   5.319
  269    HG2  PRO  40           1HG      PRO  40  12.071  18.762   3.892
  270    HG3  PRO  40           2HG      PRO  40  13.719  18.735   3.239
  271    HD2  PRO  40           1HD      PRO  40  12.328  16.475   3.776
  272    HD3  PRO  40           2HD      PRO  40  14.094  16.570   3.934
  273    H    SER  41           H        SER  41  12.660  20.314   7.573
  274    HA   SER  41           HA       SER  41  10.150  19.551   8.755
  275    HB2  SER  41           1HB      SER  41  10.169  21.698   9.800
  276    HB3  SER  41           2HB      SER  41  11.839  21.131   9.801
  277    HG   SER  41           HG       SER  41  12.313  22.862   8.732
  278    H    GLY  42           H        GLY  42   9.271  19.015   6.536
  279    HA2  GLY  42           1HA      GLY  42   7.625  19.485   4.996
  280    HA3  GLY  42           2HA      GLY  42   7.425  21.048   5.775
  281    HA   PRO  43           HA       PRO  43  10.871  21.452   2.366
  282    HB2  PRO  43           1HB      PRO  43  10.795  19.533   0.447
  283    HB3  PRO  43           2HB      PRO  43  11.795  19.401   1.898
  284    HG2  PRO  43           1HG      PRO  43   9.122  18.182   1.323
  285    HG3  PRO  43           2HG      PRO  43  10.544  17.450   2.090
  286    HD2  PRO  43           1HD      PRO  43   8.431  18.366   3.513
  287    HD3  PRO  43           2HD      PRO  43  10.093  18.413   4.135
  288    H    SER  44           H        SER  44   7.758  19.995   1.536
  289    HA   SER  44           HA       SER  44   7.445  21.351  -0.939
  290    HB2  SER  44           1HB      SER  44   5.215  20.501  -0.948
  291    HB3  SER  44           2HB      SER  44   6.215  19.258  -0.197
  292    HG   SER  44           HG       SER  44   4.483  21.107   1.071
  293    H    SER  45           H        SER  45   5.423  22.790  -1.258
  294    HA   SER  45           HA       SER  45   5.490  24.894   0.804
  295    HB2  SER  45           1HB      SER  45   5.085  26.516  -0.956
  296    HB3  SER  45           2HB      SER  45   6.479  25.529  -1.394
  297    HG   SER  45           HG       SER  45   3.925  24.761  -2.262
  298    H    GLY  46           H        GLY  46   3.622  25.590   1.681
  299    HA2  GLY  46           1HA      GLY  46   1.101  25.627   0.542
  300    HA3  GLY  46           2HA      GLY  46   1.256  24.050   1.303
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1  -6.418  -1.839 -29.852
    2    HA2  GLY   1           1HA      GLY   1  -7.179  -1.040 -27.109
    3    HA3  GLY   1           2HA      GLY   1  -7.985  -2.328 -27.992
    4    H    SER   2           H        SER   2  -5.183  -1.417 -26.160
    5    HA   SER   2           HA       SER   2  -4.180  -4.180 -26.303
    6    HB2  SER   2           1HB      SER   2  -2.796  -1.590 -25.591
    7    HB3  SER   2           2HB      SER   2  -2.066  -3.174 -25.330
    8    HG   SER   2           HG       SER   2  -1.692  -3.338 -27.398
    9    H    SER   3           H        SER   3  -5.685  -4.990 -24.785
   10    HA   SER   3           HA       SER   3  -4.907  -4.463 -22.021
   11    HB2  SER   3           1HB      SER   3  -6.874  -3.019 -22.461
   12    HB3  SER   3           2HB      SER   3  -7.799  -4.449 -22.919
   13    HG   SER   3           HG       SER   3  -7.462  -3.458 -20.503
   14    H    GLY   4           H        GLY   4  -4.999  -6.237 -20.709
   15    HA2  GLY   4           1HA      GLY   4  -6.563  -8.539 -21.210
   16    HA3  GLY   4           2HA      GLY   4  -4.942  -8.784 -21.843
   17    H    SER   5           H        SER   5  -5.894  -6.989 -18.947
   18    HA   SER   5           HA       SER   5  -4.402  -8.964 -17.345
   19    HB2  SER   5           1HB      SER   5  -3.347  -6.644 -17.654
   20    HB3  SER   5           2HB      SER   5  -4.647  -6.046 -16.623
   21    HG   SER   5           HG       SER   5  -2.908  -6.533 -15.322
   22    H    SER   6           H        SER   6  -5.818 -10.118 -16.214
   23    HA   SER   6           HA       SER   6  -8.071  -8.704 -14.942
   24    HB2  SER   6           1HB      SER   6  -7.948 -11.569 -15.914
   25    HB3  SER   6           2HB      SER   6  -9.301 -10.861 -15.033
   26    HG   SER   6           HG       SER   6  -8.313  -9.849 -17.491
   27    H    GLY   7           H        GLY   7  -7.567  -8.401 -12.867
   28    HA2  GLY   7           1HA      GLY   7  -7.608  -9.585 -10.702
   29    HA3  GLY   7           2HA      GLY   7  -6.430 -10.694 -11.388
   30    H    THR   8           H        THR   8  -6.906  -7.805  -9.665
   31    HA   THR   8           HA       THR   8  -4.118  -6.970 -10.026
   32    HB   THR   8           HB       THR   8  -6.347  -5.524  -8.581
   33    HG1  THR   8           HG1      THR   8  -6.460  -4.270 -10.463
   34   HG21  THR   8          3HG2      THR   8  -4.053  -4.015  -9.601
   35   HG22  THR   8          1HG2      THR   8  -3.647  -5.156  -8.319
   36   HG23  THR   8          2HG2      THR   8  -4.870  -3.917  -8.041
   37    H    GLY   9           H        GLY   9  -6.454  -7.439  -7.363
   38    HA2  GLY   9           1HA      GLY   9  -4.968  -9.102  -5.774
   39    HA3  GLY   9           2HA      GLY   9  -4.383  -7.493  -5.378
   40    H    GLU  10           H        GLU  10  -6.094  -9.665  -4.000
   41    HA   GLU  10           HA       GLU  10  -8.565  -8.253  -3.480
   42    HB2  GLU  10           1HB      GLU  10  -8.066 -10.854  -3.513
   43    HB3  GLU  10           2HB      GLU  10  -7.674 -10.569  -1.823
   44    HG2  GLU  10           1HG      GLU  10  -9.834 -10.036  -1.266
   45    HG3  GLU  10           2HG      GLU  10 -10.249  -9.540  -2.906
   46    H    LYS  11           H        LYS  11  -5.634  -7.474  -2.623
   47    HA   LYS  11           HA       LYS  11  -5.674  -7.351   0.207
   48    HB2  LYS  11           1HB      LYS  11  -4.049  -6.135  -1.966
   49    HB3  LYS  11           2HB      LYS  11  -3.998  -5.354  -0.391
   50    HG2  LYS  11           1HG      LYS  11  -2.192  -6.855  -0.427
   51    HG3  LYS  11           2HG      LYS  11  -3.430  -7.622   0.570
   52    HD2  LYS  11           1HD      LYS  11  -2.656  -9.340  -0.820
   53    HD3  LYS  11           2HD      LYS  11  -4.159  -8.810  -1.579
   54    HE2  LYS  11           1HE      LYS  11  -2.810  -8.852  -3.416
   55    HE3  LYS  11           2HE      LYS  11  -2.507  -7.201  -2.877
   56    HZ1  LYS  11           3HZ      LYS  11  -0.794  -9.583  -2.455
   57    HZ2  LYS  11           1HZ      LYS  11  -0.556  -8.121  -1.637
   58    HZ3  LYS  11           2HZ      LYS  11  -0.420  -8.179  -3.321
   59    HA   PRO  12           HA       PRO  12  -8.764  -4.107   0.412
   60    HB2  PRO  12           1HB      PRO  12  -8.970  -4.147   3.119
   61    HB3  PRO  12           2HB      PRO  12  -9.755  -5.341   2.078
   62    HG2  PRO  12           1HG      PRO  12  -7.197  -5.560   3.617
   63    HG3  PRO  12           2HG      PRO  12  -8.499  -6.750   3.436
   64    HD2  PRO  12           1HD      PRO  12  -6.200  -6.876   2.010
   65    HD3  PRO  12           2HD      PRO  12  -7.757  -7.432   1.363
   66    H    TYR  13           H        TYR  13  -5.549  -4.037   1.076
   67    HA   TYR  13           HA       TYR  13  -5.680  -1.223   1.914
   68    HB2  TYR  13           1HB      TYR  13  -3.950  -3.410   3.047
   69    HB3  TYR  13           2HB      TYR  13  -3.480  -1.717   3.162
   70    HD1  TYR  13           HD2      TYR  13  -4.756  -0.164   4.555
   71    HD2  TYR  13           HD1      TYR  13  -5.785  -4.287   4.351
   72    HE1  TYR  13           HE2      TYR  13  -6.144   0.089   6.570
   73    HE2  TYR  13           HE1      TYR  13  -7.177  -4.046   6.364
   74    HH   TYR  13           HH       TYR  13  -8.234  -1.205   7.537
   75    H    ASN  14           H        ASN  14  -3.994   0.111   1.153
   76    HA   ASN  14           HA       ASN  14  -1.938  -0.935  -0.558
   77    HB2  ASN  14           1HB      ASN  14  -4.286   0.549  -1.745
   78    HB3  ASN  14           2HB      ASN  14  -2.731   0.410  -2.560
   79   HD21  ASN  14          1HD2      ASN  14  -5.523  -1.328  -1.397
   80   HD22  ASN  14          2HD2      ASN  14  -5.281  -2.747  -2.353
   81    H    CYS  15           H        CYS  15  -0.549   0.791  -1.431
   82    HA   CYS  15           HA       CYS  15  -0.523   3.086   0.397
   83    HB2  CYS  15           1HB      CYS  15   1.471   1.497   0.186
   84    HB3  CYS  15           2HB      CYS  15   1.735   2.213  -1.401
   85    H    GLU  16           H        GLU  16  -1.372   4.895  -0.379
   86    HA   GLU  16           HA       GLU  16  -1.745   5.347  -3.177
   87    HB2  GLU  16           1HB      GLU  16  -3.190   6.173  -1.195
   88    HB3  GLU  16           2HB      GLU  16  -2.008   7.468  -1.065
   89    HG2  GLU  16           1HG      GLU  16  -3.361   6.883  -3.666
   90    HG3  GLU  16           2HG      GLU  16  -4.147   7.866  -2.432
   91    H    GLU  17           H        GLU  17   0.870   5.769  -1.119
   92    HA   GLU  17           HA       GLU  17   1.961   8.151  -2.284
   93    HB2  GLU  17           1HB      GLU  17   3.197   6.007  -0.550
   94    HB3  GLU  17           2HB      GLU  17   4.038   7.465  -1.058
   95    HG2  GLU  17           1HG      GLU  17   1.424   7.671   0.366
   96    HG3  GLU  17           2HG      GLU  17   2.906   7.367   1.270
   97    H    CYS  18           H        CYS  18   2.593   4.674  -2.614
   98    HA   CYS  18           HA       CYS  18   4.124   5.270  -5.062
   99    HB2  CYS  18           1HB      CYS  18   5.247   3.065  -4.672
  100    HB3  CYS  18           2HB      CYS  18   5.584   4.270  -3.433
  101    H    GLY  19           H        GLY  19   1.825   3.045  -3.545
  102    HA2  GLY  19           1HA      GLY  19  -0.144   2.478  -4.925
  103    HA3  GLY  19           2HA      GLY  19   0.974   2.242  -6.260
  104    H    LYS  20           H        LYS  20   1.659   1.172  -3.001
  105    HA   LYS  20           HA       LYS  20   1.923  -1.550  -3.954
  106    HB2  LYS  20           1HB      LYS  20   2.714  -0.052  -1.508
  107    HB3  LYS  20           2HB      LYS  20   2.492  -1.790  -1.357
  108    HG2  LYS  20           1HG      LYS  20   4.039  -1.888  -3.450
  109    HG3  LYS  20           2HG      LYS  20   4.511  -0.267  -2.936
  110    HD2  LYS  20           1HD      LYS  20   6.055  -1.556  -1.816
  111    HD3  LYS  20           2HD      LYS  20   4.785  -1.415  -0.598
  112    HE2  LYS  20           1HE      LYS  20   5.227  -3.676  -0.550
  113    HE3  LYS  20           2HE      LYS  20   3.882  -3.602  -1.687
  114    HZ1  LYS  20           3HZ      LYS  20   5.154  -4.418  -3.293
  115    HZ2  LYS  20           1HZ      LYS  20   6.343  -4.730  -2.131
  116    HZ3  LYS  20           2HZ      LYS  20   6.380  -3.287  -3.012
  117    H    ALA  21           H        ALA  21   1.095  -3.335  -2.474
  118    HA   ALA  21           HA       ALA  21  -1.597  -2.681  -1.473
  119    HB1  ALA  21           3HB      ALA  21  -2.608  -4.198  -2.777
  120    HB2  ALA  21           1HB      ALA  21  -1.161  -4.067  -3.777
  121    HB3  ALA  21           2HB      ALA  21  -1.302  -5.370  -2.596
  122    H    PHE  22           H        PHE  22  -2.363  -3.942   0.253
  123    HA   PHE  22           HA       PHE  22  -0.547  -5.884   1.448
  124    HB2  PHE  22           1HB      PHE  22  -1.482  -3.381   2.861
  125    HB3  PHE  22           2HB      PHE  22  -0.752  -4.758   3.679
  126    HD1  PHE  22           HD2      PHE  22  -0.158  -1.966   1.377
  127    HD2  PHE  22           HD1      PHE  22   1.600  -5.181   3.543
  128    HE1  PHE  22           HE2      PHE  22   2.077  -1.032   0.945
  129    HE2  PHE  22           HE1      PHE  22   3.837  -4.251   3.115
  130    HZ   PHE  22           HZ       PHE  22   4.078  -2.174   1.813
  131    H    ILE  23           H        ILE  23  -1.544  -7.332   2.868
  132    HA   ILE  23           HA       ILE  23  -4.391  -7.618   2.459
  133    HB   ILE  23           HB       ILE  23  -2.478  -9.351   4.028
  134   HG12  ILE  23          1HG1      ILE  23  -3.641  -9.788   1.271
  135   HG13  ILE  23          2HG1      ILE  23  -2.022  -9.167   1.570
  136   HG21  ILE  23          1HG2      ILE  23  -5.324  -9.324   3.908
  137   HG22  ILE  23          2HG2      ILE  23  -4.734 -10.785   3.118
  138   HG23  ILE  23          3HG2      ILE  23  -4.263 -10.431   4.779
  139   HD11  ILE  23          3HD1      ILE  23  -1.403 -11.230   2.664
  140   HD12  ILE  23          1HD1      ILE  23  -3.041 -11.852   2.466
  141   HD13  ILE  23          2HD1      ILE  23  -2.032 -11.557   1.049
  142    H    HIS  24           H        HIS  24  -2.195  -7.022   5.167
  143    HA   HIS  24           HA       HIS  24  -4.541  -6.330   6.812
  144    HB2  HIS  24           1HB      HIS  24  -1.920  -7.587   7.626
  145    HB3  HIS  24           2HB      HIS  24  -3.042  -6.880   8.785
  146    HD2  HIS  24           HD2      HIS  24  -2.586 -10.106   6.713
  147    HE1  HIS  24           HE1      HIS  24  -6.227 -10.450   8.863
  148    HE2  HIS  24           HE2      HIS  24  -4.491 -11.667   7.503
  149    H    ASP  25           H        ASP  25  -4.534  -4.406   7.883
  150    HA   ASP  25           HA       ASP  25  -3.163  -2.240   6.916
  151    HB2  ASP  25           1HB      ASP  25  -3.640  -1.269   9.313
  152    HB3  ASP  25           2HB      ASP  25  -4.972  -1.647   8.225
  153    H    SER  26           H        SER  26  -2.403  -3.923   9.971
  154    HA   SER  26           HA       SER  26  -0.223  -2.638  10.850
  155    HB2  SER  26           1HB      SER  26   0.601  -4.720  11.781
  156    HB3  SER  26           2HB      SER  26  -1.161  -4.725  11.848
  157    HG   SER  26           HG       SER  26  -1.225  -6.297  10.422
  158    H    GLN  27           H        GLN  27  -0.201  -4.985   8.190
  159    HA   GLN  27           HA       GLN  27   2.566  -4.911   7.696
  160    HB2  GLN  27           1HB      GLN  27   0.259  -5.535   5.848
  161    HB3  GLN  27           2HB      GLN  27   1.950  -5.795   5.439
  162    HG2  GLN  27           1HG      GLN  27   1.974  -7.196   7.635
  163    HG3  GLN  27           2HG      GLN  27   0.228  -7.244   7.391
  164   HE21  GLN  27          1HE2      GLN  27  -0.616  -8.430   5.722
  165   HE22  GLN  27          2HE2      GLN  27   0.324  -9.521   4.767
  166    H    LEU  28           H        LEU  28  -0.098  -3.210   6.048
  167    HA   LEU  28           HA       LEU  28   1.447  -1.722   4.278
  168    HB2  LEU  28           1HB      LEU  28  -0.898  -1.805   3.964
  169    HB3  LEU  28           2HB      LEU  28  -1.206  -1.163   5.576
  170    HG   LEU  28           HG       LEU  28  -0.087   0.982   4.729
  171   HD11  LEU  28          1HD1      LEU  28  -0.810  -0.167   2.046
  172   HD12  LEU  28          2HD1      LEU  28   0.834  -0.161   2.682
  173   HD13  LEU  28          3HD1      LEU  28  -0.006   1.363   2.396
  174   HD21  LEU  28          3HD2      LEU  28  -2.435   1.022   3.152
  175   HD22  LEU  28          1HD2      LEU  28  -2.202   1.644   4.786
  176   HD23  LEU  28          2HD2      LEU  28  -2.748  -0.016   4.545
  177    H    GLN  29           H        GLN  29   0.302  -0.842   7.528
  178    HA   GLN  29           HA       GLN  29   1.327   1.724   7.673
  179    HB2  GLN  29           1HB      GLN  29   1.146  -0.315   9.898
  180    HB3  GLN  29           2HB      GLN  29   1.337   1.419  10.119
  181    HG2  GLN  29           1HG      GLN  29  -1.035  -0.061   9.028
  182    HG3  GLN  29           2HG      GLN  29  -0.940   0.937  10.479
  183   HE21  GLN  29          1HE2      GLN  29  -2.780   1.161   8.270
  184   HE22  GLN  29          2HE2      GLN  29  -2.559   2.737   7.597
  185    H    GLU  30           H        GLU  30   2.936  -1.357   8.326
  186    HA   GLU  30           HA       GLU  30   5.362  -0.259   9.271
  187    HB2  GLU  30           1HB      GLU  30   4.810  -2.569   9.716
  188    HB3  GLU  30           2HB      GLU  30   4.759  -2.931   7.997
  189    HG2  GLU  30           1HG      GLU  30   7.272  -1.877   9.204
  190    HG3  GLU  30           2HG      GLU  30   6.840  -3.573   9.417
  191    H    HIS  31           H        HIS  31   3.988  -0.212   6.215
  192    HA   HIS  31           HA       HIS  31   6.591  -0.011   4.869
  193    HB2  HIS  31           1HB      HIS  31   5.329  -1.494   3.608
  194    HB3  HIS  31           2HB      HIS  31   3.821  -0.641   3.926
  195    HD1  HIS  31           HD1      HIS  31   6.972  -0.292   1.856
  196    HD2  HIS  31           HD2      HIS  31   3.067   1.121   1.979
  197    HE1  HIS  31           HE1      HIS  31   6.660   1.008  -0.273
  198    H    GLN  32           H        GLN  32   3.445   1.647   5.049
  199    HA   GLN  32           HA       GLN  32   3.985   3.889   3.568
  200    HB2  GLN  32           1HB      GLN  32   2.345   3.562   6.074
  201    HB3  GLN  32           2HB      GLN  32   2.403   5.077   5.183
  202    HG2  GLN  32           1HG      GLN  32   1.629   3.817   3.166
  203    HG3  GLN  32           2HG      GLN  32   1.383   2.422   4.214
  204   HE21  GLN  32          1HE2      GLN  32  -0.155   4.884   2.764
  205   HE22  GLN  32          2HE2      GLN  32  -1.491   5.091   3.840
  206    H    ARG  33           H        ARG  33   5.397   2.963   6.547
  207    HA   ARG  33           HA       ARG  33   6.103   5.432   7.644
  208    HB2  ARG  33           1HB      ARG  33   8.101   4.083   8.574
  209    HB3  ARG  33           2HB      ARG  33   6.475   3.598   9.035
  210    HG2  ARG  33           1HG      ARG  33   6.506   1.761   7.531
  211    HG3  ARG  33           2HG      ARG  33   7.996   2.329   6.775
  212    HD2  ARG  33           1HD      ARG  33   8.678   0.598   8.196
  213    HD3  ARG  33           2HD      ARG  33   9.057   2.075   9.081
  214    HE   ARG  33           HE       ARG  33   6.545   1.371   9.917
  215   HH11  ARG  33          1HH1      ARG  33   9.672  -0.160   9.860
  216   HH12  ARG  33          2HH1      ARG  33   9.375  -1.115  11.275
  217   HH21  ARG  33          1HH2      ARG  33   6.143   0.119  11.781
  218   HH22  ARG  33          2HH2      ARG  33   7.367  -0.956  12.366
  219    H    ILE  34           H        ILE  34   7.557   3.563   5.055
  220    HA   ILE  34           HA       ILE  34  10.008   4.889   4.850
  221    HB   ILE  34           HB       ILE  34  10.223   3.979   2.679
  222   HG12  ILE  34          1HG1      ILE  34   7.227   3.559   2.627
  223   HG13  ILE  34          2HG1      ILE  34   8.062   4.877   1.812
  224   HG21  ILE  34          1HG2      ILE  34   9.076   2.396   4.802
  225   HG22  ILE  34          2HG2      ILE  34   8.708   1.709   3.220
  226   HG23  ILE  34          3HG2      ILE  34  10.383   2.003   3.685
  227   HD11  ILE  34          3HD1      ILE  34   8.898   2.086   1.231
  228   HD12  ILE  34          1HD1      ILE  34   7.396   2.693   0.535
  229   HD13  ILE  34          2HD1      ILE  34   8.919   3.514   0.196
  230    H    HIS  35           H        HIS  35   6.825   5.916   4.034
  231    HA   HIS  35           HA       HIS  35   7.804   8.101   2.360
  232    HB2  HIS  35           1HB      HIS  35   4.964   7.356   3.087
  233    HB3  HIS  35           2HB      HIS  35   5.449   8.555   1.892
  234    HD1  HIS  35           HD1      HIS  35   7.183   7.331  -0.014
  235    HD2  HIS  35           HD2      HIS  35   4.288   5.042   1.893
  236    HE1  HIS  35           HE1      HIS  35   6.839   5.321  -1.485
  237    H    THR  36           H        THR  36   5.976   7.585   5.357
  238    HA   THR  36           HA       THR  36   5.357  10.120   6.116
  239    HB   THR  36           HB       THR  36   5.426   9.428   8.408
  240    HG1  THR  36           HG1      THR  36   6.973   8.169   9.100
  241   HG21  THR  36          3HG2      THR  36   4.882   6.873   6.923
  242   HG22  THR  36          1HG2      THR  36   3.827   8.276   6.763
  243   HG23  THR  36          2HG2      THR  36   4.058   7.522   8.340
  244    H    GLY  37           H        GLY  37   6.745  11.756   5.578
  245    HA2  GLY  37           1HA      GLY  37   8.364  13.180   6.781
  246    HA3  GLY  37           2HA      GLY  37   9.352  11.740   6.972
  247    H    GLU  38           H        GLU  38   7.720  13.394   4.262
  248    HA   GLU  38           HA       GLU  38  10.290  13.333   2.824
  249    HB2  GLU  38           1HB      GLU  38   9.094  12.915   0.742
  250    HB3  GLU  38           2HB      GLU  38   8.765  11.640   1.906
  251    HG2  GLU  38           1HG      GLU  38   6.903  13.960   1.639
  252    HG3  GLU  38           2HG      GLU  38   6.829  12.612   0.505
  253    H    LYS  39           H        LYS  39   9.880  14.801   0.692
  254    HA   LYS  39           HA       LYS  39  10.114  17.395   1.351
  255    HB2  LYS  39           1HB      LYS  39   8.908  16.124  -1.085
  256    HB3  LYS  39           2HB      LYS  39   8.976  17.875  -0.944
  257    HG2  LYS  39           1HG      LYS  39  11.500  17.420  -0.403
  258    HG3  LYS  39           2HG      LYS  39  11.186  15.908  -1.257
  259    HD2  LYS  39           1HD      LYS  39  10.347  18.516  -2.460
  260    HD3  LYS  39           2HD      LYS  39  12.026  17.986  -2.580
  261    HE2  LYS  39           1HE      LYS  39  11.103  17.134  -4.521
  262    HE3  LYS  39           2HE      LYS  39  10.995  15.759  -3.423
  263    HZ1  LYS  39           3HZ      LYS  39   8.945  16.694  -4.858
  264    HZ2  LYS  39           1HZ      LYS  39   8.705  17.532  -3.408
  265    HZ3  LYS  39           2HZ      LYS  39   8.767  15.842  -3.407
  266    HA   PRO  40           HA       PRO  40   6.324  18.981   2.901
  267    HB2  PRO  40           1HB      PRO  40   6.469  21.559   2.063
  268    HB3  PRO  40           2HB      PRO  40   7.470  20.916   3.370
  269    HG2  PRO  40           1HG      PRO  40   8.167  21.356   0.492
  270    HG3  PRO  40           2HG      PRO  40   9.127  21.705   1.941
  271    HD2  PRO  40           1HD      PRO  40   9.539  19.507   0.415
  272    HD3  PRO  40           2HD      PRO  40   9.809  19.515   2.169
  273    H    SER  41           H        SER  41   4.402  20.404   2.166
  274    HA   SER  41           HA       SER  41   3.440  19.285  -0.333
  275    HB2  SER  41           1HB      SER  41   2.088  19.386   1.835
  276    HB3  SER  41           2HB      SER  41   1.909  21.111   1.520
  277    HG   SER  41           HG       SER  41   1.003  20.496  -0.540
  278    H    GLY  42           H        GLY  42   4.643  20.440  -1.872
  279    HA2  GLY  42           1HA      GLY  42   5.075  22.161  -3.328
  280    HA3  GLY  42           2HA      GLY  42   3.455  22.718  -2.936
  281    HA   PRO  43           HA       PRO  43   6.493  24.929   0.131
  282    HB2  PRO  43           1HB      PRO  43   9.131  24.767  -0.492
  283    HB3  PRO  43           2HB      PRO  43   8.321  23.608   0.569
  284    HG2  PRO  43           1HG      PRO  43   9.004  23.362  -2.335
  285    HG3  PRO  43           2HG      PRO  43   9.169  22.160  -1.041
  286    HD2  PRO  43           1HD      PRO  43   7.111  22.132  -2.801
  287    HD3  PRO  43           2HD      PRO  43   6.940  21.582  -1.122
  288    H    SER  44           H        SER  44   7.374  27.039  -0.042
  289    HA   SER  44           HA       SER  44   7.646  29.074  -1.023
  290    HB2  SER  44           1HB      SER  44   8.816  27.387  -3.249
  291    HB3  SER  44           2HB      SER  44   8.967  29.140  -3.127
  292    HG   SER  44           HG       SER  44   9.727  27.625  -0.914
  293    H    SER  45           H        SER  45   5.110  27.903  -1.272
  294    HA   SER  45           HA       SER  45   4.260  28.772  -3.955
  295    HB2  SER  45           1HB      SER  45   3.609  26.510  -3.682
  296    HB3  SER  45           2HB      SER  45   3.072  26.781  -2.025
  297    HG   SER  45           HG       SER  45   1.394  28.102  -2.894
  298    H    GLY  46           H        GLY  46   3.235  28.778  -0.541
  299    HA2  GLY  46           1HA      GLY  46   1.850  31.332  -1.088
  300    HA3  GLY  46           2HA      GLY  46   1.196  30.115  -0.002
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1  -8.364  -1.073 -13.647
    2    HA2  GLY   1           1HA      GLY   1  -8.324  -1.109 -16.377
    3    HA3  GLY   1           2HA      GLY   1  -6.864  -1.977 -15.926
    4    H    SER   2           H        SER   2  -8.324  -3.540 -17.281
    5    HA   SER   2           HA       SER   2  -9.912  -5.122 -15.367
    6    HB2  SER   2           1HB      SER   2 -11.104  -3.986 -17.389
    7    HB3  SER   2           2HB      SER   2 -10.357  -5.274 -18.334
    8    HG   SER   2           HG       SER   2 -12.578  -5.428 -16.996
    9    H    SER   3           H        SER   3  -8.814  -6.870 -14.792
   10    HA   SER   3           HA       SER   3  -7.563  -8.504 -16.869
   11    HB2  SER   3           1HB      SER   3  -5.657  -7.314 -16.113
   12    HB3  SER   3           2HB      SER   3  -6.162  -7.420 -14.426
   13    HG   SER   3           HG       SER   3  -5.589  -9.728 -15.950
   14    H    GLY   4           H        GLY   4  -8.011 -10.603 -16.627
   15    HA2  GLY   4           1HA      GLY   4  -9.533 -11.432 -14.297
   16    HA3  GLY   4           2HA      GLY   4  -9.255 -12.375 -15.754
   17    H    SER   5           H        SER   5  -7.464 -11.055 -12.972
   18    HA   SER   5           HA       SER   5  -6.274 -13.665 -12.519
   19    HB2  SER   5           1HB      SER   5  -4.723 -11.266 -13.428
   20    HB3  SER   5           2HB      SER   5  -3.973 -12.413 -12.319
   21    HG   SER   5           HG       SER   5  -5.267 -13.467 -14.545
   22    H    SER   6           H        SER   6  -5.156 -13.805 -10.460
   23    HA   SER   6           HA       SER   6  -5.178 -11.662  -8.595
   24    HB2  SER   6           1HB      SER   6  -7.670 -12.468  -8.865
   25    HB3  SER   6           2HB      SER   6  -7.142 -13.790  -7.824
   26    HG   SER   6           HG       SER   6  -7.263 -12.467  -6.211
   27    H    GLY   7           H        GLY   7  -4.089 -12.168  -6.695
   28    HA2  GLY   7           1HA      GLY   7  -3.154 -14.955  -6.444
   29    HA3  GLY   7           2HA      GLY   7  -2.015 -13.618  -6.394
   30    H    THR   8           H        THR   8  -2.926 -15.741  -4.410
   31    HA   THR   8           HA       THR   8  -3.565 -15.913  -2.205
   32    HB   THR   8           HB       THR   8  -2.247 -14.483  -0.707
   33    HG1  THR   8           HG1      THR   8  -0.958 -12.824  -1.637
   34   HG21  THR   8          3HG2      THR   8  -1.244 -16.412  -2.066
   35   HG22  THR   8          1HG2      THR   8  -0.123 -15.261  -1.340
   36   HG23  THR   8          2HG2      THR   8  -0.502 -15.159  -3.059
   37    H    GLY   9           H        GLY   9  -5.570 -14.612  -3.671
   38    HA2  GLY   9           1HA      GLY   9  -7.563 -13.567  -3.149
   39    HA3  GLY   9           2HA      GLY   9  -6.930 -13.252  -1.540
   40    H    GLU  10           H        GLU  10  -8.290 -11.241  -2.245
   41    HA   GLU  10           HA       GLU  10  -6.710  -9.360  -3.817
   42    HB2  GLU  10           1HB      GLU  10  -9.176  -9.554  -4.155
   43    HB3  GLU  10           2HB      GLU  10  -9.409  -8.956  -2.519
   44    HG2  GLU  10           1HG      GLU  10  -9.724  -7.104  -3.911
   45    HG3  GLU  10           2HG      GLU  10  -8.111  -6.905  -3.228
   46    H    LYS  11           H        LYS  11  -5.978  -7.372  -3.021
   47    HA   LYS  11           HA       LYS  11  -5.436  -7.385  -0.149
   48    HB2  LYS  11           1HB      LYS  11  -4.147  -6.170  -2.539
   49    HB3  LYS  11           2HB      LYS  11  -3.989  -5.309  -1.013
   50    HG2  LYS  11           1HG      LYS  11  -2.130  -6.612  -0.917
   51    HG3  LYS  11           2HG      LYS  11  -3.286  -7.693  -0.134
   52    HD2  LYS  11           1HD      LYS  11  -2.302  -9.114  -1.657
   53    HD3  LYS  11           2HD      LYS  11  -3.696  -8.539  -2.576
   54    HE2  LYS  11           1HE      LYS  11  -2.191  -6.773  -3.545
   55    HE3  LYS  11           2HE      LYS  11  -0.838  -7.605  -2.781
   56    HZ1  LYS  11           3HZ      LYS  11  -1.354  -9.575  -4.061
   57    HZ2  LYS  11           1HZ      LYS  11  -1.125  -8.258  -5.099
   58    HZ3  LYS  11           2HZ      LYS  11  -2.689  -8.811  -4.767
   59    HA   PRO  12           HA       PRO  12  -8.785  -4.372   0.103
   60    HB2  PRO  12           1HB      PRO  12  -8.978  -4.491   2.809
   61    HB3  PRO  12           2HB      PRO  12  -9.708  -5.695   1.740
   62    HG2  PRO  12           1HG      PRO  12  -7.136  -5.827   3.266
   63    HG3  PRO  12           2HG      PRO  12  -8.379  -7.075   3.057
   64    HD2  PRO  12           1HD      PRO  12  -6.082  -7.052   1.623
   65    HD3  PRO  12           2HD      PRO  12  -7.613  -7.666   0.965
   66    H    TYR  13           H        TYR  13  -5.573  -4.166   0.773
   67    HA   TYR  13           HA       TYR  13  -5.839  -1.384   1.686
   68    HB2  TYR  13           1HB      TYR  13  -4.033  -3.530   2.762
   69    HB3  TYR  13           2HB      TYR  13  -3.579  -1.834   2.880
   70    HD1  TYR  13           HD2      TYR  13  -4.910  -0.287   4.260
   71    HD2  TYR  13           HD1      TYR  13  -5.775  -4.451   4.133
   72    HE1  TYR  13           HE2      TYR  13  -6.268  -0.061   6.299
   73    HE2  TYR  13           HE1      TYR  13  -7.136  -4.237   6.170
   74    HH   TYR  13           HH       TYR  13  -7.099  -2.445   8.228
   75    H    ASN  14           H        ASN  14  -4.314   0.071   0.883
   76    HA   ASN  14           HA       ASN  14  -2.204  -0.834  -0.866
   77    HB2  ASN  14           1HB      ASN  14  -4.196   1.009  -2.140
   78    HB3  ASN  14           2HB      ASN  14  -3.006  -0.043  -2.902
   79   HD21  ASN  14          1HD2      ASN  14  -3.513  -2.146  -3.326
   80   HD22  ASN  14          2HD2      ASN  14  -5.099  -2.801  -3.123
   81    H    CYS  15           H        CYS  15  -0.574   0.620  -0.988
   82    HA   CYS  15           HA       CYS  15  -0.608   2.858   0.762
   83    HB2  CYS  15           1HB      CYS  15   1.380   1.349  -0.072
   84    HB3  CYS  15           2HB      CYS  15   1.475   2.541  -1.365
   85    H    GLU  16           H        GLU  16  -1.195   4.893   0.395
   86    HA   GLU  16           HA       GLU  16  -2.015   5.660  -2.288
   87    HB2  GLU  16           1HB      GLU  16  -3.242   6.097   0.016
   88    HB3  GLU  16           2HB      GLU  16  -2.204   7.516   0.042
   89    HG2  GLU  16           1HG      GLU  16  -3.108   8.232  -2.102
   90    HG3  GLU  16           2HG      GLU  16  -4.135   6.800  -2.153
   91    H    GLU  17           H        GLU  17   0.860   5.422  -1.354
   92    HA   GLU  17           HA       GLU  17   1.704   8.142  -2.114
   93    HB2  GLU  17           1HB      GLU  17   2.849   6.224  -0.113
   94    HB3  GLU  17           2HB      GLU  17   3.892   7.403  -0.896
   95    HG2  GLU  17           1HG      GLU  17   2.060   9.098  -0.129
   96    HG3  GLU  17           2HG      GLU  17   1.659   7.828   1.027
   97    H    CYS  18           H        CYS  18   2.134   4.702  -2.533
   98    HA   CYS  18           HA       CYS  18   3.851   5.253  -4.863
   99    HB2  CYS  18           1HB      CYS  18   4.884   2.995  -4.433
  100    HB3  CYS  18           2HB      CYS  18   5.262   4.224  -3.231
  101    H    GLY  19           H        GLY  19   1.606   2.907  -3.406
  102    HA2  GLY  19           1HA      GLY  19  -0.379   2.511  -4.950
  103    HA3  GLY  19           2HA      GLY  19   0.846   2.076  -6.133
  104    H    LYS  20           H        LYS  20   2.444   0.863  -3.845
  105    HA   LYS  20           HA       LYS  20   1.976  -1.780  -4.239
  106    HB2  LYS  20           1HB      LYS  20   3.743  -0.492  -2.752
  107    HB3  LYS  20           2HB      LYS  20   2.644  -0.935  -1.452
  108    HG2  LYS  20           1HG      LYS  20   2.835  -3.322  -2.380
  109    HG3  LYS  20           2HG      LYS  20   4.248  -2.715  -3.247
  110    HD2  LYS  20           1HD      LYS  20   5.156  -1.928  -1.056
  111    HD3  LYS  20           2HD      LYS  20   3.807  -2.744  -0.263
  112    HE2  LYS  20           1HE      LYS  20   5.667  -4.221  -0.175
  113    HE3  LYS  20           2HE      LYS  20   4.555  -4.860  -1.384
  114    HZ1  LYS  20           3HZ      LYS  20   6.665  -4.999  -2.347
  115    HZ2  LYS  20           1HZ      LYS  20   7.120  -3.456  -1.823
  116    HZ3  LYS  20           2HZ      LYS  20   5.976  -3.626  -3.056
  117    H    ALA  21           H        ALA  21   0.918  -3.452  -3.037
  118    HA   ALA  21           HA       ALA  21  -1.547  -2.516  -1.721
  119    HB1  ALA  21           3HB      ALA  21  -0.996  -4.769  -3.583
  120    HB2  ALA  21           1HB      ALA  21  -2.259  -4.970  -2.368
  121    HB3  ALA  21           2HB      ALA  21  -2.357  -3.649  -3.533
  122    H    PHE  22           H        PHE  22  -2.422  -3.928  -0.031
  123    HA   PHE  22           HA       PHE  22  -0.513  -5.702   1.270
  124    HB2  PHE  22           1HB      PHE  22  -1.657  -3.235   2.591
  125    HB3  PHE  22           2HB      PHE  22  -0.870  -4.543   3.468
  126    HD1  PHE  22           HD2      PHE  22  -0.328  -1.953   0.880
  127    HD2  PHE  22           HD1      PHE  22   1.461  -4.636   3.658
  128    HE1  PHE  22           HE2      PHE  22   1.856  -0.887   0.498
  129    HE2  PHE  22           HE1      PHE  22   3.648  -3.574   3.281
  130    HZ   PHE  22           HZ       PHE  22   3.848  -1.698   1.699
  131    H    ILE  23           H        ILE  23  -1.465  -7.074   2.865
  132    HA   ILE  23           HA       ILE  23  -4.281  -7.582   2.336
  133    HB   ILE  23           HB       ILE  23  -2.277  -9.184   3.931
  134   HG12  ILE  23          1HG1      ILE  23  -3.462  -9.909   1.260
  135   HG13  ILE  23          2HG1      ILE  23  -2.003  -8.931   1.378
  136   HG21  ILE  23          1HG2      ILE  23  -4.612  -9.502   4.665
  137   HG22  ILE  23          2HG2      ILE  23  -5.043  -9.959   3.018
  138   HG23  ILE  23          3HG2      ILE  23  -3.920 -10.955   3.943
  139   HD11  ILE  23          3HD1      ILE  23  -1.179 -10.885   2.900
  140   HD12  ILE  23          1HD1      ILE  23  -2.426 -11.796   2.050
  141   HD13  ILE  23          2HD1      ILE  23  -1.123 -11.027   1.143
  142    H    HIS  24           H        HIS  24  -2.163  -6.730   5.022
  143    HA   HIS  24           HA       HIS  24  -4.561  -6.127   6.622
  144    HB2  HIS  24           1HB      HIS  24  -1.962  -7.357   7.547
  145    HB3  HIS  24           2HB      HIS  24  -3.164  -6.690   8.647
  146    HD2  HIS  24           HD2      HIS  24  -2.734  -9.761   6.252
  147    HE1  HIS  24           HE1      HIS  24  -6.098 -10.426   8.750
  148    HE2  HIS  24           HE2      HIS  24  -4.513 -11.446   7.079
  149    H    ASP  25           H        ASP  25  -4.547  -4.236   7.788
  150    HA   ASP  25           HA       ASP  25  -3.227  -2.035   6.847
  151    HB2  ASP  25           1HB      ASP  25  -5.166  -1.960   8.383
  152    HB3  ASP  25           2HB      ASP  25  -4.117  -2.455   9.708
  153    H    SER  26           H        SER  26  -2.371  -3.673   9.902
  154    HA   SER  26           HA       SER  26  -0.157  -2.408  10.683
  155    HB2  SER  26           1HB      SER  26   0.685  -4.465  11.622
  156    HB3  SER  26           2HB      SER  26  -1.076  -4.507  11.703
  157    HG   SER  26           HG       SER  26  -1.130  -6.046  10.217
  158    H    GLN  27           H        GLN  27  -0.224  -4.768   8.036
  159    HA   GLN  27           HA       GLN  27   2.518  -4.723   7.447
  160    HB2  GLN  27           1HB      GLN  27   0.235  -5.191   5.522
  161    HB3  GLN  27           2HB      GLN  27   1.906  -5.690   5.299
  162    HG2  GLN  27           1HG      GLN  27   1.696  -7.156   7.272
  163    HG3  GLN  27           2HG      GLN  27  -0.003  -6.704   7.391
  164   HE21  GLN  27          1HE2      GLN  27   2.361  -8.542   5.669
  165   HE22  GLN  27          2HE2      GLN  27   1.259  -9.435   4.684
  166    H    LEU  28           H        LEU  28  -0.156  -2.966   5.873
  167    HA   LEU  28           HA       LEU  28   1.438  -1.454   4.136
  168    HB2  LEU  28           1HB      LEU  28  -0.841  -1.527   3.642
  169    HB3  LEU  28           2HB      LEU  28  -1.304  -1.078   5.282
  170    HG   LEU  28           HG       LEU  28  -0.457   1.211   4.844
  171   HD11  LEU  28          1HD1      LEU  28  -0.475   1.226   2.026
  172   HD12  LEU  28          2HD1      LEU  28   0.625  -0.057   2.528
  173   HD13  LEU  28          3HD1      LEU  28   0.868   1.590   3.110
  174   HD21  LEU  28          3HD2      LEU  28  -2.778   0.956   4.626
  175   HD22  LEU  28          1HD2      LEU  28  -2.625   0.050   3.120
  176   HD23  LEU  28          2HD2      LEU  28  -2.277   1.779   3.148
  177    H    GLN  29           H        GLN  29  -0.059  -0.444   7.214
  178    HA   GLN  29           HA       GLN  29   0.967   2.077   7.445
  179    HB2  GLN  29           1HB      GLN  29   0.633   0.036   9.649
  180    HB3  GLN  29           2HB      GLN  29   0.854   1.762   9.906
  181    HG2  GLN  29           1HG      GLN  29  -1.458   0.445   8.500
  182    HG3  GLN  29           2HG      GLN  29  -1.477   1.168  10.107
  183   HE21  GLN  29          1HE2      GLN  29  -2.621   1.681   7.215
  184   HE22  GLN  29          2HE2      GLN  29  -2.517   3.401   7.092
  185    H    GLU  30           H        GLU  30   2.564  -0.948   8.397
  186    HA   GLU  30           HA       GLU  30   4.899   0.199   9.442
  187    HB2  GLU  30           1HB      GLU  30   4.483  -2.084   9.927
  188    HB3  GLU  30           2HB      GLU  30   4.330  -2.497   8.225
  189    HG2  GLU  30           1HG      GLU  30   6.901  -1.507   9.413
  190    HG3  GLU  30           2HG      GLU  30   6.456  -3.212   9.396
  191    H    HIS  31           H        HIS  31   3.885  -0.407   6.173
  192    HA   HIS  31           HA       HIS  31   6.502  -0.092   5.022
  193    HB2  HIS  31           1HB      HIS  31   5.098  -1.423   3.711
  194    HB3  HIS  31           2HB      HIS  31   3.722  -0.343   3.917
  195    HD1  HIS  31           HD1      HIS  31   7.032  -0.508   2.087
  196    HD2  HIS  31           HD2      HIS  31   3.393   1.489   1.918
  197    HE1  HIS  31           HE1      HIS  31   7.083   0.800  -0.060
  198    H    GLN  32           H        GLN  32   3.655   1.936   5.500
  199    HA   GLN  32           HA       GLN  32   4.354   4.131   3.963
  200    HB2  GLN  32           1HB      GLN  32   2.824   3.911   6.547
  201    HB3  GLN  32           2HB      GLN  32   3.037   5.449   5.722
  202    HG2  GLN  32           1HG      GLN  32   1.866   4.652   3.796
  203    HG3  GLN  32           2HG      GLN  32   1.801   3.018   4.455
  204   HE21  GLN  32          1HE2      GLN  32  -0.527   3.794   3.756
  205   HE22  GLN  32          2HE2      GLN  32  -1.498   4.359   5.068
  206    H    ARG  33           H        ARG  33   5.948   2.881   6.666
  207    HA   ARG  33           HA       ARG  33   6.958   5.164   7.918
  208    HB2  ARG  33           1HB      ARG  33   8.438   2.558   7.542
  209    HB3  ARG  33           2HB      ARG  33   8.678   3.741   8.821
  210    HG2  ARG  33           1HG      ARG  33   5.992   2.500   8.517
  211    HG3  ARG  33           2HG      ARG  33   7.297   1.550   9.231
  212    HD2  ARG  33           1HD      ARG  33   6.322   4.243  10.176
  213    HD3  ARG  33           2HD      ARG  33   6.015   2.692  10.955
  214    HE   ARG  33           HE       ARG  33   8.697   2.780  10.906
  215   HH11  ARG  33          1HH1      ARG  33   6.302   5.096  11.917
  216   HH12  ARG  33          2HH1      ARG  33   7.319   5.818  13.120
  217   HH21  ARG  33          1HH2      ARG  33  10.045   3.722  12.487
  218   HH22  ARG  33          2HH2      ARG  33   9.448   5.036  13.443
  219    H    ILE  34           H        ILE  34   8.289   3.273   5.219
  220    HA   ILE  34           HA       ILE  34  10.630   4.776   4.861
  221    HB   ILE  34           HB       ILE  34  10.810   3.774   2.683
  222   HG12  ILE  34          1HG1      ILE  34   8.118   2.503   2.850
  223   HG13  ILE  34          2HG1      ILE  34   8.202   4.186   2.344
  224   HG21  ILE  34          1HG2      ILE  34  10.086   2.224   5.037
  225   HG22  ILE  34          2HG2      ILE  34   9.840   1.343   3.529
  226   HG23  ILE  34          3HG2      ILE  34  11.426   2.013   3.910
  227   HD11  ILE  34          3HD1      ILE  34   9.004   1.741   0.933
  228   HD12  ILE  34          1HD1      ILE  34   8.403   3.275   0.306
  229   HD13  ILE  34          2HD1      ILE  34  10.099   3.113   0.765
  230    H    HIS  35           H        HIS  35   7.404   5.620   4.313
  231    HA   HIS  35           HA       HIS  35   8.019   7.570   2.235
  232    HB2  HIS  35           1HB      HIS  35   5.480   6.582   3.499
  233    HB3  HIS  35           2HB      HIS  35   5.491   8.078   2.570
  234    HD1  HIS  35           HD1      HIS  35   7.162   7.378   0.179
  235    HD2  HIS  35           HD2      HIS  35   4.408   4.744   1.834
  236    HE1  HIS  35           HE1      HIS  35   6.580   5.768  -1.664
  237    H    THR  36           H        THR  36   8.891   7.648   5.173
  238    HA   THR  36           HA       THR  36   7.655  10.166   6.007
  239    HB   THR  36           HB       THR  36   8.943   9.836   8.119
  240    HG1  THR  36           HG1      THR  36  10.359   8.259   8.263
  241   HG21  THR  36          3HG2      THR  36   7.427   8.330   9.022
  242   HG22  THR  36          1HG2      THR  36   7.419   7.316   7.581
  243   HG23  THR  36          2HG2      THR  36   6.589   8.872   7.568
  244    H    GLY  37           H        GLY  37   8.673  11.419   4.317
  245    HA2  GLY  37           1HA      GLY  37  11.552  11.882   4.788
  246    HA3  GLY  37           2HA      GLY  37  10.749  12.143   3.247
  247    H    GLU  38           H        GLU  38   9.059  13.851   3.210
  248    HA   GLU  38           HA       GLU  38  10.083  16.290   4.107
  249    HB2  GLU  38           1HB      GLU  38   7.428  15.437   3.008
  250    HB3  GLU  38           2HB      GLU  38   7.643  17.076   3.605
  251    HG2  GLU  38           1HG      GLU  38   9.676  17.167   2.049
  252    HG3  GLU  38           2HG      GLU  38   8.987  15.731   1.295
  253    H    LYS  39           H        LYS  39  10.477  16.256   6.312
  254    HA   LYS  39           HA       LYS  39   8.171  15.933   8.095
  255    HB2  LYS  39           1HB      LYS  39  11.142  16.003   8.629
  256    HB3  LYS  39           2HB      LYS  39   9.930  15.968   9.903
  257    HG2  LYS  39           1HG      LYS  39   9.112  13.824   9.073
  258    HG3  LYS  39           2HG      LYS  39  10.319  13.861   7.785
  259    HD2  LYS  39           1HD      LYS  39  12.095  13.590   9.287
  260    HD3  LYS  39           2HD      LYS  39  11.108  14.053  10.676
  261    HE2  LYS  39           1HE      LYS  39  10.573  11.582   9.046
  262    HE3  LYS  39           2HE      LYS  39  11.651  11.587  10.441
  263    HZ1  LYS  39           3HZ      LYS  39   9.724  11.037  11.467
  264    HZ2  LYS  39           1HZ      LYS  39   8.744  11.827  10.337
  265    HZ3  LYS  39           2HZ      LYS  39   9.545  12.718  11.530
  266    HA   PRO  40           HA       PRO  40   7.797  20.238   8.881
  267    HB2  PRO  40           1HB      PRO  40   6.945  20.208  11.458
  268    HB3  PRO  40           2HB      PRO  40   5.920  19.722  10.102
  269    HG2  PRO  40           1HG      PRO  40   7.472  18.016  12.011
  270    HG3  PRO  40           2HG      PRO  40   5.824  17.792  11.395
  271    HD2  PRO  40           1HD      PRO  40   7.947  16.435  10.403
  272    HD3  PRO  40           2HD      PRO  40   6.556  16.897   9.401
  273    H    SER  41           H        SER  41   8.337  21.884  10.729
  274    HA   SER  41           HA       SER  41  11.121  22.010  10.972
  275    HB2  SER  41           1HB      SER  41   9.329  23.889  11.153
  276    HB3  SER  41           2HB      SER  41   9.298  23.469  12.865
  277    HG   SER  41           HG       SER  41  11.782  23.880  11.653
  278    H    GLY  42           H        GLY  42   8.641  20.942  13.255
  279    HA2  GLY  42           1HA      GLY  42  10.653  19.437  14.713
  280    HA3  GLY  42           2HA      GLY  42   9.871  20.721  15.625
  281    HA   PRO  43           HA       PRO  43   6.530  17.365  14.513
  282    HB2  PRO  43           1HB      PRO  43   7.540  14.920  13.902
  283    HB3  PRO  43           2HB      PRO  43   7.184  16.145  12.679
  284    HG2  PRO  43           1HG      PRO  43   9.806  15.424  13.929
  285    HG3  PRO  43           2HG      PRO  43   9.433  15.767  12.229
  286    HD2  PRO  43           1HD      PRO  43  10.571  17.597  13.869
  287    HD3  PRO  43           2HD      PRO  43   9.472  18.049  12.551
  288    H    SER  44           H        SER  44   9.225  17.318  16.476
  289    HA   SER  44           HA       SER  44   9.320  15.160  18.034
  290    HB2  SER  44           1HB      SER  44   8.979  17.908  19.249
  291    HB3  SER  44           2HB      SER  44   9.869  16.543  19.924
  292    HG   SER  44           HG       SER  44  10.881  18.419  18.493
  293    H    SER  45           H        SER  45   7.676  13.832  18.491
  294    HA   SER  45           HA       SER  45   5.595  13.098  19.116
  295    HB2  SER  45           1HB      SER  45   6.232  15.070  21.323
  296    HB3  SER  45           2HB      SER  45   4.963  13.849  21.411
  297    HG   SER  45           HG       SER  45   7.452  13.535  22.075
  298    H    GLY  46           H        GLY  46   5.163  14.770  17.099
  299    HA2  GLY  46           1HA      GLY  46   2.990  16.548  18.020
  300    HA3  GLY  46           2HA      GLY  46   3.950  16.839  16.577
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1  -0.250  -7.920 -31.177
    2    HA2  GLY   1           1HA      GLY   1   1.183  -8.308 -29.025
    3    HA3  GLY   1           2HA      GLY   1   0.682  -6.655 -28.701
    4    H    SER   2           H        SER   2   0.089  -9.547 -27.640
    5    HA   SER   2           HA       SER   2  -2.758  -9.002 -27.188
    6    HB2  SER   2           1HB      SER   2  -3.359 -11.325 -27.534
    7    HB3  SER   2           2HB      SER   2  -2.544 -10.727 -28.979
    8    HG   SER   2           HG       SER   2  -0.580 -11.649 -27.854
    9    H    SER   3           H        SER   3  -2.856  -8.621 -25.075
   10    HA   SER   3           HA       SER   3  -2.129 -10.662 -23.200
   11    HB2  SER   3           1HB      SER   3   0.037  -9.365 -23.679
   12    HB3  SER   3           2HB      SER   3  -0.720  -8.023 -22.822
   13    HG   SER   3           HG       SER   3   0.404  -9.159 -21.308
   14    H    GLY   4           H        GLY   4  -2.573  -9.892 -20.899
   15    HA2  GLY   4           1HA      GLY   4  -3.920  -7.631 -20.164
   16    HA3  GLY   4           2HA      GLY   4  -5.160  -8.643 -20.888
   17    H    SER   5           H        SER   5  -2.982  -8.239 -18.204
   18    HA   SER   5           HA       SER   5  -4.415 -10.391 -16.789
   19    HB2  SER   5           1HB      SER   5  -2.123 -11.101 -17.195
   20    HB3  SER   5           2HB      SER   5  -1.506  -9.597 -16.510
   21    HG   SER   5           HG       SER   5  -3.207 -11.116 -14.915
   22    H    SER   6           H        SER   6  -5.919  -8.865 -15.993
   23    HA   SER   6           HA       SER   6  -4.818  -7.003 -13.991
   24    HB2  SER   6           1HB      SER   6  -7.389  -6.801 -15.577
   25    HB3  SER   6           2HB      SER   6  -6.912  -5.690 -14.293
   26    HG   SER   6           HG       SER   6  -5.333  -6.191 -16.593
   27    H    GLY   7           H        GLY   7  -4.890  -8.156 -12.134
   28    HA2  GLY   7           1HA      GLY   7  -6.777  -8.359 -10.376
   29    HA3  GLY   7           2HA      GLY   7  -7.374  -9.589 -11.481
   30    H    THR   8           H        THR   8  -4.361  -8.694  -9.799
   31    HA   THR   8           HA       THR   8  -3.445 -11.420  -9.762
   32    HB   THR   8           HB       THR   8  -2.335  -9.084  -8.198
   33    HG1  THR   8           HG1      THR   8  -1.574  -8.374 -10.034
   34   HG21  THR   8          3HG2      THR   8  -1.686 -11.587  -7.766
   35   HG22  THR   8          1HG2      THR   8  -0.435 -10.348  -7.850
   36   HG23  THR   8          2HG2      THR   8  -0.742 -11.387  -9.242
   37    H    GLY   9           H        GLY   9  -4.532  -9.102  -7.280
   38    HA2  GLY   9           1HA      GLY   9  -5.917 -11.062  -5.787
   39    HA3  GLY   9           2HA      GLY   9  -4.333 -10.798  -5.072
   40    H    GLU  10           H        GLU  10  -7.521  -9.780  -5.141
   41    HA   GLU  10           HA       GLU  10  -7.320  -7.028  -4.657
   42    HB2  GLU  10           1HB      GLU  10  -9.555  -7.183  -3.726
   43    HB3  GLU  10           2HB      GLU  10  -9.438  -8.192  -5.161
   44    HG2  GLU  10           1HG      GLU  10  -9.318 -10.177  -3.850
   45    HG3  GLU  10           2HG      GLU  10  -9.163  -9.247  -2.360
   46    H    LYS  11           H        LYS  11  -6.779  -5.847  -2.924
   47    HA   LYS  11           HA       LYS  11  -6.366  -7.245  -0.364
   48    HB2  LYS  11           1HB      LYS  11  -4.609  -5.093  -1.558
   49    HB3  LYS  11           2HB      LYS  11  -4.405  -5.806   0.036
   50    HG2  LYS  11           1HG      LYS  11  -4.281  -8.045  -1.301
   51    HG3  LYS  11           2HG      LYS  11  -3.874  -6.981  -2.649
   52    HD2  LYS  11           1HD      LYS  11  -2.163  -5.957  -0.980
   53    HD3  LYS  11           2HD      LYS  11  -2.381  -7.473  -0.102
   54    HE2  LYS  11           1HE      LYS  11  -1.717  -7.394  -3.032
   55    HE3  LYS  11           2HE      LYS  11  -0.470  -7.362  -1.786
   56    HZ1  LYS  11           3HZ      LYS  11  -0.840  -9.510  -1.229
   57    HZ2  LYS  11           1HZ      LYS  11  -1.360  -9.603  -2.837
   58    HZ3  LYS  11           2HZ      LYS  11  -2.492  -9.455  -1.590
   59    HA   PRO  12           HA       PRO  12  -9.044  -4.123   1.246
   60    HB2  PRO  12           1HB      PRO  12  -8.524  -4.517   3.881
   61    HB3  PRO  12           2HB      PRO  12  -9.518  -5.621   2.922
   62    HG2  PRO  12           1HG      PRO  12  -6.637  -5.858   3.703
   63    HG3  PRO  12           2HG      PRO  12  -7.902  -7.101   3.699
   64    HD2  PRO  12           1HD      PRO  12  -6.060  -6.891   1.726
   65    HD3  PRO  12           2HD      PRO  12  -7.714  -7.464   1.431
   66    H    TYR  13           H        TYR  13  -5.711  -4.007   1.226
   67    HA   TYR  13           HA       TYR  13  -5.742  -1.234   2.164
   68    HB2  TYR  13           1HB      TYR  13  -3.866  -3.389   3.136
   69    HB3  TYR  13           2HB      TYR  13  -3.509  -1.673   3.295
   70    HD1  TYR  13           HD2      TYR  13  -4.868  -0.255   4.783
   71    HD2  TYR  13           HD1      TYR  13  -5.492  -4.457   4.543
   72    HE1  TYR  13           HE2      TYR  13  -6.149  -0.179   6.881
   73    HE2  TYR  13           HE1      TYR  13  -6.776  -4.392   6.640
   74    HH   TYR  13           HH       TYR  13  -7.575  -3.123   8.271
   75    H    ASN  14           H        ASN  14  -4.135   0.092   1.253
   76    HA   ASN  14           HA       ASN  14  -2.201  -0.967  -0.585
   77    HB2  ASN  14           1HB      ASN  14  -4.679   0.412  -1.605
   78    HB3  ASN  14           2HB      ASN  14  -3.177   0.406  -2.525
   79   HD21  ASN  14          1HD2      ASN  14  -5.910  -1.399  -1.509
   80   HD22  ASN  14          2HD2      ASN  14  -5.567  -2.840  -2.398
   81    H    CYS  15           H        CYS  15  -0.685   0.580  -1.264
   82    HA   CYS  15           HA       CYS  15  -0.631   2.965   0.407
   83    HB2  CYS  15           1HB      CYS  15   1.331   1.304   0.030
   84    HB3  CYS  15           2HB      CYS  15   1.549   2.156  -1.495
   85    H    GLU  16           H        GLU  16  -1.446   4.800  -0.338
   86    HA   GLU  16           HA       GLU  16  -1.832   5.211  -3.177
   87    HB2  GLU  16           1HB      GLU  16  -3.479   5.852  -1.314
   88    HB3  GLU  16           2HB      GLU  16  -2.411   7.213  -1.005
   89    HG2  GLU  16           1HG      GLU  16  -4.203   7.937  -2.408
   90    HG3  GLU  16           2HG      GLU  16  -2.712   7.933  -3.348
   91    H    GLU  17           H        GLU  17   0.879   5.249  -1.748
   92    HA   GLU  17           HA       GLU  17   1.752   7.922  -2.617
   93    HB2  GLU  17           1HB      GLU  17   2.928   5.975  -0.638
   94    HB3  GLU  17           2HB      GLU  17   3.830   7.353  -1.254
   95    HG2  GLU  17           1HG      GLU  17   2.765   7.741   0.948
   96    HG3  GLU  17           2HG      GLU  17   2.279   8.891  -0.297
   97    H    CYS  18           H        CYS  18   2.514   4.474  -2.797
   98    HA   CYS  18           HA       CYS  18   4.194   5.048  -5.150
   99    HB2  CYS  18           1HB      CYS  18   5.478   3.010  -4.594
  100    HB3  CYS  18           2HB      CYS  18   5.569   4.221  -3.319
  101    H    GLY  19           H        GLY  19   2.028   2.678  -3.633
  102    HA2  GLY  19           1HA      GLY  19   0.153   1.940  -5.089
  103    HA3  GLY  19           2HA      GLY  19   1.359   1.717  -6.348
  104    H    LYS  20           H        LYS  20   1.646   0.839  -2.938
  105    HA   LYS  20           HA       LYS  20   2.020  -1.953  -3.781
  106    HB2  LYS  20           1HB      LYS  20   3.880  -0.732  -2.561
  107    HB3  LYS  20           2HB      LYS  20   2.837  -0.732  -1.145
  108    HG2  LYS  20           1HG      LYS  20   2.921  -3.067  -0.946
  109    HG3  LYS  20           2HG      LYS  20   3.572  -3.265  -2.575
  110    HD2  LYS  20           1HD      LYS  20   5.669  -2.283  -1.908
  111    HD3  LYS  20           2HD      LYS  20   5.023  -1.892  -0.313
  112    HE2  LYS  20           1HE      LYS  20   4.582  -4.458  -0.175
  113    HE3  LYS  20           2HE      LYS  20   5.791  -4.546  -1.455
  114    HZ1  LYS  20           3HZ      LYS  20   6.806  -4.799   0.713
  115    HZ2  LYS  20           1HZ      LYS  20   6.180  -3.310   1.218
  116    HZ3  LYS  20           2HZ      LYS  20   7.339  -3.367  -0.013
  117    H    ALA  21           H        ALA  21   0.532  -3.411  -3.265
  118    HA   ALA  21           HA       ALA  21  -1.702  -2.657  -1.588
  119    HB1  ALA  21           3HB      ALA  21  -2.846  -4.426  -2.509
  120    HB2  ALA  21           1HB      ALA  21  -1.717  -4.035  -3.807
  121    HB3  ALA  21           2HB      ALA  21  -1.388  -5.394  -2.731
  122    H    PHE  22           H        PHE  22  -2.420  -3.844   0.239
  123    HA   PHE  22           HA       PHE  22  -0.470  -5.643   1.478
  124    HB2  PHE  22           1HB      PHE  22  -1.632  -3.178   2.788
  125    HB3  PHE  22           2HB      PHE  22  -0.782  -4.449   3.660
  126    HD1  PHE  22           HD2      PHE  22  -0.399  -1.877   1.030
  127    HD2  PHE  22           HD1      PHE  22   1.560  -4.493   3.757
  128    HE1  PHE  22           HE2      PHE  22   1.742  -0.761   0.557
  129    HE2  PHE  22           HE1      PHE  22   3.704  -3.381   3.289
  130    HZ   PHE  22           HZ       PHE  22   3.797  -1.513   1.686
  131    H    ILE  23           H        ILE  23  -1.354  -7.268   2.660
  132    HA   ILE  23           HA       ILE  23  -4.163  -7.743   2.368
  133    HB   ILE  23           HB       ILE  23  -2.084  -9.295   3.914
  134   HG12  ILE  23          1HG1      ILE  23  -3.313  -9.932   1.230
  135   HG13  ILE  23          2HG1      ILE  23  -1.782  -9.082   1.410
  136   HG21  ILE  23          1HG2      ILE  23  -4.500 -10.667   2.983
  137   HG22  ILE  23          2HG2      ILE  23  -3.642 -10.791   4.518
  138   HG23  ILE  23          3HG2      ILE  23  -4.776  -9.468   4.246
  139   HD11  ILE  23          3HD1      ILE  23  -1.798 -11.501   2.965
  140   HD12  ILE  23          1HD1      ILE  23  -2.182 -11.827   1.275
  141   HD13  ILE  23          2HD1      ILE  23  -0.690 -10.984   1.695
  142    H    HIS  24           H        HIS  24  -2.011  -7.041   5.098
  143    HA   HIS  24           HA       HIS  24  -4.396  -6.568   6.762
  144    HB2  HIS  24           1HB      HIS  24  -1.590  -7.346   7.576
  145    HB3  HIS  24           2HB      HIS  24  -2.866  -6.913   8.710
  146    HD2  HIS  24           HD2      HIS  24  -2.215  -9.759   6.045
  147    HE1  HIS  24           HE1      HIS  24  -4.853 -11.191   9.043
  148    HE2  HIS  24           HE2      HIS  24  -3.475 -11.795   7.023
  149    H    ASP  25           H        ASP  25  -4.075  -4.875   8.468
  150    HA   ASP  25           HA       ASP  25  -3.183  -2.453   7.220
  151    HB2  ASP  25           1HB      ASP  25  -5.193  -2.779   8.812
  152    HB3  ASP  25           2HB      ASP  25  -4.000  -2.691  10.105
  153    H    SER  26           H        SER  26  -2.121  -4.407   9.978
  154    HA   SER  26           HA       SER  26  -0.086  -2.732  10.899
  155    HB2  SER  26           1HB      SER  26   0.806  -4.681  12.031
  156    HB3  SER  26           2HB      SER  26  -0.955  -4.740  12.102
  157    HG   SER  26           HG       SER  26  -0.508  -6.028   9.980
  158    H    GLN  27           H        GLN  27  -0.272  -4.648   8.063
  159    HA   GLN  27           HA       GLN  27   2.576  -4.862   7.663
  160    HB2  GLN  27           1HB      GLN  27   0.194  -5.486   5.923
  161    HB3  GLN  27           2HB      GLN  27   1.850  -5.655   5.357
  162    HG2  GLN  27           1HG      GLN  27   2.164  -7.136   7.450
  163    HG3  GLN  27           2HG      GLN  27   0.403  -7.219   7.449
  164   HE21  GLN  27          1HE2      GLN  27  -0.654  -8.204   5.695
  165   HE22  GLN  27          2HE2      GLN  27   0.170  -9.308   4.653
  166    H    LEU  28           H        LEU  28  -0.063  -3.105   6.033
  167    HA   LEU  28           HA       LEU  28   1.524  -1.638   4.271
  168    HB2  LEU  28           1HB      LEU  28  -0.735  -1.586   3.794
  169    HB3  LEU  28           2HB      LEU  28  -1.183  -1.239   5.463
  170    HG   LEU  28           HG       LEU  28  -0.233   1.067   5.128
  171   HD11  LEU  28          1HD1      LEU  28   0.734  -0.050   2.765
  172   HD12  LEU  28          2HD1      LEU  28   0.789   1.646   3.245
  173   HD13  LEU  28          3HD1      LEU  28  -0.551   1.050   2.265
  174   HD21  LEU  28          3HD2      LEU  28  -2.202   1.897   4.029
  175   HD22  LEU  28          1HD2      LEU  28  -2.652   0.522   5.037
  176   HD23  LEU  28          2HD2      LEU  28  -2.505   0.324   3.291
  177    H    GLN  29           H        GLN  29   0.351  -0.771   7.513
  178    HA   GLN  29           HA       GLN  29   1.346   1.796   7.694
  179    HB2  GLN  29           1HB      GLN  29   1.073  -0.337   9.810
  180    HB3  GLN  29           2HB      GLN  29   1.521   1.323  10.178
  181    HG2  GLN  29           1HG      GLN  29  -1.059   0.338   8.994
  182    HG3  GLN  29           2HG      GLN  29  -0.808   1.088  10.570
  183   HE21  GLN  29          1HE2      GLN  29  -1.663   1.596   7.377
  184   HE22  GLN  29          2HE2      GLN  29  -1.584   3.321   7.355
  185    H    GLU  30           H        GLU  30   3.007  -1.242   8.503
  186    HA   GLU  30           HA       GLU  30   5.411  -0.159   9.390
  187    HB2  GLU  30           1HB      GLU  30   4.944  -2.497   9.704
  188    HB3  GLU  30           2HB      GLU  30   4.848  -2.762   7.968
  189    HG2  GLU  30           1HG      GLU  30   7.132  -2.658   7.688
  190    HG3  GLU  30           2HG      GLU  30   7.377  -1.734   9.169
  191    H    HIS  31           H        HIS  31   4.083  -0.222   6.247
  192    HA   HIS  31           HA       HIS  31   6.668   0.178   4.948
  193    HB2  HIS  31           1HB      HIS  31   5.280  -1.258   3.690
  194    HB3  HIS  31           2HB      HIS  31   3.867  -0.232   3.920
  195    HD1  HIS  31           HD1      HIS  31   7.140  -0.300   2.026
  196    HD2  HIS  31           HD2      HIS  31   3.466   1.639   1.962
  197    HE1  HIS  31           HE1      HIS  31   7.119   1.032  -0.107
  198    H    GLN  32           H        GLN  32   3.520   1.845   5.131
  199    HA   GLN  32           HA       GLN  32   4.005   4.153   3.825
  200    HB2  GLN  32           1HB      GLN  32   2.651   3.923   6.518
  201    HB3  GLN  32           2HB      GLN  32   2.500   5.292   5.424
  202    HG2  GLN  32           1HG      GLN  32   1.592   3.675   3.718
  203    HG3  GLN  32           2HG      GLN  32   1.512   2.487   5.018
  204   HE21  GLN  32          1HE2      GLN  32  -0.671   3.520   3.491
  205   HE22  GLN  32          2HE2      GLN  32  -1.734   4.318   4.594
  206    H    ARG  33           H        ARG  33   5.527   3.125   6.754
  207    HA   ARG  33           HA       ARG  33   6.391   5.466   7.904
  208    HB2  ARG  33           1HB      ARG  33   8.209   3.087   7.577
  209    HB3  ARG  33           2HB      ARG  33   8.132   4.222   8.918
  210    HG2  ARG  33           1HG      ARG  33   5.667   3.269   9.097
  211    HG3  ARG  33           2HG      ARG  33   6.422   1.882   8.309
  212    HD2  ARG  33           1HD      ARG  33   6.616   1.462  10.612
  213    HD3  ARG  33           2HD      ARG  33   8.209   2.028  10.110
  214    HE   ARG  33           HE       ARG  33   6.932   4.284  10.943
  215   HH11  ARG  33          1HH1      ARG  33   7.594   1.180  12.375
  216   HH12  ARG  33          2HH1      ARG  33   7.670   1.797  13.992
  217   HH21  ARG  33          1HH2      ARG  33   7.031   5.108  13.067
  218   HH22  ARG  33          2HH2      ARG  33   7.349   4.031  14.385
  219    H    ILE  34           H        ILE  34   7.943   3.683   5.247
  220    HA   ILE  34           HA       ILE  34  10.137   5.379   4.898
  221    HB   ILE  34           HB       ILE  34  10.395   4.419   2.702
  222   HG12  ILE  34          1HG1      ILE  34   7.822   2.918   2.894
  223   HG13  ILE  34          2HG1      ILE  34   7.767   4.597   2.369
  224   HG21  ILE  34          1HG2      ILE  34   9.805   2.785   5.047
  225   HG22  ILE  34          2HG2      ILE  34   9.686   1.905   3.524
  226   HG23  ILE  34          3HG2      ILE  34  11.182   2.736   3.947
  227   HD11  ILE  34          3HD1      ILE  34   8.035   3.688   0.340
  228   HD12  ILE  34          1HD1      ILE  34   9.739   3.664   0.793
  229   HD13  ILE  34          2HD1      ILE  34   8.756   2.211   0.978
  230    H    HIS  35           H        HIS  35   6.829   5.862   4.177
  231    HA   HIS  35           HA       HIS  35   7.364   7.967   2.230
  232    HB2  HIS  35           1HB      HIS  35   4.819   6.724   3.271
  233    HB3  HIS  35           2HB      HIS  35   4.823   8.138   2.221
  234    HD1  HIS  35           HD1      HIS  35   6.517   7.575  -0.037
  235    HD2  HIS  35           HD2      HIS  35   4.417   4.503   1.810
  236    HE1  HIS  35           HE1      HIS  35   6.372   5.736  -1.747
  237    H    THR  36           H        THR  36   7.590   7.807   5.430
  238    HA   THR  36           HA       THR  36   6.707  10.591   5.783
  239    HB   THR  36           HB       THR  36   5.796  10.191   7.917
  240    HG1  THR  36           HG1      THR  36   7.302   7.836   7.776
  241   HG21  THR  36          3HG2      THR  36   5.018   7.859   6.163
  242   HG22  THR  36          1HG2      THR  36   4.298   9.469   6.142
  243   HG23  THR  36          2HG2      THR  36   4.103   8.434   7.557
  244    H    GLY  37           H        GLY  37   9.312   9.727   5.105
  245    HA2  GLY  37           1HA      GLY  37  10.742  10.594   7.528
  246    HA3  GLY  37           2HA      GLY  37  11.305   9.182   6.647
  247    H    GLU  38           H        GLU  38  11.361   9.756   4.113
  248    HA   GLU  38           HA       GLU  38  13.570  11.341   3.699
  249    HB2  GLU  38           1HB      GLU  38  12.816   9.770   2.024
  250    HB3  GLU  38           2HB      GLU  38  11.332  10.680   1.780
  251    HG2  GLU  38           1HG      GLU  38  12.622  12.555   0.898
  252    HG3  GLU  38           2HG      GLU  38  14.111  11.645   1.144
  253    H    LYS  39           H        LYS  39  13.834  13.424   4.120
  254    HA   LYS  39           HA       LYS  39  11.568  15.257   3.809
  255    HB2  LYS  39           1HB      LYS  39  13.125  16.857   5.041
  256    HB3  LYS  39           2HB      LYS  39  12.520  15.481   5.955
  257    HG2  LYS  39           1HG      LYS  39  15.127  15.192   4.565
  258    HG3  LYS  39           2HG      LYS  39  15.058  16.191   6.019
  259    HD2  LYS  39           1HD      LYS  39  13.772  13.510   6.097
  260    HD3  LYS  39           2HD      LYS  39  15.535  13.588   6.135
  261    HE2  LYS  39           1HE      LYS  39  15.274  15.266   8.019
  262    HE3  LYS  39           2HE      LYS  39  13.574  14.799   8.069
  263    HZ1  LYS  39           3HZ      LYS  39  14.844  12.419   8.120
  264    HZ2  LYS  39           1HZ      LYS  39  14.272  13.240   9.484
  265    HZ3  LYS  39           2HZ      LYS  39  15.893  13.388   9.026
  266    HA   PRO  40           HA       PRO  40  13.312  16.783   0.036
  267    HB2  PRO  40           1HB      PRO  40  11.731  18.977  -0.200
  268    HB3  PRO  40           2HB      PRO  40  11.160  17.340  -0.543
  269    HG2  PRO  40           1HG      PRO  40  10.787  19.000   1.920
  270    HG3  PRO  40           2HG      PRO  40   9.611  17.981   1.069
  271    HD2  PRO  40           1HD      PRO  40  10.885  17.169   3.316
  272    HD3  PRO  40           2HD      PRO  40  10.406  16.043   2.031
  273    H    SER  41           H        SER  41  12.618  19.158   2.608
  274    HA   SER  41           HA       SER  41  15.247  20.371   2.075
  275    HB2  SER  41           1HB      SER  41  12.570  21.693   2.318
  276    HB3  SER  41           2HB      SER  41  14.008  22.554   2.867
  277    HG   SER  41           HG       SER  41  13.340  22.833   0.586
  278    H    GLY  42           H        GLY  42  12.566  20.479   4.435
  279    HA2  GLY  42           1HA      GLY  42  13.874  19.379   6.592
  280    HA3  GLY  42           2HA      GLY  42  14.312  21.080   6.617
  281    HA   PRO  43           HA       PRO  43   9.509  20.883   7.223
  282    HB2  PRO  43           1HB      PRO  43   8.464  18.426   7.713
  283    HB3  PRO  43           2HB      PRO  43   8.611  19.100   6.086
  284    HG2  PRO  43           1HG      PRO  43  10.385  17.141   7.491
  285    HG3  PRO  43           2HG      PRO  43   9.806  17.124   5.815
  286    HD2  PRO  43           1HD      PRO  43  12.291  17.963   6.491
  287    HD3  PRO  43           2HD      PRO  43  11.392  18.646   5.121
  288    H    SER  44           H        SER  44   9.638  21.835   9.181
  289    HA   SER  44           HA       SER  44   9.750  20.080  11.530
  290    HB2  SER  44           1HB      SER  44  11.986  21.231  11.054
  291    HB3  SER  44           2HB      SER  44  11.175  22.739  11.478
  292    HG   SER  44           HG       SER  44  12.327  21.503  13.205
  293    H    SER  45           H        SER  45   9.281  21.597  13.563
  294    HA   SER  45           HA       SER  45   6.805  23.033  12.891
  295    HB2  SER  45           1HB      SER  45   6.926  20.965  14.514
  296    HB3  SER  45           2HB      SER  45   7.473  22.169  15.681
  297    HG   SER  45           HG       SER  45   4.980  21.698  14.741
  298    H    GLY  46           H        GLY  46   6.275  24.963  14.087
  299    HA2  GLY  46           1HA      GLY  46   6.931  26.721  15.610
  300    HA3  GLY  46           2HA      GLY  46   8.608  26.328  15.264
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1  13.478 -20.929 -16.084
    2    HA2  GLY   1           1HA      GLY   1  12.733 -20.949 -13.868
    3    HA3  GLY   1           2HA      GLY   1  13.862 -19.654 -13.500
    4    H    SER   2           H        SER   2  10.640 -20.461 -14.201
    5    HA   SER   2           HA       SER   2   9.939 -17.602 -14.362
    6    HB2  SER   2           1HB      SER   2   8.848 -19.970 -15.828
    7    HB3  SER   2           2HB      SER   2   7.763 -18.631 -15.452
    8    HG   SER   2           HG       SER   2   9.869 -18.764 -17.237
    9    H    SER   3           H        SER   3   8.755 -16.846 -12.740
   10    HA   SER   3           HA       SER   3   6.817 -18.512 -11.384
   11    HB2  SER   3           1HB      SER   3   8.684 -19.146 -10.057
   12    HB3  SER   3           2HB      SER   3   9.299 -17.494 -10.000
   13    HG   SER   3           HG       SER   3   7.432 -16.952  -8.762
   14    H    GLY   4           H        GLY   4   5.298 -17.330 -10.184
   15    HA2  GLY   4           1HA      GLY   4   5.572 -14.397 -10.311
   16    HA3  GLY   4           2HA      GLY   4   4.113 -15.180 -10.900
   17    H    SER   5           H        SER   5   3.328 -13.537  -9.211
   18    HA   SER   5           HA       SER   5   3.339 -14.777  -6.540
   19    HB2  SER   5           1HB      SER   5   2.901 -11.915  -7.403
   20    HB3  SER   5           2HB      SER   5   2.535 -12.490  -5.776
   21    HG   SER   5           HG       SER   5   4.744 -13.132  -5.618
   22    H    SER   6           H        SER   6   1.229 -14.128  -5.297
   23    HA   SER   6           HA       SER   6  -1.048 -14.750  -7.063
   24    HB2  SER   6           1HB      SER   6  -0.246 -16.498  -5.321
   25    HB3  SER   6           2HB      SER   6  -0.991 -15.430  -4.133
   26    HG   SER   6           HG       SER   6  -2.322 -17.188  -5.111
   27    H    GLY   7           H        GLY   7  -0.300 -12.110  -6.673
   28    HA2  GLY   7           1HA      GLY   7  -2.227 -11.091  -4.692
   29    HA3  GLY   7           2HA      GLY   7  -0.887 -10.176  -5.367
   30    H    THR   8           H        THR   8  -3.510 -12.079  -6.845
   31    HA   THR   8           HA       THR   8  -3.871 -10.545  -9.095
   32    HB   THR   8           HB       THR   8  -6.058 -11.957  -7.553
   33    HG1  THR   8           HG1      THR   8  -5.115 -13.717  -8.230
   34   HG21  THR   8          3HG2      THR   8  -7.456 -11.592  -9.275
   35   HG22  THR   8          1HG2      THR   8  -6.192 -11.845 -10.478
   36   HG23  THR   8          2HG2      THR   8  -6.358 -10.276  -9.690
   37    H    GLY   9           H        GLY   9  -5.853 -10.295  -6.129
   38    HA2  GLY   9           1HA      GLY   9  -5.794  -7.506  -5.962
   39    HA3  GLY   9           2HA      GLY   9  -7.193  -7.944  -6.930
   40    H    GLU  10           H        GLU  10  -5.741  -9.493  -4.076
   41    HA   GLU  10           HA       GLU  10  -8.372  -9.300  -2.769
   42    HB2  GLU  10           1HB      GLU  10  -6.251 -11.388  -2.780
   43    HB3  GLU  10           2HB      GLU  10  -7.169 -11.172  -1.297
   44    HG2  GLU  10           1HG      GLU  10  -9.137 -11.873  -2.248
   45    HG3  GLU  10           2HG      GLU  10  -8.625 -11.449  -3.880
   46    H    LYS  11           H        LYS  11  -6.031  -7.371  -2.821
   47    HA   LYS  11           HA       LYS  11  -5.332  -7.314   0.022
   48    HB2  LYS  11           1HB      LYS  11  -4.165  -6.155  -2.454
   49    HB3  LYS  11           2HB      LYS  11  -3.965  -5.236  -0.968
   50    HG2  LYS  11           1HG      LYS  11  -2.044  -6.574  -1.169
   51    HG3  LYS  11           2HG      LYS  11  -3.041  -7.347   0.065
   52    HD2  LYS  11           1HD      LYS  11  -3.747  -9.039  -1.434
   53    HD3  LYS  11           2HD      LYS  11  -3.110  -8.167  -2.830
   54    HE2  LYS  11           1HE      LYS  11  -0.898  -8.667  -2.281
   55    HE3  LYS  11           2HE      LYS  11  -1.303  -9.058  -0.610
   56    HZ1  LYS  11           3HZ      LYS  11  -2.706 -10.773  -2.355
   57    HZ2  LYS  11           1HZ      LYS  11  -1.563 -11.169  -1.172
   58    HZ3  LYS  11           2HZ      LYS  11  -1.060 -10.810  -2.747
   59    HA   PRO  12           HA       PRO  12  -8.740  -4.352   0.284
   60    HB2  PRO  12           1HB      PRO  12  -8.912  -4.469   2.991
   61    HB3  PRO  12           2HB      PRO  12  -9.640  -5.680   1.929
   62    HG2  PRO  12           1HG      PRO  12  -7.056  -5.790   3.436
   63    HG3  PRO  12           2HG      PRO  12  -8.290  -7.048   3.239
   64    HD2  PRO  12           1HD      PRO  12  -6.005  -7.009   1.787
   65    HD3  PRO  12           2HD      PRO  12  -7.535  -7.636   1.142
   66    H    TYR  13           H        TYR  13  -5.529  -4.108   0.898
   67    HA   TYR  13           HA       TYR  13  -5.810  -1.334   1.834
   68    HB2  TYR  13           1HB      TYR  13  -3.915  -3.447   2.838
   69    HB3  TYR  13           2HB      TYR  13  -3.550  -1.733   3.005
   70    HD1  TYR  13           HD2      TYR  13  -4.976  -0.296   4.425
   71    HD2  TYR  13           HD1      TYR  13  -5.558  -4.506   4.219
   72    HE1  TYR  13           HE2      TYR  13  -6.319  -0.205   6.483
   73    HE2  TYR  13           HE1      TYR  13  -6.904  -4.426   6.276
   74    HH   TYR  13           HH       TYR  13  -7.614  -3.156   7.964
   75    H    ASN  14           H        ASN  14  -4.228   0.127   1.080
   76    HA   ASN  14           HA       ASN  14  -2.242  -0.787  -0.819
   77    HB2  ASN  14           1HB      ASN  14  -4.503   1.030  -1.684
   78    HB3  ASN  14           2HB      ASN  14  -3.075   0.660  -2.645
   79   HD21  ASN  14          1HD2      ASN  14  -6.029  -0.604  -1.297
   80   HD22  ASN  14          2HD2      ASN  14  -6.125  -2.001  -2.309
   81    H    CYS  15           H        CYS  15  -0.750   0.884  -1.445
   82    HA   CYS  15           HA       CYS  15  -0.612   3.022   0.558
   83    HB2  CYS  15           1HB      CYS  15   1.286   1.320   0.186
   84    HB3  CYS  15           2HB      CYS  15   1.620   2.214  -1.294
   85    H    GLU  16           H        GLU  16  -1.938   4.573  -0.357
   86    HA   GLU  16           HA       GLU  16  -2.042   5.363  -3.010
   87    HB2  GLU  16           1HB      GLU  16  -2.909   7.522  -2.164
   88    HB3  GLU  16           2HB      GLU  16  -3.673   6.135  -1.400
   89    HG2  GLU  16           1HG      GLU  16  -2.304   6.425   0.573
   90    HG3  GLU  16           2HG      GLU  16  -1.447   7.762  -0.194
   91    H    GLU  17           H        GLU  17   0.509   5.714  -0.805
   92    HA   GLU  17           HA       GLU  17   1.666   8.109  -1.821
   93    HB2  GLU  17           1HB      GLU  17   2.858   5.821  -0.250
   94    HB3  GLU  17           2HB      GLU  17   3.723   7.302  -0.636
   95    HG2  GLU  17           1HG      GLU  17   2.299   8.606   0.711
   96    HG3  GLU  17           2HG      GLU  17   1.121   7.303   0.858
   97    H    CYS  18           H        CYS  18   2.405   4.663  -2.325
   98    HA   CYS  18           HA       CYS  18   3.869   5.427  -4.767
   99    HB2  CYS  18           1HB      CYS  18   5.014   3.183  -4.481
  100    HB3  CYS  18           2HB      CYS  18   5.412   4.403  -3.275
  101    H    GLY  19           H        GLY  19   1.819   2.883  -3.353
  102    HA2  GLY  19           1HA      GLY  19  -0.203   2.365  -4.735
  103    HA3  GLY  19           2HA      GLY  19   0.907   2.251  -6.092
  104    H    LYS  20           H        LYS  20   1.429   1.024  -2.824
  105    HA   LYS  20           HA       LYS  20   1.684  -1.670  -3.968
  106    HB2  LYS  20           1HB      LYS  20   3.580  -0.481  -2.643
  107    HB3  LYS  20           2HB      LYS  20   2.626  -0.894  -1.224
  108    HG2  LYS  20           1HG      LYS  20   2.730  -3.268  -1.882
  109    HG3  LYS  20           2HG      LYS  20   3.762  -2.819  -3.242
  110    HD2  LYS  20           1HD      LYS  20   4.422  -2.232  -0.359
  111    HD3  LYS  20           2HD      LYS  20   4.993  -3.657  -1.231
  112    HE2  LYS  20           1HE      LYS  20   5.494  -0.814  -2.101
  113    HE3  LYS  20           2HE      LYS  20   6.629  -1.777  -1.156
  114    HZ1  LYS  20           3HZ      LYS  20   6.503  -1.674  -3.869
  115    HZ2  LYS  20           1HZ      LYS  20   5.721  -3.131  -3.511
  116    HZ3  LYS  20           2HZ      LYS  20   7.298  -2.861  -2.964
  117    H    ALA  21           H        ALA  21   0.236  -3.186  -3.491
  118    HA   ALA  21           HA       ALA  21  -1.909  -2.576  -1.645
  119    HB1  ALA  21           3HB      ALA  21  -3.003  -3.684  -3.238
  120    HB2  ALA  21           1HB      ALA  21  -1.513  -4.357  -3.900
  121    HB3  ALA  21           2HB      ALA  21  -2.318  -5.156  -2.549
  122    H    PHE  22           H        PHE  22  -2.450  -3.750   0.190
  123    HA   PHE  22           HA       PHE  22  -0.492  -5.727   1.129
  124    HB2  PHE  22           1HB      PHE  22  -1.483  -3.304   2.630
  125    HB3  PHE  22           2HB      PHE  22  -0.744  -4.684   3.436
  126    HD1  PHE  22           HD2      PHE  22  -0.169  -1.854   1.182
  127    HD2  PHE  22           HD1      PHE  22   1.612  -5.101   3.280
  128    HE1  PHE  22           HE2      PHE  22   2.059  -0.900   0.760
  129    HE2  PHE  22           HE1      PHE  22   3.843  -4.151   2.862
  130    HZ   PHE  22           HZ       PHE  22   4.069  -2.049   1.600
  131    H    ILE  23           H        ILE  23  -1.292  -7.156   2.787
  132    HA   ILE  23           HA       ILE  23  -4.019  -7.911   2.329
  133    HB   ILE  23           HB       ILE  23  -1.928  -9.020   4.200
  134   HG12  ILE  23          1HG1      ILE  23  -1.419  -9.401   1.862
  135   HG13  ILE  23          2HG1      ILE  23  -1.949 -10.915   2.587
  136   HG21  ILE  23          1HG2      ILE  23  -4.105  -9.444   5.153
  137   HG22  ILE  23          2HG2      ILE  23  -4.699 -10.046   3.607
  138   HG23  ILE  23          3HG2      ILE  23  -3.456 -10.940   4.481
  139   HD11  ILE  23          3HD1      ILE  23  -4.292  -9.975   1.647
  140   HD12  ILE  23          1HD1      ILE  23  -3.171  -9.302   0.463
  141   HD13  ILE  23          2HD1      ILE  23  -3.217 -11.043   0.746
  142    H    HIS  24           H        HIS  24  -2.213  -6.951   5.252
  143    HA   HIS  24           HA       HIS  24  -4.780  -6.170   6.467
  144    HB2  HIS  24           1HB      HIS  24  -2.207  -7.133   7.716
  145    HB3  HIS  24           2HB      HIS  24  -3.485  -6.364   8.652
  146    HD2  HIS  24           HD2      HIS  24  -2.718  -9.758   6.922
  147    HE1  HIS  24           HE1      HIS  24  -6.425 -10.107   8.955
  148    HE2  HIS  24           HE2      HIS  24  -4.576 -11.343   7.773
  149    H    ASP  25           H        ASP  25  -4.233  -4.488   8.359
  150    HA   ASP  25           HA       ASP  25  -3.312  -2.137   6.984
  151    HB2  ASP  25           1HB      ASP  25  -5.256  -2.082   8.512
  152    HB3  ASP  25           2HB      ASP  25  -4.191  -2.472   9.860
  153    H    SER  26           H        SER  26  -2.312  -3.818   9.965
  154    HA   SER  26           HA       SER  26  -0.157  -2.321  10.703
  155    HB2  SER  26           1HB      SER  26   0.802  -4.380  11.680
  156    HB3  SER  26           2HB      SER  26  -0.928  -4.249  11.995
  157    HG   SER  26           HG       SER  26  -1.142  -6.089  11.030
  158    H    GLN  27           H        GLN  27  -0.295  -4.721   8.126
  159    HA   GLN  27           HA       GLN  27   2.459  -4.801   7.545
  160    HB2  GLN  27           1HB      GLN  27   0.103  -5.281   5.713
  161    HB3  GLN  27           2HB      GLN  27   1.767  -5.731   5.365
  162    HG2  GLN  27           1HG      GLN  27   1.567  -7.035   7.623
  163    HG3  GLN  27           2HG      GLN  27  -0.161  -6.931   7.288
  164   HE21  GLN  27          1HE2      GLN  27  -0.847  -8.765   6.466
  165   HE22  GLN  27          2HE2      GLN  27  -0.037  -9.715   5.272
  166    H    LEU  28           H        LEU  28  -0.170  -2.974   5.979
  167    HA   LEU  28           HA       LEU  28   1.453  -1.563   4.180
  168    HB2  LEU  28           1HB      LEU  28  -0.852  -1.587   3.748
  169    HB3  LEU  28           2HB      LEU  28  -1.247  -1.022   5.370
  170    HG   LEU  28           HG       LEU  28  -0.210   1.184   4.740
  171   HD11  LEU  28          1HD1      LEU  28   0.996   0.052   2.745
  172   HD12  LEU  28          2HD1      LEU  28   0.370   1.690   2.561
  173   HD13  LEU  28          3HD1      LEU  28  -0.524   0.325   1.894
  174   HD21  LEU  28          3HD2      LEU  28  -2.200   1.597   3.012
  175   HD22  LEU  28          1HD2      LEU  28  -2.468   1.392   4.743
  176   HD23  LEU  28          2HD2      LEU  28  -2.709   0.032   3.646
  177    H    GLN  29           H        GLN  29   0.247  -0.656   7.398
  178    HA   GLN  29           HA       GLN  29   1.295   1.910   7.533
  179    HB2  GLN  29           1HB      GLN  29   0.977  -0.098   9.771
  180    HB3  GLN  29           2HB      GLN  29   1.221   1.630   9.988
  181    HG2  GLN  29           1HG      GLN  29  -1.134   0.346   8.623
  182    HG3  GLN  29           2HG      GLN  29  -1.117   1.003  10.258
  183   HE21  GLN  29          1HE2      GLN  29  -1.757   1.642   7.048
  184   HE22  GLN  29          2HE2      GLN  29  -1.859   3.364   7.134
  185    H    GLU  30           H        GLU  30   2.810  -1.179   8.393
  186    HA   GLU  30           HA       GLU  30   5.218  -0.114   9.380
  187    HB2  GLU  30           1HB      GLU  30   4.357  -2.489   9.632
  188    HB3  GLU  30           2HB      GLU  30   4.927  -2.777   7.994
  189    HG2  GLU  30           1HG      GLU  30   6.780  -1.694  10.073
  190    HG3  GLU  30           2HG      GLU  30   6.428  -3.420   9.991
  191    H    HIS  31           H        HIS  31   3.977  -0.107   6.263
  192    HA   HIS  31           HA       HIS  31   6.637   0.029   5.026
  193    HB2  HIS  31           1HB      HIS  31   5.353  -1.455   3.763
  194    HB3  HIS  31           2HB      HIS  31   3.885  -0.501   3.953
  195    HD1  HIS  31           HD1      HIS  31   7.130  -0.529   2.027
  196    HD2  HIS  31           HD2      HIS  31   3.422   1.344   1.967
  197    HE1  HIS  31           HE1      HIS  31   7.052   0.739  -0.143
  198    H    GLN  32           H        GLN  32   3.539   1.776   5.123
  199    HA   GLN  32           HA       GLN  32   4.148   3.977   3.613
  200    HB2  GLN  32           1HB      GLN  32   2.525   3.802   6.152
  201    HB3  GLN  32           2HB      GLN  32   2.580   5.239   5.139
  202    HG2  GLN  32           1HG      GLN  32   1.775   3.806   3.242
  203    HG3  GLN  32           2HG      GLN  32   1.509   2.525   4.423
  204   HE21  GLN  32          1HE2      GLN  32   0.068   4.979   2.791
  205   HE22  GLN  32          2HE2      GLN  32  -1.275   5.276   3.835
  206    H    ARG  33           H        ARG  33   5.535   3.054   6.605
  207    HA   ARG  33           HA       ARG  33   6.334   5.561   7.602
  208    HB2  ARG  33           1HB      ARG  33   8.190   4.150   8.705
  209    HB3  ARG  33           2HB      ARG  33   6.518   3.797   9.122
  210    HG2  ARG  33           1HG      ARG  33   6.492   1.868   7.735
  211    HG3  ARG  33           2HG      ARG  33   8.049   2.290   7.019
  212    HD2  ARG  33           1HD      ARG  33   7.486   1.384   9.833
  213    HD3  ARG  33           2HD      ARG  33   8.455   0.570   8.606
  214    HE   ARG  33           HE       ARG  33   9.295   2.687  10.351
  215   HH11  ARG  33          1HH1      ARG  33   9.849   1.126   7.289
  216   HH12  ARG  33          2HH1      ARG  33  11.502   1.633   7.182
  217   HH21  ARG  33          1HH2      ARG  33  11.470   3.361  10.221
  218   HH22  ARG  33          2HH2      ARG  33  12.423   2.904   8.850
  219    H    ILE  34           H        ILE  34   7.852   3.331   5.323
  220    HA   ILE  34           HA       ILE  34  10.354   4.508   5.094
  221    HB   ILE  34           HB       ILE  34  10.636   3.357   3.077
  222   HG12  ILE  34          1HG1      ILE  34   7.629   3.345   2.739
  223   HG13  ILE  34          2HG1      ILE  34   8.743   4.404   1.881
  224   HG21  ILE  34          1HG2      ILE  34   8.560   1.486   3.860
  225   HG22  ILE  34          2HG2      ILE  34  10.314   1.308   3.893
  226   HG23  ILE  34          3HG2      ILE  34   9.481   2.086   5.239
  227   HD11  ILE  34          3HD1      ILE  34   8.288   1.477   1.562
  228   HD12  ILE  34          1HD1      ILE  34   8.353   2.746   0.340
  229   HD13  ILE  34          2HD1      ILE  34   9.838   2.183   1.108
  230    H    HIS  35           H        HIS  35   7.289   5.673   4.060
  231    HA   HIS  35           HA       HIS  35   8.371   7.535   2.124
  232    HB2  HIS  35           1HB      HIS  35   5.593   7.104   3.227
  233    HB3  HIS  35           2HB      HIS  35   5.982   8.376   2.073
  234    HD1  HIS  35           HD1      HIS  35   6.587   7.629  -0.351
  235    HD2  HIS  35           HD2      HIS  35   5.407   4.541   2.167
  236    HE1  HIS  35           HE1      HIS  35   6.126   5.670  -1.859
  237    H    THR  36           H        THR  36   7.038   7.628   5.396
  238    HA   THR  36           HA       THR  36   7.634  10.489   5.579
  239    HB   THR  36           HB       THR  36   5.467   9.983   6.418
  240    HG1  THR  36           HG1      THR  36   5.952  11.294   7.999
  241   HG21  THR  36          3HG2      THR  36   5.698   8.327   8.602
  242   HG22  THR  36          1HG2      THR  36   6.788   7.584   7.432
  243   HG23  THR  36          2HG2      THR  36   5.096   7.853   7.014
  244    H    GLY  37           H        GLY  37   9.985   9.728   5.435
  245    HA2  GLY  37           1HA      GLY  37  10.989   9.511   8.185
  246    HA3  GLY  37           2HA      GLY  37  11.566   8.360   6.990
  247    H    GLU  38           H        GLU  38  13.445   8.855   6.097
  248    HA   GLU  38           HA       GLU  38  14.079  11.671   5.581
  249    HB2  GLU  38           1HB      GLU  38  15.228  11.269   7.626
  250    HB3  GLU  38           2HB      GLU  38  15.798   9.699   7.078
  251    HG2  GLU  38           1HG      GLU  38  17.602  11.297   7.055
  252    HG3  GLU  38           2HG      GLU  38  17.211  10.800   5.410
  253    H    LYS  39           H        LYS  39  14.843  11.995   3.595
  254    HA   LYS  39           HA       LYS  39  16.552  10.164   2.242
  255    HB2  LYS  39           1HB      LYS  39  15.099   9.470   0.455
  256    HB3  LYS  39           2HB      LYS  39  14.353   9.017   1.982
  257    HG2  LYS  39           1HG      LYS  39  13.159  11.354   1.686
  258    HG3  LYS  39           2HG      LYS  39  13.516  11.045  -0.015
  259    HD2  LYS  39           1HD      LYS  39  12.280   8.881   1.625
  260    HD3  LYS  39           2HD      LYS  39  11.269  10.214   1.061
  261    HE2  LYS  39           1HE      LYS  39  11.979   9.760  -1.243
  262    HE3  LYS  39           2HE      LYS  39  12.971   8.420  -0.670
  263    HZ1  LYS  39           3HZ      LYS  39  11.155   7.208  -1.084
  264    HZ2  LYS  39           1HZ      LYS  39  10.122   8.548  -1.101
  265    HZ3  LYS  39           2HZ      LYS  39  10.559   7.835   0.369
  266    HA   PRO  40           HA       PRO  40  17.548  13.996   0.299
  267    HB2  PRO  40           1HB      PRO  40  19.110  13.028  -1.700
  268    HB3  PRO  40           2HB      PRO  40  19.644  13.109  -0.017
  269    HG2  PRO  40           1HG      PRO  40  18.569  10.775  -1.553
  270    HG3  PRO  40           2HG      PRO  40  19.938  10.839  -0.427
  271    HD2  PRO  40           1HD      PRO  40  17.503   9.897   0.291
  272    HD3  PRO  40           2HD      PRO  40  18.576  10.734   1.430
  273    H    SER  41           H        SER  41  17.663  14.882  -2.035
  274    HA   SER  41           HA       SER  41  15.123  14.243  -3.304
  275    HB2  SER  41           1HB      SER  41  15.461  16.314  -4.567
  276    HB3  SER  41           2HB      SER  41  15.686  16.603  -2.842
  277    HG   SER  41           HG       SER  41  17.841  16.769  -3.137
  278    H    GLY  42           H        GLY  42  15.864  12.164  -4.123
  279    HA2  GLY  42           1HA      GLY  42  16.619  12.297  -6.841
  280    HA3  GLY  42           2HA      GLY  42  18.006  11.809  -5.879
  281    HA   PRO  43           HA       PRO  43  16.620   7.660  -5.578
  282    HB2  PRO  43           1HB      PRO  43  16.578   7.058  -2.931
  283    HB3  PRO  43           2HB      PRO  43  18.076   7.292  -3.839
  284    HG2  PRO  43           1HG      PRO  43  16.627   9.204  -2.049
  285    HG3  PRO  43           2HG      PRO  43  18.367   8.877  -2.162
  286    HD2  PRO  43           1HD      PRO  43  17.211  11.032  -3.325
  287    HD3  PRO  43           2HD      PRO  43  18.625  10.215  -4.022
  288    H    SER  44           H        SER  44  14.465   8.237  -6.394
  289    HA   SER  44           HA       SER  44  12.411   7.340  -4.562
  290    HB2  SER  44           1HB      SER  44  12.363  10.104  -5.785
  291    HB3  SER  44           2HB      SER  44  10.923   9.306  -5.151
  292    HG   SER  44           HG       SER  44  13.112   9.334  -3.463
  293    H    SER  45           H        SER  45  10.800   6.265  -5.584
  294    HA   SER  45           HA       SER  45  10.712   6.416  -8.524
  295    HB2  SER  45           1HB      SER  45  10.529   4.045  -8.708
  296    HB3  SER  45           2HB      SER  45  11.890   4.351  -7.629
  297    HG   SER  45           HG       SER  45  10.653   2.803  -6.658
  298    H    GLY  46           H        GLY  46   8.647   5.181  -9.316
  299    HA2  GLY  46           1HA      GLY  46   6.370   5.071  -7.651
  300    HA3  GLY  46           2HA      GLY  46   6.416   6.630  -8.462
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1   5.127  -7.424 -20.718
    2    HA2  GLY   1           1HA      GLY   1   6.450  -7.706 -22.641
    3    HA3  GLY   1           2HA      GLY   1   7.570  -6.503 -22.020
    4    H    SER   2           H        SER   2   8.821  -7.191 -20.043
    5    HA   SER   2           HA       SER   2   9.859  -9.874 -20.533
    6    HB2  SER   2           1HB      SER   2  10.919  -7.426 -19.162
    7    HB3  SER   2           2HB      SER   2  11.623  -9.002 -18.803
    8    HG   SER   2           HG       SER   2  12.765  -8.573 -20.524
    9    H    SER   3           H        SER   3   8.758  -7.885 -17.799
   10    HA   SER   3           HA       SER   3   8.936  -9.918 -15.856
   11    HB2  SER   3           1HB      SER   3   7.185  -7.449 -15.926
   12    HB3  SER   3           2HB      SER   3   7.447  -8.457 -14.503
   13    HG   SER   3           HG       SER   3   9.193  -6.695 -15.792
   14    H    GLY   4           H        GLY   4   6.873 -10.599 -14.595
   15    HA2  GLY   4           1HA      GLY   4   4.953 -11.643 -16.583
   16    HA3  GLY   4           2HA      GLY   4   5.437 -12.508 -15.132
   17    H    SER   5           H        SER   5   3.047 -12.646 -14.902
   18    HA   SER   5           HA       SER   5   1.948 -10.197 -13.687
   19    HB2  SER   5           1HB      SER   5  -0.278 -11.068 -14.212
   20    HB3  SER   5           2HB      SER   5   0.706 -10.986 -15.673
   21    HG   SER   5           HG       SER   5   0.110 -13.284 -14.121
   22    H    SER   6           H        SER   6   2.442 -10.388 -11.568
   23    HA   SER   6           HA       SER   6   1.536 -12.836 -10.199
   24    HB2  SER   6           1HB      SER   6   3.899 -11.065  -9.536
   25    HB3  SER   6           2HB      SER   6   3.306 -12.356  -8.492
   26    HG   SER   6           HG       SER   6   4.876 -13.283  -9.695
   27    H    GLY   7           H        GLY   7  -0.477 -12.113  -9.604
   28    HA2  GLY   7           1HA      GLY   7  -0.649 -10.515  -7.273
   29    HA3  GLY   7           2HA      GLY   7  -1.147  -9.575  -8.672
   30    H    THR   8           H        THR   8  -1.733 -12.721  -7.117
   31    HA   THR   8           HA       THR   8  -4.421 -12.786  -8.243
   32    HB   THR   8           HB       THR   8  -3.010 -14.826  -6.513
   33    HG1  THR   8           HG1      THR   8  -2.667 -15.905  -8.472
   34   HG21  THR   8          3HG2      THR   8  -4.849 -16.131  -6.605
   35   HG22  THR   8          1HG2      THR   8  -5.251 -15.625  -8.246
   36   HG23  THR   8          2HG2      THR   8  -5.690 -14.604  -6.876
   37    H    GLY   9           H        GLY   9  -6.240 -12.366  -7.131
   38    HA2  GLY   9           1HA      GLY   9  -7.585 -12.340  -5.168
   39    HA3  GLY   9           2HA      GLY   9  -6.121 -12.253  -4.201
   40    H    GLU  10           H        GLU  10  -7.856 -10.561  -3.351
   41    HA   GLU  10           HA       GLU  10  -7.106  -7.971  -4.541
   42    HB2  GLU  10           1HB      GLU  10  -9.723  -8.609  -3.172
   43    HB3  GLU  10           2HB      GLU  10  -9.278  -7.082  -3.920
   44    HG2  GLU  10           1HG      GLU  10  -9.606  -7.855  -6.033
   45    HG3  GLU  10           2HG      GLU  10  -9.211  -9.519  -5.606
   46    H    LYS  11           H        LYS  11  -5.908  -6.781  -3.230
   47    HA   LYS  11           HA       LYS  11  -5.686  -7.446  -0.425
   48    HB2  LYS  11           1HB      LYS  11  -4.209  -5.728  -2.348
   49    HB3  LYS  11           2HB      LYS  11  -4.131  -5.273  -0.651
   50    HG2  LYS  11           1HG      LYS  11  -2.252  -6.652  -1.138
   51    HG3  LYS  11           2HG      LYS  11  -3.365  -7.584  -0.133
   52    HD2  LYS  11           1HD      LYS  11  -3.649  -7.808  -3.081
   53    HD3  LYS  11           2HD      LYS  11  -2.255  -8.590  -2.330
   54    HE2  LYS  11           1HE      LYS  11  -3.733  -9.821  -0.837
   55    HE3  LYS  11           2HE      LYS  11  -5.135  -9.007  -1.531
   56    HZ1  LYS  11           3HZ      LYS  11  -3.289 -10.620  -3.186
   57    HZ2  LYS  11           1HZ      LYS  11  -4.863 -10.120  -3.552
   58    HZ3  LYS  11           2HZ      LYS  11  -4.606 -11.315  -2.383
   59    HA   PRO  12           HA       PRO  12  -8.815  -4.505   0.751
   60    HB2  PRO  12           1HB      PRO  12  -8.528  -4.845   3.430
   61    HB3  PRO  12           2HB      PRO  12  -9.379  -6.002   2.401
   62    HG2  PRO  12           1HG      PRO  12  -6.577  -6.104   3.450
   63    HG3  PRO  12           2HG      PRO  12  -7.782  -7.401   3.349
   64    HD2  PRO  12           1HD      PRO  12  -5.774  -7.134   1.552
   65    HD3  PRO  12           2HD      PRO  12  -7.368  -7.783   1.114
   66    H    TYR  13           H        TYR  13  -5.537  -4.184   0.913
   67    HA   TYR  13           HA       TYR  13  -5.770  -1.444   1.919
   68    HB2  TYR  13           1HB      TYR  13  -3.831  -3.528   2.908
   69    HB3  TYR  13           2HB      TYR  13  -3.510  -1.806   3.072
   70    HD1  TYR  13           HD2      TYR  13  -4.884  -0.421   4.558
   71    HD2  TYR  13           HD1      TYR  13  -5.498  -4.620   4.262
   72    HE1  TYR  13           HE2      TYR  13  -6.203  -0.368   6.633
   73    HE2  TYR  13           HE1      TYR  13  -6.821  -4.579   6.336
   74    HH   TYR  13           HH       TYR  13  -8.171  -2.008   7.604
   75    H    ASN  14           H        ASN  14  -4.185  -0.003   1.120
   76    HA   ASN  14           HA       ASN  14  -2.198  -0.922  -0.753
   77    HB2  ASN  14           1HB      ASN  14  -4.547   0.716  -1.733
   78    HB3  ASN  14           2HB      ASN  14  -3.091   0.379  -2.665
   79   HD21  ASN  14          1HD2      ASN  14  -5.767  -1.188  -0.978
   80   HD22  ASN  14          2HD2      ASN  14  -5.853  -2.562  -2.022
   81    H    CYS  15           H        CYS  15  -0.656   0.646  -1.246
   82    HA   CYS  15           HA       CYS  15  -0.578   2.866   0.612
   83    HB2  CYS  15           1HB      CYS  15   1.381   1.299  -0.035
   84    HB3  CYS  15           2HB      CYS  15   1.505   2.296  -1.480
   85    H    GLU  16           H        GLU  16  -1.135   4.889   0.154
   86    HA   GLU  16           HA       GLU  16  -1.834   5.577  -2.588
   87    HB2  GLU  16           1HB      GLU  16  -3.180   6.083  -0.373
   88    HB3  GLU  16           2HB      GLU  16  -2.126   7.489  -0.311
   89    HG2  GLU  16           1HG      GLU  16  -2.880   7.957  -2.695
   90    HG3  GLU  16           2HG      GLU  16  -4.144   6.763  -2.406
   91    H    GLU  17           H        GLU  17   0.985   5.413  -1.310
   92    HA   GLU  17           HA       GLU  17   1.886   8.110  -2.071
   93    HB2  GLU  17           1HB      GLU  17   3.102   6.029  -0.260
   94    HB3  GLU  17           2HB      GLU  17   4.015   7.411  -0.851
   95    HG2  GLU  17           1HG      GLU  17   1.407   7.827   0.538
   96    HG3  GLU  17           2HG      GLU  17   2.870   7.515   1.469
   97    H    CYS  18           H        CYS  18   2.421   4.666  -2.558
   98    HA   CYS  18           HA       CYS  18   4.093   5.324  -4.896
   99    HB2  CYS  18           1HB      CYS  18   5.145   3.066  -4.554
  100    HB3  CYS  18           2HB      CYS  18   5.496   4.237  -3.287
  101    H    GLY  19           H        GLY  19   1.902   2.858  -3.547
  102    HA2  GLY  19           1HA      GLY  19  -0.104   2.415  -4.971
  103    HA3  GLY  19           2HA      GLY  19   1.025   2.293  -6.313
  104    H    LYS  20           H        LYS  20   1.457   0.996  -3.058
  105    HA   LYS  20           HA       LYS  20   1.745  -1.670  -4.239
  106    HB2  LYS  20           1HB      LYS  20   3.448  -0.453  -2.618
  107    HB3  LYS  20           2HB      LYS  20   2.383  -1.100  -1.378
  108    HG2  LYS  20           1HG      LYS  20   2.716  -3.360  -2.355
  109    HG3  LYS  20           2HG      LYS  20   3.904  -2.658  -3.456
  110    HD2  LYS  20           1HD      LYS  20   4.123  -2.342  -0.476
  111    HD3  LYS  20           2HD      LYS  20   4.774  -3.753  -1.312
  112    HE2  LYS  20           1HE      LYS  20   5.473  -1.058  -2.353
  113    HE3  LYS  20           2HE      LYS  20   6.237  -1.592  -0.857
  114    HZ1  LYS  20           3HZ      LYS  20   7.683  -2.326  -2.482
  115    HZ2  LYS  20           1HZ      LYS  20   6.448  -2.754  -3.557
  116    HZ3  LYS  20           2HZ      LYS  20   6.751  -3.708  -2.194
  117    H    ALA  21           H        ALA  21   0.921  -3.525  -2.964
  118    HA   ALA  21           HA       ALA  21  -1.656  -2.859  -1.696
  119    HB1  ALA  21           3HB      ALA  21  -1.414  -5.566  -2.767
  120    HB2  ALA  21           1HB      ALA  21  -2.713  -4.385  -2.943
  121    HB3  ALA  21           2HB      ALA  21  -1.297  -4.301  -3.991
  122    H    PHE  22           H        PHE  22  -2.328  -4.096   0.086
  123    HA   PHE  22           HA       PHE  22  -0.364  -5.927   1.253
  124    HB2  PHE  22           1HB      PHE  22  -1.539  -3.515   2.645
  125    HB3  PHE  22           2HB      PHE  22  -0.714  -4.822   3.487
  126    HD1  PHE  22           HD2      PHE  22  -0.296  -2.048   1.110
  127    HD2  PHE  22           HD1      PHE  22   1.657  -5.007   3.466
  128    HE1  PHE  22           HE2      PHE  22   1.861  -0.934   0.714
  129    HE2  PHE  22           HE1      PHE  22   3.818  -3.897   3.073
  130    HZ   PHE  22           HZ       PHE  22   3.922  -1.859   1.695
  131    H    ILE  23           H        ILE  23  -1.282  -7.127   3.139
  132    HA   ILE  23           HA       ILE  23  -4.040  -7.874   2.529
  133    HB   ILE  23           HB       ILE  23  -2.045  -9.254   4.329
  134   HG12  ILE  23          1HG1      ILE  23  -2.933 -10.182   1.606
  135   HG13  ILE  23          2HG1      ILE  23  -1.554  -9.104   1.800
  136   HG21  ILE  23          1HG2      ILE  23  -4.050 -10.996   3.349
  137   HG22  ILE  23          2HG2      ILE  23  -3.740 -10.507   5.014
  138   HG23  ILE  23          3HG2      ILE  23  -4.852  -9.573   4.014
  139   HD11  ILE  23          3HD1      ILE  23  -0.458 -11.077   1.821
  140   HD12  ILE  23          1HD1      ILE  23  -0.842 -10.982   3.539
  141   HD13  ILE  23          2HD1      ILE  23  -1.837 -11.967   2.466
  142    H    HIS  24           H        HIS  24  -2.037  -7.121   5.376
  143    HA   HIS  24           HA       HIS  24  -4.508  -6.448   6.830
  144    HB2  HIS  24           1HB      HIS  24  -1.822  -7.386   7.844
  145    HB3  HIS  24           2HB      HIS  24  -3.087  -6.758   8.896
  146    HD2  HIS  24           HD2      HIS  24  -2.241  -9.971   6.876
  147    HE1  HIS  24           HE1      HIS  24  -5.791 -10.680   9.088
  148    HE2  HIS  24           HE2      HIS  24  -3.956 -11.719   7.711
  149    H    ASP  25           H        ASP  25  -4.348  -4.655   8.374
  150    HA   ASP  25           HA       ASP  25  -3.392  -2.312   7.174
  151    HB2  ASP  25           1HB      ASP  25  -5.200  -2.110   8.700
  152    HB3  ASP  25           2HB      ASP  25  -4.304  -2.918   9.984
  153    H    SER  26           H        SER  26  -2.280  -3.629  10.297
  154    HA   SER  26           HA       SER  26  -0.103  -2.175  10.807
  155    HB2  SER  26           1HB      SER  26   0.963  -4.174  11.809
  156    HB3  SER  26           2HB      SER  26  -0.752  -4.068  12.207
  157    HG   SER  26           HG       SER  26  -0.902  -5.986  11.386
  158    H    GLN  27           H        GLN  27  -0.258  -4.709   8.355
  159    HA   GLN  27           HA       GLN  27   2.457  -4.737   7.648
  160    HB2  GLN  27           1HB      GLN  27  -0.027  -5.383   6.061
  161    HB3  GLN  27           2HB      GLN  27   1.600  -5.632   5.440
  162    HG2  GLN  27           1HG      GLN  27   1.901  -6.981   7.667
  163    HG3  GLN  27           2HG      GLN  27   0.144  -7.085   7.586
  164   HE21  GLN  27          1HE2      GLN  27  -0.768  -8.513   6.241
  165   HE22  GLN  27          2HE2      GLN  27   0.096  -9.517   5.133
  166    H    LEU  28           H        LEU  28  -0.264  -2.901   6.283
  167    HA   LEU  28           HA       LEU  28   1.273  -1.539   4.338
  168    HB2  LEU  28           1HB      LEU  28  -1.068  -1.660   4.023
  169    HB3  LEU  28           2HB      LEU  28  -1.389  -0.972   5.613
  170    HG   LEU  28           HG       LEU  28  -0.509   1.194   4.821
  171   HD11  LEU  28          1HD1      LEU  28  -0.164  -0.344   2.268
  172   HD12  LEU  28          2HD1      LEU  28   1.011   0.652   3.127
  173   HD13  LEU  28          3HD1      LEU  28  -0.339   1.411   2.285
  174   HD21  LEU  28          3HD2      LEU  28  -2.965   0.167   4.456
  175   HD22  LEU  28          1HD2      LEU  28  -2.539   0.533   2.784
  176   HD23  LEU  28          2HD2      LEU  28  -2.520   1.812   3.999
  177    H    GLN  29           H        GLN  29   0.093  -0.545   7.545
  178    HA   GLN  29           HA       GLN  29   1.155   2.026   7.573
  179    HB2  GLN  29           1HB      GLN  29   0.700   0.091   9.847
  180    HB3  GLN  29           2HB      GLN  29   1.113   1.785  10.072
  181    HG2  GLN  29           1HG      GLN  29  -1.381   0.942  10.116
  182    HG3  GLN  29           2HG      GLN  29  -0.943   2.518   9.460
  183   HE21  GLN  29          1HE2      GLN  29  -0.899   2.801   7.207
  184   HE22  GLN  29          2HE2      GLN  29  -1.754   1.736   6.149
  185    H    GLU  30           H        GLU  30   2.658  -1.065   8.326
  186    HA   GLU  30           HA       GLU  30   5.056  -0.000   9.405
  187    HB2  GLU  30           1HB      GLU  30   4.049  -2.429   9.485
  188    HB3  GLU  30           2HB      GLU  30   4.989  -2.649   8.016
  189    HG2  GLU  30           1HG      GLU  30   6.896  -1.602   9.526
  190    HG3  GLU  30           2HG      GLU  30   5.892  -2.271  10.811
  191    H    HIS  31           H        HIS  31   3.842  -0.097   6.258
  192    HA   HIS  31           HA       HIS  31   6.501   0.002   5.033
  193    HB2  HIS  31           1HB      HIS  31   5.160  -1.424   3.765
  194    HB3  HIS  31           2HB      HIS  31   3.728  -0.419   3.966
  195    HD1  HIS  31           HD1      HIS  31   6.837  -0.749   1.909
  196    HD2  HIS  31           HD2      HIS  31   3.450   1.649   2.109
  197    HE1  HIS  31           HE1      HIS  31   6.829   0.583  -0.224
  198    H    GLN  32           H        GLN  32   3.486   1.878   5.188
  199    HA   GLN  32           HA       GLN  32   4.101   4.049   3.663
  200    HB2  GLN  32           1HB      GLN  32   2.647   3.929   6.303
  201    HB3  GLN  32           2HB      GLN  32   2.732   5.392   5.331
  202    HG2  GLN  32           1HG      GLN  32   1.725   4.063   3.447
  203    HG3  GLN  32           2HG      GLN  32   1.435   2.779   4.620
  204   HE21  GLN  32          1HE2      GLN  32  -0.754   3.513   3.531
  205   HE22  GLN  32          2HE2      GLN  32  -1.684   4.601   4.498
  206    H    ARG  33           H        ARG  33   5.566   3.120   6.647
  207    HA   ARG  33           HA       ARG  33   6.562   5.503   7.625
  208    HB2  ARG  33           1HB      ARG  33   8.281   3.045   7.578
  209    HB3  ARG  33           2HB      ARG  33   8.093   4.240   8.854
  210    HG2  ARG  33           1HG      ARG  33   5.642   3.344   8.935
  211    HG3  ARG  33           2HG      ARG  33   6.349   1.932   8.147
  212    HD2  ARG  33           1HD      ARG  33   7.212   3.140  10.773
  213    HD3  ARG  33           2HD      ARG  33   6.314   1.638  10.559
  214    HE   ARG  33           HE       ARG  33   8.534   1.173   9.127
  215   HH11  ARG  33          1HH1      ARG  33   8.053   2.398  12.350
  216   HH12  ARG  33          2HH1      ARG  33   9.542   1.753  12.957
  217   HH21  ARG  33          1HH2      ARG  33  10.497   0.320   9.915
  218   HH22  ARG  33          2HH2      ARG  33  10.932   0.572  11.571
  219    H    ILE  34           H        ILE  34   7.987   3.383   5.156
  220    HA   ILE  34           HA       ILE  34  10.369   4.649   4.686
  221    HB   ILE  34           HB       ILE  34  10.408   3.694   2.529
  222   HG12  ILE  34          1HG1      ILE  34   7.393   3.464   2.634
  223   HG13  ILE  34          2HG1      ILE  34   8.266   4.721   1.764
  224   HG21  ILE  34          1HG2      ILE  34   8.596   1.635   3.425
  225   HG22  ILE  34          2HG2      ILE  34  10.353   1.603   3.280
  226   HG23  ILE  34          3HG2      ILE  34   9.601   2.223   4.750
  227   HD11  ILE  34          3HD1      ILE  34   7.400   2.585   0.538
  228   HD12  ILE  34          1HD1      ILE  34   8.963   3.290   0.125
  229   HD13  ILE  34          2HD1      ILE  34   8.883   1.874   1.174
  230    H    HIS  35           H        HIS  35   7.175   5.769   3.928
  231    HA   HIS  35           HA       HIS  35   8.128   7.866   2.162
  232    HB2  HIS  35           1HB      HIS  35   5.368   7.221   3.215
  233    HB3  HIS  35           2HB      HIS  35   5.719   8.528   2.088
  234    HD1  HIS  35           HD1      HIS  35   6.423   7.836  -0.337
  235    HD2  HIS  35           HD2      HIS  35   5.245   4.686   2.103
  236    HE1  HIS  35           HE1      HIS  35   6.040   5.893  -1.886
  237    H    THR  36           H        THR  36   6.247   7.791   5.194
  238    HA   THR  36           HA       THR  36   6.773  10.563   5.722
  239    HB   THR  36           HB       THR  36   4.678   9.659   6.489
  240    HG1  THR  36           HG1      THR  36   5.180  11.164   7.943
  241   HG21  THR  36          3HG2      THR  36   6.370   7.489   7.439
  242   HG22  THR  36          1HG2      THR  36   4.644   7.499   7.080
  243   HG23  THR  36          2HG2      THR  36   5.219   8.036   8.658
  244    H    GLY  37           H        GLY  37   9.093  10.568   5.725
  245    HA2  GLY  37           1HA      GLY  37  10.535  10.989   7.806
  246    HA3  GLY  37           2HA      GLY  37  10.317   9.265   8.068
  247    H    GLU  38           H        GLU  38  10.881  10.997   5.027
  248    HA   GLU  38           HA       GLU  38  13.627  10.175   4.874
  249    HB2  GLU  38           1HB      GLU  38  11.492   8.629   3.499
  250    HB3  GLU  38           2HB      GLU  38  12.962   8.951   2.591
  251    HG2  GLU  38           1HG      GLU  38  12.664   7.432   5.160
  252    HG3  GLU  38           2HG      GLU  38  13.256   6.850   3.605
  253    H    LYS  39           H        LYS  39  14.604  10.792   2.753
  254    HA   LYS  39           HA       LYS  39  13.293  13.224   1.751
  255    HB2  LYS  39           1HB      LYS  39  15.477  14.021   1.139
  256    HB3  LYS  39           2HB      LYS  39  15.544  13.454   2.803
  257    HG2  LYS  39           1HG      LYS  39  16.718  11.501   2.195
  258    HG3  LYS  39           2HG      LYS  39  16.384  11.747   0.479
  259    HD2  LYS  39           1HD      LYS  39  17.833  13.649   0.401
  260    HD3  LYS  39           2HD      LYS  39  18.023  13.642   2.156
  261    HE2  LYS  39           1HE      LYS  39  19.366  11.739   2.123
  262    HE3  LYS  39           2HE      LYS  39  18.816  11.262   0.517
  263    HZ1  LYS  39           3HZ      LYS  39  20.128  12.887  -0.490
  264    HZ2  LYS  39           1HZ      LYS  39  21.130  12.248   0.714
  265    HZ3  LYS  39           2HZ      LYS  39  20.369  13.740   0.951
  266    HA   PRO  40           HA       PRO  40  12.621  11.310  -2.162
  267    HB2  PRO  40           1HB      PRO  40  12.356  13.552  -3.669
  268    HB3  PRO  40           2HB      PRO  40  11.107  12.993  -2.550
  269    HG2  PRO  40           1HG      PRO  40  13.177  15.122  -2.169
  270    HG3  PRO  40           2HG      PRO  40  11.461  15.139  -1.725
  271    HD2  PRO  40           1HD      PRO  40  13.425  14.650   0.073
  272    HD3  PRO  40           2HD      PRO  40  11.815  13.912   0.194
  273    H    SER  41           H        SER  41  13.510  11.256  -4.369
  274    HA   SER  41           HA       SER  41  16.354  11.263  -4.328
  275    HB2  SER  41           1HB      SER  41  14.921   9.669  -5.649
  276    HB3  SER  41           2HB      SER  41  14.567  10.996  -6.754
  277    HG   SER  41           HG       SER  41  16.300  10.182  -7.691
  278    H    GLY  42           H        GLY  42  13.917  13.333  -5.849
  279    HA2  GLY  42           1HA      GLY  42  15.801  14.954  -7.251
  280    HA3  GLY  42           2HA      GLY  42  14.109  15.337  -6.968
  281    HA   PRO  43           HA       PRO  43  15.328  18.473  -4.157
  282    HB2  PRO  43           1HB      PRO  43  13.165  18.541  -2.517
  283    HB3  PRO  43           2HB      PRO  43  13.135  19.159  -4.173
  284    HG2  PRO  43           1HG      PRO  43  12.168  16.532  -3.114
  285    HG3  PRO  43           2HG      PRO  43  11.397  17.619  -4.284
  286    HD2  PRO  43           1HD      PRO  43  12.759  15.402  -5.033
  287    HD3  PRO  43           2HD      PRO  43  12.702  16.870  -6.030
  288    H    SER  44           H        SER  44  17.072  17.102  -3.282
  289    HA   SER  44           HA       SER  44  16.721  15.367  -1.101
  290    HB2  SER  44           1HB      SER  44  19.037  16.830  -2.288
  291    HB3  SER  44           2HB      SER  44  19.234  16.120  -0.686
  292    HG   SER  44           HG       SER  44  19.331  14.225  -1.576
  293    H    SER  45           H        SER  45  15.231  16.478   0.268
  294    HA   SER  45           HA       SER  45  14.624  17.743   2.061
  295    HB2  SER  45           1HB      SER  45  17.596  17.486   2.467
  296    HB3  SER  45           2HB      SER  45  16.595  18.390   3.603
  297    HG   SER  45           HG       SER  45  16.692  15.653   3.093
  298    H    GLY  46           H        GLY  46  14.833  19.132  -0.358
  299    HA2  GLY  46           1HA      GLY  46  14.423  21.412  -0.788
  300    HA3  GLY  46           2HA      GLY  46  15.305  21.824   0.676
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1 -17.570   3.909 -26.219
    2    HA2  GLY   1           1HA      GLY   1 -19.265   3.910 -24.641
    3    HA3  GLY   1           2HA      GLY   1 -19.503   2.196 -24.949
    4    H    SER   2           H        SER   2 -19.582   3.352 -22.389
    5    HA   SER   2           HA       SER   2 -17.085   2.988 -21.045
    6    HB2  SER   2           1HB      SER   2 -19.893   3.569 -20.225
    7    HB3  SER   2           2HB      SER   2 -18.792   2.934 -19.003
    8    HG   SER   2           HG       SER   2 -17.511   4.693 -19.227
    9    H    SER   3           H        SER   3 -16.320   0.933 -21.427
   10    HA   SER   3           HA       SER   3 -17.892  -1.416 -21.159
   11    HB2  SER   3           1HB      SER   3 -15.792  -1.279 -22.500
   12    HB3  SER   3           2HB      SER   3 -14.879  -1.163 -20.995
   13    HG   SER   3           HG       SER   3 -15.320  -3.225 -20.544
   14    H    GLY   4           H        GLY   4 -15.341  -0.042 -19.072
   15    HA2  GLY   4           1HA      GLY   4 -16.102   0.072 -16.650
   16    HA3  GLY   4           2HA      GLY   4 -16.447  -1.639 -16.850
   17    H    SER   5           H        SER   5 -14.237   0.513 -15.696
   18    HA   SER   5           HA       SER   5 -11.763  -0.583 -16.432
   19    HB2  SER   5           1HB      SER   5 -12.687   1.002 -14.047
   20    HB3  SER   5           2HB      SER   5 -11.028   0.414 -14.158
   21    HG   SER   5           HG       SER   5 -11.149   1.474 -16.358
   22    H    SER   6           H        SER   6 -10.348  -1.982 -15.294
   23    HA   SER   6           HA       SER   6 -11.714  -3.853 -13.471
   24    HB2  SER   6           1HB      SER   6 -11.412  -5.018 -15.535
   25    HB3  SER   6           2HB      SER   6  -9.755  -4.435 -15.697
   26    HG   SER   6           HG       SER   6  -9.207  -5.695 -13.881
   27    H    GLY   7           H        GLY   7 -10.401  -4.877 -11.870
   28    HA2  GLY   7           1HA      GLY   7  -8.301  -5.147 -10.732
   29    HA3  GLY   7           2HA      GLY   7  -7.784  -3.609 -11.407
   30    H    THR   8           H        THR   8 -10.597  -4.714  -9.512
   31    HA   THR   8           HA       THR   8 -10.951  -2.316  -8.120
   32    HB   THR   8           HB       THR   8 -11.693  -5.104  -7.213
   33    HG1  THR   8           HG1      THR   8 -13.134  -3.145  -8.704
   34   HG21  THR   8          3HG2      THR   8 -12.366  -4.111  -5.332
   35   HG22  THR   8          1HG2      THR   8 -13.563  -3.245  -6.295
   36   HG23  THR   8          2HG2      THR   8 -11.991  -2.512  -5.974
   37    H    GLY   9           H        GLY   9  -9.414  -5.336  -6.990
   38    HA2  GLY   9           1HA      GLY   9  -7.148  -4.560  -5.875
   39    HA3  GLY   9           2HA      GLY   9  -8.286  -3.891  -4.715
   40    H    GLU  10           H        GLU  10  -6.367  -6.489  -5.373
   41    HA   GLU  10           HA       GLU  10  -8.080  -8.533  -4.249
   42    HB2  GLU  10           1HB      GLU  10  -5.180  -8.549  -5.092
   43    HB3  GLU  10           2HB      GLU  10  -6.010  -9.951  -4.433
   44    HG2  GLU  10           1HG      GLU  10  -7.241  -8.584  -6.758
   45    HG3  GLU  10           2HG      GLU  10  -5.785  -9.539  -7.032
   46    H    LYS  11           H        LYS  11  -6.700  -6.010  -2.871
   47    HA   LYS  11           HA       LYS  11  -6.265  -7.429  -0.346
   48    HB2  LYS  11           1HB      LYS  11  -4.307  -5.728  -1.795
   49    HB3  LYS  11           2HB      LYS  11  -4.404  -5.523  -0.051
   50    HG2  LYS  11           1HG      LYS  11  -3.813  -7.780   0.340
   51    HG3  LYS  11           2HG      LYS  11  -4.022  -8.200  -1.362
   52    HD2  LYS  11           1HD      LYS  11  -2.160  -6.574  -1.868
   53    HD3  LYS  11           2HD      LYS  11  -1.874  -6.486  -0.129
   54    HE2  LYS  11           1HE      LYS  11  -0.363  -8.103  -0.880
   55    HE3  LYS  11           2HE      LYS  11  -1.703  -9.038  -0.217
   56    HZ1  LYS  11           3HZ      LYS  11  -2.442  -9.621  -2.320
   57    HZ2  LYS  11           1HZ      LYS  11  -0.760  -9.705  -2.483
   58    HZ3  LYS  11           2HZ      LYS  11  -1.601  -8.370  -3.089
   59    HA   PRO  12           HA       PRO  12  -8.960  -4.257   1.129
   60    HB2  PRO  12           1HB      PRO  12  -8.562  -4.638   3.788
   61    HB3  PRO  12           2HB      PRO  12  -9.527  -5.736   2.794
   62    HG2  PRO  12           1HG      PRO  12  -6.687  -6.004   3.703
   63    HG3  PRO  12           2HG      PRO  12  -7.967  -7.231   3.652
   64    HD2  PRO  12           1HD      PRO  12  -6.037  -7.060   1.761
   65    HD3  PRO  12           2HD      PRO  12  -7.684  -7.614   1.397
   66    H    TYR  13           H        TYR  13  -5.654  -4.139   1.165
   67    HA   TYR  13           HA       TYR  13  -5.686  -1.388   2.169
   68    HB2  TYR  13           1HB      TYR  13  -3.830  -3.578   3.093
   69    HB3  TYR  13           2HB      TYR  13  -3.429  -1.873   3.263
   70    HD1  TYR  13           HD2      TYR  13  -4.729  -0.438   4.782
   71    HD2  TYR  13           HD1      TYR  13  -5.477  -4.617   4.500
   72    HE1  TYR  13           HE2      TYR  13  -5.988  -0.349   6.893
   73    HE2  TYR  13           HE1      TYR  13  -6.738  -4.540   6.610
   74    HH   TYR  13           HH       TYR  13  -7.428  -3.278   8.298
   75    H    ASN  14           H        ASN  14  -4.156  -0.023   1.234
   76    HA   ASN  14           HA       ASN  14  -2.165  -1.002  -0.580
   77    HB2  ASN  14           1HB      ASN  14  -4.199   0.720  -1.932
   78    HB3  ASN  14           2HB      ASN  14  -3.077  -0.445  -2.629
   79   HD21  ASN  14          1HD2      ASN  14  -3.715  -2.503  -2.938
   80   HD22  ASN  14          2HD2      ASN  14  -5.288  -3.103  -2.548
   81    H    CYS  15           H        CYS  15  -0.697   0.591  -1.214
   82    HA   CYS  15           HA       CYS  15  -0.801   3.008   0.403
   83    HB2  CYS  15           1HB      CYS  15   1.249   1.484   0.171
   84    HB3  CYS  15           2HB      CYS  15   1.445   2.187  -1.431
   85    H    GLU  16           H        GLU  16  -1.333   4.948  -0.354
   86    HA   GLU  16           HA       GLU  16  -1.965   5.249  -3.165
   87    HB2  GLU  16           1HB      GLU  16  -3.397   6.120  -1.253
   88    HB3  GLU  16           2HB      GLU  16  -2.171   7.358  -1.019
   89    HG2  GLU  16           1HG      GLU  16  -2.580   7.752  -3.595
   90    HG3  GLU  16           2HG      GLU  16  -4.140   7.025  -3.212
   91    H    GLU  17           H        GLU  17   0.760   5.642  -1.302
   92    HA   GLU  17           HA       GLU  17   1.787   8.000  -2.628
   93    HB2  GLU  17           1HB      GLU  17   2.917   6.079  -0.606
   94    HB3  GLU  17           2HB      GLU  17   3.923   7.296  -1.379
   95    HG2  GLU  17           1HG      GLU  17   1.548   7.729   0.406
   96    HG3  GLU  17           2HG      GLU  17   3.227   8.178   0.701
   97    H    CYS  18           H        CYS  18   2.335   4.508  -2.698
   98    HA   CYS  18           HA       CYS  18   3.888   4.881  -5.175
   99    HB2  CYS  18           1HB      CYS  18   4.999   2.698  -4.581
  100    HB3  CYS  18           2HB      CYS  18   5.387   4.043  -3.512
  101    H    GLY  19           H        GLY  19   1.749   2.645  -3.420
  102    HA2  GLY  19           1HA      GLY  19  -0.278   2.022  -4.784
  103    HA3  GLY  19           2HA      GLY  19   0.875   1.589  -6.037
  104    H    LYS  20           H        LYS  20   2.438   0.759  -3.342
  105    HA   LYS  20           HA       LYS  20   2.222  -1.993  -3.714
  106    HB2  LYS  20           1HB      LYS  20   3.938  -0.490  -2.363
  107    HB3  LYS  20           2HB      LYS  20   2.910  -0.938  -1.008
  108    HG2  LYS  20           1HG      LYS  20   3.250  -3.343  -1.724
  109    HG3  LYS  20           2HG      LYS  20   4.518  -2.739  -2.794
  110    HD2  LYS  20           1HD      LYS  20   5.583  -1.681  -0.789
  111    HD3  LYS  20           2HD      LYS  20   4.396  -2.521   0.212
  112    HE2  LYS  20           1HE      LYS  20   6.145  -3.992  -1.734
  113    HE3  LYS  20           2HE      LYS  20   6.694  -3.614  -0.102
  114    HZ1  LYS  20           3HZ      LYS  20   5.688  -5.485   0.502
  115    HZ2  LYS  20           1HZ      LYS  20   4.888  -5.644  -0.981
  116    HZ3  LYS  20           2HZ      LYS  20   4.212  -4.698   0.248
  117    H    ALA  21           H        ALA  21   0.783  -3.474  -3.101
  118    HA   ALA  21           HA       ALA  21  -1.491  -2.636  -1.490
  119    HB1  ALA  21           3HB      ALA  21  -2.560  -4.656  -2.231
  120    HB2  ALA  21           1HB      ALA  21  -1.812  -3.868  -3.620
  121    HB3  ALA  21           2HB      ALA  21  -1.041  -5.272  -2.881
  122    H    PHE  22           H        PHE  22  -2.306  -3.993   0.250
  123    HA   PHE  22           HA       PHE  22  -0.341  -5.726   1.539
  124    HB2  PHE  22           1HB      PHE  22  -1.543  -3.261   2.804
  125    HB3  PHE  22           2HB      PHE  22  -0.794  -4.553   3.738
  126    HD1  PHE  22           HD2      PHE  22  -0.175  -1.930   1.223
  127    HD2  PHE  22           HD1      PHE  22   1.556  -4.745   3.906
  128    HE1  PHE  22           HE2      PHE  22   2.027  -0.883   0.896
  129    HE2  PHE  22           HE1      PHE  22   3.761  -3.701   3.584
  130    HZ   PHE  22           HZ       PHE  22   3.999  -1.768   2.077
  131    H    ILE  23           H        ILE  23  -1.223  -7.341   2.769
  132    HA   ILE  23           HA       ILE  23  -4.004  -7.901   2.354
  133    HB   ILE  23           HB       ILE  23  -2.022  -9.384   4.084
  134   HG12  ILE  23          1HG1      ILE  23  -2.829  -9.874   1.209
  135   HG13  ILE  23          2HG1      ILE  23  -1.287  -9.204   1.731
  136   HG21  ILE  23          1HG2      ILE  23  -4.017 -11.057   2.960
  137   HG22  ILE  23          2HG2      ILE  23  -3.720 -10.689   4.659
  138   HG23  ILE  23          3HG2      ILE  23  -4.821  -9.683   3.718
  139   HD11  ILE  23          3HD1      ILE  23  -2.316 -11.951   2.404
  140   HD12  ILE  23          1HD1      ILE  23  -1.120 -11.571   1.165
  141   HD13  ILE  23          2HD1      ILE  23  -0.752 -11.279   2.866
  142    H    HIS  24           H        HIS  24  -2.026  -6.786   5.030
  143    HA   HIS  24           HA       HIS  24  -4.489  -6.317   6.567
  144    HB2  HIS  24           1HB      HIS  24  -1.887  -7.474   7.561
  145    HB3  HIS  24           2HB      HIS  24  -3.081  -6.765   8.644
  146    HD2  HIS  24           HD2      HIS  24  -2.519  -9.997   6.570
  147    HE1  HIS  24           HE1      HIS  24  -6.143 -10.425   8.734
  148    HE2  HIS  24           HE2      HIS  24  -4.390 -11.599   7.358
  149    H    ASP  25           H        ASP  25  -4.289  -4.599   8.183
  150    HA   ASP  25           HA       ASP  25  -3.165  -2.264   7.108
  151    HB2  ASP  25           1HB      ASP  25  -5.070  -2.643   8.897
  152    HB3  ASP  25           2HB      ASP  25  -3.740  -2.452  10.036
  153    H    SER  26           H        SER  26  -2.252  -3.843  10.176
  154    HA   SER  26           HA       SER  26  -0.044  -2.511  10.885
  155    HB2  SER  26           1HB      SER  26   0.803  -4.500  11.938
  156    HB3  SER  26           2HB      SER  26  -0.957  -4.577  12.000
  157    HG   SER  26           HG       SER  26   0.813  -6.230  10.751
  158    H    GLN  27           H        GLN  27  -0.183  -4.890   8.278
  159    HA   GLN  27           HA       GLN  27   2.579  -4.899   7.688
  160    HB2  GLN  27           1HB      GLN  27   0.214  -5.520   5.911
  161    HB3  GLN  27           2HB      GLN  27   1.889  -5.882   5.518
  162    HG2  GLN  27           1HG      GLN  27   1.825  -7.163   7.800
  163    HG3  GLN  27           2HG      GLN  27   0.087  -7.164   7.507
  164   HE21  GLN  27          1HE2      GLN  27  -0.742  -8.612   6.138
  165   HE22  GLN  27          2HE2      GLN  27   0.182  -9.698   5.163
  166    H    LEU  28           H        LEU  28  -0.138  -3.074   6.314
  167    HA   LEU  28           HA       LEU  28   1.402  -1.680   4.391
  168    HB2  LEU  28           1HB      LEU  28  -0.914  -1.779   4.019
  169    HB3  LEU  28           2HB      LEU  28  -1.282  -1.201   5.643
  170    HG   LEU  28           HG       LEU  28  -0.442   1.030   5.009
  171   HD11  LEU  28          1HD1      LEU  28   0.262   1.579   2.862
  172   HD12  LEU  28          2HD1      LEU  28  -0.399   0.102   2.161
  173   HD13  LEU  28          3HD1      LEU  28   1.048   0.029   3.167
  174   HD21  LEU  28          3HD2      LEU  28  -2.850   0.285   4.753
  175   HD22  LEU  28          1HD2      LEU  28  -2.509   0.105   3.031
  176   HD23  LEU  28          2HD2      LEU  28  -2.358   1.686   3.800
  177    H    GLN  29           H        GLN  29   0.166  -0.706   7.586
  178    HA   GLN  29           HA       GLN  29   1.173   1.863   7.681
  179    HB2  GLN  29           1HB      GLN  29   0.879  -0.146   9.918
  180    HB3  GLN  29           2HB      GLN  29   1.203   1.565  10.166
  181    HG2  GLN  29           1HG      GLN  29  -1.251   0.332   8.943
  182    HG3  GLN  29           2HG      GLN  29  -1.128   1.177  10.485
  183   HE21  GLN  29          1HE2      GLN  29  -2.139   1.479   7.400
  184   HE22  GLN  29          2HE2      GLN  29  -2.060   3.196   7.223
  185    H    GLU  30           H        GLU  30   2.790  -1.172   8.538
  186    HA   GLU  30           HA       GLU  30   5.177  -0.048   9.497
  187    HB2  GLU  30           1HB      GLU  30   4.511  -2.407   9.839
  188    HB3  GLU  30           2HB      GLU  30   4.793  -2.718   8.132
  189    HG2  GLU  30           1HG      GLU  30   7.109  -2.430   8.347
  190    HG3  GLU  30           2HG      GLU  30   6.950  -1.664   9.926
  191    H    HIS  31           H        HIS  31   3.908  -0.158   6.363
  192    HA   HIS  31           HA       HIS  31   6.531   0.066   5.087
  193    HB2  HIS  31           1HB      HIS  31   5.246  -1.329   3.764
  194    HB3  HIS  31           2HB      HIS  31   3.756  -0.457   4.108
  195    HD1  HIS  31           HD1      HIS  31   6.841  -0.261   1.956
  196    HD2  HIS  31           HD2      HIS  31   3.112   1.535   2.311
  197    HE1  HIS  31           HE1      HIS  31   6.575   1.150  -0.108
  198    H    GLN  32           H        GLN  32   3.445   1.844   5.202
  199    HA   GLN  32           HA       GLN  32   3.963   4.066   3.778
  200    HB2  GLN  32           1HB      GLN  32   2.580   3.771   6.429
  201    HB3  GLN  32           2HB      GLN  32   2.695   5.339   5.642
  202    HG2  GLN  32           1HG      GLN  32   1.729   4.013   3.590
  203    HG3  GLN  32           2HG      GLN  32   1.154   2.925   4.852
  204   HE21  GLN  32          1HE2      GLN  32  -0.840   3.849   3.623
  205   HE22  GLN  32          2HE2      GLN  32  -1.600   5.197   4.392
  206    H    ARG  33           H        ARG  33   5.540   3.145   6.721
  207    HA   ARG  33           HA       ARG  33   6.539   5.511   7.695
  208    HB2  ARG  33           1HB      ARG  33   8.371   3.155   7.489
  209    HB3  ARG  33           2HB      ARG  33   8.124   4.260   8.834
  210    HG2  ARG  33           1HG      ARG  33   5.822   3.233   9.076
  211    HG3  ARG  33           2HG      ARG  33   6.373   1.987   7.954
  212    HD2  ARG  33           1HD      ARG  33   6.648   1.269  10.268
  213    HD3  ARG  33           2HD      ARG  33   8.209   1.433   9.465
  214    HE   ARG  33           HE       ARG  33   7.175   3.070  11.630
  215   HH11  ARG  33          1HH1      ARG  33   9.609   2.616   9.182
  216   HH12  ARG  33          2HH1      ARG  33  10.753   3.673   9.939
  217   HH21  ARG  33          1HH2      ARG  33   8.673   4.464  12.636
  218   HH22  ARG  33          2HH2      ARG  33  10.221   4.723  11.905
  219    H    ILE  34           H        ILE  34   7.978   3.486   5.146
  220    HA   ILE  34           HA       ILE  34  10.247   4.934   4.599
  221    HB   ILE  34           HB       ILE  34  10.222   4.018   2.371
  222   HG12  ILE  34          1HG1      ILE  34   7.484   2.879   2.706
  223   HG13  ILE  34          2HG1      ILE  34   7.628   4.567   2.227
  224   HG21  ILE  34          1HG2      ILE  34   9.124   1.621   3.287
  225   HG22  ILE  34          2HG2      ILE  34  10.808   2.133   3.390
  226   HG23  ILE  34          3HG2      ILE  34   9.706   2.451   4.730
  227   HD11  ILE  34          3HD1      ILE  34   9.071   3.824   0.337
  228   HD12  ILE  34          1HD1      ILE  34   8.688   2.160   0.774
  229   HD13  ILE  34          2HD1      ILE  34   7.404   3.254   0.260
  230    H    HIS  35           H        HIS  35   6.966   5.815   4.013
  231    HA   HIS  35           HA       HIS  35   7.698   7.945   2.160
  232    HB2  HIS  35           1HB      HIS  35   5.021   7.030   3.226
  233    HB3  HIS  35           2HB      HIS  35   5.230   8.375   2.109
  234    HD1  HIS  35           HD1      HIS  35   6.547   7.610  -0.213
  235    HD2  HIS  35           HD2      HIS  35   4.585   4.675   1.978
  236    HE1  HIS  35           HE1      HIS  35   6.212   5.693  -1.806
  237    H    THR  36           H        THR  36   6.430   7.513   5.427
  238    HA   THR  36           HA       THR  36   6.715  10.406   5.881
  239    HB   THR  36           HB       THR  36   4.470   9.459   6.344
  240    HG1  THR  36           HG1      THR  36   6.035  10.560   8.431
  241   HG21  THR  36          3HG2      THR  36   4.313   7.467   7.331
  242   HG22  THR  36          1HG2      THR  36   4.878   8.212   8.826
  243   HG23  THR  36          2HG2      THR  36   6.034   7.473   7.718
  244    H    GLY  37           H        GLY  37   8.985   8.654   5.843
  245    HA2  GLY  37           1HA      GLY  37   9.856   7.693   8.280
  246    HA3  GLY  37           2HA      GLY  37  10.917   8.373   7.055
  247    H    GLU  38           H        GLU  38  11.007  10.817   7.028
  248    HA   GLU  38           HA       GLU  38  11.737  11.715   9.632
  249    HB2  GLU  38           1HB      GLU  38  11.620  13.038   6.933
  250    HB3  GLU  38           2HB      GLU  38  12.027  13.946   8.382
  251    HG2  GLU  38           1HG      GLU  38  13.512  11.449   7.681
  252    HG3  GLU  38           2HG      GLU  38  13.922  12.989   6.928
  253    H    LYS  39           H        LYS  39   9.711  11.471  10.750
  254    HA   LYS  39           HA       LYS  39   7.290  12.604  10.173
  255    HB2  LYS  39           1HB      LYS  39   7.925  11.191  12.187
  256    HB3  LYS  39           2HB      LYS  39   8.496  12.675  12.938
  257    HG2  LYS  39           1HG      LYS  39   6.252  13.627  12.763
  258    HG3  LYS  39           2HG      LYS  39   5.680  12.135  12.013
  259    HD2  LYS  39           1HD      LYS  39   6.401  10.916  14.071
  260    HD3  LYS  39           2HD      LYS  39   6.754  12.480  14.810
  261    HE2  LYS  39           1HE      LYS  39   4.060  11.944  13.625
  262    HE3  LYS  39           2HE      LYS  39   4.455  11.342  15.234
  263    HZ1  LYS  39           3HZ      LYS  39   5.222  13.809  15.564
  264    HZ2  LYS  39           1HZ      LYS  39   3.596  13.374  15.744
  265    HZ3  LYS  39           2HZ      LYS  39   4.123  14.102  14.312
  266    HA   PRO  40           HA       PRO  40   7.931  16.965  10.065
  267    HB2  PRO  40           1HB      PRO  40   5.356  17.753  10.406
  268    HB3  PRO  40           2HB      PRO  40   5.958  17.068   8.892
  269    HG2  PRO  40           1HG      PRO  40   4.427  15.740  11.095
  270    HG3  PRO  40           2HG      PRO  40   4.218  15.592   9.340
  271    HD2  PRO  40           1HD      PRO  40   5.524  13.733  10.814
  272    HD3  PRO  40           2HD      PRO  40   5.961  14.098   9.132
  273    H    SER  41           H        SER  41   6.592  18.890  11.398
  274    HA   SER  41           HA       SER  41   7.348  18.372  14.187
  275    HB2  SER  41           1HB      SER  41   7.441  20.845  14.399
  276    HB3  SER  41           2HB      SER  41   8.525  20.235  13.150
  277    HG   SER  41           HG       SER  41   6.656  22.054  12.881
  278    H    GLY  42           H        GLY  42   5.465  17.388  14.925
  279    HA2  GLY  42           1HA      GLY  42   3.307  17.255  15.707
  280    HA3  GLY  42           2HA      GLY  42   3.512  18.964  16.061
  281    HA   PRO  43           HA       PRO  43   1.493  18.692  11.664
  282    HB2  PRO  43           1HB      PRO  43   0.561  16.251  10.926
  283    HB3  PRO  43           2HB      PRO  43   2.196  16.808  10.553
  284    HG2  PRO  43           1HG      PRO  43   1.265  15.003  12.752
  285    HG3  PRO  43           2HG      PRO  43   2.687  14.849  11.705
  286    HD2  PRO  43           1HD      PRO  43   2.838  15.798  14.236
  287    HD3  PRO  43           2HD      PRO  43   3.918  16.355  12.942
  288    H    SER  44           H        SER  44   0.265  16.440  14.111
  289    HA   SER  44           HA       SER  44  -2.243  17.924  14.177
  290    HB2  SER  44           1HB      SER  44  -2.062  14.959  13.615
  291    HB3  SER  44           2HB      SER  44  -3.540  15.753  14.157
  292    HG   SER  44           HG       SER  44  -2.228  16.870  11.972
  293    H    SER  45           H        SER  45  -2.929  18.212  16.201
  294    HA   SER  45           HA       SER  45  -1.458  17.591  18.433
  295    HB2  SER  45           1HB      SER  45  -4.464  17.944  18.337
  296    HB3  SER  45           2HB      SER  45  -3.439  18.151  19.757
  297    HG   SER  45           HG       SER  45  -3.500  19.720  17.400
  298    H    GLY  46           H        GLY  46  -0.814  15.607  18.994
  299    HA2  GLY  46           1HA      GLY  46  -2.880  13.615  19.572
  300    HA3  GLY  46           2HA      GLY  46  -1.603  13.155  18.456
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1   0.791   1.708 -23.317
    2    HA2  GLY   1           1HA      GLY   1  -0.426   0.464 -21.342
    3    HA3  GLY   1           2HA      GLY   1  -1.406  -0.116 -22.680
    4    H    SER   2           H        SER   2   1.782  -0.154 -21.226
    5    HA   SER   2           HA       SER   2   2.650  -2.250 -23.074
    6    HB2  SER   2           1HB      SER   2   4.100  -0.221 -22.367
    7    HB3  SER   2           2HB      SER   2   4.332  -1.102 -20.857
    8    HG   SER   2           HG       SER   2   5.979  -1.625 -22.299
    9    H    SER   3           H        SER   3   3.363  -4.280 -22.364
   10    HA   SER   3           HA       SER   3   1.835  -5.640 -20.563
   11    HB2  SER   3           1HB      SER   3   3.181  -6.916 -22.037
   12    HB3  SER   3           2HB      SER   3   4.665  -6.146 -21.475
   13    HG   SER   3           HG       SER   3   3.120  -7.533 -19.609
   14    H    GLY   4           H        GLY   4   1.931  -6.202 -18.410
   15    HA2  GLY   4           1HA      GLY   4   4.026  -4.908 -16.789
   16    HA3  GLY   4           2HA      GLY   4   2.331  -4.696 -16.375
   17    H    SER   5           H        SER   5   1.947  -5.817 -14.584
   18    HA   SER   5           HA       SER   5   3.028  -8.552 -14.399
   19    HB2  SER   5           1HB      SER   5   2.537  -6.455 -12.302
   20    HB3  SER   5           2HB      SER   5   2.580  -8.164 -11.866
   21    HG   SER   5           HG       SER   5   4.627  -6.473 -12.553
   22    H    SER   6           H        SER   6   1.673 -10.059 -13.094
   23    HA   SER   6           HA       SER   6  -0.710 -10.647 -14.161
   24    HB2  SER   6           1HB      SER   6   0.641 -11.785 -12.201
   25    HB3  SER   6           2HB      SER   6  -0.532 -10.944 -11.187
   26    HG   SER   6           HG       SER   6  -2.184 -12.021 -12.270
   27    H    GLY   7           H        GLY   7  -2.666  -9.765 -14.320
   28    HA2  GLY   7           1HA      GLY   7  -3.244  -7.277 -13.016
   29    HA3  GLY   7           2HA      GLY   7  -4.307  -8.155 -14.105
   30    H    THR   8           H        THR   8  -2.926  -8.546 -10.839
   31    HA   THR   8           HA       THR   8  -5.632  -9.133  -9.860
   32    HB   THR   8           HB       THR   8  -4.758 -10.932  -8.420
   33    HG1  THR   8           HG1      THR   8  -2.672 -11.198  -8.252
   34   HG21  THR   8          3HG2      THR   8  -4.894 -12.582 -10.023
   35   HG22  THR   8          1HG2      THR   8  -3.909 -11.689 -11.180
   36   HG23  THR   8          2HG2      THR   8  -5.585 -11.216 -10.897
   37    H    GLY   9           H        GLY   9  -5.823  -8.937  -7.491
   38    HA2  GLY   9           1HA      GLY   9  -4.061  -8.056  -5.654
   39    HA3  GLY   9           2HA      GLY   9  -4.374  -6.599  -6.585
   40    H    GLU  10           H        GLU  10  -5.960  -9.148  -4.705
   41    HA   GLU  10           HA       GLU  10  -8.316  -7.470  -4.351
   42    HB2  GLU  10           1HB      GLU  10  -8.190 -10.092  -4.712
   43    HB3  GLU  10           2HB      GLU  10  -7.994 -10.093  -2.965
   44    HG2  GLU  10           1HG      GLU  10 -10.095  -8.988  -2.664
   45    HG3  GLU  10           2HG      GLU  10 -10.271  -8.754  -4.402
   46    H    LYS  11           H        LYS  11  -5.448  -7.279  -3.064
   47    HA   LYS  11           HA       LYS  11  -5.638  -7.600  -0.315
   48    HB2  LYS  11           1HB      LYS  11  -4.057  -5.735  -2.055
   49    HB3  LYS  11           2HB      LYS  11  -3.974  -5.593  -0.304
   50    HG2  LYS  11           1HG      LYS  11  -2.172  -6.952  -0.814
   51    HG3  LYS  11           2HG      LYS  11  -3.421  -8.106  -0.340
   52    HD2  LYS  11           1HD      LYS  11  -3.912  -8.602  -2.641
   53    HD3  LYS  11           2HD      LYS  11  -2.828  -7.323  -3.192
   54    HE2  LYS  11           1HE      LYS  11  -1.767  -9.496  -3.420
   55    HE3  LYS  11           2HE      LYS  11  -0.928  -8.524  -2.213
   56    HZ1  LYS  11           3HZ      LYS  11  -1.106 -10.526  -1.146
   57    HZ2  LYS  11           1HZ      LYS  11  -2.601 -10.908  -1.841
   58    HZ3  LYS  11           2HZ      LYS  11  -2.515  -9.769  -0.593
   59    HA   PRO  12           HA       PRO  12  -8.765  -4.606   0.699
   60    HB2  PRO  12           1HB      PRO  12  -8.591  -4.902   3.392
   61    HB3  PRO  12           2HB      PRO  12  -9.407  -6.072   2.348
   62    HG2  PRO  12           1HG      PRO  12  -6.652  -6.172   3.514
   63    HG3  PRO  12           2HG      PRO  12  -7.860  -7.463   3.385
   64    HD2  PRO  12           1HD      PRO  12  -5.777  -7.239   1.669
   65    HD3  PRO  12           2HD      PRO  12  -7.356  -7.886   1.176
   66    H    TYR  13           H        TYR  13  -5.498  -4.294   0.975
   67    HA   TYR  13           HA       TYR  13  -5.756  -1.548   1.964
   68    HB2  TYR  13           1HB      TYR  13  -3.844  -3.639   2.982
   69    HB3  TYR  13           2HB      TYR  13  -3.495  -1.921   3.132
   70    HD1  TYR  13           HD2      TYR  13  -4.817  -0.507   4.620
   71    HD2  TYR  13           HD1      TYR  13  -5.581  -4.681   4.306
   72    HE1  TYR  13           HE2      TYR  13  -6.152  -0.412   6.683
   73    HE2  TYR  13           HE1      TYR  13  -6.920  -4.597   6.368
   74    HH   TYR  13           HH       TYR  13  -8.298  -2.484   7.581
   75    H    ASN  14           H        ASN  14  -4.201  -0.093   1.162
   76    HA   ASN  14           HA       ASN  14  -2.188  -1.014  -0.694
   77    HB2  ASN  14           1HB      ASN  14  -4.234   0.898  -1.794
   78    HB3  ASN  14           2HB      ASN  14  -3.038  -0.057  -2.665
   79   HD21  ASN  14          1HD2      ASN  14  -3.446  -2.208  -3.104
   80   HD22  ASN  14          2HD2      ASN  14  -5.018  -2.906  -2.937
   81    H    CYS  15           H        CYS  15  -0.832   0.756  -1.491
   82    HA   CYS  15           HA       CYS  15  -0.763   2.962   0.449
   83    HB2  CYS  15           1HB      CYS  15   1.219   1.413   0.268
   84    HB3  CYS  15           2HB      CYS  15   1.473   2.035  -1.360
   85    H    GLU  16           H        GLU  16  -1.541   4.829  -0.252
   86    HA   GLU  16           HA       GLU  16  -1.956   5.383  -3.022
   87    HB2  GLU  16           1HB      GLU  16  -3.502   6.253  -1.374
   88    HB3  GLU  16           2HB      GLU  16  -2.209   7.134  -0.573
   89    HG2  GLU  16           1HG      GLU  16  -3.478   8.683  -1.855
   90    HG3  GLU  16           2HG      GLU  16  -1.916   8.472  -2.644
   91    H    GLU  17           H        GLU  17   0.661   5.820  -0.881
   92    HA   GLU  17           HA       GLU  17   1.835   8.118  -2.077
   93    HB2  GLU  17           1HB      GLU  17   3.174   5.915  -0.498
   94    HB3  GLU  17           2HB      GLU  17   3.840   7.509  -0.826
   95    HG2  GLU  17           1HG      GLU  17   2.396   8.562   0.640
   96    HG3  GLU  17           2HG      GLU  17   1.234   7.237   0.605
   97    H    CYS  18           H        CYS  18   2.583   4.643  -2.340
   98    HA   CYS  18           HA       CYS  18   4.071   5.221  -4.809
   99    HB2  CYS  18           1HB      CYS  18   5.029   2.923  -4.474
  100    HB3  CYS  18           2HB      CYS  18   5.438   4.075  -3.207
  101    H    GLY  19           H        GLY  19   1.743   2.911  -3.426
  102    HA2  GLY  19           1HA      GLY  19  -0.280   2.508  -4.795
  103    HA3  GLY  19           2HA      GLY  19   0.798   2.397  -6.179
  104    H    LYS  20           H        LYS  20   1.395   1.000  -3.003
  105    HA   LYS  20           HA       LYS  20   1.572  -1.633  -4.258
  106    HB2  LYS  20           1HB      LYS  20   3.331  -0.521  -2.650
  107    HB3  LYS  20           2HB      LYS  20   2.261  -1.122  -1.391
  108    HG2  LYS  20           1HG      LYS  20   2.680  -3.336  -1.907
  109    HG3  LYS  20           2HG      LYS  20   3.225  -2.957  -3.543
  110    HD2  LYS  20           1HD      LYS  20   4.738  -1.989  -1.140
  111    HD3  LYS  20           2HD      LYS  20   4.988  -3.615  -1.781
  112    HE2  LYS  20           1HE      LYS  20   5.310  -2.417  -4.048
  113    HE3  LYS  20           2HE      LYS  20   5.539  -0.967  -3.073
  114    HZ1  LYS  20           3HZ      LYS  20   7.121  -2.878  -1.899
  115    HZ2  LYS  20           1HZ      LYS  20   7.643  -1.594  -2.871
  116    HZ3  LYS  20           2HZ      LYS  20   7.346  -3.110  -3.560
  117    H    ALA  21           H        ALA  21   0.916  -3.482  -2.659
  118    HA   ALA  21           HA       ALA  21  -1.723  -2.832  -1.518
  119    HB1  ALA  21           3HB      ALA  21  -1.637  -5.554  -2.386
  120    HB2  ALA  21           1HB      ALA  21  -2.719  -4.257  -2.895
  121    HB3  ALA  21           2HB      ALA  21  -1.180  -4.499  -3.723
  122    H    PHE  22           H        PHE  22  -2.382  -4.042   0.292
  123    HA   PHE  22           HA       PHE  22  -0.406  -5.822   1.507
  124    HB2  PHE  22           1HB      PHE  22  -1.541  -3.349   2.820
  125    HB3  PHE  22           2HB      PHE  22  -0.739  -4.640   3.710
  126    HD1  PHE  22           HD2      PHE  22  -0.252  -2.055   1.116
  127    HD2  PHE  22           HD1      PHE  22   1.606  -4.777   3.810
  128    HE1  PHE  22           HE2      PHE  22   1.926  -0.997   0.678
  129    HE2  PHE  22           HE1      PHE  22   3.787  -3.723   3.376
  130    HZ   PHE  22           HZ       PHE  22   3.949  -1.831   1.807
  131    H    ILE  23           H        ILE  23  -1.259  -7.244   3.083
  132    HA   ILE  23           HA       ILE  23  -4.053  -7.862   2.657
  133    HB   ILE  23           HB       ILE  23  -1.979  -9.270   4.342
  134   HG12  ILE  23          1HG1      ILE  23  -3.126 -10.154   1.697
  135   HG13  ILE  23          2HG1      ILE  23  -1.666  -9.177   1.806
  136   HG21  ILE  23          1HG2      ILE  23  -3.498 -11.013   4.679
  137   HG22  ILE  23          2HG2      ILE  23  -4.449  -9.554   4.948
  138   HG23  ILE  23          3HG2      ILE  23  -4.588 -10.428   3.422
  139   HD11  ILE  23          3HD1      ILE  23  -1.806 -11.923   1.837
  140   HD12  ILE  23          1HD1      ILE  23  -0.421 -10.941   2.311
  141   HD13  ILE  23          2HD1      ILE  23  -1.565 -11.501   3.532
  142    H    HIS  24           H        HIS  24  -1.973  -7.057   5.426
  143    HA   HIS  24           HA       HIS  24  -4.408  -6.409   6.955
  144    HB2  HIS  24           1HB      HIS  24  -1.728  -7.448   7.867
  145    HB3  HIS  24           2HB      HIS  24  -2.882  -6.720   8.980
  146    HD2  HIS  24           HD2      HIS  24  -2.608  -9.921   6.712
  147    HE1  HIS  24           HE1      HIS  24  -5.646 -10.520   9.613
  148    HE2  HIS  24           HE2      HIS  24  -4.244 -11.593   7.816
  149    H    ASP  25           H        ASP  25  -4.427  -4.520   8.210
  150    HA   ASP  25           HA       ASP  25  -3.331  -2.245   7.084
  151    HB2  ASP  25           1HB      ASP  25  -3.867  -1.151   9.307
  152    HB3  ASP  25           2HB      ASP  25  -5.201  -2.003   8.535
  153    H    SER  26           H        SER  26  -2.287  -3.769  10.139
  154    HA   SER  26           HA       SER  26  -0.146  -2.262  10.800
  155    HB2  SER  26           1HB      SER  26   0.889  -4.303  11.765
  156    HB3  SER  26           2HB      SER  26  -0.831  -4.184  12.132
  157    HG   SER  26           HG       SER  26   0.053  -6.284  11.329
  158    H    GLN  27           H        GLN  27  -0.209  -4.755   8.297
  159    HA   GLN  27           HA       GLN  27   2.528  -4.727   7.670
  160    HB2  GLN  27           1HB      GLN  27   0.191  -5.323   5.848
  161    HB3  GLN  27           2HB      GLN  27   1.867  -5.760   5.545
  162    HG2  GLN  27           1HG      GLN  27   1.845  -7.196   7.526
  163    HG3  GLN  27           2HG      GLN  27   0.157  -6.771   7.806
  164   HE21  GLN  27          1HE2      GLN  27   2.199  -7.919   5.135
  165   HE22  GLN  27          2HE2      GLN  27   1.089  -9.119   4.578
  166    H    LEU  28           H        LEU  28  -0.190  -3.014   6.132
  167    HA   LEU  28           HA       LEU  28   1.341  -1.598   4.258
  168    HB2  LEU  28           1HB      LEU  28  -0.990  -1.717   3.923
  169    HB3  LEU  28           2HB      LEU  28  -1.330  -1.067   5.525
  170    HG   LEU  28           HG       LEU  28  -0.417   1.121   4.762
  171   HD11  LEU  28          1HD1      LEU  28  -0.656   0.193   1.945
  172   HD12  LEU  28          2HD1      LEU  28   0.838  -0.134   2.823
  173   HD13  LEU  28          3HD1      LEU  28   0.279   1.527   2.622
  174   HD21  LEU  28          3HD2      LEU  28  -2.504   0.669   2.779
  175   HD22  LEU  28          1HD2      LEU  28  -2.489   1.725   4.192
  176   HD23  LEU  28          2HD2      LEU  28  -2.903   0.020   4.370
  177    H    GLN  29           H        GLN  29   0.088  -0.550   7.425
  178    HA   GLN  29           HA       GLN  29   1.154   2.004   7.467
  179    HB2  GLN  29           1HB      GLN  29   0.643   0.051   9.707
  180    HB3  GLN  29           2HB      GLN  29   1.158   1.708   9.991
  181    HG2  GLN  29           1HG      GLN  29  -1.391   0.776   8.701
  182    HG3  GLN  29           2HG      GLN  29  -1.202   1.618  10.239
  183   HE21  GLN  29          1HE2      GLN  29  -1.433   1.918   6.830
  184   HE22  GLN  29          2HE2      GLN  29  -1.406   3.644   6.756
  185    H    GLU  30           H        GLU  30   2.637  -1.022   8.596
  186    HA   GLU  30           HA       GLU  30   5.033   0.080   9.533
  187    HB2  GLU  30           1HB      GLU  30   4.426  -2.182  10.101
  188    HB3  GLU  30           2HB      GLU  30   4.438  -2.659   8.409
  189    HG2  GLU  30           1HG      GLU  30   6.822  -2.365   8.291
  190    HG3  GLU  30           2HG      GLU  30   6.858  -1.730   9.934
  191    H    HIS  31           H        HIS  31   3.852  -0.047   6.401
  192    HA   HIS  31           HA       HIS  31   6.527  -0.018   5.196
  193    HB2  HIS  31           1HB      HIS  31   5.305  -1.459   3.885
  194    HB3  HIS  31           2HB      HIS  31   3.789  -0.612   4.177
  195    HD1  HIS  31           HD1      HIS  31   6.930  -0.348   2.095
  196    HD2  HIS  31           HD2      HIS  31   3.080   1.206   2.246
  197    HE1  HIS  31           HE1      HIS  31   6.644   0.948  -0.041
  198    H    GLN  32           H        GLN  32   3.458   1.790   5.006
  199    HA   GLN  32           HA       GLN  32   4.146   3.919   3.491
  200    HB2  GLN  32           1HB      GLN  32   2.495   3.832   6.008
  201    HB3  GLN  32           2HB      GLN  32   2.661   5.302   5.057
  202    HG2  GLN  32           1HG      GLN  32   1.791   4.041   3.091
  203    HG3  GLN  32           2HG      GLN  32   1.469   2.688   4.174
  204   HE21  GLN  32          1HE2      GLN  32  -0.618   3.596   2.847
  205   HE22  GLN  32          2HE2      GLN  32  -1.667   4.528   3.855
  206    H    ARG  33           H        ARG  33   5.427   3.138   6.597
  207    HA   ARG  33           HA       ARG  33   6.323   5.608   7.501
  208    HB2  ARG  33           1HB      ARG  33   8.249   4.162   8.498
  209    HB3  ARG  33           2HB      ARG  33   6.597   3.899   9.040
  210    HG2  ARG  33           1HG      ARG  33   6.383   1.929   7.770
  211    HG3  ARG  33           2HG      ARG  33   7.841   2.282   6.839
  212    HD2  ARG  33           1HD      ARG  33   8.573   0.675   8.339
  213    HD3  ARG  33           2HD      ARG  33   9.038   2.181   9.129
  214    HE   ARG  33           HE       ARG  33   6.451   1.282   9.939
  215   HH11  ARG  33          1HH1      ARG  33   9.868   0.851  10.447
  216   HH12  ARG  33          2HH1      ARG  33   9.686   0.267  12.068
  217   HH21  ARG  33          1HH2      ARG  33   6.198   0.514  12.072
  218   HH22  ARG  33          2HH2      ARG  33   7.598   0.075  12.991
  219    H    ILE  34           H        ILE  34   7.867   3.335   5.262
  220    HA   ILE  34           HA       ILE  34  10.326   4.516   4.931
  221    HB   ILE  34           HB       ILE  34  10.459   3.502   2.764
  222   HG12  ILE  34          1HG1      ILE  34   7.581   2.723   2.740
  223   HG13  ILE  34          2HG1      ILE  34   7.991   4.370   2.271
  224   HG21  ILE  34          1HG2      ILE  34   8.797   1.384   3.751
  225   HG22  ILE  34          2HG2      ILE  34  10.555   1.490   3.696
  226   HG23  ILE  34          3HG2      ILE  34   9.677   2.134   5.083
  227   HD11  ILE  34          3HD1      ILE  34   8.062   3.358   0.243
  228   HD12  ILE  34          1HD1      ILE  34   9.737   3.120   0.741
  229   HD13  ILE  34          2HD1      ILE  34   8.572   1.806   0.908
  230    H    HIS  35           H        HIS  35   7.235   5.687   3.922
  231    HA   HIS  35           HA       HIS  35   8.272   7.570   2.001
  232    HB2  HIS  35           1HB      HIS  35   5.541   7.207   3.239
  233    HB3  HIS  35           2HB      HIS  35   5.908   8.459   2.056
  234    HD1  HIS  35           HD1      HIS  35   6.072   7.760  -0.385
  235    HD2  HIS  35           HD2      HIS  35   5.537   4.560   2.209
  236    HE1  HIS  35           HE1      HIS  35   5.562   5.783  -1.853
  237    H    THR  36           H        THR  36   8.886   7.504   5.065
  238    HA   THR  36           HA       THR  36   8.042  10.152   5.881
  239    HB   THR  36           HB       THR  36   9.436   9.670   7.922
  240    HG1  THR  36           HG1      THR  36  10.517   7.814   8.062
  241   HG21  THR  36          3HG2      THR  36   7.247   9.191   8.367
  242   HG22  THR  36          1HG2      THR  36   7.920   7.568   8.513
  243   HG23  THR  36          2HG2      THR  36   7.108   8.055   7.025
  244    H    GLY  37           H        GLY  37   9.609  10.165   3.535
  245    HA2  GLY  37           1HA      GLY  37  12.327  10.574   3.811
  246    HA3  GLY  37           2HA      GLY  37  11.321  11.403   2.633
  247    H    GLU  38           H        GLU  38  10.769  13.519   2.949
  248    HA   GLU  38           HA       GLU  38  12.352  14.971   4.860
  249    HB2  GLU  38           1HB      GLU  38  11.789  15.701   2.475
  250    HB3  GLU  38           2HB      GLU  38  10.199  16.123   3.095
  251    HG2  GLU  38           1HG      GLU  38  11.788  18.026   2.949
  252    HG3  GLU  38           2HG      GLU  38  11.115  17.761   4.556
  253    H    LYS  39           H        LYS  39  10.698  13.327   6.272
  254    HA   LYS  39           HA       LYS  39   9.376  15.147   7.996
  255    HB2  LYS  39           1HB      LYS  39   7.783  14.647   5.921
  256    HB3  LYS  39           2HB      LYS  39   7.411  13.212   6.867
  257    HG2  LYS  39           1HG      LYS  39   7.319  15.883   8.184
  258    HG3  LYS  39           2HG      LYS  39   5.994  15.388   7.129
  259    HD2  LYS  39           1HD      LYS  39   7.003  13.626   9.345
  260    HD3  LYS  39           2HD      LYS  39   5.777  14.865   9.624
  261    HE2  LYS  39           1HE      LYS  39   5.475  12.816   7.452
  262    HE3  LYS  39           2HE      LYS  39   4.993  12.473   9.113
  263    HZ1  LYS  39           3HZ      LYS  39   3.149  13.289   7.750
  264    HZ2  LYS  39           1HZ      LYS  39   3.979  14.739   7.482
  265    HZ3  LYS  39           2HZ      LYS  39   3.477  14.328   9.044
  266    HA   PRO  40           HA       PRO  40  10.359  11.788  10.682
  267    HB2  PRO  40           1HB      PRO  40   9.021  12.649  12.882
  268    HB3  PRO  40           2HB      PRO  40  10.539  13.372  12.337
  269    HG2  PRO  40           1HG      PRO  40   7.730  14.319  11.916
  270    HG3  PRO  40           2HG      PRO  40   9.174  15.255  12.348
  271    HD2  PRO  40           1HD      PRO  40   8.199  15.164   9.823
  272    HD3  PRO  40           2HD      PRO  40   9.932  15.328  10.173
  273    H    SER  41           H        SER  41   9.272  10.162  12.060
  274    HA   SER  41           HA       SER  41   7.057   9.016  10.721
  275    HB2  SER  41           1HB      SER  41   8.784   7.697  11.930
  276    HB3  SER  41           2HB      SER  41   8.152   8.316  13.456
  277    HG   SER  41           HG       SER  41   7.305   6.227  12.067
  278    H    GLY  42           H        GLY  42   7.345  10.400  13.998
  279    HA2  GLY  42           1HA      GLY  42   4.760  11.610  13.841
  280    HA3  GLY  42           2HA      GLY  42   4.734  10.158  14.831
  281    HA   PRO  43           HA       PRO  43   7.662  13.382  16.986
  282    HB2  PRO  43           1HB      PRO  43   7.366  15.949  16.152
  283    HB3  PRO  43           2HB      PRO  43   8.546  14.839  15.445
  284    HG2  PRO  43           1HG      PRO  43   5.838  15.620  14.435
  285    HG3  PRO  43           2HG      PRO  43   7.357  15.435  13.537
  286    HD2  PRO  43           1HD      PRO  43   5.431  13.531  13.550
  287    HD3  PRO  43           2HD      PRO  43   7.159  13.141  13.428
  288    H    SER  44           H        SER  44   6.928  13.932  18.942
  289    HA   SER  44           HA       SER  44   4.159  14.885  19.171
  290    HB2  SER  44           1HB      SER  44   4.536  12.829  20.373
  291    HB3  SER  44           2HB      SER  44   5.963  13.497  21.165
  292    HG   SER  44           HG       SER  44   3.258  14.259  21.531
  293    H    SER  45           H        SER  45   3.647  16.550  20.683
  294    HA   SER  45           HA       SER  45   5.703  18.596  20.799
  295    HB2  SER  45           1HB      SER  45   3.484  19.263  20.055
  296    HB3  SER  45           2HB      SER  45   2.771  18.661  21.551
  297    HG   SER  45           HG       SER  45   3.857  20.268  22.678
  298    H    GLY  46           H        GLY  46   7.132  18.044  22.398
  299    HA2  GLY  46           1HA      GLY  46   7.086  18.868  24.883
  300    HA3  GLY  46           2HA      GLY  46   6.075  17.442  25.065