*HEADER    TRANSCRIPTION                           28-MAR-07   2EMI              
*TITLE     SOLUTION STRUCTURE OF THE C2H2 TYPE ZINC FINGER (REGION 547-          
*TITLE    2 579) OF HUMAN ZINC FINGER PROTEIN 484                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER PROTEIN 484;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-C2H2 DOMAIN;                                            
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: ZNF484;                                                        
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P070115-44;                               
*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    T.TOMIZAWA, N.TOCHIO, 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 2EMI    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
18 CYSS SG   201 ZN   ZN   2.19  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 CB   201 ZN   ZN   3.25  5.00E+00
18 CYSS CB   201 ZN   ZN   3.25  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
18 CYSS SG   201 ZN   ZN   2.39  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 CB   201 ZN   ZN   3.51  5.00E+00
18 CYSS CB   201 ZN   ZN   3.51  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
 12 HIS  HD2    13 TYR  HN      4.96 #SUP  0.98  #QF  0.76
 13 TYR  HN     13 TYR  QE      5.34 #SUP  0.98  #QF  0.76
 12 HIS  HB3    13 TYR  HN      4.38 #SUP  0.63  #QF  0.63
 13 TYR  HN     21 ALA  QB      5.50 #SUP  0.95  #QF  0.95
 13 TYR  HN     13 TYR  QD      3.67 #SUP  0.98  #QF  0.98
 12 HIS  HA     13 TYR  HN      3.16 #SUP  1.00  #QF  0.91
 13 TYR  HN     13 TYR  HB3     3.98 #SUP  0.99  #QF  0.99
 13 TYR  HN     13 TYR  HB2     3.98 #SUP  0.98  #QF  0.98
 13 TYR  HN     28 LEU  QD2     5.17 #SUP  0.97  #QF  0.97
 15 CYSS HN     19 GLY  HN      4.90 #SUP  0.95  #QF  0.95
 17 GLU  HN     19 GLY  HN      4.10 #SUP  0.95  #QF  0.95
 15 CYSS HB3    19 GLY  HN      3.76 #SUP  1.00  #QF  0.98
 15 CYSS HB2    19 GLY  HN      4.39 #SUP  0.97  #QF  0.70
 18 CYSS HB2    19 GLY  HN      4.90 #SUP  0.97  #QF  0.70
 27 THR  HA     31 HIS  HN      5.48 #SUP  1.00  #QF  0.98
 28 LEU  HG     31 HIS  HN      5.04 #SUP  0.80  #QF  0.80
 27 THR  QG2    31 HIS  HN      4.74 #SUP  0.92  #QF  0.92
 31 HIS  HN     32 GLN  HN      3.55 #SUP  0.99  #QF  0.99
 31 HIS  HN     33 ARG  HN      4.87 #SUP  0.96  #QF  0.96
 28 LEU  HA     31 HIS  HN      3.66 #SUP  0.99  #QF  0.75
 31 HIS  HN     31 HIS  HB2     3.60 #SUP  0.97  #QF  0.97
 38 GLU  HN     38 GLU  QG      4.39 #SUP  0.94  #QF  0.94
 32 GLN  QG     32 GLN  HE22    3.95 #SUP  0.94  #QF  0.94
 32 GLN  QG     32 GLN  HE21    3.95 #SUP  0.98  #QF  0.98
 29 SER  HN     30 MET  HN      3.56 #SUP  0.99  #QF  0.99
 30 MET  HN     30 MET  HB2     4.00 #SUP  0.90  #QF  0.73
 30 MET  HN     30 MET  QG      3.10 #SUP  0.98  #QF  0.98
 28 LEU  HA     30 MET  HN      4.44 #SUP  0.88  #QF  0.88
 12 HIS  HN     13 TYR  HN      4.68 #SUP  0.99  #QF  0.99
 11 ARG  QB     12 HIS  HN      4.63 #SUP  0.98  #QF  0.98
 15 CYSS HN     22 PHE  QD      4.84 #SUP  0.96  #QF  0.96
 14 GLU  HA     15 CYSS HN      3.09 #SUP  0.94  #QF  0.94
 15 CYSS HN     15 CYSS HB3     3.41 #SUP  0.99  #QF  0.99
 15 CYSS HN     15 CYSS HB2     3.49 #SUP  1.00
 14 GLU  QB     15 CYSS HN      3.92 #SUP  0.99  #QF  0.99
 15 CYSS HN     20 LYS  HN      4.20 #SUP  0.90  #QF  0.90
 15 CYSS HN     22 PHE  QE      4.45 #SUP  0.98  #QF  0.98
 14 GLU  QG     15 CYSS HN      4.19 #SUP  0.95  #QF  0.95
 23 ILE  HN     23 ILE  HG12    4.71 #SUP  1.00
 24 GLN  HB2    27 THR  HN      4.35 #SUP  0.98  #QF  0.98
 33 ARG  HA     36 ARG  HN      4.52 #SUP  0.92  #QF  0.81
 35 HIS  HB2    36 ARG  HN      4.84 #SUP  0.99  #QF  0.94
 24 GLN  HN     27 THR  HN      4.77 #SUP  0.88  #QF  0.88
 27 THR  HN     27 THR  HB      3.78 #SUP  0.99  #QF  0.99
 27 THR  HN     27 THR  QG2     4.36 #SUP  0.98  #QF  0.98
 36 ARG  HN     36 ARG  QG      3.96 #SUP  1.00
 35 HIS  HB3    36 ARG  HN      4.84 #SUP  0.93  #QF  0.93
 15 CYSS HN     22 PHE  HN      5.01 #SUP  0.95  #QF  0.95
 22 PHE  HN     22 PHE  QD      3.48 #SUP  0.98  #QF  0.98
 12 HIS  HD2    22 PHE  HN      5.28 #SUP  1.00  #QF  0.71
 22 PHE  HN     22 PHE  QE      5.50 #SUP  1.00  #QF  0.71
 21 ALA  HA     22 PHE  HN      3.03 #SUP  0.86  #QF  0.86
 22 PHE  HN     22 PHE  HB3     3.97 #SUP  0.99  #QF  0.99
 22 PHE  HN     22 PHE  HB2     3.97 #SUP  0.97  #QF  0.97
 14 GLU  QG     22 PHE  HN      4.69 #SUP  0.82  #QF  0.82
 22 PHE  HN     28 LEU  HB2     5.02 #SUP  0.90  #QF  0.90
 35 HIS  HN     35 HIS  HB3     3.90 #SUP  0.99  #QF  0.99
 33 ARG  HG3    35 HIS  HN      5.05 #SUP  0.73  #QF  0.60
 35 HIS  HN     36 ARG  QG      5.00 #SUP  1.00
 34 ILE  HG12   35 HIS  HN      4.70 #SUP  0.98  #QF  0.98
 35 HIS  HN     36 ARG  HN      3.79 #SUP  0.98  #QF  0.98
 35 HIS  HN     35 HIS  HD2     4.40 #SUP  1.00
 33 ARG  HA     35 HIS  HN      4.45 #SUP  1.00  #QF  0.83
 35 HIS  HN     35 HIS  HB2     3.90 #SUP  0.96  #QF  0.96
 32 GLN  QG     33 ARG  HN      4.53 #SUP  0.99  #QF  0.99
 33 ARG  HN     34 ILE  QG2     4.88 #SUP  0.95  #QF  0.95
 34 ILE  HG13   35 HIS  HN      4.70 #SUP  0.86  #QF  0.86
 33 ARG  HN     34 ILE  HN      3.57 #SUP  1.00
 30 MET  HA     33 ARG  HN      4.65 #SUP  1.00  #QF  0.92
 33 ARG  HN     36 ARG  QD      5.28 #SUP  0.99  #QF  0.99
 32 GLN  HB2    33 ARG  HN      4.38 #SUP  0.99  #QF  0.99
 32 GLN  HB3    33 ARG  HN      4.38 #SUP  0.98  #QF  0.98
 33 ARG  HN     33 ARG  HB3     3.01 #SUP  0.91  #QF  0.91
 33 ARG  HN     33 ARG  HG2     3.64 #SUP  0.98  #QF  0.98
 34 ILE  HN     35 HIS  HN      3.50 #SUP  0.99  #QF  0.99
 33 ARG  HG3    34 ILE  HN      3.85 #SUP  1.00  #QF  0.82
 33 ARG  HG2    34 ILE  HN      3.42 #SUP  0.81  #QF  0.81
 34 ILE  HN     34 ILE  HG13    4.22 #SUP  0.92  #QF  0.92
 31 HIS  HA     34 ILE  HN      4.51 #SUP  0.96  #QF  0.96
 28 LEU  HN     28 LEU  HG      4.15 #SUP  1.00
 13 TYR  HA     14 GLU  HN      3.06 #SUP  0.87  #QF  0.87
 14 GLU  HN     14 GLU  QB      3.43 #SUP  0.98  #QF  0.98
 14 GLU  HN     14 GLU  QG      4.00 #SUP  0.89  #QF  0.89
 22 PHE  HB3    28 LEU  HN      4.58 #SUP  0.97  #QF  0.97
 28 LEU  HN     30 MET  HN      4.46 #SUP  0.96  #QF  0.96
 27 THR  HB     28 LEU  HN      3.72 #SUP  0.97  #QF  0.97
 22 PHE  HB2    28 LEU  HN      4.58 #SUP  0.98  #QF  0.98
 28 LEU  HN     28 LEU  HB3     3.40 #SUP  1.00
 28 LEU  HN     28 LEU  HB2     3.51 #SUP  0.99  #QF  0.99
 28 LEU  HN     28 LEU  QD2     4.46 #SUP  0.96  #QF  0.90
 28 LEU  HN     28 LEU  QD1     4.85 #SUP  0.96  #QF  0.90
 13 TYR  HB3    14 GLU  HN      4.49 #SUP  0.98  #QF  0.98
 13 TYR  HB2    14 GLU  HN      4.49 #SUP  0.94  #QF  0.94
 14 GLU  HN     15 CYSS HN      4.82 #SUP  0.99  #QF  0.99
 14 GLU  HN     28 LEU  QD2     4.14 #SUP  0.96  #QF  0.96
 20 LYS  HA     21 ALA  HN      2.85 #SUP  0.94  #QF  0.94
 20 LYS  HB3    21 ALA  HN      4.63 #SUP  0.97  #QF  0.95
 20 LYS  HG3    21 ALA  HN      4.98 #SUP  0.97  #QF  0.95
 20 LYS  HB2    21 ALA  HN      4.63 #SUP  0.96  #QF  0.96
 39 LYS  HN     39 LYS  QD      4.68 #SUP  0.98  #QF  0.97
 39 LYS  HN     39 LYS  QG      4.71 #SUP  0.99  #QF  0.99
 23 ILE  HN     24 GLN  HN      4.04 #SUP  0.99  #QF  0.99
 24 GLN  HN     27 THR  HB      4.20 #SUP  1.00
 22 PHE  HB3    24 GLN  HN      4.15 #SUP  0.98  #QF  0.98
 22 PHE  HB2    24 GLN  HN      4.15 #SUP  0.98  #QF  0.98
 24 GLN  HN     24 GLN  QG      3.78 #SUP  0.99  #QF  0.99
 23 ILE  HG13   24 GLN  HN      4.92 #SUP  0.95  #QF  0.95
 23 ILE  HG12   24 GLN  HN      4.92 #SUP  0.84  #QF  0.41
 23 ILE  QG2    24 GLN  HN      4.23 #SUP  1.00
 15 CYSS HB2    17 GLU  HN      4.89 #SUP  0.86  #QF  0.86
 15 CYSS HA     17 GLU  HN      4.58 #SUP  0.88  #QF  0.88
 16 SER  QB     17 GLU  HN      4.41 #SUP  0.83  #QF  0.83
 15 CYSS HB3    17 GLU  HN      4.48 #SUP  0.95  #QF  0.95
 17 GLU  HN     17 GLU  HG3     4.08 #SUP  1.00
 17 GLU  HN     17 GLU  HG2     4.08 #SUP  1.00
 17 GLU  HN     17 GLU  HB2     3.77 #SUP  0.99  #QF  0.99
 32 GLN  HN     34 ILE  HN      4.85 #SUP  0.97  #QF  0.97
 32 GLN  HN     33 ARG  HN      3.60 #SUP  1.00
 31 HIS  HD2    32 GLN  HN      4.31 #SUP  0.99  #QF  0.99
 28 LEU  HA     32 GLN  HN      4.33 #SUP  1.00  #QF  0.91
 32 GLN  HN     32 GLN  QG      3.32 #SUP  0.98  #QF  0.98
 32 GLN  HN     32 GLN  HB2     3.77 #SUP  0.99  #QF  0.99
 32 GLN  HN     32 GLN  HB3     3.77 #SUP  0.98  #QF  0.98
 28 LEU  QD1    32 GLN  HN      4.29 #SUP  0.97  #QF  0.97
 32 GLN  HN     33 ARG  HB3     5.27 #SUP  0.91  #QF  0.91
 19 GLY  HN     20 LYS  HN      3.72 #SUP  0.96  #QF  0.96
 15 CYSS HB3    20 LYS  HN      3.55 #SUP  0.98  #QF  0.98
 20 LYS  HN     20 LYS  HB3     3.68 #SUP  0.97  #QF  0.96
 20 LYS  HN     20 LYS  HB2     3.68 #SUP  1.00
 28 LEU  HB2    32 GLN  HN      5.50 #SUP  0.83  #QF  0.83
 11 ARG  HN     11 ARG  QB      4.01 #SUP  0.99  #QF  0.99
 17 GLU  HN     18 CYSS HN      3.27 #SUP  1.00
 15 CYSS HB3    18 CYSS HN      3.76 #SUP  0.99  #QF  0.73
 18 CYSS HN     18 CYSS HB2     4.04 #SUP  0.99  #QF  0.99
 17 GLU  HG2    18 CYSS HN      4.81 #SUP  0.99  #QF  0.99
 17 GLU  HB3    18 CYSS HN      3.76 #SUP  0.93  #QF  0.93
 17 GLU  HB2    18 CYSS HN      3.76 #SUP  0.97  #QF  0.97
 28 LEU  HN     29 SER  HN      3.51 #SUP  0.99  #QF  0.99
 28 LEU  HB3    29 SER  HN      3.55 #SUP  0.99  #QF  0.99
 11 ARG  HN     11 ARG  QG      4.56 #SUP  1.00  #QF  0.66
 28 LEU  HG     29 SER  HN      4.77 #SUP  1.00  #QF  0.66
 28 LEU  HB2    29 SER  HN      4.02 #SUP  1.00
 28 LEU  QD2    29 SER  HN      4.26 #SUP  0.98  #QF  0.93
 28 LEU  QD1    29 SER  HN      4.63 #SUP  0.98  #QF  0.93
 30 MET  HN     31 HIS  HN      3.47 #SUP  0.93  #QF  0.93
 23 ILE  HN     23 ILE  HG13    4.71 #SUP  0.99  #QF  0.99
 18 CYSS HN     19 GLY  HN      3.02 #SUP  0.81  #QF  0.81
 18 CYSS HA     35 HIS  HE1     4.26 #SUP  0.98  #QF  0.98
 18 CYSS HB3    35 HIS  HE1     3.87 #SUP  0.99  #QF  0.99
 18 CYSS HB2    35 HIS  HE1     3.87 #SUP  0.96  #QF  0.96
 20 LYS  HD3    31 HIS  HE1     4.56 #SUP  0.58  #QF  0.22
 12 HIS  HE1    21 ALA  QB      4.86 #SUP  0.88  #QF  0.88
 13 TYR  QD     28 LEU  HB2     5.34 #SUP  0.94  #QF  0.94
 12 HIS  HA     13 TYR  QD      3.98 #SUP  0.95  #QF  0.23
 13 TYR  HA     13 TYR  QD      4.12 #SUP  0.95  #QF  0.23
 13 TYR  QD     25 LYS  QE      4.39 #SUP  0.97  #QF  0.97
 13 TYR  QD     28 LEU  HB3     4.88 #SUP  0.83  #QF  0.83
 22 PHE  QD     22 PHE  HZ      4.21 #SUP  1.00
 21 ALA  HA     22 PHE  QD      3.95 #SUP  0.84  #QF  0.84
 22 PHE  QD     27 THR  HB      4.06 #SUP  1.00
 22 PHE  QD     28 LEU  HA      3.96 #SUP  1.00
 15 CYSS HB2    22 PHE  QD      4.72 #SUP  0.99  #QF  0.98
 22 PHE  QD     28 LEU  HB3     4.48 #SUP  0.98  #QF  0.98
 22 PHE  QD     28 LEU  HG      5.50 #SUP  1.00  #QF  0.63
 22 PHE  QD     28 LEU  QD1     3.41 #SUP  1.00
 20 LYS  HN     22 PHE  QE      4.69 #SUP  0.93  #QF  0.91
 21 ALA  HN     22 PHE  QE      5.23 #SUP  0.93  #QF  0.91
 22 PHE  QE     31 HIS  HD2     3.78 #SUP  0.87  #QF  0.87
 15 CYSS HB3    22 PHE  QE      4.00 #SUP  1.00
 22 PHE  QE     28 LEU  HA      4.39 #SUP  1.00  #QF  0.97
 15 CYSS HB2    22 PHE  QE      3.68 #SUP  1.00  #QF  0.99
 20 LYS  HB3    22 PHE  QE      4.03 #SUP  0.98  #QF  0.94
 20 LYS  HB2    22 PHE  QE      4.03 #SUP  0.95  #QF  0.64
 20 LYS  HB2    22 PHE  HZ      4.44 #SUP  0.99  #QF  0.99
 22 PHE  HZ     31 HIS  HB3     4.57 #SUP  1.00  #QF  0.80
 22 PHE  HZ     31 HIS  HB2     4.57 #SUP  1.00  #QF  0.78
 20 LYS  HB3    22 PHE  HZ      4.44 #SUP  1.00  #QF  0.98
 31 HIS  HD2    35 HIS  HD2     4.44 #SUP  0.83  #QF  0.83
 32 GLN  QG     35 HIS  HD2     4.21 #SUP  0.98  #QF  0.98
 17 GLU  HB2    35 HIS  HD2     4.74 #SUP  0.95  #QF  0.95
 31 HIS  HN     31 HIS  HD2     4.67 #SUP  1.00
 28 LEU  HA     31 HIS  HD2     4.49 #SUP  1.00  #QF  0.31
 12 HIS  HA     12 HIS  HD2     4.47 #SUP  0.89  #QF  0.89
 12 HIS  HD2    14 GLU  QG      4.83 #SUP  0.86  #QF  0.86
 12 HIS  HD2    14 GLU  QB      4.86 #SUP  0.84  #QF  0.84
 12 HIS  HA     13 TYR  QE      5.13 #SUP  0.99  #QF  0.62
 13 TYR  HA     13 TYR  QE      5.50 #SUP  0.99  #QF  0.62
 13 TYR  QE     25 LYS  QE      4.26 #SUP  0.99  #QF  0.99
 13 TYR  QE     25 LYS  HA      4.58 #SUP  0.93  #QF  0.93
 15 CYSS HN     28 LEU  QD1     4.11 #SUP  1.00
 17 GLU  HN     28 LEU  QD1     5.50 #SUP  0.97  #QF  0.88
 22 PHE  HN     28 LEU  QD1     5.50 #SUP  0.97  #QF  0.88
 28 LEU  QD1    31 HIS  HN      4.41 #SUP  0.99  #QF  0.99
 28 LEU  QD1    32 GLN  HE22    4.43 #SUP  0.99  #QF  0.99
 28 LEU  QD1    32 GLN  HE21    4.43 #SUP  0.88  #QF  0.88
 28 LEU  QD1    31 HIS  HD2     3.46 #SUP  1.00
 22 PHE  QE     28 LEU  QD1     3.60 #SUP  1.00
 14 GLU  HA     28 LEU  QD1     4.39 #SUP  0.84  #QF  0.84
 15 CYSS HA     28 LEU  QD1     3.44 #SUP  0.96  #QF  0.96
 28 LEU  HA     28 LEU  QD1     3.15 #SUP  1.00
 28 LEU  QD1    32 GLN  QG      3.30 #SUP  0.92  #QF  0.73
 28 LEU  HB3    28 LEU  QD1     3.73 #SUP  1.00
 28 LEU  HB2    28 LEU  QD1     3.50 #SUP  1.00
 21 ALA  QB     22 PHE  HN      3.53 #SUP  0.96  #QF  0.96
 21 ALA  HN     21 ALA  QB      3.13 #SUP  0.92  #QF  0.92
 21 ALA  QB     22 PHE  QD      4.87 #SUP  0.96  #QF  0.96
 12 HIS  HD2    21 ALA  QB      4.44 #SUP  1.00
 20 LYS  HA     21 ALA  QB      4.12 #SUP  0.85  #QF  0.85
 14 GLU  QG     21 ALA  QB      3.92 #SUP  0.85  #QF  0.85
 14 GLU  QB     21 ALA  QB      3.90 #SUP  0.95  #QF  0.95
 22 PHE  HB3    27 THR  HB      4.38 #SUP  1.00
 24 GLN  HB2    27 THR  HB      4.80 #SUP  0.96  #QF  0.96
 22 PHE  HB2    27 THR  HB      4.38 #SUP  1.00
 36 ARG  HN     36 ARG  QD      4.72 #SUP  0.98  #QF  0.98
 33 ARG  HA     36 ARG  QD      3.76 #SUP  0.95  #QF  0.95
 36 ARG  QG     36 ARG  QD      2.97 #SUP  1.00  #QF  0.99
 36 ARG  HA     36 ARG  QD      4.36 #SUP  0.99  #QF  0.99
 11 ARG  HA     11 ARG  QD      4.29 #SUP  0.99  #QF  0.99
 11 ARG  QB     11 ARG  QD      3.38 #SUP  0.97  #QF  0.97
 39 LYS  QG     39 LYS  QE      3.78 #SUP  1.00  #QF  0.28
 27 THR  HA     30 MET  HB3     4.87 #SUP  0.83  #QF  0.83
 27 THR  HA     30 MET  HN      4.10 #SUP  0.96  #QF  0.96
 27 THR  HA     30 MET  QG      3.50 #SUP  0.93  #QF  0.93
 23 ILE  HN     23 ILE  QG2     4.61 #SUP  1.00
 23 ILE  HA     23 ILE  QG2     3.40 #SUP  0.98  #QF  0.98
 23 ILE  QG2    24 GLN  QG      3.60 #SUP  0.98  #QF  0.98
 31 HIS  HE1    34 ILE  QG2     4.45 #SUP  0.66  #QF  0.66
 34 ILE  HN     34 ILE  QG2     3.43 #SUP  1.00
 34 ILE  QG2    35 HIS  HN      4.15 #SUP  0.99  #QF  0.99
 31 HIS  HA     34 ILE  QG2     4.21 #SUP  0.99  #QF  0.99
 34 ILE  HA     34 ILE  QG2     3.24 #SUP  1.00
 33 ARG  HG3    34 ILE  QG2     4.24 #SUP  0.90  #QF  0.90
 33 ARG  HG2    34 ILE  QG2     3.50 #SUP  1.00  #QF  0.61
 13 TYR  HB2    28 LEU  QD2     3.77 #SUP  0.98  #QF  0.98
 28 LEU  HB3    28 LEU  QD2     3.50 #SUP  0.98  #QF  0.91
 22 PHE  QD     28 LEU  HB2     4.41 #SUP  1.00
 34 ILE  HA     34 ILE  QD1     4.27 #SUP  1.00
 13 TYR  HB3    28 LEU  QD2     3.77 #SUP  0.99  #QF  0.99
 13 TYR  QD     23 ILE  HA      4.64 #SUP  0.96  #QF  0.96
 23 ILE  HB     24 GLN  HN      4.12 #SUP  0.98  #QF  0.98
 23 ILE  HB     24 GLN  QG      5.00 #SUP  0.99  #QF  0.99
  8 THR  HA      8 THR  QG2     3.95 #SUP  0.94  #QF  0.94
 29 SER  HA     32 GLN  QG      4.40 #SUP  0.97  #QF  0.97
 29 SER  HA     32 GLN  HB2     4.64 #SUP  1.00
 29 SER  HA     32 GLN  HB3     4.64 #SUP  0.98  #QF  0.98
 28 LEU  HG     29 SER  HA      4.62 #SUP  1.00
 28 LEU  QD2    29 SER  HA      5.38 #SUP  0.97  #QF  0.68
 28 LEU  QD1    29 SER  HA      5.50 #SUP  0.97  #QF  0.68
 33 ARG  HG3    34 ILE  HB      4.74 #SUP  0.92  #QF  0.92
 34 ILE  HN     34 ILE  HB      3.79 #SUP  0.98  #QF  0.98
 34 ILE  HB     35 HIS  HN      4.33 #SUP  0.99  #QF  0.99
 31 HIS  HE1    34 ILE  QD1     3.53 #SUP  0.94  #QF  0.94
 34 ILE  HN     34 ILE  QD1     4.07 #SUP  0.99  #QF  0.99
 31 HIS  HA     34 ILE  QD1     4.93 #SUP  0.99  #QF  0.99
 33 ARG  HG3    34 ILE  QD1     5.50 #SUP  0.89  #QF  0.89
 34 ILE  HB     34 ILE  QD1     3.32 #SUP  0.99  #QF  0.99
 16 SER  HA     16 SER  QB      3.00 #SUP  0.98  #QF  0.98
 26 SER  HA     26 SER  QB      2.91 #SUP  0.87  #QF  0.87
 23 ILE  HA     23 ILE  QD1     3.98 #SUP  0.99  #QF  0.99
 23 ILE  HB     23 ILE  QD1     3.49 #SUP  0.99  #QF  0.99
 14 GLU  HA     14 GLU  QG      4.09 #SUP  0.80  #QF  0.80
 17 GLU  HG3    18 CYSS HN      4.81 #SUP  0.98  #QF  0.98
 17 GLU  HA     17 GLU  HG3     4.00 #SUP  1.00
 32 GLN  HA     34 ILE  HN      4.44 #SUP  1.00
 32 GLN  HA     35 HIS  HN      4.30 #SUP  0.99  #QF  0.99
 31 HIS  HD2    32 GLN  HA      4.00 #SUP  0.99  #QF  0.99
 28 LEU  QD1    32 GLN  HA      5.18 #SUP  0.98  #QF  0.97
 32 GLN  HA     35 HIS  HD2     3.47 #SUP  0.99  #QF  0.99
 32 GLN  HA     32 GLN  QG      3.41 #SUP  1.00
 25 LYS  HA     29 SER  HN      4.88 #SUP  0.96  #QF  0.96
 25 LYS  HA     28 LEU  HN      4.14 #SUP  0.86  #QF  0.86
 13 TYR  QD     25 LYS  HA      4.26 #SUP  0.91  #QF  0.91
 25 LYS  HA     28 LEU  HB3     3.65 #SUP  0.90  #QF  0.90
 31 HIS  HA     33 ARG  HN      4.74 #SUP  0.99  #QF  0.99
 31 HIS  HA     33 ARG  HG2     4.73 #SUP  0.56  #QF  0.56
 31 HIS  HD2    32 GLN  QG      4.10 #SUP  0.94  #QF  0.94
 28 LEU  HA     32 GLN  QG      5.00 #SUP  0.91  #QF  0.82
 28 LEU  HG     32 GLN  QG      4.28 #SUP  0.95  #QF  0.95
 17 GLU  HA     17 GLU  HG2     4.00 #SUP  1.00
 30 MET  HA     33 ARG  HB3     3.82 #SUP  0.82  #QF  0.82
 30 MET  HA     33 ARG  HG2     4.56 #SUP  0.98  #QF  0.98
 27 THR  HB     28 LEU  HA      4.56 #SUP  0.98  #QF  0.98
 28 LEU  HA     28 LEU  HG      4.06 #SUP  1.00
 20 LYS  HA     20 LYS  HG3     3.79 #SUP  1.00  #QF  0.99
 20 LYS  HA     20 LYS  HG2     3.79 #SUP  1.00
 24 GLN  QG     27 THR  HN      4.69 #SUP  0.94  #QF  0.94
 24 GLN  QG     27 THR  HB      4.86 #SUP  0.99  #QF  0.99
 23 ILE  HG13   24 GLN  QG      4.65 #SUP  0.99  #QF  0.99
 23 ILE  HG12   24 GLN  QG      4.65 #SUP  0.87  #QF  0.87
 10 GLU  HA     10 GLU  QG      3.98 #SUP  0.97  #QF  0.97
 38 GLU  HA     38 GLU  QG      3.81 #SUP  0.99  #QF  0.99
 18 CYSS HB3    19 GLY  HN      4.90 #SUP  1.00
 18 CYSS HN     18 CYSS HB3     4.04 #SUP  1.00
 30 MET  QG     31 HIS  HN      3.97 #SUP  0.99  #QF  0.99
 30 MET  HA     30 MET  QG      3.45 #SUP  1.00
 28 LEU  HA     30 MET  QG      5.50 #SUP  0.95  #QF  0.82
 30 MET  HB3    31 HIS  HN      4.81 #SUP  0.99  #QF  0.99
 30 MET  HN     30 MET  HB3     4.00 #SUP  1.00
 30 MET  HB2    31 HIS  HN      4.81 #SUP  0.99  #QF  0.99
 27 THR  HA     30 MET  HB2     4.87 #SUP  0.96  #QF  0.96
 11 ARG  HA     11 ARG  QG      3.66 #SUP  0.98  #QF  0.98
 12 HIS  HB2    13 TYR  HN      4.38 #SUP  0.99  #QF  0.99
 24 GLN  HB3    27 THR  HN      4.35 #SUP  0.98  #QF  0.98
 24 GLN  HB3    27 THR  HB      4.80 #SUP  0.99  #QF  0.99
 11 ARG  QB     11 ARG  QG      2.73 #SUP  0.92  #QF  0.92
 33 ARG  HB3    34 ILE  HN      4.48 #SUP  1.00
 33 ARG  HB2    34 ILE  HN      4.76 #SUP  1.00
 33 ARG  HN     33 ARG  HB2     3.84 #SUP  1.00
 15 CYSS HB3    20 LYS  HB3     4.84 #SUP  1.00
 15 CYSS HB3    20 LYS  HB2     4.84 #SUP  1.00
 15 CYSS HB3    28 LEU  QD1     4.01 #SUP  0.95  #QF  0.95
 15 CYSS HB3    31 HIS  HD2     4.40 #SUP  1.00
 14 GLU  HA     15 CYSS HB3     5.10 #SUP  0.98  #QF  0.98
 15 CYSS HB2    20 LYS  HN      3.87 #SUP  0.99  #QF  0.99
 15 CYSS HB2    31 HIS  HD2     3.68 #SUP  0.86  #QF  0.86
 14 GLU  HA     15 CYSS HB2     4.60 #SUP  0.97  #QF  0.97
 15 CYSS HB2    20 LYS  HB3     4.93 #SUP  0.98  #QF  0.98
 15 CYSS HB2    20 LYS  HB2     4.93 #SUP  0.99  #QF  0.98
 15 CYSS HB2    28 LEU  HB2     5.50 #SUP  0.99  #QF  0.98
 15 CYSS HB2    28 LEU  QD1     3.60 #SUP  0.98  #QF  0.98
 17 GLU  HN     17 GLU  HB3     3.77 #SUP  1.00
 17 GLU  HB3    35 HIS  HD2     4.74 #SUP  0.84  #QF  0.84
 20 LYS  HD2    22 PHE  HZ      4.70 #SUP  0.98  #QF  0.98
 20 LYS  HD2    31 HIS  HE1     4.56 #SUP  0.73  #QF  0.73
 20 LYS  HN     20 LYS  HD2     5.50 #SUP  0.89  #QF  0.74
 20 LYS  HD2    21 ALA  HN      5.50 #SUP  0.89  #QF  0.74
 20 LYS  HA     20 LYS  HD2     4.67 #SUP  1.00
 20 LYS  HD3    22 PHE  HZ      4.70 #SUP  0.95  #QF  0.95
 20 LYS  HN     20 LYS  HD3     5.50 #SUP  0.77  #QF  0.62
 20 LYS  HD3    21 ALA  HN      5.50 #SUP  0.77  #QF  0.62
 39 LYS  HA     39 LYS  QD      4.88 #SUP  0.99  #QF  0.99
 13 TYR  QE     25 LYS  HD3     5.32 #SUP  0.95  #QF  0.60
 20 LYS  HD2    22 PHE  QE      5.50 #SUP  0.95  #QF  0.60
 13 TYR  QE     25 LYS  HD2     5.32 #SUP  0.97  #QF  0.94
 20 LYS  HD3    22 PHE  QE      5.50 #SUP  0.97  #QF  0.94
 20 LYS  HA     20 LYS  HD3     4.67 #SUP  0.94  #QF  0.94
 22 PHE  QE     31 HIS  HB2     4.64 #SUP  1.00
 28 LEU  QD1    31 HIS  HB2     4.66 #SUP  0.99  #QF  0.99
 31 HIS  HB3    32 GLN  HN      4.32 #SUP  0.99  #QF  0.99
 31 HIS  HN     31 HIS  HB3     3.60 #SUP  0.99  #QF  0.99
 22 PHE  QE     31 HIS  HB3     4.64 #SUP  0.96  #QF  0.96
 28 LEU  QD1    31 HIS  HB3     4.66 #SUP  0.99  #QF  0.99
 31 HIS  HB2    32 GLN  HN      4.32 #SUP  1.00
 33 ARG  HG3    34 ILE  HA      3.93 #SUP  1.00  #QF  0.99
 33 ARG  HN     33 ARG  HG3     3.95 #SUP  1.00
 31 HIS  HA     33 ARG  HG3     4.92 #SUP  0.63  #QF  0.63
 33 ARG  HA     36 ARG  QG      4.27 #SUP  0.99  #QF  0.95
 39 LYS  HA     40 PRO  HD2     3.40 #SUP  0.97  #QF  0.97
 39 LYS  HA     40 PRO  HD3     3.40 #SUP  0.97  #QF  0.97
 36 ARG  HA     36 ARG  QG      3.73 #SUP  1.00
 22 PHE  QD     28 LEU  QD2     4.56 #SUP  0.99  #QF  0.98
 13 TYR  QD     28 LEU  QD2     3.88 #SUP  0.96  #QF  0.96
 22 PHE  QE     28 LEU  QD2     4.62 #SUP  0.80  #QF  0.80
 13 TYR  HA     28 LEU  QD2     4.03 #SUP  0.91  #QF  0.91
 25 LYS  HA     28 LEU  QD2     3.76 #SUP  0.89  #QF  0.89
 25 LYS  QE     28 LEU  QD2     4.14 #SUP  0.50  #QF  0.50
 28 LEU  HB2    28 LEU  QD2     3.61 #SUP  0.99  #QF  0.99
 34 ILE  HN     34 ILE  HG12    4.22 #SUP  1.00
 20 LYS  HG2    21 ALA  HN      4.98 #SUP  0.91  #QF  0.63
 42 GLY  QA     43 PRO  QD      3.25 #SUP  0.73  #QF  0.73
 24 GLN  HN     27 THR  QG2     4.51 #SUP  0.96  #QF  0.96
 22 PHE  QD     27 THR  QG2     3.42 #SUP  0.97  #QF  0.97
 22 PHE  QE     27 THR  QG2     3.79 #SUP  0.91  #QF  0.91
 27 THR  HA     27 THR  QG2     3.26 #SUP  0.98  #QF  0.98
 22 PHE  HB3    27 THR  QG2     4.20 #SUP  0.99  #QF  0.99
 27 THR  QG2    28 LEU  HA      4.52 #SUP  0.99  #QF  0.96
 27 THR  QG2    31 HIS  HB3     5.12 #SUP  0.99  #QF  0.96
 27 THR  QG2    31 HIS  HB2     5.12 #SUP  0.92  #QF  0.92
 22 PHE  HB2    27 THR  QG2     4.20 #SUP  1.00
 27 THR  QG2    30 MET  QG      4.13 #SUP  0.58  #QF  0.58
 12 HIS  QB     13 TYR  HN      3.59 
 12 HIS  QB     21 ALA  QB      3.82 
 12 HIS  QB     22 PHE  HN      4.48 
 13 TYR  HN     13 TYR  QB      3.38 
 13 TYR  QB     14 GLU  HN      3.86 
 13 TYR  QB     22 PHE  QD      4.78 
 13 TYR  QB     28 LEU  HB2     4.65 
 13 TYR  QB     28 LEU  HB3     4.60 
 13 TYR  QB     28 LEU  QD2     3.21 
 13 TYR  QD     25 LYS  QB      4.80 
 13 TYR  QD     25 LYS  QG      4.15 
 13 TYR  QD     25 LYS  QD      4.24 
 13 TYR  QE     25 LYS  QB      4.27 
 13 TYR  QE     25 LYS  QG      4.22 
 13 TYR  QE     25 LYS  QD      4.45 
 14 GLU  QB     19 GLY  QA      4.36 
 14 GLU  QG     19 GLY  QA      5.03 
 15 CYSS HA     32 GLN  QE2     4.75 
 15 CYSS HB2    20 LYS  QB      4.10 
 15 CYSS HB3    19 GLY  QA      4.64 
 15 CYSS HB3    20 LYS  QB      4.07 
 17 GLU  HN     17 GLU  QB      3.16 
 17 GLU  HN     17 GLU  QG      3.57 
 17 GLU  QB     35 HIS  HD2     4.12 
 17 GLU  QG     18 CYSS HN      4.22 
 18 CYSS HN     18 CYSS QB      3.42 
 18 CYSS HN     19 GLY  QA      4.60 
 18 CYSS QB     19 GLY  HN      4.25 
 18 CYSS QB     35 HIS  HE1     3.17 
 19 GLY  HN     20 LYS  QB      4.43 
 20 LYS  HN     20 LYS  QB      3.01 
 20 LYS  HN     20 LYS  QG      4.17 
 20 LYS  HA     20 LYS  QG      3.24 
 20 LYS  QB     20 LYS  QD      3.32 
 20 LYS  QB     20 LYS  QE      4.73 
 20 LYS  QB     21 ALA  HN      3.79 
 20 LYS  QB     22 PHE  QD      5.34 
 20 LYS  QB     22 PHE  HZ      3.84 
 20 LYS  QB     31 HIS  HE1     4.29 
 20 LYS  QD     22 PHE  QE      4.73 
 20 LYS  QD     22 PHE  HZ      4.13 
 20 LYS  QE     21 ALA  HN      4.85 
 22 PHE  HN     22 PHE  QB      3.38 
 22 PHE  QB     23 ILE  QG2     4.48 
 22 PHE  QB     24 GLN  HN      3.49 
 22 PHE  QB     27 THR  HB      3.75 
 22 PHE  QB     28 LEU  HA      4.71 
 22 PHE  QB     28 LEU  HB2     4.19 
 22 PHE  QB     28 LEU  HB3     4.59 
 22 PHE  QB     28 LEU  QD1     5.04 
 22 PHE  QB     28 LEU  QD2     4.62 
 22 PHE  QD     31 HIS  QB      5.15 
 22 PHE  QE     31 HIS  QB      4.07 
 22 PHE  HZ     31 HIS  QB      3.96 
 23 ILE  QG1    24 GLN  HN      4.19 
 23 ILE  QG1    24 GLN  QG      4.03 
 24 GLN  HN     24 GLN  QB      3.47 
 24 GLN  QB     27 THR  HN      3.64 
 24 GLN  QB     27 THR  HB      4.00 
 25 LYS  HA     25 LYS  QG      3.64 
 25 LYS  HA     25 LYS  QD      3.83 
 25 LYS  QG     25 LYS  QE      3.56 
 27 THR  HA     30 MET  QB      4.02 
 27 THR  QG2    31 HIS  QB      4.29 
 28 LEU  HA     31 HIS  QB      3.79 
 28 LEU  HG     29 SER  QB      4.74 
 28 LEU  HG     32 GLN  QE2     5.34 
 28 LEU  QD1    29 SER  QB      5.34 
 28 LEU  QD1    31 HIS  QB      4.10 
 28 LEU  QD1    32 GLN  QE2     3.79 
 28 LEU  QD2    32 GLN  QE2     4.34 
 29 SER  HN     29 SER  QB      3.06 
 29 SER  HA     32 GLN  QB      3.88 
 29 SER  QB     30 MET  HN      3.26 
 29 SER  QB     30 MET  HA      4.65 
 29 SER  QB     30 MET  QG      4.41 
 29 SER  QB     31 HIS  HN      5.34 
 30 MET  HN     30 MET  QB      3.49 
 30 MET  HN     31 HIS  QB      4.64 
 30 MET  HA     33 ARG  QD      3.78 
 30 MET  QG     31 HIS  QB      5.34 
 31 HIS  HN     31 HIS  QB      3.06 
 31 HIS  HA     34 ILE  QG1     4.72 
 31 HIS  QB     32 GLN  HN      3.74 
 31 HIS  QB     34 ILE  QG2     4.84 
 31 HIS  HE1    34 ILE  QG1     4.65 
 32 GLN  HN     32 GLN  QB      3.21 
 32 GLN  HA     34 ILE  QG1     5.27 
 32 GLN  HA     35 HIS  QB      4.10 
 32 GLN  QB     32 GLN  QE2     4.69 
 32 GLN  QB     33 ARG  HN      3.85 
 32 GLN  QB     35 HIS  HD2     4.73 
 32 GLN  QG     32 GLN  QE2     3.31 
 32 GLN  QG     35 HIS  QB      5.26 
 33 ARG  HN     33 ARG  QD      4.38 
 33 ARG  HA     36 ARG  QB      4.31 
 33 ARG  HB2    33 ARG  QD      3.60 
 33 ARG  HB3    33 ARG  QD      3.07 
 33 ARG  QD     34 ILE  QG2     5.17 
 34 ILE  HN     34 ILE  QG1     3.55 
 34 ILE  HA     34 ILE  QG1     3.64 
 35 HIS  HN     35 HIS  QB      3.33 
 35 HIS  HN     36 ARG  QB      5.34 
 35 HIS  QB     35 HIS  HD2     3.45 
 35 HIS  QB     36 ARG  HN      4.14 
 35 HIS  QB     36 ARG  HA      4.92 
 36 ARG  HN     36 ARG  QB      3.59 
 36 ARG  QB     36 ARG  QD      3.01 
 38 GLU  HN     38 GLU  QB      3.64 
 38 GLU  QB     39 LYS  HN      4.21 
 39 LYS  HN     39 LYS  QB      3.67 
 39 LYS  HA     40 PRO  QD      2.98 
 39 LYS  QB     40 PRO  QD      3.85 
     14   GLU  PHI  -139.00     -79.00
     14   GLU  PSI   100.00     160.00
     15   CYSS  PHI  -110.00     -50.00
     15   CYSS  PSI   113.00     173.00
     21   ALA  PHI  -150.00     -90.00
     21   ALA  PSI   111.00     171.00
     22   PHE  PHI  -167.00    -107.00
     22   PHE  PSI   123.00     183.00
     25   LYS  PHI   -91.00     -31.00
     25   LYS  PSI   -70.00     -10.00
     26   SER  PHI   -95.00     -35.00
     26   SER  PSI   -66.00      -6.00
     27   THR  PHI   -96.00     -36.00
     27   THR  PSI   -77.00     -17.00
     28   LEU  PHI   -92.00     -32.00
     28   LEU  PSI   -74.00     -14.00
     29   SER  PHI   -90.00     -30.00
     29   SER  PSI   -71.00     -11.00
     30   MET  PHI   -99.00     -39.00
     30   MET  PSI   -66.00      -6.00
     31   HIS  PHI   -95.00     -35.00
     31   HIS  PSI   -74.00     -14.00
     32   GLN  PHI   -94.00     -34.00
     32   GLN  PSI   -71.00     -11.00
     33   ARG  PHI   -95.00     -35.00
     33   ARG  PSI   -73.00     -13.00
     34   ILE  PHI  -105.00     -45.00
     34   ILE  PSI   -58.00       2.00
     35   HIS  PHI  -118.00     -58.00
     35   HIS  PSI   -42.00      18.00

     15  CYSS CHI1  150.00     210.00
     18  CYSS CHI1   30.00      90.00
     31  HIS  CHI1  150.00     210.00
     35  HIS  CHI1  -90.00     -30.00


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1  -9.752 -32.413  -6.080
    2    HA2  GLY   1           1HA      GLY   1  -8.413 -32.094  -3.640
    3    HA3  GLY   1           2HA      GLY   1  -7.730 -30.946  -4.781
    4    H    SER   2           H        SER   2  -8.821 -29.822  -2.676
    5    HA   SER   2           HA       SER   2 -11.115 -28.443  -3.772
    6    HB2  SER   2           1HB      SER   2 -12.357 -30.132  -2.670
    7    HB3  SER   2           2HB      SER   2 -11.294 -30.107  -1.263
    8    HG   SER   2           HG       SER   2 -12.855 -28.866  -0.535
    9    H    SER   3           H        SER   3 -10.632 -26.374  -3.529
   10    HA   SER   3           HA       SER   3  -9.809 -25.347  -0.951
   11    HB2  SER   3           1HB      SER   3  -8.007 -25.236  -3.370
   12    HB3  SER   3           2HB      SER   3  -7.857 -24.101  -2.029
   13    HG   SER   3           HG       SER   3  -7.719 -26.929  -1.812
   14    H    GLY   4           H        GLY   4  -9.524 -22.884  -1.101
   15    HA2  GLY   4           1HA      GLY   4 -10.186 -21.085  -2.877
   16    HA3  GLY   4           2HA      GLY   4 -11.748 -21.876  -2.727
   17    H    SER   5           H        SER   5  -9.226 -20.288  -0.794
   18    HA   SER   5           HA       SER   5 -11.318 -19.438   1.094
   19    HB2  SER   5           1HB      SER   5  -9.258 -20.781   1.886
   20    HB3  SER   5           2HB      SER   5  -8.360 -19.284   1.634
   21    HG   SER   5           HG       SER   5 -10.163 -18.360   3.003
   22    H    SER   6           H        SER   6 -11.089 -18.102  -1.349
   23    HA   SER   6           HA       SER   6  -9.872 -15.538  -0.556
   24    HB2  SER   6           1HB      SER   6  -8.777 -16.300  -2.531
   25    HB3  SER   6           2HB      SER   6 -10.305 -16.755  -3.286
   26    HG   SER   6           HG       SER   6 -10.170 -14.837  -4.141
   27    H    GLY   7           H        GLY   7 -11.806 -15.021   0.634
   28    HA2  GLY   7           1HA      GLY   7 -13.475 -13.195  -0.272
   29    HA3  GLY   7           2HA      GLY   7 -14.236 -14.628  -0.947
   30    H    THR   8           H        THR   8 -12.661 -14.185   2.200
   31    HA   THR   8           HA       THR   8 -15.254 -14.776   3.474
   32    HB   THR   8           HB       THR   8 -13.951 -15.874   5.309
   33    HG1  THR   8           HG1      THR   8 -11.850 -15.722   5.232
   34   HG21  THR   8          3HG2      THR   8 -14.470 -17.778   4.276
   35   HG22  THR   8          1HG2      THR   8 -13.098 -17.596   3.184
   36   HG23  THR   8          2HG2      THR   8 -14.656 -16.880   2.770
   37    H    GLY   9           H        GLY   9 -15.762 -12.634   3.913
   38    HA2  GLY   9           1HA      GLY   9 -15.725 -11.248   5.958
   39    HA3  GLY   9           2HA      GLY   9 -13.971 -11.311   5.858
   40    H    GLU  10           H        GLU  10 -12.954  -9.695   4.855
   41    HA   GLU  10           HA       GLU  10 -13.939  -8.325   2.594
   42    HB2  GLU  10           1HB      GLU  10 -15.379  -7.478   4.614
   43    HB3  GLU  10           2HB      GLU  10 -13.946  -6.532   4.992
   44    HG2  GLU  10           1HG      GLU  10 -15.084  -5.037   3.712
   45    HG3  GLU  10           2HG      GLU  10 -14.131  -5.841   2.466
   46    H    ARG  11           H        ARG  11 -12.148  -7.777   1.561
   47    HA   ARG  11           HA       ARG  11  -9.586  -7.944   2.430
   48    HB2  ARG  11           1HB      ARG  11 -10.807  -6.133   0.360
   49    HB3  ARG  11           2HB      ARG  11  -9.073  -6.154   0.652
   50    HG2  ARG  11           1HG      ARG  11  -9.238  -7.646  -1.070
   51    HG3  ARG  11           2HG      ARG  11  -9.354  -8.734   0.315
   52    HD2  ARG  11           1HD      ARG  11 -11.849  -7.562  -0.819
   53    HD3  ARG  11           2HD      ARG  11 -11.062  -8.885  -1.678
   54    HE   ARG  11           HE       ARG  11 -11.385  -9.488   1.081
   55   HH11  ARG  11          1HH1      ARG  11 -13.101  -9.308  -1.943
   56   HH12  ARG  11          2HH1      ARG  11 -14.287 -10.487  -1.490
   57   HH21  ARG  11          1HH2      ARG  11 -12.940 -11.042   1.689
   58   HH22  ARG  11          2HH2      ARG  11 -14.195 -11.472   0.577
   59    H    HIS  12           H        HIS  12  -7.956  -6.353   2.980
   60    HA   HIS  12           HA       HIS  12  -8.938  -3.878   4.182
   61    HB2  HIS  12           1HB      HIS  12  -7.410  -4.437   6.201
   62    HB3  HIS  12           2HB      HIS  12  -9.008  -5.173   6.122
   63    HD1  HIS  12           HD1      HIS  12  -8.704  -7.405   7.163
   64    HD2  HIS  12           HD2      HIS  12  -5.678  -6.522   4.457
   65    HE1  HIS  12           HE1      HIS  12  -7.313  -9.494   7.006
   66    H    TYR  13           H        TYR  13  -7.204  -2.367   4.713
   67    HA   TYR  13           HA       TYR  13  -4.949  -2.690   2.864
   68    HB2  TYR  13           1HB      TYR  13  -5.863  -0.151   4.219
   69    HB3  TYR  13           2HB      TYR  13  -4.758  -0.298   2.858
   70    HD1  TYR  13           HD2      TYR  13  -8.291  -0.776   3.881
   71    HD2  TYR  13           HD1      TYR  13  -5.564  -0.328   0.645
   72    HE1  TYR  13           HE2      TYR  13 -10.183  -0.536   2.327
   73    HE2  TYR  13           HE1      TYR  13  -7.449  -0.085  -0.917
   74    HH   TYR  13           HH       TYR  13 -10.776  -0.538   0.134
   75    H    GLU  14           H        GLU  14  -3.284  -3.631   3.883
   76    HA   GLU  14           HA       GLU  14  -2.580  -2.700   6.580
   77    HB2  GLU  14           1HB      GLU  14  -1.079  -4.776   6.538
   78    HB3  GLU  14           2HB      GLU  14  -2.815  -5.034   6.643
   79    HG2  GLU  14           1HG      GLU  14  -2.922  -5.557   4.291
   80    HG3  GLU  14           2HG      GLU  14  -1.209  -5.187   4.103
   81    H    CYS  15           H        CYS  15  -0.545  -1.932   7.048
   82    HA   CYS  15           HA       CYS  15   0.814  -0.495   5.090
   83    HB2  CYS  15           1HB      CYS  15   0.909  -0.182   7.613
   84    HB3  CYS  15           2HB      CYS  15   2.078  -1.498   7.641
   85    H    SER  16           H        SER  16   2.916  -0.772   4.178
   86    HA   SER  16           HA       SER  16   3.605  -3.604   3.762
   87    HB2  SER  16           1HB      SER  16   2.865  -2.302   1.751
   88    HB3  SER  16           2HB      SER  16   4.273  -1.263   1.964
   89    HG   SER  16           HG       SER  16   4.708  -2.925   0.479
   90    H    GLU  17           H        GLU  17   4.632  -0.798   5.266
   91    HA   GLU  17           HA       GLU  17   7.476  -1.283   4.956
   92    HB2  GLU  17           1HB      GLU  17   5.951   0.729   6.617
   93    HB3  GLU  17           2HB      GLU  17   7.705   0.650   6.516
   94    HG2  GLU  17           1HG      GLU  17   6.028   0.959   4.057
   95    HG3  GLU  17           2HG      GLU  17   6.461   2.348   5.052
   96    H    CYS  18           H        CYS  18   5.212  -1.125   7.710
   97    HA   CYS  18           HA       CYS  18   7.091  -2.668   9.325
   98    HB2  CYS  18           1HB      CYS  18   5.512  -2.168  11.186
   99    HB3  CYS  18           2HB      CYS  18   6.140  -0.723  10.399
  100    H    GLY  19           H        GLY  19   3.733  -2.836   8.180
  101    HA2  GLY  19           1HA      GLY  19   3.027  -5.052   7.335
  102    HA3  GLY  19           2HA      GLY  19   3.800  -5.734   8.759
  103    H    LYS  20           H        LYS  20   2.200  -2.802   9.358
  104    HA   LYS  20           HA       LYS  20   0.320  -4.047  11.096
  105    HB2  LYS  20           1HB      LYS  20   1.421  -1.645  11.139
  106    HB3  LYS  20           2HB      LYS  20  -0.007  -1.213  10.207
  107    HG2  LYS  20           1HG      LYS  20  -1.456  -1.903  11.972
  108    HG3  LYS  20           2HG      LYS  20  -0.109  -2.598  12.876
  109    HD2  LYS  20           1HD      LYS  20   0.712  -0.530  13.497
  110    HD3  LYS  20           2HD      LYS  20  -0.054   0.297  12.139
  111    HE2  LYS  20           1HE      LYS  20  -2.207   0.128  13.163
  112    HE3  LYS  20           2HE      LYS  20  -1.584  -0.933  14.425
  113    HZ1  LYS  20           3HZ      LYS  20  -1.375   0.929  15.607
  114    HZ2  LYS  20           1HZ      LYS  20  -1.532   1.934  14.254
  115    HZ3  LYS  20           2HZ      LYS  20  -0.026   1.270  14.645
  116    H    ALA  21           H        ALA  21  -2.012  -3.801  10.992
  117    HA   ALA  21           HA       ALA  21  -3.014  -3.761   8.219
  118    HB1  ALA  21           3HB      ALA  21  -3.674  -5.856   8.560
  119    HB2  ALA  21           1HB      ALA  21  -3.258  -5.775  10.272
  120    HB3  ALA  21           2HB      ALA  21  -4.842  -5.226   9.722
  121    H    PHE  22           H        PHE  22  -4.910  -2.683   7.795
  122    HA   PHE  22           HA       PHE  22  -6.230  -1.325  10.038
  123    HB2  PHE  22           1HB      PHE  22  -5.494   0.026   7.435
  124    HB3  PHE  22           2HB      PHE  22  -6.304   0.769   8.810
  125    HD1  PHE  22           HD2      PHE  22  -3.125  -0.807   7.744
  126    HD2  PHE  22           HD1      PHE  22  -5.077   1.737  10.543
  127    HE1  PHE  22           HE2      PHE  22  -0.941  -0.162   8.676
  128    HE2  PHE  22           HE1      PHE  22  -2.896   2.387  11.479
  129    HZ   PHE  22           HZ       PHE  22  -0.825   1.436  10.546
  130    H    ILE  23           H        ILE  23  -8.384  -0.493   9.489
  131    HA   ILE  23           HA       ILE  23  -9.795  -2.402   7.825
  132    HB   ILE  23           HB       ILE  23 -10.727  -1.860  10.009
  133   HG12  ILE  23          1HG1      ILE  23 -13.036  -1.109   9.215
  134   HG13  ILE  23          2HG1      ILE  23 -12.325  -0.967   7.611
  135   HG21  ILE  23          1HG2      ILE  23 -11.036   0.945   8.946
  136   HG22  ILE  23          2HG2      ILE  23 -11.628   0.353  10.497
  137   HG23  ILE  23          3HG2      ILE  23  -9.894   0.431  10.188
  138   HD11  ILE  23          3HD1      ILE  23 -12.219  -3.506   9.204
  139   HD12  ILE  23          1HD1      ILE  23 -13.552  -3.109   8.121
  140   HD13  ILE  23          2HD1      ILE  23 -11.917  -3.279   7.482
  141    H    GLN  24           H        GLN  24  -9.237   1.091   7.935
  142    HA   GLN  24           HA       GLN  24 -10.468   1.319   5.273
  143    HB2  GLN  24           1HB      GLN  24 -10.013   3.374   7.435
  144    HB3  GLN  24           2HB      GLN  24 -10.517   3.792   5.803
  145    HG2  GLN  24           1HG      GLN  24 -12.609   2.876   6.066
  146    HG3  GLN  24           2HG      GLN  24 -12.089   1.794   7.357
  147   HE21  GLN  24          1HE2      GLN  24 -11.674   2.712   9.444
  148   HE22  GLN  24          2HE2      GLN  24 -12.500   4.147   9.937
  149    H    LYS  25           H        LYS  25  -9.413   2.544   3.653
  150    HA   LYS  25           HA       LYS  25  -6.601   2.155   3.556
  151    HB2  LYS  25           1HB      LYS  25  -7.761   2.037   1.495
  152    HB3  LYS  25           2HB      LYS  25  -8.555   3.583   1.763
  153    HG2  LYS  25           1HG      LYS  25  -6.929   4.026   0.153
  154    HG3  LYS  25           2HG      LYS  25  -6.223   4.608   1.663
  155    HD2  LYS  25           1HD      LYS  25  -4.661   2.935   1.736
  156    HD3  LYS  25           2HD      LYS  25  -5.680   1.798   0.850
  157    HE2  LYS  25           1HE      LYS  25  -4.074   2.288  -0.723
  158    HE3  LYS  25           2HE      LYS  25  -5.324   3.464  -1.127
  159    HZ1  LYS  25           3HZ      LYS  25  -2.734   3.896   0.201
  160    HZ2  LYS  25           1HZ      LYS  25  -4.009   4.971   0.485
  161    HZ3  LYS  25           2HZ      LYS  25  -3.429   4.743  -1.087
  162    H    SER  26           H        SER  26  -8.603   5.096   3.715
  163    HA   SER  26           HA       SER  26  -6.582   6.985   3.766
  164    HB2  SER  26           1HB      SER  26  -9.206   7.083   5.276
  165    HB3  SER  26           2HB      SER  26  -8.192   8.470   4.878
  166    HG   SER  26           HG       SER  26  -9.903   8.189   3.379
  167    H    THR  27           H        THR  27  -8.048   5.249   6.494
  168    HA   THR  27           HA       THR  27  -6.696   6.490   8.577
  169    HB   THR  27           HB       THR  27  -7.641   3.631   8.337
  170    HG1  THR  27           HG1      THR  27  -9.037   5.734   8.464
  171   HG21  THR  27          3HG2      THR  27  -6.689   3.148  10.290
  172   HG22  THR  27          1HG2      THR  27  -7.474   4.536  11.042
  173   HG23  THR  27          2HG2      THR  27  -5.896   4.723  10.276
  174    H    LEU  28           H        LEU  28  -5.682   3.808   6.513
  175    HA   LEU  28           HA       LEU  28  -3.343   3.119   7.906
  176    HB2  LEU  28           1HB      LEU  28  -3.872   1.523   6.375
  177    HB3  LEU  28           2HB      LEU  28  -4.404   2.697   5.173
  178    HG   LEU  28           HG       LEU  28  -1.961   3.227   4.793
  179   HD11  LEU  28          1HD1      LEU  28  -0.302   1.696   5.534
  180   HD12  LEU  28          2HD1      LEU  28  -1.514   0.618   6.226
  181   HD13  LEU  28          3HD1      LEU  28  -1.219   2.197   6.955
  182   HD21  LEU  28          3HD2      LEU  28  -3.424   1.740   3.366
  183   HD22  LEU  28          1HD2      LEU  28  -2.691   0.370   4.200
  184   HD23  LEU  28          2HD2      LEU  28  -1.686   1.461   3.245
  185    H    SER  29           H        SER  29  -3.873   5.371   5.214
  186    HA   SER  29           HA       SER  29  -1.262   6.115   4.704
  187    HB2  SER  29           1HB      SER  29  -3.690   7.925   4.662
  188    HB3  SER  29           2HB      SER  29  -2.171   8.205   3.809
  189    HG   SER  29           HG       SER  29  -3.968   7.209   2.586
  190    H    MET  30           H        MET  30  -3.497   7.443   7.119
  191    HA   MET  30           HA       MET  30  -1.929   9.509   8.094
  192    HB2  MET  30           1HB      MET  30  -3.671   7.760   9.827
  193    HB3  MET  30           2HB      MET  30  -3.281   9.458  10.061
  194    HG2  MET  30           1HG      MET  30  -4.462   9.791   7.784
  195    HG3  MET  30           2HG      MET  30  -5.157   8.204   8.108
  196    HE1  MET  30           3HE      MET  30  -7.022  11.961   9.243
  197    HE2  MET  30           1HE      MET  30  -5.286  12.027   8.938
  198    HE3  MET  30           2HE      MET  30  -6.362  11.286   7.753
  199    H    HIS  31           H        HIS  31  -1.621   6.083   8.554
  200    HA   HIS  31           HA       HIS  31   0.285   6.389  10.733
  201    HB2  HIS  31           1HB      HIS  31  -0.956   4.498  11.157
  202    HB3  HIS  31           2HB      HIS  31  -1.129   4.098   9.451
  203    HD1  HIS  31           HD1      HIS  31   0.978   3.456  12.417
  204    HD2  HIS  31           HD2      HIS  31   1.102   2.711   8.331
  205    HE1  HIS  31           HE1      HIS  31   2.775   1.725  12.103
  206    H    GLN  32           H        GLN  32   0.276   4.909   7.487
  207    HA   GLN  32           HA       GLN  32   2.846   4.170   7.171
  208    HB2  GLN  32           1HB      GLN  32   0.864   5.372   5.308
  209    HB3  GLN  32           2HB      GLN  32   2.527   5.253   4.749
  210    HG2  GLN  32           1HG      GLN  32   1.282   2.845   5.955
  211    HG3  GLN  32           2HG      GLN  32   0.775   3.330   4.338
  212   HE21  GLN  32          1HE2      GLN  32   1.712   1.865   3.067
  213   HE22  GLN  32          2HE2      GLN  32   3.406   1.529   3.017
  214    H    ARG  33           H        ARG  33   1.676   7.450   7.367
  215    HA   ARG  33           HA       ARG  33   3.754   8.906   6.310
  216    HB2  ARG  33           1HB      ARG  33   3.043  10.729   7.654
  217    HB3  ARG  33           2HB      ARG  33   1.602   9.782   7.309
  218    HG2  ARG  33           1HG      ARG  33   1.819   8.721   9.534
  219    HG3  ARG  33           2HG      ARG  33   3.180   9.793   9.871
  220    HD2  ARG  33           1HD      ARG  33   0.862  10.478  10.730
  221    HD3  ARG  33           2HD      ARG  33   1.830  11.694   9.898
  222    HE   ARG  33           HE       ARG  33  -0.021  10.229   8.225
  223   HH11  ARG  33          1HH1      ARG  33   0.529  13.050  10.189
  224   HH12  ARG  33          2HH1      ARG  33  -0.720  13.981   9.433
  225   HH21  ARG  33          1HH2      ARG  33  -1.669  11.445   7.221
  226   HH22  ARG  33          2HH2      ARG  33  -1.971  13.067   7.745
  227    H    ILE  34           H        ILE  34   3.515   7.542   9.578
  228    HA   ILE  34           HA       ILE  34   5.741   8.545  10.783
  229    HB   ILE  34           HB       ILE  34   5.785   6.672  12.212
  230   HG12  ILE  34          1HG1      ILE  34   4.356   5.103  10.055
  231   HG13  ILE  34          2HG1      ILE  34   6.065   4.960  10.451
  232   HG21  ILE  34          1HG2      ILE  34   3.012   6.156  11.734
  233   HG22  ILE  34          2HG2      ILE  34   3.762   7.115  13.008
  234   HG23  ILE  34          3HG2      ILE  34   3.350   7.866  11.467
  235   HD11  ILE  34          3HD1      ILE  34   5.669   3.764  12.330
  236   HD12  ILE  34          1HD1      ILE  34   4.128   4.559  12.648
  237   HD13  ILE  34          2HD1      ILE  34   4.236   3.306  11.411
  238    H    HIS  35           H        HIS  35   5.612   6.153   8.237
  239    HA   HIS  35           HA       HIS  35   8.398   5.448   8.456
  240    HB2  HIS  35           1HB      HIS  35   6.394   4.858   6.267
  241    HB3  HIS  35           2HB      HIS  35   7.996   4.139   6.407
  242    HD1  HIS  35           HD1      HIS  35   8.207   3.093   9.121
  243    HD2  HIS  35           HD2      HIS  35   4.579   3.054   7.097
  244    HE1  HIS  35           HE1      HIS  35   6.828   1.317  10.247
  245    H    ARG  36           H        ARG  36   6.456   7.700   6.632
  246    HA   ARG  36           HA       ARG  36   8.165   8.304   4.529
  247    HB2  ARG  36           1HB      ARG  36   6.419  10.261   6.033
  248    HB3  ARG  36           2HB      ARG  36   7.016  10.441   4.389
  249    HG2  ARG  36           1HG      ARG  36   5.255   8.153   5.204
  250    HG3  ARG  36           2HG      ARG  36   4.605   9.707   4.678
  251    HD2  ARG  36           1HD      ARG  36   6.526   8.037   3.064
  252    HD3  ARG  36           2HD      ARG  36   4.774   7.993   2.871
  253    HE   ARG  36           HE       ARG  36   5.387  10.624   2.600
  254   HH11  ARG  36          1HH1      ARG  36   6.517   7.704   1.078
  255   HH12  ARG  36          2HH1      ARG  36   6.877   8.475  -0.431
  256   HH21  ARG  36          1HH2      ARG  36   5.857  11.651   0.618
  257   HH22  ARG  36          2HH2      ARG  36   6.502  10.720  -0.691
  258    H    GLY  37           H        GLY  37  10.146   9.129   4.448
  259    HA2  GLY  37           1HA      GLY  37  11.187  11.348   5.553
  260    HA3  GLY  37           2HA      GLY  37  11.363  10.185   6.859
  261    H    GLU  38           H        GLU  38  13.594  10.167   6.839
  262    HA   GLU  38           HA       GLU  38  14.946   9.424   4.357
  263    HB2  GLU  38           1HB      GLU  38  16.997   9.996   5.465
  264    HB3  GLU  38           2HB      GLU  38  15.835  11.278   5.775
  265    HG2  GLU  38           1HG      GLU  38  16.667  11.032   7.864
  266    HG3  GLU  38           2HG      GLU  38  15.370   9.841   7.942
  267    H    LYS  39           H        LYS  39  16.402   7.645   4.258
  268    HA   LYS  39           HA       LYS  39  15.913   5.558   6.278
  269    HB2  LYS  39           1HB      LYS  39  15.846   5.363   3.280
  270    HB3  LYS  39           2HB      LYS  39  16.201   3.951   4.267
  271    HG2  LYS  39           1HG      LYS  39  13.753   5.595   4.774
  272    HG3  LYS  39           2HG      LYS  39  13.778   4.365   3.509
  273    HD2  LYS  39           1HD      LYS  39  14.264   2.644   5.095
  274    HD3  LYS  39           2HD      LYS  39  14.524   3.826   6.379
  275    HE2  LYS  39           1HE      LYS  39  11.892   3.787   4.989
  276    HE3  LYS  39           2HE      LYS  39  12.247   2.511   6.153
  277    HZ1  LYS  39           3HZ      LYS  39  11.133   4.716   6.918
  278    HZ2  LYS  39           1HZ      LYS  39  12.719   5.306   6.917
  279    HZ3  LYS  39           2HZ      LYS  39  12.310   3.982   7.886
  280    HA   PRO  40           HA       PRO  40  20.258   5.008   6.546
  281    HB2  PRO  40           1HB      PRO  40  20.456   2.330   6.946
  282    HB3  PRO  40           2HB      PRO  40  19.852   3.443   8.179
  283    HG2  PRO  40           1HG      PRO  40  18.321   1.687   6.299
  284    HG3  PRO  40           2HG      PRO  40  18.043   1.990   8.024
  285    HD2  PRO  40           1HD      PRO  40  16.605   3.209   6.081
  286    HD3  PRO  40           2HD      PRO  40  16.976   3.994   7.629
  287    H    SER  41           H        SER  41  22.125   4.142   5.498
  288    HA   SER  41           HA       SER  41  22.013   4.034   2.735
  289    HB2  SER  41           1HB      SER  41  24.071   4.472   4.063
  290    HB3  SER  41           2HB      SER  41  24.133   2.760   4.483
  291    HG   SER  41           HG       SER  41  25.071   3.953   2.304
  292    H    GLY  42           H        GLY  42  22.589   1.265   4.919
  293    HA2  GLY  42           1HA      GLY  42  20.968  -0.644   4.350
  294    HA3  GLY  42           2HA      GLY  42  21.681  -0.510   2.749
  295    HA   PRO  43           HA       PRO  43  25.121  -3.018   3.814
  296    HB2  PRO  43           1HB      PRO  43  27.350  -1.564   3.278
  297    HB3  PRO  43           2HB      PRO  43  26.296  -2.207   2.014
  298    HG2  PRO  43           1HG      PRO  43  26.408   0.554   3.164
  299    HG3  PRO  43           2HG      PRO  43  26.249   0.053   1.470
  300    HD2  PRO  43           1HD      PRO  43  24.135   0.866   2.954
  301    HD3  PRO  43           2HD      PRO  43  23.989  -0.353   1.672
  302    H    SER  44           H        SER  44  24.415  -0.413   5.699
  303    HA   SER  44           HA       SER  44  26.389   0.278   7.349
  304    HB2  SER  44           1HB      SER  44  23.758  -0.786   8.402
  305    HB3  SER  44           2HB      SER  44  24.814   0.388   9.188
  306    HG   SER  44           HG       SER  44  23.088   1.413   8.112
  307    H    SER  45           H        SER  45  28.076  -0.876   8.016
  308    HA   SER  45           HA       SER  45  27.655  -3.631   8.933
  309    HB2  SER  45           1HB      SER  45  30.192  -3.733   8.804
  310    HB3  SER  45           2HB      SER  45  29.355  -3.524   7.266
  311    HG   SER  45           HG       SER  45  30.296  -1.662   7.039
  312    H    GLY  46           H        GLY  46  26.986  -3.447  11.026
  313    HA2  GLY  46           1HA      GLY  46  27.832  -3.573  13.280
  314    HA3  GLY  46           2HA      GLY  46  28.945  -2.271  12.886
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1   0.814 -12.056 -15.406
    2    HA2  GLY   1           1HA      GLY   1   1.778 -12.804 -12.906
    3    HA3  GLY   1           2HA      GLY   1   0.103 -12.402 -13.251
    4    H    SER   2           H        SER   2  -1.342 -14.096 -13.874
    5    HA   SER   2           HA       SER   2  -2.306 -16.129 -13.519
    6    HB2  SER   2           1HB      SER   2  -0.813 -16.714 -15.403
    7    HB3  SER   2           2HB      SER   2   0.452 -17.145 -14.252
    8    HG   SER   2           HG       SER   2  -1.935 -18.468 -14.863
    9    H    SER   3           H        SER   3  -1.443 -14.884 -11.195
   10    HA   SER   3           HA       SER   3  -0.248 -17.023  -9.582
   11    HB2  SER   3           1HB      SER   3  -0.779 -14.134  -8.847
   12    HB3  SER   3           2HB      SER   3   0.095 -15.311  -7.867
   13    HG   SER   3           HG       SER   3   1.371 -15.431 -10.044
   14    H    GLY   4           H        GLY   4  -2.847 -14.601  -9.192
   15    HA2  GLY   4           1HA      GLY   4  -5.047 -14.950  -8.516
   16    HA3  GLY   4           2HA      GLY   4  -4.690 -16.660  -8.326
   17    H    SER   5           H        SER   5  -3.125 -13.829  -6.863
   18    HA   SER   5           HA       SER   5  -3.277 -15.082  -4.262
   19    HB2  SER   5           1HB      SER   5  -1.866 -13.295  -3.499
   20    HB3  SER   5           2HB      SER   5  -1.267 -13.796  -5.080
   21    HG   SER   5           HG       SER   5  -2.246 -11.393  -4.289
   22    H    SER   6           H        SER   6  -4.621 -12.223  -5.857
   23    HA   SER   6           HA       SER   6  -6.319 -11.731  -3.516
   24    HB2  SER   6           1HB      SER   6  -4.929  -9.872  -4.597
   25    HB3  SER   6           2HB      SER   6  -6.073  -9.947  -5.937
   26    HG   SER   6           HG       SER   6  -6.755  -9.480  -3.220
   27    H    GLY   7           H        GLY   7  -7.948 -13.221  -3.722
   28    HA2  GLY   7           1HA      GLY   7  -9.897 -12.662  -5.807
   29    HA3  GLY   7           2HA      GLY   7  -9.227 -14.287  -5.812
   30    H    THR   8           H        THR   8  -9.092 -14.992  -3.234
   31    HA   THR   8           HA       THR   8 -11.913 -15.109  -2.485
   32    HB   THR   8           HB       THR   8 -10.667 -17.232  -2.674
   33    HG1  THR   8           HG1      THR   8 -11.241 -16.868   0.069
   34   HG21  THR   8          3HG2      THR   8  -9.218 -17.249  -0.255
   35   HG22  THR   8          1HG2      THR   8  -8.731 -15.795  -1.125
   36   HG23  THR   8          2HG2      THR   8  -8.585 -17.375  -1.896
   37    H    GLY   9           H        GLY   9 -10.697 -12.642  -1.990
   38    HA2  GLY   9           1HA      GLY   9 -11.431 -11.506   0.138
   39    HA3  GLY   9           2HA      GLY   9 -10.392 -12.668   0.948
   40    H    GLU  10           H        GLU  10  -9.009 -11.186   1.860
   41    HA   GLU  10           HA       GLU  10  -7.113  -9.925   1.969
   42    HB2  GLU  10           1HB      GLU  10  -6.580 -11.473  -0.107
   43    HB3  GLU  10           2HB      GLU  10  -6.756  -9.967  -0.996
   44    HG2  GLU  10           1HG      GLU  10  -4.824 -10.515   1.245
   45    HG3  GLU  10           2HG      GLU  10  -4.439 -10.347  -0.467
   46    H    ARG  11           H        ARG  11  -9.611  -8.683   1.809
   47    HA   ARG  11           HA       ARG  11  -9.148  -6.334   0.111
   48    HB2  ARG  11           1HB      ARG  11 -11.507  -5.792   0.526
   49    HB3  ARG  11           2HB      ARG  11 -11.325  -7.403  -0.154
   50    HG2  ARG  11           1HG      ARG  11 -11.372  -8.154   2.342
   51    HG3  ARG  11           2HG      ARG  11 -12.142  -6.586   2.592
   52    HD2  ARG  11           1HD      ARG  11 -13.141  -8.350   0.409
   53    HD3  ARG  11           2HD      ARG  11 -13.565  -8.739   2.075
   54    HE   ARG  11           HE       ARG  11 -14.062  -5.999   1.439
   55   HH11  ARG  11          1HH1      ARG  11 -15.334  -9.228   1.166
   56   HH12  ARG  11          2HH1      ARG  11 -16.984  -8.709   1.057
   57   HH21  ARG  11          1HH2      ARG  11 -16.229  -5.303   1.297
   58   HH22  ARG  11          2HH2      ARG  11 -17.491  -6.476   1.131
   59    H    HIS  12           H        HIS  12  -7.521  -6.588   2.359
   60    HA   HIS  12           HA       HIS  12  -8.585  -4.472   4.115
   61    HB2  HIS  12           1HB      HIS  12  -8.060  -6.908   5.018
   62    HB3  HIS  12           2HB      HIS  12  -6.411  -6.290   5.058
   63    HD1  HIS  12           HD1      HIS  12  -9.841  -5.421   6.431
   64    HD2  HIS  12           HD2      HIS  12  -5.815  -4.831   7.274
   65    HE1  HIS  12           HE1      HIS  12  -9.783  -4.280   8.671
   66    H    TYR  13           H        TYR  13  -7.237  -2.777   4.664
   67    HA   TYR  13           HA       TYR  13  -5.031  -2.327   2.835
   68    HB2  TYR  13           1HB      TYR  13  -6.146  -0.485   4.958
   69    HB3  TYR  13           2HB      TYR  13  -5.067  -0.039   3.641
   70    HD1  TYR  13           HD1      TYR  13  -5.900   0.136   1.352
   71    HD2  TYR  13           HD2      TYR  13  -8.507  -0.843   4.570
   72    HE1  TYR  13           HE1      TYR  13  -7.840   0.636  -0.075
   73    HE2  TYR  13           HE2      TYR  13 -10.454  -0.347   3.151
   74    HH   TYR  13           HH       TYR  13 -10.966  -0.283   0.684
   75    H    GLU  14           H        GLU  14  -3.191  -3.319   3.411
   76    HA   GLU  14           HA       GLU  14  -2.328  -3.154   6.216
   77    HB2  GLU  14           1HB      GLU  14  -1.785  -5.091   4.006
   78    HB3  GLU  14           2HB      GLU  14  -0.582  -4.888   5.271
   79    HG2  GLU  14           1HG      GLU  14  -1.942  -6.718   5.890
   80    HG3  GLU  14           2HG      GLU  14  -2.380  -5.372   6.940
   81    H    CYS  15           H        CYS  15  -0.073  -2.707   6.654
   82    HA   CYS  15           HA       CYS  15   0.985  -0.706   4.801
   83    HB2  CYS  15           1HB      CYS  15   0.639  -0.137   7.216
   84    HB3  CYS  15           2HB      CYS  15   1.877  -1.320   7.624
   85    H    SER  16           H        SER  16   2.456  -1.345   3.383
   86    HA   SER  16           HA       SER  16   3.984  -3.762   3.798
   87    HB2  SER  16           1HB      SER  16   3.984  -1.768   1.520
   88    HB3  SER  16           2HB      SER  16   4.877  -3.288   1.526
   89    HG   SER  16           HG       SER  16   2.155  -3.409   2.094
   90    H    GLU  17           H        GLU  17   4.556  -1.767   5.701
   91    HA   GLU  17           HA       GLU  17   7.369  -1.207   5.039
   92    HB2  GLU  17           1HB      GLU  17   5.412   0.601   6.461
   93    HB3  GLU  17           2HB      GLU  17   7.152   0.855   6.476
   94    HG2  GLU  17           1HG      GLU  17   5.805   0.562   3.848
   95    HG3  GLU  17           2HG      GLU  17   5.579   2.064   4.742
   96    H    CYS  18           H        CYS  18   5.031  -1.439   7.716
   97    HA   CYS  18           HA       CYS  18   7.181  -2.570   9.382
   98    HB2  CYS  18           1HB      CYS  18   5.750  -1.883  11.322
   99    HB3  CYS  18           2HB      CYS  18   6.352  -0.538  10.359
  100    H    GLY  19           H        GLY  19   3.693  -2.812   8.708
  101    HA2  GLY  19           1HA      GLY  19   2.961  -5.137   8.136
  102    HA3  GLY  19           2HA      GLY  19   3.837  -5.634   9.576
  103    H    LYS  20           H        LYS  20   1.452  -3.097   8.799
  104    HA   LYS  20           HA       LYS  20  -0.156  -4.069  11.069
  105    HB2  LYS  20           1HB      LYS  20   1.127  -1.754  11.207
  106    HB3  LYS  20           2HB      LYS  20  -0.255  -1.192  10.275
  107    HG2  LYS  20           1HG      LYS  20  -1.765  -1.719  11.992
  108    HG3  LYS  20           2HG      LYS  20  -0.579  -2.713  12.842
  109    HD2  LYS  20           1HD      LYS  20   0.680  -0.799  13.488
  110    HD3  LYS  20           2HD      LYS  20  -0.248   0.251  12.415
  111    HE2  LYS  20           1HE      LYS  20  -2.258  -0.187  13.772
  112    HE3  LYS  20           2HE      LYS  20  -1.288  -1.177  14.862
  113    HZ1  LYS  20           3HZ      LYS  20  -1.409   0.913  15.868
  114    HZ2  LYS  20           1HZ      LYS  20  -1.136   1.743  14.419
  115    HZ3  LYS  20           2HZ      LYS  20   0.125   0.889  15.154
  116    H    ALA  21           H        ALA  21  -2.261  -4.436  10.681
  117    HA   ALA  21           HA       ALA  21  -3.246  -3.893   7.973
  118    HB1  ALA  21           3HB      ALA  21  -3.819  -6.045   8.159
  119    HB2  ALA  21           1HB      ALA  21  -3.641  -6.033   9.914
  120    HB3  ALA  21           2HB      ALA  21  -5.141  -5.470   9.175
  121    H    PHE  22           H        PHE  22  -4.994  -2.639   7.568
  122    HA   PHE  22           HA       PHE  22  -6.458  -1.534   9.866
  123    HB2  PHE  22           1HB      PHE  22  -5.639   0.096   7.458
  124    HB3  PHE  22           2HB      PHE  22  -6.391   0.678   8.940
  125    HD1  PHE  22           HD1      PHE  22  -5.097   0.825  11.014
  126    HD2  PHE  22           HD2      PHE  22  -3.293  -0.322   7.333
  127    HE1  PHE  22           HE1      PHE  22  -2.873   1.263  11.971
  128    HE2  PHE  22           HE2      PHE  22  -1.067   0.114   8.285
  129    HZ   PHE  22           HZ       PHE  22  -0.854   0.906  10.607
  130    H    ILE  23           H        ILE  23  -8.619  -0.962   9.485
  131    HA   ILE  23           HA       ILE  23  -9.894  -2.506   7.417
  132    HB   ILE  23           HB       ILE  23 -10.884  -2.365   9.658
  133   HG12  ILE  23          1HG1      ILE  23 -12.777  -0.969   7.786
  134   HG13  ILE  23          2HG1      ILE  23 -12.230  -2.608   7.453
  135   HG21  ILE  23          1HG2      ILE  23 -11.557   0.501   9.038
  136   HG22  ILE  23          2HG2      ILE  23 -11.811  -0.373  10.547
  137   HG23  ILE  23          3HG2      ILE  23 -10.175   0.025  10.024
  138   HD11  ILE  23          3HD1      ILE  23 -14.322  -1.748   9.150
  139   HD12  ILE  23          1HD1      ILE  23 -13.791  -3.392   8.800
  140   HD13  ILE  23          2HD1      ILE  23 -13.084  -2.506  10.151
  141    H    GLN  24           H        GLN  24  -9.475   0.927   8.164
  142    HA   GLN  24           HA       GLN  24 -10.783   1.638   5.642
  143    HB2  GLN  24           1HB      GLN  24  -9.972   3.271   8.044
  144    HB3  GLN  24           2HB      GLN  24 -10.547   3.996   6.549
  145    HG2  GLN  24           1HG      GLN  24 -12.550   2.309   6.940
  146    HG3  GLN  24           2HG      GLN  24 -12.025   2.473   8.614
  147   HE21  GLN  24          1HE2      GLN  24 -11.670   4.791   9.310
  148   HE22  GLN  24          2HE2      GLN  24 -12.861   5.937   8.809
  149    H    LYS  25           H        LYS  25  -9.756   2.794   4.030
  150    HA   LYS  25           HA       LYS  25  -7.012   2.300   3.647
  151    HB2  LYS  25           1HB      LYS  25  -8.908   2.798   1.927
  152    HB3  LYS  25           2HB      LYS  25  -8.467   4.480   2.188
  153    HG2  LYS  25           1HG      LYS  25  -6.507   2.357   1.354
  154    HG3  LYS  25           2HG      LYS  25  -7.382   3.389   0.220
  155    HD2  LYS  25           1HD      LYS  25  -6.427   5.362   1.489
  156    HD3  LYS  25           2HD      LYS  25  -5.371   4.208   2.306
  157    HE2  LYS  25           1HE      LYS  25  -4.040   4.900   0.556
  158    HE3  LYS  25           2HE      LYS  25  -4.785   3.451  -0.116
  159    HZ1  LYS  25           3HZ      LYS  25  -5.586   6.263  -0.626
  160    HZ2  LYS  25           1HZ      LYS  25  -6.460   4.917  -1.162
  161    HZ3  LYS  25           2HZ      LYS  25  -4.890   5.186  -1.730
  162    H    SER  26           H        SER  26  -8.754   5.291   4.462
  163    HA   SER  26           HA       SER  26  -6.624   7.052   4.507
  164    HB2  SER  26           1HB      SER  26  -9.137   7.509   4.862
  165    HB3  SER  26           2HB      SER  26  -8.821   7.173   6.565
  166    HG   SER  26           HG       SER  26  -7.178   8.832   6.431
  167    H    THR  27           H        THR  27  -7.877   5.093   7.201
  168    HA   THR  27           HA       THR  27  -6.251   5.869   9.244
  169    HB   THR  27           HB       THR  27  -6.968   2.995   8.634
  170    HG1  THR  27           HG1      THR  27  -8.704   3.651  10.235
  171   HG21  THR  27          3HG2      THR  27  -5.236   3.696  10.495
  172   HG22  THR  27          1HG2      THR  27  -6.455   2.461  10.810
  173   HG23  THR  27          2HG2      THR  27  -6.700   4.110  11.386
  174    H    LEU  28           H        LEU  28  -5.381   3.919   6.473
  175    HA   LEU  28           HA       LEU  28  -2.814   3.156   7.530
  176    HB2  LEU  28           1HB      LEU  28  -3.589   1.588   6.041
  177    HB3  LEU  28           2HB      LEU  28  -4.264   2.799   4.953
  178    HG   LEU  28           HG       LEU  28  -1.971   3.354   4.209
  179   HD11  LEU  28          1HD1      LEU  28  -0.885   2.556   6.332
  180   HD12  LEU  28          2HD1      LEU  28  -0.096   2.050   4.839
  181   HD13  LEU  28          3HD1      LEU  28  -1.101   0.911   5.734
  182   HD21  LEU  28          3HD2      LEU  28  -3.210   0.681   3.868
  183   HD22  LEU  28          1HD2      LEU  28  -1.581   0.916   3.234
  184   HD23  LEU  28          2HD2      LEU  28  -2.900   1.949   2.681
  185    H    SER  29           H        SER  29  -3.847   5.233   4.818
  186    HA   SER  29           HA       SER  29  -1.424   6.264   4.069
  187    HB2  SER  29           1HB      SER  29  -4.141   7.579   4.161
  188    HB3  SER  29           2HB      SER  29  -2.735   8.357   3.434
  189    HG   SER  29           HG       SER  29  -3.017   7.160   1.742
  190    H    MET  30           H        MET  30  -3.461   7.286   6.765
  191    HA   MET  30           HA       MET  30  -1.863   9.528   7.484
  192    HB2  MET  30           1HB      MET  30  -3.225   9.679   9.437
  193    HB3  MET  30           2HB      MET  30  -4.274   9.188   8.113
  194    HG2  MET  30           1HG      MET  30  -4.352   6.950   8.890
  195    HG3  MET  30           2HG      MET  30  -3.063   7.244  10.056
  196    HE1  MET  30           3HE      MET  30  -7.158   9.287  10.316
  197    HE2  MET  30           1HE      MET  30  -6.151   9.084   8.882
  198    HE3  MET  30           2HE      MET  30  -7.095   7.726   9.495
  199    H    HIS  31           H        HIS  31  -1.662   6.135   8.085
  200    HA   HIS  31           HA       HIS  31   0.105   6.400  10.360
  201    HB2  HIS  31           1HB      HIS  31  -1.109   4.454  10.579
  202    HB3  HIS  31           2HB      HIS  31  -1.107   4.131   8.848
  203    HD1  HIS  31           HD1      HIS  31   0.895   3.595  11.952
  204    HD2  HIS  31           HD2      HIS  31   1.111   2.697   7.902
  205    HE1  HIS  31           HE1      HIS  31   2.737   1.896  11.738
  206    H    GLN  32           H        GLN  32   0.389   5.250   7.003
  207    HA   GLN  32           HA       GLN  32   2.966   4.505   6.812
  208    HB2  GLN  32           1HB      GLN  32   1.295   6.144   4.930
  209    HB3  GLN  32           2HB      GLN  32   2.951   5.716   4.518
  210    HG2  GLN  32           1HG      GLN  32   2.163   3.297   5.095
  211    HG3  GLN  32           2HG      GLN  32   0.558   3.968   4.808
  212   HE21  GLN  32          1HE2      GLN  32   3.364   2.708   3.407
  213   HE22  GLN  32          2HE2      GLN  32   2.966   3.003   1.752
  214    H    ARG  33           H        ARG  33   1.837   7.713   7.475
  215    HA   ARG  33           HA       ARG  33   3.955   9.307   6.751
  216    HB2  ARG  33           1HB      ARG  33   3.206  10.880   8.352
  217    HB3  ARG  33           2HB      ARG  33   1.770  10.001   7.842
  218    HG2  ARG  33           1HG      ARG  33   1.894   8.628   9.862
  219    HG3  ARG  33           2HG      ARG  33   3.328   9.522  10.374
  220    HD2  ARG  33           1HD      ARG  33   0.698  10.861   9.795
  221    HD3  ARG  33           2HD      ARG  33   1.113  10.235  11.390
  222    HE   ARG  33           HE       ARG  33   3.218  11.807  10.828
  223   HH11  ARG  33          1HH1      ARG  33  -0.218  12.343  10.658
  224   HH12  ARG  33          2HH1      ARG  33  -0.102  14.039  10.990
  225   HH21  ARG  33          1HH2      ARG  33   3.384  14.039  11.266
  226   HH22  ARG  33          2HH2      ARG  33   1.948  15.003  11.335
  227    H    ILE  34           H        ILE  34   3.608   7.400   9.725
  228    HA   ILE  34           HA       ILE  34   5.834   8.160  11.121
  229    HB   ILE  34           HB       ILE  34   5.856   5.995  12.174
  230   HG12  ILE  34          1HG1      ILE  34   3.867   4.925  10.200
  231   HG13  ILE  34          2HG1      ILE  34   5.588   4.836   9.842
  232   HG21  ILE  34          1HG2      ILE  34   4.020   6.663  13.223
  233   HG22  ILE  34          2HG2      ILE  34   3.492   7.552  11.796
  234   HG23  ILE  34          3HG2      ILE  34   3.049   5.857  11.992
  235   HD11  ILE  34          3HD1      ILE  34   6.003   3.389  11.611
  236   HD12  ILE  34          1HD1      ILE  34   4.489   3.792  12.420
  237   HD13  ILE  34          2HD1      ILE  34   4.471   2.822  10.947
  238    H    HIS  35           H        HIS  35   5.715   6.457   8.129
  239    HA   HIS  35           HA       HIS  35   8.504   5.613   8.330
  240    HB2  HIS  35           1HB      HIS  35   6.453   5.162   6.153
  241    HB3  HIS  35           2HB      HIS  35   8.088   4.508   6.152
  242    HD1  HIS  35           HD1      HIS  35   8.608   2.642   7.931
  243    HD2  HIS  35           HD2      HIS  35   4.618   3.770   7.678
  244    HE1  HIS  35           HE1      HIS  35   7.324   0.844   9.132
  245    H    ARG  36           H        ARG  36   6.445   7.847   6.553
  246    HA   ARG  36           HA       ARG  36   8.289   8.704   4.633
  247    HB2  ARG  36           1HB      ARG  36   5.885   9.968   5.908
  248    HB3  ARG  36           2HB      ARG  36   6.888  10.898   4.802
  249    HG2  ARG  36           1HG      ARG  36   6.510   9.219   3.058
  250    HG3  ARG  36           2HG      ARG  36   5.483   8.311   4.170
  251    HD2  ARG  36           1HD      ARG  36   4.008   9.568   2.831
  252    HD3  ARG  36           2HD      ARG  36   4.087  10.418   4.374
  253    HE   ARG  36           HE       ARG  36   5.089  12.194   3.315
  254   HH11  ARG  36          1HH1      ARG  36   5.055   9.435   1.192
  255   HH12  ARG  36          2HH1      ARG  36   5.570  10.334  -0.197
  256   HH21  ARG  36          1HH2      ARG  36   5.768  13.388   1.494
  257   HH22  ARG  36          2HH2      ARG  36   5.977  12.582  -0.023
  258    H    GLY  37           H        GLY  37  10.333   9.006   5.490
  259    HA2  GLY  37           1HA      GLY  37  10.676  11.522   6.946
  260    HA3  GLY  37           2HA      GLY  37  11.340  10.069   7.677
  261    H    GLU  38           H        GLU  38  11.273  11.408   4.370
  262    HA   GLU  38           HA       GLU  38  14.183  10.962   4.256
  263    HB2  GLU  38           1HB      GLU  38  13.967  10.674   1.865
  264    HB3  GLU  38           2HB      GLU  38  12.856   9.585   2.683
  265    HG2  GLU  38           1HG      GLU  38  11.057  11.294   2.287
  266    HG3  GLU  38           2HG      GLU  38  12.204  12.143   1.252
  267    H    LYS  39           H        LYS  39  15.486  12.647   3.885
  268    HA   LYS  39           HA       LYS  39  14.902  15.235   4.279
  269    HB2  LYS  39           1HB      LYS  39  16.889  15.845   3.001
  270    HB3  LYS  39           2HB      LYS  39  17.186  14.393   3.949
  271    HG2  LYS  39           1HG      LYS  39  18.108  13.743   1.982
  272    HG3  LYS  39           2HG      LYS  39  16.449  13.214   1.698
  273    HD2  LYS  39           1HD      LYS  39  17.068  14.360  -0.259
  274    HD3  LYS  39           2HD      LYS  39  16.072  15.503   0.644
  275    HE2  LYS  39           1HE      LYS  39  17.826  16.857   0.073
  276    HE3  LYS  39           2HE      LYS  39  18.398  16.245   1.624
  277    HZ1  LYS  39           3HZ      LYS  39  20.079  16.174  -0.172
  278    HZ2  LYS  39           1HZ      LYS  39  19.118  15.050  -0.995
  279    HZ3  LYS  39           2HZ      LYS  39  19.770  14.661   0.516
  280    HA   PRO  40           HA       PRO  40  12.372  16.769   1.029
  281    HB2  PRO  40           1HB      PRO  40  13.092  19.386   1.056
  282    HB3  PRO  40           2HB      PRO  40  12.095  18.651   2.317
  283    HG2  PRO  40           1HG      PRO  40  15.030  19.238   2.325
  284    HG3  PRO  40           2HG      PRO  40  13.836  19.485   3.613
  285    HD2  PRO  40           1HD      PRO  40  15.524  17.368   3.579
  286    HD3  PRO  40           2HD      PRO  40  13.886  17.273   4.258
  287    H    SER  41           H        SER  41  13.096  15.852  -0.868
  288    HA   SER  41           HA       SER  41  15.397  15.960  -2.211
  289    HB2  SER  41           1HB      SER  41  13.104  15.019  -2.965
  290    HB3  SER  41           2HB      SER  41  12.882  16.587  -3.741
  291    HG   SER  41           HG       SER  41  14.293  16.057  -5.216
  292    H    GLY  42           H        GLY  42  16.757  17.441  -2.973
  293    HA2  GLY  42           1HA      GLY  42  16.051  20.237  -2.836
  294    HA3  GLY  42           2HA      GLY  42  17.621  19.575  -3.265
  295    HA   PRO  43           HA       PRO  43  15.584  21.338  -7.071
  296    HB2  PRO  43           1HB      PRO  43  17.690  22.891  -7.792
  297    HB3  PRO  43           2HB      PRO  43  16.423  23.443  -6.691
  298    HG2  PRO  43           1HG      PRO  43  19.151  22.384  -6.060
  299    HG3  PRO  43           2HG      PRO  43  18.294  23.764  -5.349
  300    HD2  PRO  43           1HD      PRO  43  18.437  21.351  -4.128
  301    HD3  PRO  43           2HD      PRO  43  17.034  22.426  -3.958
  302    H    SER  44           H        SER  44  15.647  19.669  -8.465
  303    HA   SER  44           HA       SER  44  18.283  18.710  -9.366
  304    HB2  SER  44           1HB      SER  44  16.887  16.985  -8.281
  305    HB3  SER  44           2HB      SER  44  15.618  17.275  -9.470
  306    HG   SER  44           HG       SER  44  17.537  16.820 -10.997
  307    H    SER  45           H        SER  45  14.958  18.872 -10.654
  308    HA   SER  45           HA       SER  45  15.862  19.068 -13.352
  309    HB2  SER  45           1HB      SER  45  13.628  18.124 -12.535
  310    HB3  SER  45           2HB      SER  45  13.102  19.799 -12.373
  311    HG   SER  45           HG       SER  45  13.700  18.328 -14.681
  312    H    GLY  46           H        GLY  46  16.723  20.812 -14.251
  313    HA2  GLY  46           1HA      GLY  46  15.475  23.344 -14.237
  314    HA3  GLY  46           2HA      GLY  46  16.807  23.353 -13.090
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1  -7.258 -22.691  23.658
    2    HA2  GLY   1           1HA      GLY   1  -8.500 -21.166  25.257
    3    HA3  GLY   1           2HA      GLY   1  -6.898 -20.615  25.727
    4    H    SER   2           H        SER   2  -8.961 -18.946  24.736
    5    HA   SER   2           HA       SER   2  -7.823 -18.139  22.139
    6    HB2  SER   2           1HB      SER   2 -10.646 -17.971  23.181
    7    HB3  SER   2           2HB      SER   2 -10.094 -16.967  21.841
    8    HG   SER   2           HG       SER   2 -10.772 -19.593  21.864
    9    H    SER   3           H        SER   3  -8.124 -15.743  21.707
   10    HA   SER   3           HA       SER   3  -7.542 -14.237  24.173
   11    HB2  SER   3           1HB      SER   3  -5.605 -14.493  22.617
   12    HB3  SER   3           2HB      SER   3  -6.529 -13.636  21.383
   13    HG   SER   3           HG       SER   3  -5.774 -11.897  22.269
   14    H    GLY   4           H        GLY   4  -8.761 -13.805  20.846
   15    HA2  GLY   4           1HA      GLY   4 -10.731 -12.741  20.193
   16    HA3  GLY   4           2HA      GLY   4 -10.987 -12.244  21.859
   17    H    SER   5           H        SER   5  -8.781 -10.828  22.479
   18    HA   SER   5           HA       SER   5  -9.262  -8.317  21.421
   19    HB2  SER   5           1HB      SER   5  -7.050  -7.681  22.400
   20    HB3  SER   5           2HB      SER   5  -8.079  -8.578  23.517
   21    HG   SER   5           HG       SER   5  -5.678  -9.173  23.060
   22    H    SER   6           H        SER   6  -7.854  -6.935  20.121
   23    HA   SER   6           HA       SER   6  -7.032  -6.489  18.030
   24    HB2  SER   6           1HB      SER   6  -4.996  -7.000  19.423
   25    HB3  SER   6           2HB      SER   6  -5.032  -8.636  18.767
   26    HG   SER   6           HG       SER   6  -4.242  -6.276  17.588
   27    H    GLY   7           H        GLY   7  -9.176  -8.104  17.736
   28    HA2  GLY   7           1HA      GLY   7  -8.455 -10.403  16.109
   29    HA3  GLY   7           2HA      GLY   7 -10.082  -9.895  16.537
   30    H    THR   8           H        THR   8  -8.884 -10.665  13.933
   31    HA   THR   8           HA       THR   8 -10.168  -8.699  12.335
   32    HB   THR   8           HB       THR   8  -8.023  -7.510  12.826
   33    HG1  THR   8           HG1      THR   8  -7.968  -8.137  10.090
   34   HG21  THR   8          3HG2      THR   8  -6.895  -9.929  11.446
   35   HG22  THR   8          1HG2      THR   8  -6.402  -9.202  12.975
   36   HG23  THR   8          2HG2      THR   8  -6.041  -8.386  11.454
   37    H    GLY   9           H        GLY   9  -9.599  -9.122   9.905
   38    HA2  GLY   9           1HA      GLY   9  -9.690 -12.036   9.569
   39    HA3  GLY   9           2HA      GLY   9 -10.265 -10.848   8.410
   40    H    GLU  10           H        GLU  10  -9.125 -11.133   6.606
   41    HA   GLU  10           HA       GLU  10  -6.191 -11.137   6.833
   42    HB2  GLU  10           1HB      GLU  10  -7.777 -12.763   4.839
   43    HB3  GLU  10           2HB      GLU  10  -6.028 -12.734   5.012
   44    HG2  GLU  10           1HG      GLU  10  -7.951 -13.708   7.113
   45    HG3  GLU  10           2HG      GLU  10  -7.070 -14.739   5.987
   46    H    ARG  11           H        ARG  11  -8.843 -10.807   4.470
   47    HA   ARG  11           HA       ARG  11  -7.322  -9.158   2.715
   48    HB2  ARG  11           1HB      ARG  11  -9.280 -10.596   2.051
   49    HB3  ARG  11           2HB      ARG  11 -10.327  -9.419   2.831
   50    HG2  ARG  11           1HG      ARG  11  -9.959  -7.819   1.223
   51    HG3  ARG  11           2HG      ARG  11  -8.404  -8.504   0.748
   52    HD2  ARG  11           1HD      ARG  11 -10.879 -10.109   0.327
   53    HD3  ARG  11           2HD      ARG  11 -10.532  -8.776  -0.773
   54    HE   ARG  11           HE       ARG  11  -8.206 -10.205  -0.662
   55   HH11  ARG  11          1HH1      ARG  11 -11.518 -10.930  -1.454
   56   HH12  ARG  11          2HH1      ARG  11 -11.111 -12.185  -2.576
   57   HH21  ARG  11          1HH2      ARG  11  -7.658 -11.856  -2.138
   58   HH22  ARG  11          2HH2      ARG  11  -8.915 -12.712  -2.964
   59    H    HIS  12           H        HIS  12  -6.593  -7.270   3.519
   60    HA   HIS  12           HA       HIS  12  -8.422  -5.134   3.928
   61    HB2  HIS  12           1HB      HIS  12  -7.842  -4.614   6.267
   62    HB3  HIS  12           2HB      HIS  12  -8.671  -6.162   6.129
   63    HD1  HIS  12           HD1      HIS  12  -7.457  -8.207   6.966
   64    HD2  HIS  12           HD2      HIS  12  -5.033  -4.836   6.826
   65    HE1  HIS  12           HE1      HIS  12  -5.333  -8.857   8.144
   66    H    TYR  13           H        TYR  13  -7.288  -3.081   4.436
   67    HA   TYR  13           HA       TYR  13  -4.934  -2.848   2.870
   68    HB2  TYR  13           1HB      TYR  13  -6.364  -0.904   4.684
   69    HB3  TYR  13           2HB      TYR  13  -4.945  -0.468   3.738
   70    HD1  TYR  13           HD2      TYR  13  -8.424  -1.737   3.441
   71    HD2  TYR  13           HD1      TYR  13  -5.159   0.169   1.490
   72    HE1  TYR  13           HE2      TYR  13  -9.870  -1.248   1.513
   73    HE2  TYR  13           HE1      TYR  13  -6.596   0.664  -0.444
   74    HH   TYR  13           HH       TYR  13 -10.009   0.236  -0.354
   75    H    GLU  14           H        GLU  14  -3.110  -3.780   3.585
   76    HA   GLU  14           HA       GLU  14  -2.319  -3.353   6.383
   77    HB2  GLU  14           1HB      GLU  14  -1.718  -5.473   4.367
   78    HB3  GLU  14           2HB      GLU  14  -0.529  -5.141   5.619
   79    HG2  GLU  14           1HG      GLU  14  -2.433  -5.439   7.279
   80    HG3  GLU  14           2HG      GLU  14  -3.342  -6.126   5.934
   81    H    CYS  15           H        CYS  15  -0.154  -2.734   6.871
   82    HA   CYS  15           HA       CYS  15   0.916  -0.848   4.946
   83    HB2  CYS  15           1HB      CYS  15   0.639  -0.442   7.474
   84    HB3  CYS  15           2HB      CYS  15   2.077  -1.441   7.661
   85    H    SER  16           H        SER  16   2.407  -1.401   3.515
   86    HA   SER  16           HA       SER  16   3.910  -3.856   3.823
   87    HB2  SER  16           1HB      SER  16   2.866  -2.946   1.638
   88    HB3  SER  16           2HB      SER  16   4.268  -1.878   1.581
   89    HG   SER  16           HG       SER  16   4.301  -4.716   1.660
   90    H    GLU  17           H        GLU  17   4.377  -1.368   5.499
   91    HA   GLU  17           HA       GLU  17   7.233  -0.996   4.886
   92    HB2  GLU  17           1HB      GLU  17   5.436   0.790   6.534
   93    HB3  GLU  17           2HB      GLU  17   7.112   1.106   6.111
   94    HG2  GLU  17           1HG      GLU  17   5.136   0.676   3.930
   95    HG3  GLU  17           2HG      GLU  17   5.149   2.216   4.786
   96    H    CYS  18           H        CYS  18   4.903  -1.558   7.485
   97    HA   CYS  18           HA       CYS  18   7.123  -2.544   9.155
   98    HB2  CYS  18           1HB      CYS  18   5.735  -1.920  11.126
   99    HB3  CYS  18           2HB      CYS  18   6.221  -0.536  10.152
  100    H    GLY  19           H        GLY  19   3.693  -2.923   8.341
  101    HA2  GLY  19           1HA      GLY  19   3.053  -5.266   7.787
  102    HA3  GLY  19           2HA      GLY  19   3.892  -5.725   9.262
  103    H    LYS  20           H        LYS  20   1.912  -2.853   9.039
  104    HA   LYS  20           HA       LYS  20   0.232  -3.846  11.177
  105    HB2  LYS  20           1HB      LYS  20   0.362  -1.193   9.740
  106    HB3  LYS  20           2HB      LYS  20  -0.800  -1.546  11.012
  107    HG2  LYS  20           1HG      LYS  20   2.075  -2.005  11.590
  108    HG3  LYS  20           2HG      LYS  20   1.494  -0.340  11.508
  109    HD2  LYS  20           1HD      LYS  20   1.346  -1.061  13.784
  110    HD3  LYS  20           2HD      LYS  20  -0.295  -0.968  13.138
  111    HE2  LYS  20           1HE      LYS  20   1.141  -3.563  12.946
  112    HE3  LYS  20           2HE      LYS  20   0.553  -3.059  14.530
  113    HZ1  LYS  20           3HZ      LYS  20  -1.383  -2.749  12.424
  114    HZ2  LYS  20           1HZ      LYS  20  -1.549  -3.459  13.951
  115    HZ3  LYS  20           2HZ      LYS  20  -0.909  -4.355  12.666
  116    H    ALA  21           H        ALA  21  -2.204  -2.890  10.828
  117    HA   ALA  21           HA       ALA  21  -3.212  -3.586   8.192
  118    HB1  ALA  21           3HB      ALA  21  -4.887  -5.177   9.244
  119    HB2  ALA  21           1HB      ALA  21  -3.228  -5.758   9.097
  120    HB3  ALA  21           2HB      ALA  21  -3.830  -5.192  10.656
  121    H    PHE  22           H        PHE  22  -4.951  -2.402   7.667
  122    HA   PHE  22           HA       PHE  22  -6.549  -1.190   9.804
  123    HB2  PHE  22           1HB      PHE  22  -5.628   0.415   7.423
  124    HB3  PHE  22           2HB      PHE  22  -6.416   0.999   8.885
  125    HD1  PHE  22           HD2      PHE  22  -3.272  -0.295   7.482
  126    HD2  PHE  22           HD1      PHE  22  -5.173   1.473  10.855
  127    HE1  PHE  22           HE2      PHE  22  -1.070   0.160   8.480
  128    HE2  PHE  22           HE1      PHE  22  -2.974   1.932  11.858
  129    HZ   PHE  22           HZ       PHE  22  -0.919   1.274  10.672
  130    H    ILE  23           H        ILE  23  -8.689  -1.119   9.394
  131    HA   ILE  23           HA       ILE  23  -9.721  -2.568   7.180
  132    HB   ILE  23           HB       ILE  23 -10.872  -2.542   9.339
  133   HG12  ILE  23          1HG1      ILE  23 -12.594  -1.244   7.220
  134   HG13  ILE  23          2HG1      ILE  23 -12.109  -2.936   7.187
  135   HG21  ILE  23          1HG2      ILE  23 -11.790  -0.671  10.332
  136   HG22  ILE  23          2HG2      ILE  23 -10.304  -0.023   9.639
  137   HG23  ILE  23          3HG2      ILE  23 -11.844   0.234   8.820
  138   HD11  ILE  23          3HD1      ILE  23 -14.396  -2.513   8.072
  139   HD12  ILE  23          1HD1      ILE  23 -13.339  -3.402   9.167
  140   HD13  ILE  23          2HD1      ILE  23 -13.653  -1.688   9.442
  141    H    GLN  24           H        GLN  24  -9.060   0.778   7.753
  142    HA   GLN  24           HA       GLN  24 -10.366   1.458   5.201
  143    HB2  GLN  24           1HB      GLN  24 -10.136   2.984   7.768
  144    HB3  GLN  24           2HB      GLN  24 -10.266   3.857   6.247
  145    HG2  GLN  24           1HG      GLN  24 -12.372   2.742   5.767
  146    HG3  GLN  24           2HG      GLN  24 -12.238   1.823   7.266
  147   HE21  GLN  24          1HE2      GLN  24 -14.124   3.952   6.144
  148   HE22  GLN  24          2HE2      GLN  24 -14.287   5.074   7.447
  149    H    LYS  25           H        LYS  25  -9.192   2.497   3.670
  150    HA   LYS  25           HA       LYS  25  -6.368   2.379   3.807
  151    HB2  LYS  25           1HB      LYS  25  -7.360   2.148   1.665
  152    HB3  LYS  25           2HB      LYS  25  -8.281   3.635   1.848
  153    HG2  LYS  25           1HG      LYS  25  -6.585   4.214   0.376
  154    HG3  LYS  25           2HG      LYS  25  -6.000   4.805   1.933
  155    HD2  LYS  25           1HD      LYS  25  -4.513   2.966   2.168
  156    HD3  LYS  25           2HD      LYS  25  -5.254   2.110   0.813
  157    HE2  LYS  25           1HE      LYS  25  -3.940   4.789   0.468
  158    HE3  LYS  25           2HE      LYS  25  -3.015   3.289   0.407
  159    HZ1  LYS  25           3HZ      LYS  25  -5.309   3.983  -1.348
  160    HZ2  LYS  25           1HZ      LYS  25  -4.436   2.535  -1.401
  161    HZ3  LYS  25           2HZ      LYS  25  -3.679   3.994  -1.799
  162    H    SER  26           H        SER  26  -8.680   5.044   4.070
  163    HA   SER  26           HA       SER  26  -6.905   7.180   4.095
  164    HB2  SER  26           1HB      SER  26  -9.521   6.846   5.581
  165    HB3  SER  26           2HB      SER  26  -8.667   8.378   5.403
  166    HG   SER  26           HG       SER  26 -10.398   7.814   3.817
  167    H    THR  27           H        THR  27  -8.024   5.156   6.781
  168    HA   THR  27           HA       THR  27  -6.695   6.541   8.837
  169    HB   THR  27           HB       THR  27  -7.588   3.663   8.650
  170    HG1  THR  27           HG1      THR  27  -9.006   5.741   8.865
  171   HG21  THR  27          3HG2      THR  27  -5.807   4.861  10.548
  172   HG22  THR  27          1HG2      THR  27  -6.412   3.206  10.486
  173   HG23  THR  27          2HG2      THR  27  -7.324   4.447  11.345
  174    H    LEU  28           H        LEU  28  -5.686   3.871   6.756
  175    HA   LEU  28           HA       LEU  28  -3.256   3.302   8.069
  176    HB2  LEU  28           1HB      LEU  28  -3.845   1.619   6.646
  177    HB3  LEU  28           2HB      LEU  28  -4.431   2.726   5.406
  178    HG   LEU  28           HG       LEU  28  -2.037   3.256   4.877
  179   HD11  LEU  28          1HD1      LEU  28  -0.287   1.895   5.698
  180   HD12  LEU  28          2HD1      LEU  28  -1.414   0.798   6.495
  181   HD13  LEU  28          3HD1      LEU  28  -1.197   2.438   7.108
  182   HD21  LEU  28          3HD2      LEU  28  -3.128   0.474   4.548
  183   HD22  LEU  28          1HD2      LEU  28  -1.634   1.005   3.776
  184   HD23  LEU  28          2HD2      LEU  28  -3.157   1.808   3.394
  185    H    SER  29           H        SER  29  -4.023   5.409   5.319
  186    HA   SER  29           HA       SER  29  -1.482   6.209   4.602
  187    HB2  SER  29           1HB      SER  29  -3.281   6.919   3.231
  188    HB3  SER  29           2HB      SER  29  -4.105   7.698   4.582
  189    HG   SER  29           HG       SER  29  -1.543   8.590   3.931
  190    H    MET  30           H        MET  30  -3.516   7.401   7.228
  191    HA   MET  30           HA       MET  30  -1.875   9.571   7.979
  192    HB2  MET  30           1HB      MET  30  -3.677   7.979   9.804
  193    HB3  MET  30           2HB      MET  30  -3.166   9.650  10.001
  194    HG2  MET  30           1HG      MET  30  -4.662   8.920   7.544
  195    HG3  MET  30           2HG      MET  30  -5.545   9.020   9.065
  196    HE1  MET  30           3HE      MET  30  -4.797  11.090   5.987
  197    HE2  MET  30           1HE      MET  30  -6.346  10.617   6.687
  198    HE3  MET  30           2HE      MET  30  -5.886  12.319   6.634
  199    H    HIS  31           H        HIS  31  -1.633   6.171   8.503
  200    HA   HIS  31           HA       HIS  31   0.236   6.436  10.709
  201    HB2  HIS  31           1HB      HIS  31  -0.998   4.521  11.044
  202    HB3  HIS  31           2HB      HIS  31  -1.119   4.169   9.323
  203    HD1  HIS  31           HD1      HIS  31   1.106   3.673  12.287
  204    HD2  HIS  31           HD2      HIS  31   0.962   2.627   8.269
  205    HE1  HIS  31           HE1      HIS  31   2.880   1.916  11.986
  206    H    GLN  32           H        GLN  32   0.322   5.076   7.413
  207    HA   GLN  32           HA       GLN  32   2.915   4.368   7.152
  208    HB2  GLN  32           1HB      GLN  32   1.257   5.890   5.136
  209    HB3  GLN  32           2HB      GLN  32   2.767   5.071   4.760
  210    HG2  GLN  32           1HG      GLN  32   1.625   2.973   5.700
  211    HG3  GLN  32           2HG      GLN  32   0.128   3.888   5.526
  212   HE21  GLN  32          1HE2      GLN  32   0.836   1.479   4.166
  213   HE22  GLN  32          2HE2      GLN  32   0.871   1.835   2.476
  214    H    ARG  33           H        ARG  33   1.719   7.580   7.588
  215    HA   ARG  33           HA       ARG  33   3.690   9.178   6.542
  216    HB2  ARG  33           1HB      ARG  33   2.997  10.861   8.029
  217    HB3  ARG  33           2HB      ARG  33   1.574   9.851   7.811
  218    HG2  ARG  33           1HG      ARG  33   1.987   8.759   9.934
  219    HG3  ARG  33           2HG      ARG  33   3.468   9.695  10.146
  220    HD2  ARG  33           1HD      ARG  33   0.813  11.035   9.756
  221    HD3  ARG  33           2HD      ARG  33   1.338  10.488  11.348
  222    HE   ARG  33           HE       ARG  33   3.418  11.987  10.340
  223   HH11  ARG  33          1HH1      ARG  33   0.060  12.499  11.103
  224   HH12  ARG  33          2HH1      ARG  33   0.268  14.176  11.486
  225   HH21  ARG  33          1HH2      ARG  33   3.705  14.193  10.841
  226   HH22  ARG  33          2HH2      ARG  33   2.342  15.139  11.335
  227    H    ILE  34           H        ILE  34   3.727   7.438   9.625
  228    HA   ILE  34           HA       ILE  34   6.097   8.443  10.675
  229    HB   ILE  34           HB       ILE  34   6.225   6.460  12.040
  230   HG12  ILE  34          1HG1      ILE  34   3.975   5.169  10.541
  231   HG13  ILE  34          2HG1      ILE  34   5.623   4.982   9.953
  232   HG21  ILE  34          1HG2      ILE  34   3.657   7.818  11.581
  233   HG22  ILE  34          2HG2      ILE  34   3.566   6.318  12.502
  234   HG23  ILE  34          3HG2      ILE  34   4.598   7.634  13.061
  235   HD11  ILE  34          3HD1      ILE  34   4.959   4.377  12.800
  236   HD12  ILE  34          1HD1      ILE  34   4.633   3.201  11.527
  237   HD13  ILE  34          2HD1      ILE  34   6.280   3.767  11.803
  238    H    HIS  35           H        HIS  35   5.578   6.203   8.082
  239    HA   HIS  35           HA       HIS  35   8.346   5.312   8.067
  240    HB2  HIS  35           1HB      HIS  35   6.065   4.697   6.176
  241    HB3  HIS  35           2HB      HIS  35   7.656   3.944   6.129
  242    HD1  HIS  35           HD1      HIS  35   8.181   3.064   8.894
  243    HD2  HIS  35           HD2      HIS  35   4.372   2.893   7.243
  244    HE1  HIS  35           HE1      HIS  35   6.939   1.344  10.245
  245    H    ARG  36           H        ARG  36   7.182   8.133   7.378
  246    HA   ARG  36           HA       ARG  36   9.085   8.628   5.247
  247    HB2  ARG  36           1HB      ARG  36   7.460   9.813   3.833
  248    HB3  ARG  36           2HB      ARG  36   7.060   8.108   3.993
  249    HG2  ARG  36           1HG      ARG  36   5.203   8.526   5.293
  250    HG3  ARG  36           2HG      ARG  36   5.798  10.102   5.819
  251    HD2  ARG  36           1HD      ARG  36   5.591  10.702   3.287
  252    HD3  ARG  36           2HD      ARG  36   4.490   9.325   3.249
  253    HE   ARG  36           HE       ARG  36   3.542  10.756   5.314
  254   HH11  ARG  36          1HH1      ARG  36   4.411  11.637   2.060
  255   HH12  ARG  36          2HH1      ARG  36   3.252  12.921   1.960
  256   HH21  ARG  36          1HH2      ARG  36   2.013  12.444   5.194
  257   HH22  ARG  36          2HH2      ARG  36   1.889  13.380   3.743
  258    H    GLY  37           H        GLY  37   9.954  10.651   5.331
  259    HA2  GLY  37           1HA      GLY  37  10.233  12.858   5.985
  260    HA3  GLY  37           2HA      GLY  37   8.645  12.803   6.735
  261    H    GLU  38           H        GLU  38  11.407  10.678   7.346
  262    HA   GLU  38           HA       GLU  38  11.715  11.889  10.000
  263    HB2  GLU  38           1HB      GLU  38  10.234   9.926  10.226
  264    HB3  GLU  38           2HB      GLU  38  11.474   8.918   9.494
  265    HG2  GLU  38           1HG      GLU  38  12.964   9.787  11.429
  266    HG3  GLU  38           2HG      GLU  38  11.427  10.198  12.189
  267    H    LYS  39           H        LYS  39  13.762  11.585  10.967
  268    HA   LYS  39           HA       LYS  39  15.864  10.864   9.039
  269    HB2  LYS  39           1HB      LYS  39  15.631  13.227  10.182
  270    HB3  LYS  39           2HB      LYS  39  16.419  12.421  11.531
  271    HG2  LYS  39           1HG      LYS  39  17.591  12.263   8.787
  272    HG3  LYS  39           2HG      LYS  39  17.851  13.688   9.796
  273    HD2  LYS  39           1HD      LYS  39  18.332  11.003  10.988
  274    HD3  LYS  39           2HD      LYS  39  19.517  11.636   9.843
  275    HE2  LYS  39           1HE      LYS  39  20.052  12.177  12.197
  276    HE3  LYS  39           2HE      LYS  39  19.836  13.607  11.189
  277    HZ1  LYS  39           3HZ      LYS  39  17.656  13.924  12.089
  278    HZ2  LYS  39           1HZ      LYS  39  18.741  13.767  13.377
  279    HZ3  LYS  39           2HZ      LYS  39  17.736  12.473  12.955
  280    HA   PRO  40           HA       PRO  40  16.017   7.491  12.182
  281    HB2  PRO  40           1HB      PRO  40  16.636   5.553  10.385
  282    HB3  PRO  40           2HB      PRO  40  14.975   6.053  10.725
  283    HG2  PRO  40           1HG      PRO  40  16.765   6.843   8.459
  284    HG3  PRO  40           2HG      PRO  40  15.045   6.413   8.428
  285    HD2  PRO  40           1HD      PRO  40  15.905   8.979   8.365
  286    HD3  PRO  40           2HD      PRO  40  14.380   8.503   9.138
  287    H    SER  41           H        SER  41  17.874   7.932  13.260
  288    HA   SER  41           HA       SER  41  20.416   8.047  11.884
  289    HB2  SER  41           1HB      SER  41  19.750   9.528  13.850
  290    HB3  SER  41           2HB      SER  41  19.981   8.109  14.871
  291    HG   SER  41           HG       SER  41  21.816   9.790  14.095
  292    H    GLY  42           H        GLY  42  21.803   6.417  11.640
  293    HA2  GLY  42           1HA      GLY  42  22.978   4.553  12.764
  294    HA3  GLY  42           2HA      GLY  42  21.396   4.003  13.296
  295    HA   PRO  43           HA       PRO  43  21.125   1.390   9.790
  296    HB2  PRO  43           1HB      PRO  43  18.444   1.356   9.364
  297    HB3  PRO  43           2HB      PRO  43  19.210   0.531  10.726
  298    HG2  PRO  43           1HG      PRO  43  17.827   3.185  10.654
  299    HG3  PRO  43           2HG      PRO  43  17.716   1.898  11.869
  300    HD2  PRO  43           1HD      PRO  43  19.246   4.104  12.220
  301    HD3  PRO  43           2HD      PRO  43  19.685   2.520  12.892
  302    H    SER  44           H        SER  44  20.663   4.644   9.586
  303    HA   SER  44           HA       SER  44  19.313   5.394   7.415
  304    HB2  SER  44           1HB      SER  44  22.196   6.151   7.954
  305    HB3  SER  44           2HB      SER  44  21.091   7.041   6.906
  306    HG   SER  44           HG       SER  44  20.019   7.764   8.614
  307    H    SER  45           H        SER  45  22.492   3.811   7.254
  308    HA   SER  45           HA       SER  45  22.177   3.485   4.364
  309    HB2  SER  45           1HB      SER  45  24.336   4.329   5.111
  310    HB3  SER  45           2HB      SER  45  24.538   2.942   6.181
  311    HG   SER  45           HG       SER  45  25.451   3.049   3.829
  312    H    GLY  46           H        GLY  46  20.984   1.768   3.822
  313    HA2  GLY  46           1HA      GLY  46  21.571  -0.786   5.190
  314    HA3  GLY  46           2HA      GLY  46  19.951  -0.334   4.679
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1  -9.331 -27.445  20.827
    2    HA2  GLY   1           1HA      GLY   1 -11.449 -26.607  22.351
    3    HA3  GLY   1           2HA      GLY   1 -10.041 -26.290  23.353
    4    H    SER   2           H        SER   2 -10.568 -25.991  19.847
    5    HA   SER   2           HA       SER   2  -9.234 -23.442  19.819
    6    HB2  SER   2           1HB      SER   2 -10.721 -24.841  17.583
    7    HB3  SER   2           2HB      SER   2  -9.587 -23.501  17.410
    8    HG   SER   2           HG       SER   2  -9.108 -26.188  17.808
    9    H    SER   3           H        SER   3 -10.629 -22.231  21.205
   10    HA   SER   3           HA       SER   3 -13.124 -21.379  19.885
   11    HB2  SER   3           1HB      SER   3 -13.452 -22.645  22.037
   12    HB3  SER   3           2HB      SER   3 -12.601 -21.341  22.865
   13    HG   SER   3           HG       SER   3 -14.741 -20.849  22.995
   14    H    GLY   4           H        GLY   4 -12.248 -19.636  18.799
   15    HA2  GLY   4           1HA      GLY   4 -12.063 -17.203  20.202
   16    HA3  GLY   4           2HA      GLY   4 -10.438 -17.774  19.853
   17    H    SER   5           H        SER   5 -13.530 -17.626  18.077
   18    HA   SER   5           HA       SER   5 -12.075 -16.303  15.882
   19    HB2  SER   5           1HB      SER   5 -14.189 -18.456  15.732
   20    HB3  SER   5           2HB      SER   5 -13.737 -17.463  14.347
   21    HG   SER   5           HG       SER   5 -12.187 -19.345  15.763
   22    H    SER   6           H        SER   6 -12.866 -14.400  15.275
   23    HA   SER   6           HA       SER   6 -15.618 -13.765  15.157
   24    HB2  SER   6           1HB      SER   6 -15.149 -13.721  17.674
   25    HB3  SER   6           2HB      SER   6 -14.177 -12.284  17.356
   26    HG   SER   6           HG       SER   6 -16.746 -12.343  16.288
   27    H    GLY   7           H        GLY   7 -16.012 -11.713  14.232
   28    HA2  GLY   7           1HA      GLY   7 -14.889  -9.483  13.764
   29    HA3  GLY   7           2HA      GLY   7 -13.578 -10.463  13.124
   30    H    THR   8           H        THR   8 -14.854  -8.518  11.603
   31    HA   THR   8           HA       THR   8 -16.239 -10.184   9.606
   32    HB   THR   8           HB       THR   8 -18.017  -8.868  10.222
   33    HG1  THR   8           HG1      THR   8 -17.461  -8.418   7.996
   34   HG21  THR   8          3HG2      THR   8 -17.826  -6.500  10.921
   35   HG22  THR   8          1HG2      THR   8 -16.077  -6.610  10.731
   36   HG23  THR   8          2HG2      THR   8 -16.895  -7.590  11.948
   37    H    GLY   9           H        GLY   9 -15.525 -10.038   7.545
   38    HA2  GLY   9           1HA      GLY   9 -14.602  -8.502   5.807
   39    HA3  GLY   9           2HA      GLY   9 -13.410  -8.042   7.013
   40    H    GLU  10           H        GLU  10 -12.919  -9.106   4.377
   41    HA   GLU  10           HA       GLU  10 -11.672 -11.684   5.074
   42    HB2  GLU  10           1HB      GLU  10 -12.493 -10.649   2.355
   43    HB3  GLU  10           2HB      GLU  10 -11.697 -12.186   2.658
   44    HG2  GLU  10           1HG      GLU  10 -14.236 -11.624   4.086
   45    HG3  GLU  10           2HG      GLU  10 -14.309 -12.000   2.365
   46    H    ARG  11           H        ARG  11 -11.212  -8.719   3.169
   47    HA   ARG  11           HA       ARG  11  -8.307  -9.053   3.529
   48    HB2  ARG  11           1HB      ARG  11  -9.372  -9.322   1.140
   49    HB3  ARG  11           2HB      ARG  11  -9.416  -7.564   1.183
   50    HG2  ARG  11           1HG      ARG  11  -7.390  -7.858   0.208
   51    HG3  ARG  11           2HG      ARG  11  -6.890  -7.883   1.900
   52    HD2  ARG  11           1HD      ARG  11  -7.673 -10.434   0.564
   53    HD3  ARG  11           2HD      ARG  11  -6.084  -9.742   0.240
   54    HE   ARG  11           HE       ARG  11  -6.706  -9.952   3.038
   55   HH11  ARG  11          1HH1      ARG  11  -5.415 -11.602   0.258
   56   HH12  ARG  11          2HH1      ARG  11  -4.470 -12.713   1.194
   57   HH21  ARG  11          1HH2      ARG  11  -5.467 -11.409   4.281
   58   HH22  ARG  11          2HH2      ARG  11  -4.501 -12.602   3.482
   59    H    HIS  12           H        HIS  12  -7.092  -7.179   3.893
   60    HA   HIS  12           HA       HIS  12  -8.533  -4.660   4.227
   61    HB2  HIS  12           1HB      HIS  12  -7.713  -4.311   6.479
   62    HB3  HIS  12           2HB      HIS  12  -8.612  -5.825   6.421
   63    HD1  HIS  12           HD1      HIS  12  -7.504  -7.517   7.823
   64    HD2  HIS  12           HD2      HIS  12  -4.745  -5.057   5.924
   65    HE1  HIS  12           HE1      HIS  12  -5.245  -8.372   8.525
   66    H    TYR  13           H        TYR  13  -7.008  -2.835   4.688
   67    HA   TYR  13           HA       TYR  13  -4.737  -3.058   2.913
   68    HB2  TYR  13           1HB      TYR  13  -5.528  -0.624   4.507
   69    HB3  TYR  13           2HB      TYR  13  -4.616  -0.688   3.003
   70    HD1  TYR  13           HD1      TYR  13  -5.777  -1.197   0.874
   71    HD2  TYR  13           HD2      TYR  13  -7.917  -0.637   4.508
   72    HE1  TYR  13           HE1      TYR  13  -7.853  -0.875  -0.405
   73    HE2  TYR  13           HE2      TYR  13  -9.999  -0.315   3.239
   74    HH   TYR  13           HH       TYR  13 -10.896  -0.975   0.976
   75    H    GLU  14           H        GLU  14  -2.891  -3.855   3.662
   76    HA   GLU  14           HA       GLU  14  -2.123  -3.307   6.443
   77    HB2  GLU  14           1HB      GLU  14  -2.229  -5.693   5.291
   78    HB3  GLU  14           2HB      GLU  14  -0.624  -5.239   4.735
   79    HG2  GLU  14           1HG      GLU  14  -0.063  -4.761   7.150
   80    HG3  GLU  14           2HG      GLU  14  -1.582  -5.553   7.562
   81    H    CYS  15           H        CYS  15  -0.266  -2.251   6.953
   82    HA   CYS  15           HA       CYS  15   0.863  -0.487   5.076
   83    HB2  CYS  15           1HB      CYS  15   0.791  -0.170   7.575
   84    HB3  CYS  15           2HB      CYS  15   2.104  -1.336   7.696
   85    H    SER  16           H        SER  16   2.282  -0.873   3.522
   86    HA   SER  16           HA       SER  16   3.760  -3.361   3.472
   87    HB2  SER  16           1HB      SER  16   4.323  -2.799   1.211
   88    HB3  SER  16           2HB      SER  16   2.632  -2.358   1.444
   89    HG   SER  16           HG       SER  16   3.356  -0.194   1.793
   90    H    GLU  17           H        GLU  17   4.421  -1.305   5.479
   91    HA   GLU  17           HA       GLU  17   7.232  -0.848   4.718
   92    HB2  GLU  17           1HB      GLU  17   5.541   0.835   6.574
   93    HB3  GLU  17           2HB      GLU  17   7.227   1.124   6.170
   94    HG2  GLU  17           1HG      GLU  17   5.218   0.990   3.979
   95    HG3  GLU  17           2HG      GLU  17   5.315   2.441   4.975
   96    H    CYS  18           H        CYS  18   5.000  -1.552   7.371
   97    HA   CYS  18           HA       CYS  18   7.232  -2.847   8.793
   98    HB2  CYS  18           1HB      CYS  18   6.056  -2.240  10.920
   99    HB3  CYS  18           2HB      CYS  18   6.677  -0.857  10.024
  100    H    GLY  19           H        GLY  19   3.689  -2.741   8.460
  101    HA2  GLY  19           1HA      GLY  19   2.727  -4.952   7.746
  102    HA3  GLY  19           2HA      GLY  19   3.654  -5.630   9.077
  103    H    LYS  20           H        LYS  20   1.486  -2.822   8.706
  104    HA   LYS  20           HA       LYS  20   0.051  -3.756  11.104
  105    HB2  LYS  20           1HB      LYS  20   1.311  -1.479  11.066
  106    HB3  LYS  20           2HB      LYS  20  -0.051  -0.929  10.098
  107    HG2  LYS  20           1HG      LYS  20  -1.575  -1.273  11.853
  108    HG3  LYS  20           2HG      LYS  20  -0.418  -2.236  12.775
  109    HD2  LYS  20           1HD      LYS  20   0.865  -0.349  13.340
  110    HD3  LYS  20           2HD      LYS  20   0.098   0.647  12.100
  111    HE2  LYS  20           1HE      LYS  20  -1.572  -0.519  14.281
  112    HE3  LYS  20           2HE      LYS  20  -0.572   0.892  14.624
  113    HZ1  LYS  20           3HZ      LYS  20  -2.737   0.664  12.611
  114    HZ2  LYS  20           1HZ      LYS  20  -1.658   1.966  12.667
  115    HZ3  LYS  20           2HZ      LYS  20  -2.694   1.669  13.971
  116    H    ALA  21           H        ALA  21  -2.067  -4.189  10.962
  117    HA   ALA  21           HA       ALA  21  -3.338  -3.949   8.354
  118    HB1  ALA  21           3HB      ALA  21  -3.597  -6.086   9.304
  119    HB2  ALA  21           1HB      ALA  21  -4.062  -5.422  10.871
  120    HB3  ALA  21           2HB      ALA  21  -5.162  -5.296   9.497
  121    H    PHE  22           H        PHE  22  -5.157  -2.764   7.921
  122    HA   PHE  22           HA       PHE  22  -6.229  -1.092  10.088
  123    HB2  PHE  22           1HB      PHE  22  -5.522  -0.155   7.299
  124    HB3  PHE  22           2HB      PHE  22  -6.358   0.812   8.510
  125    HD1  PHE  22           HD2      PHE  22  -3.162  -0.737   7.583
  126    HD2  PHE  22           HD1      PHE  22  -5.179   1.817  10.326
  127    HE1  PHE  22           HE2      PHE  22  -0.994   0.026   8.461
  128    HE2  PHE  22           HE1      PHE  22  -3.014   2.584  11.209
  129    HZ   PHE  22           HZ       PHE  22  -0.918   1.688  10.277
  130    H    ILE  23           H        ILE  23  -8.218   0.207   8.965
  131    HA   ILE  23           HA       ILE  23  -9.952  -1.924   7.918
  132    HB   ILE  23           HB       ILE  23 -10.712  -0.958  10.023
  133   HG12  ILE  23          1HG1      ILE  23 -12.538   0.128   7.892
  134   HG13  ILE  23          2HG1      ILE  23 -12.298  -1.605   8.089
  135   HG21  ILE  23          1HG2      ILE  23 -10.859   1.668   8.549
  136   HG22  ILE  23          2HG2      ILE  23 -11.344   1.371  10.218
  137   HG23  ILE  23          3HG2      ILE  23  -9.646   1.245   9.758
  138   HD11  ILE  23          3HD1      ILE  23 -13.158  -1.520  10.326
  139   HD12  ILE  23          1HD1      ILE  23 -13.261   0.239  10.260
  140   HD13  ILE  23          2HD1      ILE  23 -14.305  -0.745   9.233
  141    H    GLN  24           H        GLN  24  -9.163   1.511   7.494
  142    HA   GLN  24           HA       GLN  24 -10.159   1.302   4.731
  143    HB2  GLN  24           1HB      GLN  24 -10.413   3.652   6.612
  144    HB3  GLN  24           2HB      GLN  24 -10.793   3.710   4.896
  145    HG2  GLN  24           1HG      GLN  24 -12.463   1.886   5.304
  146    HG3  GLN  24           2HG      GLN  24 -12.178   2.111   7.029
  147   HE21  GLN  24          1HE2      GLN  24 -14.358   2.730   4.829
  148   HE22  GLN  24          2HE2      GLN  24 -14.936   4.278   5.333
  149    H    LYS  25           H        LYS  25  -9.040   2.503   3.153
  150    HA   LYS  25           HA       LYS  25  -6.290   2.515   3.300
  151    HB2  LYS  25           1HB      LYS  25  -8.283   3.826   1.523
  152    HB3  LYS  25           2HB      LYS  25  -6.622   4.398   1.430
  153    HG2  LYS  25           1HG      LYS  25  -7.095   1.469   1.318
  154    HG3  LYS  25           2HG      LYS  25  -7.513   2.440  -0.096
  155    HD2  LYS  25           1HD      LYS  25  -5.208   3.393  -0.035
  156    HD3  LYS  25           2HD      LYS  25  -4.824   2.255   1.259
  157    HE2  LYS  25           1HE      LYS  25  -4.054   1.314  -0.796
  158    HE3  LYS  25           2HE      LYS  25  -5.474   0.403  -0.285
  159    HZ1  LYS  25           3HZ      LYS  25  -5.579   0.877  -2.634
  160    HZ2  LYS  25           1HZ      LYS  25  -5.418   2.537  -2.350
  161    HZ3  LYS  25           2HZ      LYS  25  -6.807   1.721  -1.834
  162    H    SER  26           H        SER  26  -8.524   5.193   3.924
  163    HA   SER  26           HA       SER  26  -6.653   7.226   4.286
  164    HB2  SER  26           1HB      SER  26  -9.417   6.767   5.380
  165    HB3  SER  26           2HB      SER  26  -8.477   8.177   5.869
  166    HG   SER  26           HG       SER  26  -9.704   8.731   4.088
  167    H    THR  27           H        THR  27  -8.116   5.085   6.726
  168    HA   THR  27           HA       THR  27  -6.809   6.056   8.970
  169    HB   THR  27           HB       THR  27  -7.616   3.199   8.389
  170    HG1  THR  27           HG1      THR  27  -8.947   5.412   9.581
  171   HG21  THR  27          3HG2      THR  27  -7.176   2.628  10.545
  172   HG22  THR  27          1HG2      THR  27  -7.502   4.250  11.156
  173   HG23  THR  27          2HG2      THR  27  -5.961   3.894  10.377
  174    H    LEU  28           H        LEU  28  -5.698   3.753   6.545
  175    HA   LEU  28           HA       LEU  28  -3.347   2.954   7.914
  176    HB2  LEU  28           1HB      LEU  28  -3.900   1.470   6.266
  177    HB3  LEU  28           2HB      LEU  28  -4.390   2.735   5.141
  178    HG   LEU  28           HG       LEU  28  -1.931   3.266   4.868
  179   HD11  LEU  28          1HD1      LEU  28  -1.709   0.680   6.392
  180   HD12  LEU  28          2HD1      LEU  28  -0.999   2.242   6.800
  181   HD13  LEU  28          3HD1      LEU  28  -0.412   1.346   5.399
  182   HD21  LEU  28          3HD2      LEU  28  -3.223   2.045   3.192
  183   HD22  LEU  28          1HD2      LEU  28  -2.892   0.531   4.033
  184   HD23  LEU  28          2HD2      LEU  28  -1.571   1.436   3.293
  185    H    SER  29           H        SER  29  -3.842   5.227   5.212
  186    HA   SER  29           HA       SER  29  -1.297   6.117   4.812
  187    HB2  SER  29           1HB      SER  29  -2.269   8.254   4.069
  188    HB3  SER  29           2HB      SER  29  -3.217   6.886   3.487
  189    HG   SER  29           HG       SER  29  -3.944   8.920   5.136
  190    H    MET  30           H        MET  30  -3.573   7.344   7.252
  191    HA   MET  30           HA       MET  30  -2.095   9.371   8.356
  192    HB2  MET  30           1HB      MET  30  -3.737   7.377   9.924
  193    HB3  MET  30           2HB      MET  30  -3.329   9.015  10.417
  194    HG2  MET  30           1HG      MET  30  -4.544   9.619   8.154
  195    HG3  MET  30           2HG      MET  30  -5.326   8.066   8.442
  196    HE1  MET  30           3HE      MET  30  -8.202   8.961  10.285
  197    HE2  MET  30           1HE      MET  30  -7.936   9.859   8.790
  198    HE3  MET  30           2HE      MET  30  -7.390   8.187   8.923
  199    H    HIS  31           H        HIS  31  -1.672   5.917   8.763
  200    HA   HIS  31           HA       HIS  31   0.342   6.254  10.823
  201    HB2  HIS  31           1HB      HIS  31  -0.814   4.303  11.236
  202    HB3  HIS  31           2HB      HIS  31  -1.015   3.933   9.526
  203    HD1  HIS  31           HD1      HIS  31   1.393   3.553  12.364
  204    HD2  HIS  31           HD2      HIS  31   1.052   2.449   8.374
  205    HE1  HIS  31           HE1      HIS  31   3.209   1.857  11.978
  206    H    GLN  32           H        GLN  32   0.267   4.821   7.555
  207    HA   GLN  32           HA       GLN  32   2.850   4.220   7.113
  208    HB2  GLN  32           1HB      GLN  32   0.747   5.379   5.354
  209    HB3  GLN  32           2HB      GLN  32   2.389   5.316   4.728
  210    HG2  GLN  32           1HG      GLN  32   2.378   2.860   5.348
  211    HG3  GLN  32           2HG      GLN  32   0.640   3.036   5.588
  212   HE21  GLN  32          1HE2      GLN  32  -0.474   4.161   3.685
  213   HE22  GLN  32          2HE2      GLN  32  -0.025   3.598   2.115
  214    H    ARG  33           H        ARG  33   1.574   7.407   7.574
  215    HA   ARG  33           HA       ARG  33   3.473   9.026   6.410
  216    HB2  ARG  33           1HB      ARG  33   2.819  10.731   7.937
  217    HB3  ARG  33           2HB      ARG  33   1.392   9.751   7.632
  218    HG2  ARG  33           1HG      ARG  33   1.837   8.542   9.755
  219    HG3  ARG  33           2HG      ARG  33   3.155   9.673  10.069
  220    HD2  ARG  33           1HD      ARG  33   0.724  10.071  11.028
  221    HD3  ARG  33           2HD      ARG  33   1.744  11.410  10.506
  222    HE   ARG  33           HE       ARG  33  -0.664  10.446   9.224
  223   HH11  ARG  33          1HH1      ARG  33   2.228  12.361   8.932
  224   HH12  ARG  33          2HH1      ARG  33   1.614  13.327   7.631
  225   HH21  ARG  33          1HH2      ARG  33  -1.484  11.710   7.512
  226   HH22  ARG  33          2HH2      ARG  33  -0.498  12.956   6.825
  227    H    ILE  34           H        ILE  34   3.600   7.470   9.598
  228    HA   ILE  34           HA       ILE  34   5.946   8.543  10.570
  229    HB   ILE  34           HB       ILE  34   6.183   6.587  11.957
  230   HG12  ILE  34          1HG1      ILE  34   3.971   5.145  10.567
  231   HG13  ILE  34          2HG1      ILE  34   5.579   5.083   9.854
  232   HG21  ILE  34          1HG2      ILE  34   3.663   7.956  11.586
  233   HG22  ILE  34          2HG2      ILE  34   3.437   6.352  12.282
  234   HG23  ILE  34          3HG2      ILE  34   4.498   7.516  13.075
  235   HD11  ILE  34          3HD1      ILE  34   5.077   3.174  11.328
  236   HD12  ILE  34          1HD1      ILE  34   6.479   4.107  11.853
  237   HD13  ILE  34          2HD1      ILE  34   4.934   4.294  12.683
  238    H    HIS  35           H        HIS  35   5.510   6.363   7.942
  239    HA   HIS  35           HA       HIS  35   8.293   5.515   7.930
  240    HB2  HIS  35           1HB      HIS  35   5.955   4.886   6.123
  241    HB3  HIS  35           2HB      HIS  35   7.586   4.290   5.834
  242    HD1  HIS  35           HD1      HIS  35   8.553   2.625   7.667
  243    HD2  HIS  35           HD2      HIS  35   4.494   3.460   7.959
  244    HE1  HIS  35           HE1      HIS  35   7.607   0.844   9.170
  245    H    ARG  36           H        ARG  36   7.227   8.351   7.404
  246    HA   ARG  36           HA       ARG  36   8.828   8.788   4.978
  247    HB2  ARG  36           1HB      ARG  36   6.124   9.942   5.635
  248    HB3  ARG  36           2HB      ARG  36   7.209  10.706   4.482
  249    HG2  ARG  36           1HG      ARG  36   5.746   9.410   3.195
  250    HG3  ARG  36           2HG      ARG  36   7.245   8.481   3.264
  251    HD2  ARG  36           1HD      ARG  36   6.341   6.861   4.597
  252    HD3  ARG  36           2HD      ARG  36   5.195   7.969   5.350
  253    HE   ARG  36           HE       ARG  36   3.679   7.478   3.700
  254   HH11  ARG  36          1HH1      ARG  36   6.823   6.307   2.771
  255   HH12  ARG  36          2HH1      ARG  36   6.235   5.428   1.399
  256   HH21  ARG  36          1HH2      ARG  36   2.892   6.325   1.896
  257   HH22  ARG  36          2HH2      ARG  36   3.999   5.440   0.902
  258    H    GLY  37           H        GLY  37   7.579  10.050   8.016
  259    HA2  GLY  37           1HA      GLY  37   8.994  12.519   7.931
  260    HA3  GLY  37           2HA      GLY  37   8.277  11.784   9.357
  261    H    GLU  38           H        GLU  38   9.512  10.100  10.454
  262    HA   GLU  38           HA       GLU  38  12.412  10.357  10.005
  263    HB2  GLU  38           1HB      GLU  38  10.942  10.319  12.645
  264    HB3  GLU  38           2HB      GLU  38  12.688  10.188  12.483
  265    HG2  GLU  38           1HG      GLU  38  11.004  12.529  11.625
  266    HG3  GLU  38           2HG      GLU  38  12.022  12.449  13.061
  267    H    LYS  39           H        LYS  39  13.632   8.574  11.215
  268    HA   LYS  39           HA       LYS  39  12.126   6.051  11.184
  269    HB2  LYS  39           1HB      LYS  39  14.774   6.571   9.825
  270    HB3  LYS  39           2HB      LYS  39  14.094   4.969  10.076
  271    HG2  LYS  39           1HG      LYS  39  12.293   5.398   8.612
  272    HG3  LYS  39           2HG      LYS  39  12.645   7.127   8.570
  273    HD2  LYS  39           1HD      LYS  39  14.792   6.629   7.455
  274    HD3  LYS  39           2HD      LYS  39  14.363   4.917   7.440
  275    HE2  LYS  39           1HE      LYS  39  13.834   5.809   5.294
  276    HE3  LYS  39           2HE      LYS  39  12.314   5.532   6.141
  277    HZ1  LYS  39           3HZ      LYS  39  12.621   8.005   6.823
  278    HZ2  LYS  39           1HZ      LYS  39  12.001   7.622   5.296
  279    HZ3  LYS  39           2HZ      LYS  39  13.623   8.071   5.462
  280    HA   PRO  40           HA       PRO  40  14.154   5.235  14.996
  281    HB2  PRO  40           1HB      PRO  40  14.123   2.520  14.982
  282    HB3  PRO  40           2HB      PRO  40  12.674   3.496  15.254
  283    HG2  PRO  40           1HG      PRO  40  13.611   2.154  12.748
  284    HG3  PRO  40           2HG      PRO  40  11.976   2.235  13.430
  285    HD2  PRO  40           1HD      PRO  40  12.786   3.829  11.397
  286    HD3  PRO  40           2HD      PRO  40  11.603   4.357  12.611
  287    H    SER  41           H        SER  41  15.415   4.051  11.998
  288    HA   SER  41           HA       SER  41  17.773   2.826  12.987
  289    HB2  SER  41           1HB      SER  41  17.022   2.298  10.759
  290    HB3  SER  41           2HB      SER  41  17.107   3.992  10.276
  291    HG   SER  41           HG       SER  41  19.302   3.902  10.326
  292    H    GLY  42           H        GLY  42  19.367   3.809  14.029
  293    HA2  GLY  42           1HA      GLY  42  20.165   6.505  13.135
  294    HA3  GLY  42           2HA      GLY  42  19.981   6.142  14.844
  295    HA   PRO  43           HA       PRO  43  24.310   5.087  13.103
  296    HB2  PRO  43           1HB      PRO  43  25.656   7.310  13.888
  297    HB3  PRO  43           2HB      PRO  43  24.897   7.158  12.299
  298    HG2  PRO  43           1HG      PRO  43  23.890   8.541  14.755
  299    HG3  PRO  43           2HG      PRO  43  23.846   9.084  13.068
  300    HD2  PRO  43           1HD      PRO  43  21.694   8.003  14.306
  301    HD3  PRO  43           2HD      PRO  43  22.000   7.798  12.569
  302    H    SER  44           H        SER  44  25.130   3.686  14.517
  303    HA   SER  44           HA       SER  44  24.839   4.005  17.345
  304    HB2  SER  44           1HB      SER  44  25.860   1.858  17.535
  305    HB3  SER  44           2HB      SER  44  24.858   1.799  16.086
  306    HG   SER  44           HG       SER  44  26.585   1.457  14.950
  307    H    SER  45           H        SER  45  26.533   4.140  18.897
  308    HA   SER  45           HA       SER  45  28.667   5.909  18.055
  309    HB2  SER  45           1HB      SER  45  27.716   4.944  20.751
  310    HB3  SER  45           2HB      SER  45  29.169   5.924  20.560
  311    HG   SER  45           HG       SER  45  26.849   6.831  19.318
  312    H    GLY  46           H        GLY  46  30.281   4.843  17.037
  313    HA2  GLY  46           1HA      GLY  46  32.218   3.455  18.445
  314    HA3  GLY  46           2HA      GLY  46  31.160   2.233  17.754
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1  10.162 -23.119 -11.583
    2    HA2  GLY   1           1HA      GLY   1   9.230 -20.553 -12.668
    3    HA3  GLY   1           2HA      GLY   1   8.075 -21.866 -12.496
    4    H    SER   2           H        SER   2   9.524 -19.231 -10.986
    5    HA   SER   2           HA       SER   2   8.930 -20.172  -8.286
    6    HB2  SER   2           1HB      SER   2  10.219 -17.619  -9.277
    7    HB3  SER   2           2HB      SER   2   9.959 -18.011  -7.578
    8    HG   SER   2           HG       SER   2  11.350 -19.750  -7.794
    9    H    SER   3           H        SER   3   6.688 -19.923  -9.901
   10    HA   SER   3           HA       SER   3   5.355 -17.484  -9.845
   11    HB2  SER   3           1HB      SER   3   4.383 -20.333  -9.835
   12    HB3  SER   3           2HB      SER   3   3.248 -18.984  -9.798
   13    HG   SER   3           HG       SER   3   3.782 -18.452 -11.800
   14    H    GLY   4           H        GLY   4   5.460 -16.323  -7.977
   15    HA2  GLY   4           1HA      GLY   4   3.594 -16.787  -5.953
   16    HA3  GLY   4           2HA      GLY   4   5.141 -17.395  -5.382
   17    H    SER   5           H        SER   5   3.905 -14.505  -7.071
   18    HA   SER   5           HA       SER   5   5.705 -12.879  -5.410
   19    HB2  SER   5           1HB      SER   5   4.296 -12.108  -7.976
   20    HB3  SER   5           2HB      SER   5   5.501 -11.151  -7.114
   21    HG   SER   5           HG       SER   5   6.934 -12.199  -8.217
   22    H    SER   6           H        SER   6   2.433 -12.748  -6.821
   23    HA   SER   6           HA       SER   6   1.622 -11.012  -4.590
   24    HB2  SER   6           1HB      SER   6  -0.167 -10.217  -5.975
   25    HB3  SER   6           2HB      SER   6   1.298 -10.192  -6.957
   26    HG   SER   6           HG       SER   6   0.408 -11.575  -8.255
   27    H    GLY   7           H        GLY   7   0.628 -13.861  -6.455
   28    HA2  GLY   7           1HA      GLY   7  -0.988 -15.457  -6.009
   29    HA3  GLY   7           2HA      GLY   7  -0.173 -15.488  -4.453
   30    H    THR   8           H        THR   8  -1.554 -15.385  -2.826
   31    HA   THR   8           HA       THR   8  -4.210 -14.925  -2.838
   32    HB   THR   8           HB       THR   8  -2.374 -13.986  -0.626
   33    HG1  THR   8           HG1      THR   8  -2.089 -16.038  -0.212
   34   HG21  THR   8          3HG2      THR   8  -5.052 -13.555  -0.826
   35   HG22  THR   8          1HG2      THR   8  -4.181 -13.721   0.698
   36   HG23  THR   8          2HG2      THR   8  -5.017 -15.110   0.004
   37    H    GLY   9           H        GLY   9  -5.384 -13.311  -3.633
   38    HA2  GLY   9           1HA      GLY   9  -4.415 -10.751  -4.236
   39    HA3  GLY   9           2HA      GLY   9  -6.113 -11.197  -4.145
   40    H    GLU  10           H        GLU  10  -4.301  -8.872  -3.159
   41    HA   GLU  10           HA       GLU  10  -4.538  -8.868  -0.327
   42    HB2  GLU  10           1HB      GLU  10  -3.883  -6.535  -0.453
   43    HB3  GLU  10           2HB      GLU  10  -2.891  -7.491  -1.545
   44    HG2  GLU  10           1HG      GLU  10  -5.333  -6.059  -2.515
   45    HG3  GLU  10           2HG      GLU  10  -3.781  -5.237  -2.364
   46    H    ARG  11           H        ARG  11  -6.100  -8.083   0.992
   47    HA   ARG  11           HA       ARG  11  -8.488  -6.919  -0.280
   48    HB2  ARG  11           1HB      ARG  11  -8.306  -9.070   1.818
   49    HB3  ARG  11           2HB      ARG  11  -9.759  -8.099   1.618
   50    HG2  ARG  11           1HG      ARG  11  -8.571  -9.515  -0.728
   51    HG3  ARG  11           2HG      ARG  11  -9.573 -10.390   0.431
   52    HD2  ARG  11           1HD      ARG  11 -11.464  -9.129  -0.064
   53    HD3  ARG  11           2HD      ARG  11 -10.521  -7.817  -0.768
   54    HE   ARG  11           HE       ARG  11 -11.379 -10.250  -2.078
   55   HH11  ARG  11          1HH1      ARG  11  -9.255  -7.493  -2.147
   56   HH12  ARG  11          2HH1      ARG  11  -8.989  -7.576  -3.857
   57   HH21  ARG  11          1HH2      ARG  11 -11.038 -10.370  -4.330
   58   HH22  ARG  11          2HH2      ARG  11 -10.005  -9.212  -5.098
   59    H    HIS  12           H        HIS  12  -6.898  -7.396   2.875
   60    HA   HIS  12           HA       HIS  12  -8.120  -5.003   3.939
   61    HB2  HIS  12           1HB      HIS  12  -7.472  -7.235   5.177
   62    HB3  HIS  12           2HB      HIS  12  -5.903  -6.450   5.333
   63    HD1  HIS  12           HD1      HIS  12  -9.545  -5.694   6.132
   64    HD2  HIS  12           HD2      HIS  12  -5.716  -4.834   7.497
   65    HE1  HIS  12           HE1      HIS  12  -9.866  -4.362   8.240
   66    H    TYR  13           H        TYR  13  -7.170  -3.053   4.268
   67    HA   TYR  13           HA       TYR  13  -4.857  -2.419   2.718
   68    HB2  TYR  13           1HB      TYR  13  -6.308  -0.702   4.742
   69    HB3  TYR  13           2HB      TYR  13  -5.191  -0.138   3.504
   70    HD1  TYR  13           HD1      TYR  13  -5.846  -0.398   1.076
   71    HD2  TYR  13           HD2      TYR  13  -8.596  -0.999   4.266
   72    HE1  TYR  13           HE1      TYR  13  -7.718  -0.128  -0.496
   73    HE2  TYR  13           HE2      TYR  13 -10.477  -0.732   2.703
   74    HH   TYR  13           HH       TYR  13 -10.525   0.660   0.106
   75    H    GLU  14           H        GLU  14  -3.271  -3.798   3.688
   76    HA   GLU  14           HA       GLU  14  -2.424  -3.096   6.398
   77    HB2  GLU  14           1HB      GLU  14  -1.883  -5.385   4.553
   78    HB3  GLU  14           2HB      GLU  14  -0.713  -5.015   5.812
   79    HG2  GLU  14           1HG      GLU  14  -2.228  -5.476   7.524
   80    HG3  GLU  14           2HG      GLU  14  -3.618  -5.373   6.444
   81    H    CYS  15           H        CYS  15  -0.303  -2.434   6.879
   82    HA   CYS  15           HA       CYS  15   0.857  -0.708   4.904
   83    HB2  CYS  15           1HB      CYS  15   0.734  -0.276   7.416
   84    HB3  CYS  15           2HB      CYS  15   2.061  -1.422   7.576
   85    H    SER  16           H        SER  16   2.244  -1.321   3.396
   86    HA   SER  16           HA       SER  16   3.636  -3.856   3.628
   87    HB2  SER  16           1HB      SER  16   2.525  -3.168   1.501
   88    HB3  SER  16           2HB      SER  16   3.693  -1.855   1.357
   89    HG   SER  16           HG       SER  16   4.018  -4.579   0.958
   90    H    GLU  17           H        GLU  17   4.419  -1.729   5.420
   91    HA   GLU  17           HA       GLU  17   7.203  -1.353   4.528
   92    HB2  GLU  17           1HB      GLU  17   5.504   0.507   6.199
   93    HB3  GLU  17           2HB      GLU  17   7.231   0.709   5.937
   94    HG2  GLU  17           1HG      GLU  17   6.576   0.646   3.419
   95    HG3  GLU  17           2HG      GLU  17   4.973   1.058   4.024
   96    H    CYS  18           H        CYS  18   5.129  -1.510   7.420
   97    HA   CYS  18           HA       CYS  18   7.386  -2.715   8.876
   98    HB2  CYS  18           1HB      CYS  18   6.065  -2.071  10.933
   99    HB3  CYS  18           2HB      CYS  18   6.683  -0.723   9.983
  100    H    GLY  19           H        GLY  19   3.840  -2.913   8.559
  101    HA2  GLY  19           1HA      GLY  19   3.131  -5.287   7.973
  102    HA3  GLY  19           2HA      GLY  19   4.017  -5.728   9.425
  103    H    LYS  20           H        LYS  20   1.876  -2.959   8.865
  104    HA   LYS  20           HA       LYS  20   0.268  -3.856  11.153
  105    HB2  LYS  20           1HB      LYS  20   1.436  -1.491  10.904
  106    HB3  LYS  20           2HB      LYS  20  -0.014  -1.127   9.977
  107    HG2  LYS  20           1HG      LYS  20  -1.398  -1.325  11.808
  108    HG3  LYS  20           2HG      LYS  20  -0.263  -2.354  12.686
  109    HD2  LYS  20           1HD      LYS  20   1.251  -0.390  12.903
  110    HD3  LYS  20           2HD      LYS  20  -0.005   0.607  12.164
  111    HE2  LYS  20           1HE      LYS  20  -1.450   0.335  13.984
  112    HE3  LYS  20           2HE      LYS  20  -0.564  -1.061  14.594
  113    HZ1  LYS  20           3HZ      LYS  20   0.340   0.422  15.980
  114    HZ2  LYS  20           1HZ      LYS  20  -0.091   1.752  15.027
  115    HZ3  LYS  20           2HZ      LYS  20   1.304   0.869  14.664
  116    H    ALA  21           H        ALA  21  -2.094  -3.193  11.024
  117    HA   ALA  21           HA       ALA  21  -3.133  -3.549   8.292
  118    HB1  ALA  21           3HB      ALA  21  -3.945  -5.016  10.786
  119    HB2  ALA  21           1HB      ALA  21  -4.983  -4.919   9.362
  120    HB3  ALA  21           2HB      ALA  21  -3.396  -5.683   9.249
  121    H    PHE  22           H        PHE  22  -5.203  -2.650   7.887
  122    HA   PHE  22           HA       PHE  22  -6.384  -0.965   9.947
  123    HB2  PHE  22           1HB      PHE  22  -5.584   0.204   7.277
  124    HB3  PHE  22           2HB      PHE  22  -6.307   1.055   8.638
  125    HD1  PHE  22           HD2      PHE  22  -3.264  -0.762   7.561
  126    HD2  PHE  22           HD1      PHE  22  -4.974   2.016  10.295
  127    HE1  PHE  22           HE2      PHE  22  -1.018  -0.217   8.406
  128    HE2  PHE  22           HE1      PHE  22  -2.731   2.566  11.144
  129    HZ   PHE  22           HZ       PHE  22  -0.750   1.448  10.200
  130    H    ILE  23           H        ILE  23  -8.541  -0.396   9.546
  131    HA   ILE  23           HA       ILE  23  -9.945  -2.229   7.839
  132    HB   ILE  23           HB       ILE  23 -10.796  -1.518  10.075
  133   HG12  ILE  23          1HG1      ILE  23 -12.192  -2.319   7.978
  134   HG13  ILE  23          2HG1      ILE  23 -12.998  -1.797   9.453
  135   HG21  ILE  23          1HG2      ILE  23 -10.173   0.864   9.859
  136   HG22  ILE  23          2HG2      ILE  23 -11.464   1.066   8.676
  137   HG23  ILE  23          3HG2      ILE  23 -11.854   0.634  10.340
  138   HD11  ILE  23          3HD1      ILE  23 -13.640   0.234   8.524
  139   HD12  ILE  23          1HD1      ILE  23 -12.456   0.120   7.222
  140   HD13  ILE  23          2HD1      ILE  23 -13.876  -0.928   7.219
  141    H    GLN  24           H        GLN  24  -9.523   1.298   7.942
  142    HA   GLN  24           HA       GLN  24 -10.714   1.480   5.267
  143    HB2  GLN  24           1HB      GLN  24 -10.347   3.423   7.510
  144    HB3  GLN  24           2HB      GLN  24 -10.484   4.030   5.865
  145    HG2  GLN  24           1HG      GLN  24 -12.631   2.791   5.658
  146    HG3  GLN  24           2HG      GLN  24 -12.503   2.386   7.369
  147   HE21  GLN  24          1HE2      GLN  24 -14.563   3.498   7.515
  148   HE22  GLN  24          2HE2      GLN  24 -14.583   5.218   7.675
  149    H    LYS  25           H        LYS  25  -9.658   2.588   3.587
  150    HA   LYS  25           HA       LYS  25  -6.899   2.115   3.370
  151    HB2  LYS  25           1HB      LYS  25  -8.321   2.239   1.406
  152    HB3  LYS  25           2HB      LYS  25  -8.702   3.921   1.749
  153    HG2  LYS  25           1HG      LYS  25  -7.118   4.042   0.058
  154    HG3  LYS  25           2HG      LYS  25  -6.182   4.334   1.526
  155    HD2  LYS  25           1HD      LYS  25  -5.249   2.182   1.492
  156    HD3  LYS  25           2HD      LYS  25  -6.460   1.582   0.356
  157    HE2  LYS  25           1HE      LYS  25  -4.537   1.844  -0.944
  158    HE3  LYS  25           2HE      LYS  25  -5.489   3.287  -1.288
  159    HZ1  LYS  25           3HZ      LYS  25  -3.926   4.597  -0.426
  160    HZ2  LYS  25           1HZ      LYS  25  -2.894   3.259  -0.506
  161    HZ3  LYS  25           2HZ      LYS  25  -3.704   3.617   0.935
  162    H    SER  26           H        SER  26  -8.697   5.131   3.918
  163    HA   SER  26           HA       SER  26  -6.506   6.865   3.964
  164    HB2  SER  26           1HB      SER  26  -9.262   6.973   5.148
  165    HB3  SER  26           2HB      SER  26  -8.091   8.236   5.527
  166    HG   SER  26           HG       SER  26  -8.408   7.538   2.848
  167    H    THR  27           H        THR  27  -8.103   5.132   6.620
  168    HA   THR  27           HA       THR  27  -6.766   6.104   8.794
  169    HB   THR  27           HB       THR  27  -7.458   3.200   8.306
  170    HG1  THR  27           HG1      THR  27  -8.933   5.459   9.054
  171   HG21  THR  27          3HG2      THR  27  -5.905   4.092  10.313
  172   HG22  THR  27          1HG2      THR  27  -7.031   2.746  10.487
  173   HG23  THR  27          2HG2      THR  27  -7.496   4.360  11.025
  174    H    LEU  28           H        LEU  28  -5.600   3.736   6.453
  175    HA   LEU  28           HA       LEU  28  -3.213   3.083   7.844
  176    HB2  LEU  28           1HB      LEU  28  -3.735   1.486   6.294
  177    HB3  LEU  28           2HB      LEU  28  -4.279   2.666   5.103
  178    HG   LEU  28           HG       LEU  28  -1.859   3.254   4.736
  179   HD11  LEU  28          1HD1      LEU  28  -1.083   0.640   5.886
  180   HD12  LEU  28          2HD1      LEU  28  -1.343   1.970   7.013
  181   HD13  LEU  28          3HD1      LEU  28  -0.155   2.130   5.720
  182   HD21  LEU  28          3HD2      LEU  28  -1.609   0.628   3.844
  183   HD22  LEU  28          1HD2      LEU  28  -2.285   1.994   2.956
  184   HD23  LEU  28          2HD2      LEU  28  -3.346   0.932   3.882
  185    H    SER  29           H        SER  29  -3.940   5.346   5.209
  186    HA   SER  29           HA       SER  29  -1.398   6.244   4.628
  187    HB2  SER  29           1HB      SER  29  -3.259   6.964   3.286
  188    HB3  SER  29           2HB      SER  29  -4.014   7.762   4.665
  189    HG   SER  29           HG       SER  29  -2.724   9.068   3.070
  190    H    MET  30           H        MET  30  -3.572   7.309   7.210
  191    HA   MET  30           HA       MET  30  -2.061   9.451   8.168
  192    HB2  MET  30           1HB      MET  30  -3.737   7.580   9.846
  193    HB3  MET  30           2HB      MET  30  -3.325   9.250  10.212
  194    HG2  MET  30           1HG      MET  30  -4.542   9.686   7.914
  195    HG3  MET  30           2HG      MET  30  -5.323   8.157   8.312
  196    HE1  MET  30           3HE      MET  30  -7.987   8.670   9.907
  197    HE2  MET  30           1HE      MET  30  -8.166  10.195   9.039
  198    HE3  MET  30           2HE      MET  30  -7.380   8.823   8.257
  199    H    HIS  31           H        HIS  31  -1.667   6.016   8.581
  200    HA   HIS  31           HA       HIS  31   0.297   6.328  10.698
  201    HB2  HIS  31           1HB      HIS  31  -0.845   4.377  11.099
  202    HB3  HIS  31           2HB      HIS  31  -1.083   4.037   9.387
  203    HD1  HIS  31           HD1      HIS  31   1.133   3.302  12.237
  204    HD2  HIS  31           HD2      HIS  31   1.176   2.811   8.112
  205    HE1  HIS  31           HE1      HIS  31   2.974   1.652  11.775
  206    H    GLN  32           H        GLN  32   0.220   5.179   7.334
  207    HA   GLN  32           HA       GLN  32   2.758   4.404   6.874
  208    HB2  GLN  32           1HB      GLN  32   1.013   6.154   5.145
  209    HB3  GLN  32           2HB      GLN  32   2.541   5.486   4.586
  210    HG2  GLN  32           1HG      GLN  32   1.490   3.221   5.354
  211    HG3  GLN  32           2HG      GLN  32  -0.026   4.105   5.189
  212   HE21  GLN  32          1HE2      GLN  32   2.811   2.947   3.509
  213   HE22  GLN  32          2HE2      GLN  32   2.143   3.032   1.918
  214    H    ARG  33           H        ARG  33   1.742   7.607   7.692
  215    HA   ARG  33           HA       ARG  33   3.823   9.164   6.743
  216    HB2  ARG  33           1HB      ARG  33   3.208  10.783   8.351
  217    HB3  ARG  33           2HB      ARG  33   1.727   9.915   7.970
  218    HG2  ARG  33           1HG      ARG  33   1.919   8.626  10.009
  219    HG3  ARG  33           2HG      ARG  33   3.460   9.403  10.378
  220    HD2  ARG  33           1HD      ARG  33   0.893  10.932  10.022
  221    HD3  ARG  33           2HD      ARG  33   1.431  10.313  11.583
  222    HE   ARG  33           HE       ARG  33   3.357  11.953  10.184
  223   HH11  ARG  33          1HH1      ARG  33   0.751  11.852  12.490
  224   HH12  ARG  33          2HH1      ARG  33   1.206  13.334  13.265
  225   HH21  ARG  33          1HH2      ARG  33   3.966  13.904  11.195
  226   HH22  ARG  33          2HH2      ARG  33   3.034  14.501  12.527
  227    H    ILE  34           H        ILE  34   3.648   7.308   9.763
  228    HA   ILE  34           HA       ILE  34   5.951   8.047  11.019
  229    HB   ILE  34           HB       ILE  34   6.043   5.876  12.053
  230   HG12  ILE  34          1HG1      ILE  34   3.926   4.761  10.269
  231   HG13  ILE  34          2HG1      ILE  34   5.584   4.781   9.677
  232   HG21  ILE  34          1HG2      ILE  34   3.164   5.857  11.854
  233   HG22  ILE  34          2HG2      ILE  34   4.195   6.303  13.213
  234   HG23  ILE  34          3HG2      ILE  34   3.786   7.502  11.986
  235   HD11  ILE  34          3HD1      ILE  34   4.588   3.450  12.184
  236   HD12  ILE  34          1HD1      ILE  34   5.096   2.657  10.693
  237   HD13  ILE  34          2HD1      ILE  34   6.276   3.524  11.677
  238    H    HIS  35           H        HIS  35   5.668   6.367   8.026
  239    HA   HIS  35           HA       HIS  35   8.446   5.488   8.057
  240    HB2  HIS  35           1HB      HIS  35   6.273   5.175   5.976
  241    HB3  HIS  35           2HB      HIS  35   7.901   4.519   5.828
  242    HD1  HIS  35           HD1      HIS  35   8.550   2.760   7.827
  243    HD2  HIS  35           HD2      HIS  35   4.513   3.497   7.173
  244    HE1  HIS  35           HE1      HIS  35   7.332   0.848   8.916
  245    H    ARG  36           H        ARG  36   6.376   7.856   6.479
  246    HA   ARG  36           HA       ARG  36   8.508   8.806   4.771
  247    HB2  ARG  36           1HB      ARG  36   5.692   9.784   5.253
  248    HB3  ARG  36           2HB      ARG  36   6.811  10.556   4.137
  249    HG2  ARG  36           1HG      ARG  36   6.820   8.709   2.694
  250    HG3  ARG  36           2HG      ARG  36   6.096   7.652   3.908
  251    HD2  ARG  36           1HD      ARG  36   4.399   8.192   2.326
  252    HD3  ARG  36           2HD      ARG  36   4.047   9.086   3.805
  253    HE   ARG  36           HE       ARG  36   5.427  10.895   2.413
  254   HH11  ARG  36          1HH1      ARG  36   2.811   8.797   1.477
  255   HH12  ARG  36          2HH1      ARG  36   2.184   9.893   0.290
  256   HH21  ARG  36          1HH2      ARG  36   4.612  12.346   0.853
  257   HH22  ARG  36          2HH2      ARG  36   3.210  11.910  -0.065
  258    H    GLY  37           H        GLY  37  10.039   9.378   6.420
  259    HA2  GLY  37           1HA      GLY  37   9.366  11.927   7.757
  260    HA3  GLY  37           2HA      GLY  37  10.379  10.702   8.505
  261    H    GLU  38           H        GLU  38  11.960  12.413   8.735
  262    HA   GLU  38           HA       GLU  38  13.095  13.780   6.559
  263    HB2  GLU  38           1HB      GLU  38  13.411  14.462   8.902
  264    HB3  GLU  38           2HB      GLU  38  14.376  13.021   9.190
  265    HG2  GLU  38           1HG      GLU  38  16.090  13.791   7.715
  266    HG3  GLU  38           2HG      GLU  38  15.096  15.149   7.191
  267    H    LYS  39           H        LYS  39  13.305  12.152   4.932
  268    HA   LYS  39           HA       LYS  39  15.847  10.716   5.136
  269    HB2  LYS  39           1HB      LYS  39  13.241   9.464   4.251
  270    HB3  LYS  39           2HB      LYS  39  14.822   8.719   4.052
  271    HG2  LYS  39           1HG      LYS  39  13.825   9.555   6.750
  272    HG3  LYS  39           2HG      LYS  39  13.383   8.000   6.041
  273    HD2  LYS  39           1HD      LYS  39  15.746   7.418   5.833
  274    HD3  LYS  39           2HD      LYS  39  16.199   8.981   6.516
  275    HE2  LYS  39           1HE      LYS  39  16.337   7.554   8.341
  276    HE3  LYS  39           2HE      LYS  39  14.736   8.270   8.520
  277    HZ1  LYS  39           3HZ      LYS  39  14.192   6.116   7.032
  278    HZ2  LYS  39           1HZ      LYS  39  14.103   6.143   8.721
  279    HZ3  LYS  39           2HZ      LYS  39  15.482   5.531   7.957
  280    HA   PRO  40           HA       PRO  40  16.506  12.297   1.089
  281    HB2  PRO  40           1HB      PRO  40  18.253  10.451   0.132
  282    HB3  PRO  40           2HB      PRO  40  18.698  11.658   1.344
  283    HG2  PRO  40           1HG      PRO  40  17.955   8.783   1.719
  284    HG3  PRO  40           2HG      PRO  40  19.255   9.711   2.487
  285    HD2  PRO  40           1HD      PRO  40  16.908   9.189   3.731
  286    HD3  PRO  40           2HD      PRO  40  17.831  10.677   4.020
  287    H    SER  41           H        SER  41  15.171  12.220  -0.595
  288    HA   SER  41           HA       SER  41  14.584   9.655  -1.862
  289    HB2  SER  41           1HB      SER  41  12.682   9.798  -0.464
  290    HB3  SER  41           2HB      SER  41  12.517  11.534  -0.727
  291    HG   SER  41           HG       SER  41  12.104   9.497  -2.663
  292    H    GLY  42           H        GLY  42  14.130   9.788  -4.052
  293    HA2  GLY  42           1HA      GLY  42  14.997  12.244  -5.321
  294    HA3  GLY  42           2HA      GLY  42  14.652  10.719  -6.122
  295    HA   PRO  43           HA       PRO  43  11.082  13.920  -6.371
  296    HB2  PRO  43           1HB      PRO  43  11.670  15.117  -8.736
  297    HB3  PRO  43           2HB      PRO  43  12.223  15.744  -7.178
  298    HG2  PRO  43           1HG      PRO  43  13.703  14.093  -9.189
  299    HG3  PRO  43           2HG      PRO  43  14.264  15.497  -8.264
  300    HD2  PRO  43           1HD      PRO  43  14.881  12.954  -7.568
  301    HD3  PRO  43           2HD      PRO  43  14.669  14.247  -6.370
  302    H    SER  44           H        SER  44  12.433  11.352  -8.004
  303    HA   SER  44           HA       SER  44  10.789  11.177 -10.301
  304    HB2  SER  44           1HB      SER  44  11.489   8.804 -10.358
  305    HB3  SER  44           2HB      SER  44  12.857   9.889 -10.111
  306    HG   SER  44           HG       SER  44  13.127   8.349  -8.600
  307    H    SER  45           H        SER  45   8.648  11.520  -9.798
  308    HA   SER  45           HA       SER  45   7.386   9.576  -7.983
  309    HB2  SER  45           1HB      SER  45   7.124  12.031  -7.461
  310    HB3  SER  45           2HB      SER  45   6.207  12.185  -8.959
  311    HG   SER  45           HG       SER  45   5.275  11.500  -6.625
  312    H    GLY  46           H        GLY  46   6.561  11.420 -10.931
  313    HA2  GLY  46           1HA      GLY  46   6.086  10.102 -12.967
  314    HA3  GLY  46           2HA      GLY  46   5.219   8.982 -11.927
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1   8.524 -13.515 -12.086
    2    HA2  GLY   1           1HA      GLY   1   6.657 -15.557 -12.853
    3    HA3  GLY   1           2HA      GLY   1   7.447 -15.399 -11.291
    4    H    SER   2           H        SER   2   4.544 -15.706 -12.459
    5    HA   SER   2           HA       SER   2   2.838 -13.727 -11.941
    6    HB2  SER   2           1HB      SER   2   2.582 -16.554 -10.889
    7    HB3  SER   2           2HB      SER   2   1.252 -15.399 -10.970
    8    HG   SER   2           HG       SER   2   2.683 -15.758 -13.312
    9    H    SER   3           H        SER   3   1.879 -12.681 -10.213
   10    HA   SER   3           HA       SER   3   3.110 -13.129  -7.576
   11    HB2  SER   3           1HB      SER   3   3.970 -11.072  -8.803
   12    HB3  SER   3           2HB      SER   3   2.348 -10.404  -8.632
   13    HG   SER   3           HG       SER   3   2.578 -10.444  -6.421
   14    H    GLY   4           H        GLY   4   1.789 -12.907  -5.791
   15    HA2  GLY   4           1HA      GLY   4  -0.323 -11.965  -4.890
   16    HA3  GLY   4           2HA      GLY   4  -1.078 -12.498  -6.385
   17    H    SER   5           H        SER   5  -0.580 -13.247  -3.192
   18    HA   SER   5           HA       SER   5  -1.363 -16.042  -3.668
   19    HB2  SER   5           1HB      SER   5   0.575 -15.095  -1.542
   20    HB3  SER   5           2HB      SER   5   0.002 -16.750  -1.749
   21    HG   SER   5           HG       SER   5   1.878 -15.324  -3.199
   22    H    SER   6           H        SER   6  -3.161 -13.980  -3.251
   23    HA   SER   6           HA       SER   6  -3.871 -13.775  -0.481
   24    HB2  SER   6           1HB      SER   6  -4.380 -12.044  -2.265
   25    HB3  SER   6           2HB      SER   6  -5.633 -13.137  -2.853
   26    HG   SER   6           HG       SER   6  -5.479 -12.153  -0.195
   27    H    GLY   7           H        GLY   7  -4.803 -15.332   0.657
   28    HA2  GLY   7           1HA      GLY   7  -6.197 -17.495  -0.720
   29    HA3  GLY   7           2HA      GLY   7  -5.715 -17.477   0.970
   30    H    THR   8           H        THR   8  -7.029 -16.413   2.497
   31    HA   THR   8           HA       THR   8  -9.789 -15.977   1.563
   32    HB   THR   8           HB       THR   8  -8.836 -16.841   4.301
   33    HG1  THR   8           HG1      THR   8 -10.271 -18.254   2.279
   34   HG21  THR   8          3HG2      THR   8 -11.682 -17.056   3.569
   35   HG22  THR   8          1HG2      THR   8 -11.084 -15.413   3.800
   36   HG23  THR   8          2HG2      THR   8 -10.936 -16.597   5.100
   37    H    GLY   9           H        GLY   9  -7.428 -14.883   3.999
   38    HA2  GLY   9           1HA      GLY   9  -8.973 -12.467   4.481
   39    HA3  GLY   9           2HA      GLY   9  -7.494 -12.942   5.302
   40    H    GLU  10           H        GLU  10  -6.320 -11.102   5.070
   41    HA   GLU  10           HA       GLU  10  -5.021  -9.517   4.081
   42    HB2  GLU  10           1HB      GLU  10  -4.184 -11.705   2.987
   43    HB3  GLU  10           2HB      GLU  10  -5.060 -11.158   1.564
   44    HG2  GLU  10           1HG      GLU  10  -3.735  -9.055   1.635
   45    HG3  GLU  10           2HG      GLU  10  -2.783  -9.758   2.941
   46    H    ARG  11           H        ARG  11  -7.676  -8.908   4.062
   47    HA   ARG  11           HA       ARG  11  -8.182  -7.811   1.380
   48    HB2  ARG  11           1HB      ARG  11  -9.945  -9.278   2.309
   49    HB3  ARG  11           2HB      ARG  11 -10.113  -8.185   3.676
   50    HG2  ARG  11           1HG      ARG  11 -10.927  -6.436   2.267
   51    HG3  ARG  11           2HG      ARG  11 -10.566  -7.372   0.815
   52    HD2  ARG  11           1HD      ARG  11 -12.255  -8.978   1.348
   53    HD3  ARG  11           2HD      ARG  11 -12.506  -8.262   2.940
   54    HE   ARG  11           HE       ARG  11 -12.989  -6.346   0.919
   55   HH11  ARG  11          1HH1      ARG  11 -14.372  -9.191   2.373
   56   HH12  ARG  11          2HH1      ARG  11 -16.005  -8.744   2.006
   57   HH21  ARG  11          1HH2      ARG  11 -15.134  -5.747   0.430
   58   HH22  ARG  11          2HH2      ARG  11 -16.437  -6.785   0.900
   59    H    HIS  12           H        HIS  12  -7.986  -7.001   4.802
   60    HA   HIS  12           HA       HIS  12  -8.639  -4.239   4.439
   61    HB2  HIS  12           1HB      HIS  12  -7.512  -4.157   6.820
   62    HB3  HIS  12           2HB      HIS  12  -9.094  -4.898   6.601
   63    HD1  HIS  12           HD1      HIS  12  -9.237  -6.943   7.964
   64    HD2  HIS  12           HD2      HIS  12  -5.448  -6.451   6.332
   65    HE1  HIS  12           HE1      HIS  12  -7.918  -8.950   8.710
   66    H    TYR  13           H        TYR  13  -7.358  -2.634   3.805
   67    HA   TYR  13           HA       TYR  13  -4.967  -2.791   2.617
   68    HB2  TYR  13           1HB      TYR  13  -5.573  -0.508   4.497
   69    HB3  TYR  13           2HB      TYR  13  -4.628  -0.460   3.013
   70    HD1  TYR  13           HD2      TYR  13  -8.050  -0.807   4.368
   71    HD2  TYR  13           HD1      TYR  13  -5.672  -0.143   0.903
   72    HE1  TYR  13           HE2      TYR  13 -10.067  -0.175   3.112
   73    HE2  TYR  13           HE1      TYR  13  -7.683   0.492  -0.363
   74    HH   TYR  13           HH       TYR  13 -10.300   1.487   0.722
   75    H    GLU  14           H        GLU  14  -3.030  -3.530   3.145
   76    HA   GLU  14           HA       GLU  14  -2.255  -3.559   5.982
   77    HB2  GLU  14           1HB      GLU  14  -1.357  -5.270   3.662
   78    HB3  GLU  14           2HB      GLU  14  -0.602  -5.312   5.249
   79    HG2  GLU  14           1HG      GLU  14  -2.045  -7.038   5.491
   80    HG3  GLU  14           2HG      GLU  14  -3.093  -5.725   6.026
   81    H    CYS  15           H        CYS  15  -0.152  -2.944   6.593
   82    HA   CYS  15           HA       CYS  15   0.980  -0.873   4.905
   83    HB2  CYS  15           1HB      CYS  15   0.647  -0.463   7.315
   84    HB3  CYS  15           2HB      CYS  15   1.764  -1.773   7.686
   85    H    SER  16           H        SER  16   2.736  -1.084   3.680
   86    HA   SER  16           HA       SER  16   4.165  -3.623   3.717
   87    HB2  SER  16           1HB      SER  16   3.980  -1.346   1.764
   88    HB3  SER  16           2HB      SER  16   5.279  -2.532   1.634
   89    HG   SER  16           HG       SER  16   3.896  -3.832   0.758
   90    H    GLU  17           H        GLU  17   4.513  -1.474   5.777
   91    HA   GLU  17           HA       GLU  17   7.397  -0.998   5.406
   92    HB2  GLU  17           1HB      GLU  17   5.497   0.564   7.161
   93    HB3  GLU  17           2HB      GLU  17   7.189   0.932   6.858
   94    HG2  GLU  17           1HG      GLU  17   5.264   0.799   4.583
   95    HG3  GLU  17           2HG      GLU  17   5.332   2.234   5.604
   96    H    CYS  18           H        CYS  18   4.907  -1.709   7.839
   97    HA   CYS  18           HA       CYS  18   6.972  -3.109   9.407
   98    HB2  CYS  18           1HB      CYS  18   5.689  -2.503  11.443
   99    HB3  CYS  18           2HB      CYS  18   6.323  -1.097  10.595
  100    H    GLY  19           H        GLY  19   3.610  -3.002   8.367
  101    HA2  GLY  19           1HA      GLY  19   2.724  -5.210   7.649
  102    HA3  GLY  19           2HA      GLY  19   3.365  -5.839   9.160
  103    H    LYS  20           H        LYS  20   2.052  -2.719   9.427
  104    HA   LYS  20           HA       LYS  20  -0.041  -3.643  11.143
  105    HB2  LYS  20           1HB      LYS  20   1.311  -1.450  11.297
  106    HB3  LYS  20           2HB      LYS  20   0.197  -0.838  10.081
  107    HG2  LYS  20           1HG      LYS  20  -1.646  -1.019  11.525
  108    HG3  LYS  20           2HG      LYS  20  -0.759  -2.038  12.660
  109    HD2  LYS  20           1HD      LYS  20   0.751  -0.105  13.108
  110    HD3  LYS  20           2HD      LYS  20  -0.301   0.890  12.097
  111    HE2  LYS  20           1HE      LYS  20  -1.102   1.320  14.225
  112    HE3  LYS  20           2HE      LYS  20  -2.185   0.046  13.664
  113    HZ1  LYS  20           3HZ      LYS  20  -1.241  -1.494  15.050
  114    HZ2  LYS  20           1HZ      LYS  20  -1.093  -0.102  16.000
  115    HZ3  LYS  20           2HZ      LYS  20   0.243  -0.688  15.145
  116    H    ALA  21           H        ALA  21  -2.199  -3.794  10.781
  117    HA   ALA  21           HA       ALA  21  -3.104  -3.331   8.016
  118    HB1  ALA  21           3HB      ALA  21  -3.979  -5.369   8.031
  119    HB2  ALA  21           1HB      ALA  21  -3.246  -5.635   9.613
  120    HB3  ALA  21           2HB      ALA  21  -4.892  -5.011   9.496
  121    H    PHE  22           H        PHE  22  -4.990  -2.226   7.632
  122    HA   PHE  22           HA       PHE  22  -6.448  -1.171   9.952
  123    HB2  PHE  22           1HB      PHE  22  -5.839   0.602   7.603
  124    HB3  PHE  22           2HB      PHE  22  -6.335   1.056   9.230
  125    HD1  PHE  22           HD2      PHE  22  -3.530  -0.743   7.548
  126    HD2  PHE  22           HD1      PHE  22  -4.741   1.977  10.589
  127    HE1  PHE  22           HE2      PHE  22  -1.174  -0.384   8.159
  128    HE2  PHE  22           HE1      PHE  22  -2.386   2.342  11.205
  129    HZ   PHE  22           HZ       PHE  22  -0.600   1.160   9.991
  130    H    ILE  23           H        ILE  23  -8.584  -1.348   9.751
  131    HA   ILE  23           HA       ILE  23  -9.832  -2.689   7.678
  132    HB   ILE  23           HB       ILE  23 -10.984  -2.555   9.739
  133   HG12  ILE  23          1HG1      ILE  23 -12.600  -0.691   8.016
  134   HG13  ILE  23          2HG1      ILE  23 -12.317  -2.360   7.534
  135   HG21  ILE  23          1HG2      ILE  23 -10.320  -0.682  10.867
  136   HG22  ILE  23          2HG2      ILE  23 -10.514   0.367   9.463
  137   HG23  ILE  23          3HG2      ILE  23 -11.932  -0.174  10.362
  138   HD11  ILE  23          3HD1      ILE  23 -14.221  -1.296   9.388
  139   HD12  ILE  23          1HD1      ILE  23 -14.081  -2.928   8.735
  140   HD13  ILE  23          2HD1      ILE  23 -13.185  -2.478  10.186
  141    H    GLN  24           H        GLN  24  -9.259   0.752   8.085
  142    HA   GLN  24           HA       GLN  24 -10.615   1.272   5.530
  143    HB2  GLN  24           1HB      GLN  24  -9.731   3.245   7.642
  144    HB3  GLN  24           2HB      GLN  24 -10.656   3.619   6.195
  145    HG2  GLN  24           1HG      GLN  24 -11.731   1.620   8.120
  146    HG3  GLN  24           2HG      GLN  24 -11.833   3.336   8.511
  147   HE21  GLN  24          1HE2      GLN  24 -13.509   0.872   7.246
  148   HE22  GLN  24          2HE2      GLN  24 -14.567   1.727   6.182
  149    H    LYS  25           H        LYS  25  -9.581   2.924   4.120
  150    HA   LYS  25           HA       LYS  25  -6.772   2.271   3.792
  151    HB2  LYS  25           1HB      LYS  25  -8.678   2.490   1.963
  152    HB3  LYS  25           2HB      LYS  25  -8.194   4.181   1.991
  153    HG2  LYS  25           1HG      LYS  25  -6.080   2.108   1.723
  154    HG3  LYS  25           2HG      LYS  25  -7.100   2.467   0.328
  155    HD2  LYS  25           1HD      LYS  25  -6.502   4.836   0.505
  156    HD3  LYS  25           2HD      LYS  25  -5.480   4.473   1.898
  157    HE2  LYS  25           1HE      LYS  25  -5.086   3.173  -0.785
  158    HE3  LYS  25           2HE      LYS  25  -4.319   4.700  -0.353
  159    HZ1  LYS  25           3HZ      LYS  25  -2.962   2.640   0.031
  160    HZ2  LYS  25           1HZ      LYS  25  -4.031   2.247   1.283
  161    HZ3  LYS  25           2HZ      LYS  25  -3.115   3.666   1.367
  162    H    SER  26           H        SER  26  -8.756   4.955   4.779
  163    HA   SER  26           HA       SER  26  -6.788   6.985   4.497
  164    HB2  SER  26           1HB      SER  26  -9.323   6.807   6.129
  165    HB3  SER  26           2HB      SER  26  -8.298   8.241   6.118
  166    HG   SER  26           HG       SER  26  -8.563   8.128   3.745
  167    H    THR  27           H        THR  27  -7.825   4.956   7.209
  168    HA   THR  27           HA       THR  27  -6.283   6.103   9.223
  169    HB   THR  27           HB       THR  27  -6.927   3.161   8.949
  170    HG1  THR  27           HG1      THR  27  -8.683   4.097  10.500
  171   HG21  THR  27          3HG2      THR  27  -5.276   4.155  10.749
  172   HG22  THR  27          1HG2      THR  27  -6.463   2.927  11.187
  173   HG23  THR  27          2HG2      THR  27  -6.779   4.625  11.542
  174    H    LEU  28           H        LEU  28  -5.380   3.947   6.637
  175    HA   LEU  28           HA       LEU  28  -2.818   3.275   7.766
  176    HB2  LEU  28           1HB      LEU  28  -3.563   1.598   6.387
  177    HB3  LEU  28           2HB      LEU  28  -4.250   2.721   5.216
  178    HG   LEU  28           HG       LEU  28  -1.906   3.272   4.509
  179   HD11  LEU  28          1HD1      LEU  28  -1.163   0.795   6.046
  180   HD12  LEU  28          2HD1      LEU  28  -0.874   2.430   6.637
  181   HD13  LEU  28          3HD1      LEU  28  -0.097   1.879   5.153
  182   HD21  LEU  28          3HD2      LEU  28  -3.354   0.751   4.092
  183   HD22  LEU  28          1HD2      LEU  28  -1.651   0.718   3.632
  184   HD23  LEU  28          2HD2      LEU  28  -2.733   1.915   2.920
  185    H    SER  29           H        SER  29  -4.001   5.406   5.191
  186    HA   SER  29           HA       SER  29  -1.552   6.322   4.239
  187    HB2  SER  29           1HB      SER  29  -3.952   6.760   3.359
  188    HB3  SER  29           2HB      SER  29  -3.942   8.137   4.460
  189    HG   SER  29           HG       SER  29  -3.060   8.201   2.082
  190    H    MET  30           H        MET  30  -3.319   7.171   7.121
  191    HA   MET  30           HA       MET  30  -1.779   9.529   7.687
  192    HB2  MET  30           1HB      MET  30  -2.941   9.504   9.851
  193    HB3  MET  30           2HB      MET  30  -4.067   9.324   8.512
  194    HG2  MET  30           1HG      MET  30  -4.527   7.127   9.013
  195    HG3  MET  30           2HG      MET  30  -3.008   6.897   9.876
  196    HE1  MET  30           3HE      MET  30  -3.918   6.470  13.009
  197    HE2  MET  30           1HE      MET  30  -5.427   5.897  12.297
  198    HE3  MET  30           2HE      MET  30  -3.902   5.654  11.445
  199    H    HIS  31           H        HIS  31  -1.432   6.148   8.235
  200    HA   HIS  31           HA       HIS  31   0.498   6.476  10.378
  201    HB2  HIS  31           1HB      HIS  31  -0.742   4.543  10.721
  202    HB3  HIS  31           2HB      HIS  31  -0.773   4.136   9.008
  203    HD1  HIS  31           HD1      HIS  31   1.873   4.396  11.740
  204    HD2  HIS  31           HD2      HIS  31   0.883   2.088   8.430
  205    HE1  HIS  31           HE1      HIS  31   3.599   2.568  11.654
  206    H    GLN  32           H        GLN  32   0.482   5.270   7.031
  207    HA   GLN  32           HA       GLN  32   3.085   4.560   6.685
  208    HB2  GLN  32           1HB      GLN  32   1.454   6.164   4.709
  209    HB3  GLN  32           2HB      GLN  32   2.849   5.164   4.329
  210    HG2  GLN  32           1HG      GLN  32   1.364   3.306   5.493
  211    HG3  GLN  32           2HG      GLN  32   0.067   4.380   4.971
  212   HE21  GLN  32          1HE2      GLN  32  -0.728   3.964   3.049
  213   HE22  GLN  32          2HE2      GLN  32   0.100   3.193   1.743
  214    H    ARG  33           H        ARG  33   1.879   7.715   7.318
  215    HA   ARG  33           HA       ARG  33   4.011   9.238   6.249
  216    HB2  ARG  33           1HB      ARG  33   2.995  11.063   7.206
  217    HB3  ARG  33           2HB      ARG  33   1.639   9.944   7.155
  218    HG2  ARG  33           1HG      ARG  33   1.903   9.417   9.474
  219    HG3  ARG  33           2HG      ARG  33   3.401  10.345   9.560
  220    HD2  ARG  33           1HD      ARG  33   2.247  12.397   9.254
  221    HD3  ARG  33           2HD      ARG  33   0.756  11.568   8.810
  222    HE   ARG  33           HE       ARG  33   0.307  11.219  11.044
  223   HH11  ARG  33          1HH1      ARG  33   3.552  12.418  10.652
  224   HH12  ARG  33          2HH1      ARG  33   3.785  12.717  12.342
  225   HH21  ARG  33          1HH2      ARG  33   0.602  11.609  13.272
  226   HH22  ARG  33          2HH2      ARG  33   2.107  12.255  13.832
  227    H    ILE  34           H        ILE  34   3.434   7.792   9.422
  228    HA   ILE  34           HA       ILE  34   5.669   8.919  10.723
  229    HB   ILE  34           HB       ILE  34   5.284   7.412  12.485
  230   HG12  ILE  34          1HG1      ILE  34   3.568   5.440  11.891
  231   HG13  ILE  34          2HG1      ILE  34   4.328   5.619  10.313
  232   HG21  ILE  34          1HG2      ILE  34   2.559   7.174  12.136
  233   HG22  ILE  34          2HG2      ILE  34   3.404   8.563  12.817
  234   HG23  ILE  34          3HG2      ILE  34   2.990   8.537  11.103
  235   HD11  ILE  34          3HD1      ILE  34   5.291   3.918  11.980
  236   HD12  ILE  34          1HD1      ILE  34   6.402   4.967  11.101
  237   HD13  ILE  34          2HD1      ILE  34   5.990   5.327  12.778
  238    H    HIS  35           H        HIS  35   5.415   6.470   8.366
  239    HA   HIS  35           HA       HIS  35   7.862   5.110   9.094
  240    HB2  HIS  35           1HB      HIS  35   5.792   4.799   6.972
  241    HB3  HIS  35           2HB      HIS  35   7.395   4.141   6.660
  242    HD1  HIS  35           HD1      HIS  35   8.267   2.515   8.749
  243    HD2  HIS  35           HD2      HIS  35   4.178   3.056   8.253
  244    HE1  HIS  35           HE1      HIS  35   7.183   0.603   9.971
  245    H    ARG  36           H        ARG  36   6.780   7.427   6.657
  246    HA   ARG  36           HA       ARG  36   9.360   7.530   5.376
  247    HB2  ARG  36           1HB      ARG  36   8.358   9.330   4.020
  248    HB3  ARG  36           2HB      ARG  36   7.358   7.883   4.044
  249    HG2  ARG  36           1HG      ARG  36   6.052   9.018   5.914
  250    HG3  ARG  36           2HG      ARG  36   6.898  10.493   5.444
  251    HD2  ARG  36           1HD      ARG  36   6.080   9.963   3.068
  252    HD3  ARG  36           2HD      ARG  36   4.966   8.842   3.850
  253    HE   ARG  36           HE       ARG  36   3.730  10.630   4.578
  254   HH11  ARG  36          1HH1      ARG  36   6.836  11.751   3.475
  255   HH12  ARG  36          2HH1      ARG  36   6.411  13.428   3.575
  256   HH21  ARG  36          1HH2      ARG  36   3.159  12.834   4.713
  257   HH22  ARG  36          2HH2      ARG  36   4.320  14.043   4.279
  258    H    GLY  37           H        GLY  37   7.485   9.576   7.575
  259    HA2  GLY  37           1HA      GLY  37   9.060  11.842   7.639
  260    HA3  GLY  37           2HA      GLY  37   8.160  11.231   9.019
  261    H    GLU  38           H        GLU  38  10.436  12.555   9.536
  262    HA   GLU  38           HA       GLU  38  12.814  11.087   9.570
  263    HB2  GLU  38           1HB      GLU  38  12.358  13.583  10.140
  264    HB3  GLU  38           2HB      GLU  38  12.093  12.992  11.774
  265    HG2  GLU  38           1HG      GLU  38  14.294  12.364  12.050
  266    HG3  GLU  38           2HG      GLU  38  14.588  12.253  10.316
  267    H    LYS  39           H        LYS  39  13.913  10.412  11.687
  268    HA   LYS  39           HA       LYS  39  12.044   9.053  13.493
  269    HB2  LYS  39           1HB      LYS  39  14.148   7.797  11.785
  270    HB3  LYS  39           2HB      LYS  39  13.847   7.123  13.381
  271    HG2  LYS  39           1HG      LYS  39  11.783   6.345  12.818
  272    HG3  LYS  39           2HG      LYS  39  11.510   7.610  11.618
  273    HD2  LYS  39           1HD      LYS  39  13.561   5.448  11.224
  274    HD3  LYS  39           2HD      LYS  39  11.873   5.236  10.753
  275    HE2  LYS  39           1HE      LYS  39  12.073   7.301   9.372
  276    HE3  LYS  39           2HE      LYS  39  13.795   7.332   9.751
  277    HZ1  LYS  39           3HZ      LYS  39  12.924   6.192   7.587
  278    HZ2  LYS  39           1HZ      LYS  39  12.650   4.881   8.620
  279    HZ3  LYS  39           2HZ      LYS  39  14.209   5.516   8.455
  280    HA   PRO  40           HA       PRO  40  14.723  10.617  16.616
  281    HB2  PRO  40           1HB      PRO  40  14.077   8.917  18.632
  282    HB3  PRO  40           2HB      PRO  40  13.003  10.210  18.084
  283    HG2  PRO  40           1HG      PRO  40  12.948   7.292  17.416
  284    HG3  PRO  40           2HG      PRO  40  11.601   8.376  17.811
  285    HD2  PRO  40           1HD      PRO  40  12.209   7.674  15.267
  286    HD3  PRO  40           2HD      PRO  40  11.521   9.257  15.682
  287    H    SER  41           H        SER  41  16.857  10.310  16.431
  288    HA   SER  41           HA       SER  41  17.998   7.676  16.167
  289    HB2  SER  41           1HB      SER  41  19.042  10.476  16.064
  290    HB3  SER  41           2HB      SER  41  20.181   9.159  16.348
  291    HG   SER  41           HG       SER  41  18.852   8.254  14.400
  292    H    GLY  42           H        GLY  42  18.448  10.353  18.488
  293    HA2  GLY  42           1HA      GLY  42  18.529   8.491  20.694
  294    HA3  GLY  42           2HA      GLY  42  20.084   9.226  20.329
  295    HA   PRO  43           HA       PRO  43  17.004  12.687  21.824
  296    HB2  PRO  43           1HB      PRO  43  14.956  11.768  23.351
  297    HB3  PRO  43           2HB      PRO  43  14.828  11.983  21.601
  298    HG2  PRO  43           1HG      PRO  43  15.338   9.485  23.171
  299    HG3  PRO  43           2HG      PRO  43  14.273   9.732  21.775
  300    HD2  PRO  43           1HD      PRO  43  16.726   8.607  21.555
  301    HD3  PRO  43           2HD      PRO  43  16.010   9.596  20.266
  302    H    SER  44           H        SER  44  17.568  13.782  23.629
  303    HA   SER  44           HA       SER  44  19.065  12.405  25.656
  304    HB2  SER  44           1HB      SER  44  18.375  15.292  25.154
  305    HB3  SER  44           2HB      SER  44  19.168  14.790  26.647
  306    HG   SER  44           HG       SER  44  20.252  13.866  24.254
  307    H    SER  45           H        SER  45  17.846  11.179  26.989
  308    HA   SER  45           HA       SER  45  15.326  12.147  28.030
  309    HB2  SER  45           1HB      SER  45  15.487   9.791  27.493
  310    HB3  SER  45           2HB      SER  45  16.883   9.604  28.553
  311    HG   SER  45           HG       SER  45  14.370  10.494  29.498
  312    H    GLY  46           H        GLY  46  18.540  11.351  29.320
  313    HA2  GLY  46           1HA      GLY  46  19.483  11.784  31.383
  314    HA3  GLY  46           2HA      GLY  46  18.822  13.387  31.099
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1 -13.425 -20.484 -15.962
    2    HA2  GLY   1           1HA      GLY   1 -12.831 -20.260 -18.242
    3    HA3  GLY   1           2HA      GLY   1 -14.387 -21.074 -18.308
    4    H    SER   2           H        SER   2 -16.023 -18.905 -17.542
    5    HA   SER   2           HA       SER   2 -15.882 -17.327 -20.007
    6    HB2  SER   2           1HB      SER   2 -17.970 -18.628 -19.409
    7    HB3  SER   2           2HB      SER   2 -18.199 -17.500 -18.073
    8    HG   SER   2           HG       SER   2 -18.055 -15.826 -19.787
    9    H    SER   3           H        SER   3 -14.344 -15.793 -19.399
   10    HA   SER   3           HA       SER   3 -13.511 -13.906 -18.428
   11    HB2  SER   3           1HB      SER   3 -15.698 -13.131 -19.519
   12    HB3  SER   3           2HB      SER   3 -16.380 -13.143 -17.893
   13    HG   SER   3           HG       SER   3 -15.035 -11.531 -17.302
   14    H    GLY   4           H        GLY   4 -13.590 -16.083 -16.691
   15    HA2  GLY   4           1HA      GLY   4 -14.688 -15.196 -14.157
   16    HA3  GLY   4           2HA      GLY   4 -13.805 -16.687 -14.449
   17    H    SER   5           H        SER   5 -12.992 -13.246 -14.892
   18    HA   SER   5           HA       SER   5 -10.526 -13.745 -13.364
   19    HB2  SER   5           1HB      SER   5 -11.092 -11.549 -15.371
   20    HB3  SER   5           2HB      SER   5  -9.552 -11.851 -14.566
   21    HG   SER   5           HG       SER   5 -10.714 -13.143 -16.704
   22    H    SER   6           H        SER   6 -12.889 -13.303 -11.959
   23    HA   SER   6           HA       SER   6 -13.483 -10.679 -11.273
   24    HB2  SER   6           1HB      SER   6 -13.573 -13.200  -9.606
   25    HB3  SER   6           2HB      SER   6 -14.234 -11.656  -9.068
   26    HG   SER   6           HG       SER   6 -15.039 -13.212 -11.295
   27    H    GLY   7           H        GLY   7 -11.928  -9.224 -10.846
   28    HA2  GLY   7           1HA      GLY   7 -10.051  -9.876  -8.659
   29    HA3  GLY   7           2HA      GLY   7  -9.534  -9.000 -10.092
   30    H    THR   8           H        THR   8 -10.826  -8.754  -6.971
   31    HA   THR   8           HA       THR   8 -10.974  -5.849  -7.249
   32    HB   THR   8           HB       THR   8 -13.171  -7.412  -5.883
   33    HG1  THR   8           HG1      THR   8 -13.499  -5.888  -8.241
   34   HG21  THR   8          3HG2      THR   8 -12.411  -4.586  -5.992
   35   HG22  THR   8          1HG2      THR   8 -13.448  -5.436  -4.847
   36   HG23  THR   8          2HG2      THR   8 -14.102  -4.889  -6.390
   37    H    GLY   9           H        GLY   9 -10.220  -4.759  -5.502
   38    HA2  GLY   9           1HA      GLY   9  -8.748  -6.178  -3.537
   39    HA3  GLY   9           2HA      GLY   9  -9.051  -4.447  -3.548
   40    H    GLU  10           H        GLU  10  -9.723  -7.376  -2.025
   41    HA   GLU  10           HA       GLU  10 -11.947  -6.142  -0.533
   42    HB2  GLU  10           1HB      GLU  10 -12.421  -8.668   0.024
   43    HB3  GLU  10           2HB      GLU  10 -13.000  -7.957  -1.476
   44    HG2  GLU  10           1HG      GLU  10 -11.117  -8.900  -2.679
   45    HG3  GLU  10           2HG      GLU  10 -10.476  -9.569  -1.179
   46    H    ARG  11           H        ARG  11  -8.994  -8.033  -0.369
   47    HA   ARG  11           HA       ARG  11  -9.000  -8.547   2.398
   48    HB2  ARG  11           1HB      ARG  11  -6.968  -8.558   0.231
   49    HB3  ARG  11           2HB      ARG  11  -6.371  -8.483   1.883
   50    HG2  ARG  11           1HG      ARG  11  -6.441 -10.770   1.174
   51    HG3  ARG  11           2HG      ARG  11  -7.679 -10.515   2.405
   52    HD2  ARG  11           1HD      ARG  11  -8.557 -11.868   0.592
   53    HD3  ARG  11           2HD      ARG  11  -9.372 -10.306   0.641
   54    HE   ARG  11           HE       ARG  11  -8.496  -9.818  -1.421
   55   HH11  ARG  11          1HH1      ARG  11  -6.830 -12.566  -0.081
   56   HH12  ARG  11          2HH1      ARG  11  -5.970 -12.921  -1.542
   57   HH21  ARG  11          1HH2      ARG  11  -7.369 -10.276  -3.350
   58   HH22  ARG  11          2HH2      ARG  11  -6.276 -11.618  -3.401
   59    H    HIS  12           H        HIS  12  -8.612  -7.290   4.103
   60    HA   HIS  12           HA       HIS  12  -8.557  -4.560   4.074
   61    HB2  HIS  12           1HB      HIS  12  -7.772  -4.634   6.363
   62    HB3  HIS  12           2HB      HIS  12  -8.894  -5.965   6.097
   63    HD1  HIS  12           HD1      HIS  12  -8.117  -8.009   7.224
   64    HD2  HIS  12           HD2      HIS  12  -4.937  -5.736   5.815
   65    HE1  HIS  12           HE1      HIS  12  -6.045  -9.287   7.856
   66    H    TYR  13           H        TYR  13  -6.970  -2.956   4.241
   67    HA   TYR  13           HA       TYR  13  -4.636  -3.407   2.686
   68    HB2  TYR  13           1HB      TYR  13  -5.349  -1.028   4.413
   69    HB3  TYR  13           2HB      TYR  13  -4.104  -1.063   3.169
   70    HD1  TYR  13           HD2      TYR  13  -7.713  -0.990   3.814
   71    HD2  TYR  13           HD1      TYR  13  -4.689  -0.992   0.820
   72    HE1  TYR  13           HE2      TYR  13  -9.379  -0.305   2.139
   73    HE2  TYR  13           HE1      TYR  13  -6.346  -0.306  -0.863
   74    HH   TYR  13           HH       TYR  13  -8.585  -0.128  -1.277
   75    H    GLU  14           H        GLU  14  -2.502  -3.545   3.272
   76    HA   GLU  14           HA       GLU  14  -1.898  -3.660   6.147
   77    HB2  GLU  14           1HB      GLU  14  -1.495  -5.756   4.080
   78    HB3  GLU  14           2HB      GLU  14  -0.209  -5.539   5.258
   79    HG2  GLU  14           1HG      GLU  14  -2.991  -5.759   6.262
   80    HG3  GLU  14           2HG      GLU  14  -2.204  -7.216   5.657
   81    H    CYS  15           H        CYS  15  -0.150  -2.537   6.725
   82    HA   CYS  15           HA       CYS  15   1.272  -0.992   4.805
   83    HB2  CYS  15           1HB      CYS  15   0.761  -0.394   7.248
   84    HB3  CYS  15           2HB      CYS  15   2.130  -1.421   7.662
   85    H    SER  16           H        SER  16   2.772  -1.790   3.499
   86    HA   SER  16           HA       SER  16   4.134  -4.233   3.968
   87    HB2  SER  16           1HB      SER  16   4.674  -2.026   1.968
   88    HB3  SER  16           2HB      SER  16   5.459  -3.605   1.950
   89    HG   SER  16           HG       SER  16   2.673  -3.550   2.028
   90    H    GLU  17           H        GLU  17   4.724  -1.010   4.943
   91    HA   GLU  17           HA       GLU  17   7.550  -1.116   5.178
   92    HB2  GLU  17           1HB      GLU  17   5.419   0.627   6.381
   93    HB3  GLU  17           2HB      GLU  17   7.095   0.774   6.891
   94    HG2  GLU  17           1HG      GLU  17   6.770   2.406   5.233
   95    HG3  GLU  17           2HG      GLU  17   7.683   1.108   4.465
   96    H    CYS  18           H        CYS  18   5.068  -1.192   7.743
   97    HA   CYS  18           HA       CYS  18   6.974  -2.628   9.450
   98    HB2  CYS  18           1HB      CYS  18   5.440  -2.018  11.303
   99    HB3  CYS  18           2HB      CYS  18   6.061  -0.613  10.443
  100    H    GLY  19           H        GLY  19   3.619  -2.764   8.300
  101    HA2  GLY  19           1HA      GLY  19   2.895  -5.017   7.543
  102    HA3  GLY  19           2HA      GLY  19   3.599  -5.628   9.033
  103    H    LYS  20           H        LYS  20   1.970  -2.612   9.220
  104    HA   LYS  20           HA       LYS  20   0.070  -3.629  11.079
  105    HB2  LYS  20           1HB      LYS  20   0.377  -0.948   9.729
  106    HB3  LYS  20           2HB      LYS  20  -0.897  -1.286  10.893
  107    HG2  LYS  20           1HG      LYS  20   1.900  -1.878  11.688
  108    HG3  LYS  20           2HG      LYS  20   1.397  -0.188  11.602
  109    HD2  LYS  20           1HD      LYS  20  -0.068  -0.393  13.342
  110    HD3  LYS  20           2HD      LYS  20  -0.396  -2.095  13.008
  111    HE2  LYS  20           1HE      LYS  20   1.769  -2.713  13.918
  112    HE3  LYS  20           2HE      LYS  20   2.165  -1.015  14.184
  113    HZ1  LYS  20           3HZ      LYS  20   1.386  -1.466  16.230
  114    HZ2  LYS  20           1HZ      LYS  20   0.450  -2.780  15.722
  115    HZ3  LYS  20           2HZ      LYS  20  -0.126  -1.203  15.518
  116    H    ALA  21           H        ALA  21  -2.318  -3.084  10.826
  117    HA   ALA  21           HA       ALA  21  -3.288  -3.369   8.086
  118    HB1  ALA  21           3HB      ALA  21  -3.342  -5.484  10.102
  119    HB2  ALA  21           1HB      ALA  21  -4.911  -5.154   9.367
  120    HB3  ALA  21           2HB      ALA  21  -3.532  -5.578   8.352
  121    H    PHE  22           H        PHE  22  -5.016  -2.129   7.740
  122    HA   PHE  22           HA       PHE  22  -6.772  -1.451   9.986
  123    HB2  PHE  22           1HB      PHE  22  -6.030   0.715   8.061
  124    HB3  PHE  22           2HB      PHE  22  -6.595   0.843   9.724
  125    HD1  PHE  22           HD2      PHE  22  -3.686   0.150   7.588
  126    HD2  PHE  22           HD1      PHE  22  -5.076   0.818  11.555
  127    HE1  PHE  22           HE2      PHE  22  -1.363   0.430   8.350
  128    HE2  PHE  22           HE1      PHE  22  -2.756   1.100  12.324
  129    HZ   PHE  22           HZ       PHE  22  -0.896   0.905  10.721
  130    H    ILE  23           H        ILE  23  -8.903  -1.160   9.455
  131    HA   ILE  23           HA       ILE  23  -9.786  -2.282   6.990
  132    HB   ILE  23           HB       ILE  23 -11.088  -2.586   9.025
  133   HG12  ILE  23          1HG1      ILE  23 -13.333  -1.652   8.092
  134   HG13  ILE  23          2HG1      ILE  23 -12.356  -1.124   6.726
  135   HG21  ILE  23          1HG2      ILE  23 -10.498  -0.139   9.755
  136   HG22  ILE  23          2HG2      ILE  23 -12.023   0.242   8.957
  137   HG23  ILE  23          3HG2      ILE  23 -11.991  -0.903  10.298
  138   HD11  ILE  23          3HD1      ILE  23 -11.626  -3.766   7.097
  139   HD12  ILE  23          1HD1      ILE  23 -13.368  -3.748   7.373
  140   HD13  ILE  23          2HD1      ILE  23 -12.708  -3.131   5.858
  141    H    GLN  24           H        GLN  24  -9.698   0.998   8.314
  142    HA   GLN  24           HA       GLN  24 -10.881   2.105   5.909
  143    HB2  GLN  24           1HB      GLN  24  -9.788   3.452   8.385
  144    HB3  GLN  24           2HB      GLN  24 -10.610   4.278   7.068
  145    HG2  GLN  24           1HG      GLN  24 -12.518   2.565   7.592
  146    HG3  GLN  24           2HG      GLN  24 -11.714   2.473   9.158
  147   HE21  GLN  24          1HE2      GLN  24 -13.124   4.726   6.840
  148   HE22  GLN  24          2HE2      GLN  24 -13.625   5.896   8.008
  149    H    LYS  25           H        LYS  25  -9.728   2.577   4.171
  150    HA   LYS  25           HA       LYS  25  -6.989   2.316   3.911
  151    HB2  LYS  25           1HB      LYS  25  -8.589   2.402   2.023
  152    HB3  LYS  25           2HB      LYS  25  -8.790   4.128   2.292
  153    HG2  LYS  25           1HG      LYS  25  -6.654   4.625   1.533
  154    HG3  LYS  25           2HG      LYS  25  -6.082   2.971   1.765
  155    HD2  LYS  25           1HD      LYS  25  -7.473   2.212  -0.083
  156    HD3  LYS  25           2HD      LYS  25  -8.107   3.846  -0.295
  157    HE2  LYS  25           1HE      LYS  25  -5.208   3.062  -0.574
  158    HE3  LYS  25           2HE      LYS  25  -6.330   3.276  -1.917
  159    HZ1  LYS  25           3HZ      LYS  25  -5.040   5.275  -0.241
  160    HZ2  LYS  25           1HZ      LYS  25  -6.639   5.595  -0.690
  161    HZ3  LYS  25           2HZ      LYS  25  -5.462   5.343  -1.877
  162    H    SER  26           H        SER  26  -8.880   5.201   4.673
  163    HA   SER  26           HA       SER  26  -6.852   7.106   4.502
  164    HB2  SER  26           1HB      SER  26  -9.204   7.724   4.749
  165    HB3  SER  26           2HB      SER  26  -9.232   7.038   6.373
  166    HG   SER  26           HG       SER  26  -8.617   8.939   6.997
  167    H    THR  27           H        THR  27  -7.847   5.078   7.231
  168    HA   THR  27           HA       THR  27  -6.199   6.143   9.199
  169    HB   THR  27           HB       THR  27  -6.927   3.224   8.892
  170    HG1  THR  27           HG1      THR  27  -8.373   5.477   9.754
  171   HG21  THR  27          3HG2      THR  27  -6.944   3.938  11.574
  172   HG22  THR  27          1HG2      THR  27  -5.516   4.742  10.924
  173   HG23  THR  27          2HG2      THR  27  -5.702   2.997  10.749
  174    H    LEU  28           H        LEU  28  -5.457   3.938   6.585
  175    HA   LEU  28           HA       LEU  28  -2.879   3.191   7.585
  176    HB2  LEU  28           1HB      LEU  28  -3.722   1.601   6.159
  177    HB3  LEU  28           2HB      LEU  28  -4.391   2.797   5.051
  178    HG   LEU  28           HG       LEU  28  -2.095   3.275   4.250
  179   HD11  LEU  28          1HD1      LEU  28  -1.272   0.841   5.814
  180   HD12  LEU  28          2HD1      LEU  28  -0.988   2.492   6.365
  181   HD13  LEU  28          3HD1      LEU  28  -0.249   1.923   4.868
  182   HD21  LEU  28          3HD2      LEU  28  -3.248   0.515   4.044
  183   HD22  LEU  28          1HD2      LEU  28  -1.783   0.965   3.171
  184   HD23  LEU  28          2HD2      LEU  28  -3.291   1.829   2.868
  185    H    SER  29           H        SER  29  -3.975   5.315   4.943
  186    HA   SER  29           HA       SER  29  -1.517   6.233   4.080
  187    HB2  SER  29           1HB      SER  29  -3.521   6.776   2.853
  188    HB3  SER  29           2HB      SER  29  -4.166   7.688   4.218
  189    HG   SER  29           HG       SER  29  -3.235   9.053   2.633
  190    H    MET  30           H        MET  30  -3.464   7.325   6.808
  191    HA   MET  30           HA       MET  30  -1.737   9.527   7.439
  192    HB2  MET  30           1HB      MET  30  -3.116   9.819   9.397
  193    HB3  MET  30           2HB      MET  30  -4.154   9.487   8.017
  194    HG2  MET  30           1HG      MET  30  -4.412   7.185   8.734
  195    HG3  MET  30           2HG      MET  30  -3.319   7.470  10.087
  196    HE1  MET  30           3HE      MET  30  -4.836   7.969  12.702
  197    HE2  MET  30           1HE      MET  30  -6.222   7.009  12.184
  198    HE3  MET  30           2HE      MET  30  -4.600   6.577  11.643
  199    H    HIS  31           H        HIS  31  -1.645   6.176   7.984
  200    HA   HIS  31           HA       HIS  31  -0.018   6.360  10.387
  201    HB2  HIS  31           1HB      HIS  31  -1.379   4.491  10.534
  202    HB3  HIS  31           2HB      HIS  31  -1.238   4.125   8.817
  203    HD1  HIS  31           HD1      HIS  31   0.232   3.352  12.101
  204    HD2  HIS  31           HD2      HIS  31   1.215   2.808   8.101
  205    HE1  HIS  31           HE1      HIS  31   2.065   1.631  12.087
  206    H    GLN  32           H        GLN  32   0.343   5.227   7.035
  207    HA   GLN  32           HA       GLN  32   2.940   4.382   7.037
  208    HB2  GLN  32           1HB      GLN  32   1.368   5.869   4.946
  209    HB3  GLN  32           2HB      GLN  32   3.014   5.329   4.646
  210    HG2  GLN  32           1HG      GLN  32   2.429   3.079   4.765
  211    HG3  GLN  32           2HG      GLN  32   0.909   3.423   5.589
  212   HE21  GLN  32          1HE2      GLN  32   1.714   2.029   3.007
  213   HE22  GLN  32          2HE2      GLN  32   0.648   2.704   1.826
  214    H    ARG  33           H        ARG  33   1.782   7.608   7.444
  215    HA   ARG  33           HA       ARG  33   3.913   9.158   6.629
  216    HB2  ARG  33           1HB      ARG  33   3.082  10.860   8.020
  217    HB3  ARG  33           2HB      ARG  33   1.670   9.892   7.617
  218    HG2  ARG  33           1HG      ARG  33   1.769   8.793   9.771
  219    HG3  ARG  33           2HG      ARG  33   3.243   9.674  10.175
  220    HD2  ARG  33           1HD      ARG  33   1.909  11.796   9.856
  221    HD3  ARG  33           2HD      ARG  33   0.471  10.779   9.783
  222    HE   ARG  33           HE       ARG  33   0.630  10.426  12.054
  223   HH11  ARG  33          1HH1      ARG  33   3.511  11.996  10.889
  224   HH12  ARG  33          2HH1      ARG  33   4.115  12.351  12.474
  225   HH21  ARG  33          1HH2      ARG  33   1.415  10.887  14.145
  226   HH22  ARG  33          2HH2      ARG  33   2.923  11.719  14.325
  227    H    ILE  34           H        ILE  34   3.518   7.364   9.648
  228    HA   ILE  34           HA       ILE  34   5.712   8.307  11.056
  229    HB   ILE  34           HB       ILE  34   5.612   6.351  12.388
  230   HG12  ILE  34          1HG1      ILE  34   4.105   5.018  10.127
  231   HG13  ILE  34          2HG1      ILE  34   5.787   4.713  10.546
  232   HG21  ILE  34          1HG2      ILE  34   2.819   6.081  11.855
  233   HG22  ILE  34          2HG2      ILE  34   3.621   6.933  13.174
  234   HG23  ILE  34          3HG2      ILE  34   3.289   7.769  11.658
  235   HD11  ILE  34          3HD1      ILE  34   3.839   3.151  11.375
  236   HD12  ILE  34          1HD1      ILE  34   5.249   3.484  12.379
  237   HD13  ILE  34          2HD1      ILE  34   3.741   4.355  12.660
  238    H    HIS  35           H        HIS  35   5.639   6.442   8.197
  239    HA   HIS  35           HA       HIS  35   8.374   5.473   8.562
  240    HB2  HIS  35           1HB      HIS  35   6.430   4.982   6.297
  241    HB3  HIS  35           2HB      HIS  35   7.997   4.204   6.498
  242    HD1  HIS  35           HD1      HIS  35   7.979   3.228   9.304
  243    HD2  HIS  35           HD2      HIS  35   4.584   3.115   6.912
  244    HE1  HIS  35           HE1      HIS  35   6.505   1.457  10.311
  245    H    ARG  36           H        ARG  36   6.498   7.762   6.694
  246    HA   ARG  36           HA       ARG  36   8.694   8.435   4.945
  247    HB2  ARG  36           1HB      ARG  36   5.912   9.511   5.332
  248    HB3  ARG  36           2HB      ARG  36   7.077  10.345   4.312
  249    HG2  ARG  36           1HG      ARG  36   7.322   8.260   2.986
  250    HG3  ARG  36           2HG      ARG  36   6.026   7.549   3.951
  251    HD2  ARG  36           1HD      ARG  36   5.129   8.400   1.873
  252    HD3  ARG  36           2HD      ARG  36   4.526   9.361   3.223
  253    HE   ARG  36           HE       ARG  36   6.320  10.233   1.121
  254   HH11  ARG  36          1HH1      ARG  36   4.928  10.886   4.244
  255   HH12  ARG  36          2HH1      ARG  36   5.249  12.587   4.176
  256   HH21  ARG  36          1HH2      ARG  36   6.747  12.471   1.019
  257   HH22  ARG  36          2HH2      ARG  36   6.282  13.488   2.341
  258    H    GLY  37           H        GLY  37  10.286   9.020   6.515
  259    HA2  GLY  37           1HA      GLY  37   9.775  11.630   7.802
  260    HA3  GLY  37           2HA      GLY  37  10.869  10.416   8.448
  261    H    GLU  38           H        GLU  38  11.926  12.817   8.256
  262    HA   GLU  38           HA       GLU  38  12.954  13.930   6.050
  263    HB2  GLU  38           1HB      GLU  38  13.522  14.287   8.591
  264    HB3  GLU  38           2HB      GLU  38  14.912  13.278   8.215
  265    HG2  GLU  38           1HG      GLU  38  15.387  15.691   8.076
  266    HG3  GLU  38           2HG      GLU  38  15.673  14.836   6.561
  267    H    LYS  39           H        LYS  39  14.487  11.129   7.637
  268    HA   LYS  39           HA       LYS  39  15.371  10.176   5.025
  269    HB2  LYS  39           1HB      LYS  39  17.265  10.606   7.344
  270    HB3  LYS  39           2HB      LYS  39  17.672   9.810   5.830
  271    HG2  LYS  39           1HG      LYS  39  17.635  11.780   4.627
  272    HG3  LYS  39           2HG      LYS  39  16.611  12.601   5.808
  273    HD2  LYS  39           1HD      LYS  39  18.696  13.561   6.169
  274    HD3  LYS  39           2HD      LYS  39  18.621  12.305   7.408
  275    HE2  LYS  39           1HE      LYS  39  19.916  11.928   4.714
  276    HE3  LYS  39           2HE      LYS  39  20.791  12.442   6.156
  277    HZ1  LYS  39           3HZ      LYS  39  19.444  10.238   6.985
  278    HZ2  LYS  39           1HZ      LYS  39  21.071  10.278   6.525
  279    HZ3  LYS  39           2HZ      LYS  39  19.887   9.825   5.405
  280    HA   PRO  40           HA       PRO  40  14.309   6.251   6.691
  281    HB2  PRO  40           1HB      PRO  40  15.898   4.640   5.191
  282    HB3  PRO  40           2HB      PRO  40  14.465   5.447   4.545
  283    HG2  PRO  40           1HG      PRO  40  17.344   6.234   4.320
  284    HG3  PRO  40           2HG      PRO  40  16.079   6.251   3.077
  285    HD2  PRO  40           1HD      PRO  40  16.861   8.485   4.392
  286    HD3  PRO  40           2HD      PRO  40  15.196   8.244   3.826
  287    H    SER  41           H        SER  41  15.298   4.251   7.641
  288    HA   SER  41           HA       SER  41  17.707   4.978   9.165
  289    HB2  SER  41           1HB      SER  41  15.486   3.030   9.829
  290    HB3  SER  41           2HB      SER  41  16.918   3.296  10.824
  291    HG   SER  41           HG       SER  41  15.067   4.532  11.484
  292    H    GLY  42           H        GLY  42  19.449   3.616   9.272
  293    HA2  GLY  42           1HA      GLY  42  19.761   1.757   7.114
  294    HA3  GLY  42           2HA      GLY  42  20.949   2.120   8.357
  295    HA   PRO  43           HA       PRO  43  19.093  -2.169   8.949
  296    HB2  PRO  43           1HB      PRO  43  21.398  -3.557   8.593
  297    HB3  PRO  43           2HB      PRO  43  20.304  -3.155   7.264
  298    HG2  PRO  43           1HG      PRO  43  22.835  -1.798   8.113
  299    HG3  PRO  43           2HG      PRO  43  22.269  -2.191   6.478
  300    HD2  PRO  43           1HD      PRO  43  22.051   0.291   7.538
  301    HD3  PRO  43           2HD      PRO  43  20.868  -0.364   6.388
  302    H    SER  44           H        SER  44  18.792  -2.179  11.104
  303    HA   SER  44           HA       SER  44  21.172  -2.077  12.838
  304    HB2  SER  44           1HB      SER  44  18.325  -1.202  13.298
  305    HB3  SER  44           2HB      SER  44  19.433  -1.485  14.641
  306    HG   SER  44           HG       SER  44  20.833  -0.004  13.152
  307    H    SER  45           H        SER  45  20.908  -3.312  14.919
  308    HA   SER  45           HA       SER  45  19.915  -5.984  14.278
  309    HB2  SER  45           1HB      SER  45  21.220  -6.640  16.338
  310    HB3  SER  45           2HB      SER  45  22.190  -5.953  15.035
  311    HG   SER  45           HG       SER  45  21.496  -4.855  17.516
  312    H    GLY  46           H        GLY  46  17.909  -4.134  14.794
  313    HA2  GLY  46           1HA      GLY  46  15.954  -3.990  15.994
  314    HA3  GLY  46           2HA      GLY  46  16.441  -5.465  16.816
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1   1.296 -30.536  -9.373
    2    HA2  GLY   1           1HA      GLY   1   0.425 -32.326  -7.529
    3    HA3  GLY   1           2HA      GLY   1   2.063 -31.979  -6.997
    4    H    SER   2           H        SER   2  -0.735 -31.364  -5.941
    5    HA   SER   2           HA       SER   2  -0.273 -28.486  -5.505
    6    HB2  SER   2           1HB      SER   2  -2.254 -28.627  -6.822
    7    HB3  SER   2           2HB      SER   2  -2.881 -29.967  -5.862
    8    HG   SER   2           HG       SER   2  -3.463 -28.608  -4.307
    9    H    SER   3           H        SER   3   0.486 -28.247  -3.511
   10    HA   SER   3           HA       SER   3  -1.030 -29.260  -1.270
   11    HB2  SER   3           1HB      SER   3   1.881 -30.041  -1.555
   12    HB3  SER   3           2HB      SER   3   0.811 -30.442  -0.211
   13    HG   SER   3           HG       SER   3   0.664 -31.355  -2.889
   14    H    GLY   4           H        GLY   4  -0.495 -28.238   0.720
   15    HA2  GLY   4           1HA      GLY   4   1.131 -26.741   1.872
   16    HA3  GLY   4           2HA      GLY   4   1.177 -25.825   0.374
   17    H    SER   5           H        SER   5  -0.577 -24.505  -0.188
   18    HA   SER   5           HA       SER   5  -2.829 -24.287   1.620
   19    HB2  SER   5           1HB      SER   5  -0.786 -22.884   2.488
   20    HB3  SER   5           2HB      SER   5  -1.260 -21.766   1.210
   21    HG   SER   5           HG       SER   5  -2.583 -22.454   3.563
   22    H    SER   6           H        SER   6  -4.229 -22.329   0.901
   23    HA   SER   6           HA       SER   6  -3.992 -21.488  -1.821
   24    HB2  SER   6           1HB      SER   6  -4.812 -23.887  -2.004
   25    HB3  SER   6           2HB      SER   6  -6.300 -23.346  -1.228
   26    HG   SER   6           HG       SER   6  -6.725 -22.041  -2.957
   27    H    GLY   7           H        GLY   7  -5.433 -19.840  -2.350
   28    HA2  GLY   7           1HA      GLY   7  -7.662 -18.828  -1.736
   29    HA3  GLY   7           2HA      GLY   7  -7.072 -18.893  -0.082
   30    H    THR   8           H        THR   8  -7.507 -16.908  -2.665
   31    HA   THR   8           HA       THR   8  -5.137 -15.337  -2.594
   32    HB   THR   8           HB       THR   8  -6.631 -15.290  -4.534
   33    HG1  THR   8           HG1      THR   8  -6.950 -12.776  -4.315
   34   HG21  THR   8          3HG2      THR   8  -8.571 -13.805  -2.760
   35   HG22  THR   8          1HG2      THR   8  -8.759 -15.484  -3.262
   36   HG23  THR   8          2HG2      THR   8  -8.782 -14.196  -4.466
   37    H    GLY   9           H        GLY   9  -4.994 -13.104  -1.851
   38    HA2  GLY   9           1HA      GLY   9  -6.590 -12.678   0.600
   39    HA3  GLY   9           2HA      GLY   9  -4.897 -12.229   0.452
   40    H    GLU  10           H        GLU  10  -4.435 -10.200  -0.111
   41    HA   GLU  10           HA       GLU  10  -4.886  -7.962  -0.406
   42    HB2  GLU  10           1HB      GLU  10  -4.469  -8.967  -2.693
   43    HB3  GLU  10           2HB      GLU  10  -6.213  -8.981  -2.917
   44    HG2  GLU  10           1HG      GLU  10  -6.355  -6.691  -3.048
   45    HG3  GLU  10           2HG      GLU  10  -4.856  -6.441  -2.154
   46    H    ARG  11           H        ARG  11  -6.801  -9.030   1.278
   47    HA   ARG  11           HA       ARG  11  -9.400  -8.125   0.323
   48    HB2  ARG  11           1HB      ARG  11  -8.892 -10.244   1.774
   49    HB3  ARG  11           2HB      ARG  11  -8.888  -9.100   3.109
   50    HG2  ARG  11           1HG      ARG  11 -11.063  -9.945   3.046
   51    HG3  ARG  11           2HG      ARG  11 -11.175  -8.362   2.273
   52    HD2  ARG  11           1HD      ARG  11 -10.874  -9.598   0.068
   53    HD3  ARG  11           2HD      ARG  11 -11.171 -11.076   0.981
   54    HE   ARG  11           HE       ARG  11 -13.287  -9.554   1.641
   55   HH11  ARG  11          1HH1      ARG  11 -11.855 -10.384  -1.421
   56   HH12  ARG  11          2HH1      ARG  11 -13.351 -10.299  -2.291
   57   HH21  ARG  11          1HH2      ARG  11 -15.263  -9.438   0.507
   58   HH22  ARG  11          2HH2      ARG  11 -15.288  -9.760  -1.194
   59    H    HIS  12           H        HIS  12  -7.426  -7.553   3.244
   60    HA   HIS  12           HA       HIS  12  -8.682  -4.911   3.487
   61    HB2  HIS  12           1HB      HIS  12  -7.553  -5.007   5.806
   62    HB3  HIS  12           2HB      HIS  12  -8.948  -6.043   5.522
   63    HD1  HIS  12           HD1      HIS  12  -8.630  -8.357   6.306
   64    HD2  HIS  12           HD2      HIS  12  -5.022  -6.579   5.267
   65    HE1  HIS  12           HE1      HIS  12  -6.862 -10.070   6.823
   66    H    TYR  13           H        TYR  13  -7.205  -3.181   4.407
   67    HA   TYR  13           HA       TYR  13  -4.888  -2.994   2.685
   68    HB2  TYR  13           1HB      TYR  13  -5.728  -0.938   4.717
   69    HB3  TYR  13           2HB      TYR  13  -4.849  -0.695   3.211
   70    HD1  TYR  13           HD2      TYR  13  -8.165  -1.433   4.657
   71    HD2  TYR  13           HD1      TYR  13  -6.000  -0.373   1.151
   72    HE1  TYR  13           HE2      TYR  13 -10.281  -0.916   3.513
   73    HE2  TYR  13           HE1      TYR  13  -8.109   0.149  -0.001
   74    HH   TYR  13           HH       TYR  13 -11.242  -0.263   1.625
   75    H    GLU  14           H        GLU  14  -2.786  -3.047   3.284
   76    HA   GLU  14           HA       GLU  14  -2.148  -3.209   6.143
   77    HB2  GLU  14           1HB      GLU  14  -1.633  -5.260   4.047
   78    HB3  GLU  14           2HB      GLU  14  -0.380  -4.994   5.251
   79    HG2  GLU  14           1HG      GLU  14  -2.109  -5.367   7.015
   80    HG3  GLU  14           2HG      GLU  14  -3.226  -5.834   5.733
   81    H    CYS  15           H        CYS  15  -0.180  -2.362   6.731
   82    HA   CYS  15           HA       CYS  15   1.008  -0.520   4.883
   83    HB2  CYS  15           1HB      CYS  15   0.737  -0.031   7.306
   84    HB3  CYS  15           2HB      CYS  15   1.922  -1.284   7.664
   85    H    SER  16           H        SER  16   2.504  -1.025   3.441
   86    HA   SER  16           HA       SER  16   4.022  -3.485   3.697
   87    HB2  SER  16           1HB      SER  16   4.079  -1.420   1.484
   88    HB3  SER  16           2HB      SER  16   4.761  -3.045   1.418
   89    HG   SER  16           HG       SER  16   2.618  -3.845   1.687
   90    H    GLU  17           H        GLU  17   4.653  -1.581   5.659
   91    HA   GLU  17           HA       GLU  17   7.437  -0.973   4.927
   92    HB2  GLU  17           1HB      GLU  17   5.533   0.777   6.488
   93    HB3  GLU  17           2HB      GLU  17   7.269   1.045   6.413
   94    HG2  GLU  17           1HG      GLU  17   5.774   0.819   3.859
   95    HG3  GLU  17           2HG      GLU  17   5.599   2.294   4.807
   96    H    CYS  18           H        CYS  18   5.135  -1.511   7.569
   97    HA   CYS  18           HA       CYS  18   7.352  -2.625   9.161
   98    HB2  CYS  18           1HB      CYS  18   6.005  -2.013  11.173
   99    HB3  CYS  18           2HB      CYS  18   6.543  -0.624  10.235
  100    H    GLY  19           H        GLY  19   3.845  -2.834   8.584
  101    HA2  GLY  19           1HA      GLY  19   3.118  -5.150   7.930
  102    HA3  GLY  19           2HA      GLY  19   3.998  -5.682   9.354
  103    H    LYS  20           H        LYS  20   1.538  -3.222   8.563
  104    HA   LYS  20           HA       LYS  20   0.013  -4.159  10.904
  105    HB2  LYS  20           1HB      LYS  20   0.741  -1.410  10.033
  106    HB3  LYS  20           2HB      LYS  20  -0.862  -1.640  10.718
  107    HG2  LYS  20           1HG      LYS  20   0.167  -2.628  12.726
  108    HG3  LYS  20           2HG      LYS  20   1.761  -2.301  12.041
  109    HD2  LYS  20           1HD      LYS  20   1.505   0.007  12.235
  110    HD3  LYS  20           2HD      LYS  20  -0.252  -0.103  12.360
  111    HE2  LYS  20           1HE      LYS  20   0.359   0.344  14.542
  112    HE3  LYS  20           2HE      LYS  20   0.249  -1.415  14.546
  113    HZ1  LYS  20           3HZ      LYS  20   2.373  -1.551  15.110
  114    HZ2  LYS  20           1HZ      LYS  20   2.427   0.133  15.259
  115    HZ3  LYS  20           2HZ      LYS  20   2.851  -0.600  13.795
  116    H    ALA  21           H        ALA  21  -2.351  -3.436  10.751
  117    HA   ALA  21           HA       ALA  21  -3.331  -3.430   7.991
  118    HB1  ALA  21           3HB      ALA  21  -4.125  -5.431  10.097
  119    HB2  ALA  21           1HB      ALA  21  -5.028  -5.160   8.606
  120    HB3  ALA  21           2HB      ALA  21  -3.367  -5.752   8.537
  121    H    PHE  22           H        PHE  22  -5.092  -2.183   7.682
  122    HA   PHE  22           HA       PHE  22  -6.548  -1.228  10.053
  123    HB2  PHE  22           1HB      PHE  22  -5.683   0.489   7.716
  124    HB3  PHE  22           2HB      PHE  22  -6.622   1.027   9.105
  125    HD1  PHE  22           HD2      PHE  22  -3.312  -0.074   7.960
  126    HD2  PHE  22           HD1      PHE  22  -5.581   1.497  11.200
  127    HE1  PHE  22           HE2      PHE  22  -1.229   0.469   9.151
  128    HE2  PHE  22           HE1      PHE  22  -3.501   2.044  12.396
  129    HZ   PHE  22           HZ       PHE  22  -1.322   1.529  11.372
  130    H    ILE  23           H        ILE  23  -8.732  -0.854   9.789
  131    HA   ILE  23           HA       ILE  23 -10.047  -2.349   7.779
  132    HB   ILE  23           HB       ILE  23 -11.067  -2.043   9.961
  133   HG12  ILE  23          1HG1      ILE  23 -12.887  -0.544   8.113
  134   HG13  ILE  23          2HG1      ILE  23 -12.409  -2.189   7.709
  135   HG21  ILE  23          1HG2      ILE  23 -11.359   0.865   9.217
  136   HG22  ILE  23          2HG2      ILE  23 -11.956   0.096  10.686
  137   HG23  ILE  23          3HG2      ILE  23 -10.221   0.221  10.400
  138   HD11  ILE  23          3HD1      ILE  23 -13.236  -2.123  10.429
  139   HD12  ILE  23          1HD1      ILE  23 -14.462  -1.335   9.436
  140   HD13  ILE  23          2HD1      ILE  23 -13.956  -2.984   9.068
  141    H    GLN  24           H        GLN  24  -9.538   1.122   8.247
  142    HA   GLN  24           HA       GLN  24 -10.788   1.642   5.646
  143    HB2  GLN  24           1HB      GLN  24 -10.198   3.339   8.042
  144    HB3  GLN  24           2HB      GLN  24 -10.399   4.097   6.468
  145    HG2  GLN  24           1HG      GLN  24 -12.611   2.849   6.330
  146    HG3  GLN  24           2HG      GLN  24 -12.401   2.525   8.050
  147   HE21  GLN  24          1HE2      GLN  24 -13.218   3.955   9.400
  148   HE22  GLN  24          2HE2      GLN  24 -13.625   5.591   9.025
  149    H    LYS  25           H        LYS  25  -9.689   2.538   3.955
  150    HA   LYS  25           HA       LYS  25  -6.915   2.095   3.776
  151    HB2  LYS  25           1HB      LYS  25  -8.178   2.025   1.766
  152    HB3  LYS  25           2HB      LYS  25  -8.851   3.626   2.047
  153    HG2  LYS  25           1HG      LYS  25  -7.279   4.019   0.407
  154    HG3  LYS  25           2HG      LYS  25  -6.399   4.427   1.882
  155    HD2  LYS  25           1HD      LYS  25  -6.251   1.622   0.917
  156    HD3  LYS  25           2HD      LYS  25  -5.369   2.850   0.005
  157    HE2  LYS  25           1HE      LYS  25  -5.125   2.473   2.984
  158    HE3  LYS  25           2HE      LYS  25  -4.050   1.715   1.811
  159    HZ1  LYS  25           3HZ      LYS  25  -3.704   4.166   2.930
  160    HZ2  LYS  25           1HZ      LYS  25  -4.331   4.537   1.403
  161    HZ3  LYS  25           2HZ      LYS  25  -2.928   3.602   1.537
  162    H    SER  26           H        SER  26  -8.691   5.192   3.739
  163    HA   SER  26           HA       SER  26  -6.565   6.923   3.806
  164    HB2  SER  26           1HB      SER  26  -8.070   8.562   4.810
  165    HB3  SER  26           2HB      SER  26  -8.935   7.616   3.599
  166    HG   SER  26           HG       SER  26  -9.709   7.994   6.012
  167    H    THR  27           H        THR  27  -8.003   5.147   6.483
  168    HA   THR  27           HA       THR  27  -6.729   6.418   8.615
  169    HB   THR  27           HB       THR  27  -7.527   3.512   8.358
  170    HG1  THR  27           HG1      THR  27  -8.855   5.879   9.097
  171   HG21  THR  27          3HG2      THR  27  -6.932   3.146  10.497
  172   HG22  THR  27          1HG2      THR  27  -7.467   4.743  11.019
  173   HG23  THR  27          2HG2      THR  27  -5.880   4.544  10.278
  174    H    LEU  28           H        LEU  28  -5.632   3.767   6.546
  175    HA   LEU  28           HA       LEU  28  -3.269   3.177   7.963
  176    HB2  LEU  28           1HB      LEU  28  -3.792   1.513   6.494
  177    HB3  LEU  28           2HB      LEU  28  -4.319   2.636   5.242
  178    HG   LEU  28           HG       LEU  28  -1.847   3.181   4.924
  179   HD11  LEU  28          1HD1      LEU  28  -0.680   0.800   5.612
  180   HD12  LEU  28          2HD1      LEU  28  -1.703   1.145   7.006
  181   HD13  LEU  28          3HD1      LEU  28  -0.500   2.323   6.483
  182   HD21  LEU  28          3HD2      LEU  28  -1.593   0.735   3.836
  183   HD22  LEU  28          1HD2      LEU  28  -2.579   2.018   3.134
  184   HD23  LEU  28          2HD2      LEU  28  -3.334   0.764   4.119
  185    H    SER  29           H        SER  29  -3.888   5.308   5.194
  186    HA   SER  29           HA       SER  29  -1.321   6.109   4.604
  187    HB2  SER  29           1HB      SER  29  -3.979   7.479   4.422
  188    HB3  SER  29           2HB      SER  29  -2.512   8.386   4.055
  189    HG   SER  29           HG       SER  29  -2.688   5.896   2.875
  190    H    MET  30           H        MET  30  -3.485   7.376   7.104
  191    HA   MET  30           HA       MET  30  -1.882   9.497   7.974
  192    HB2  MET  30           1HB      MET  30  -3.673   7.836   9.745
  193    HB3  MET  30           2HB      MET  30  -3.224   9.523   9.956
  194    HG2  MET  30           1HG      MET  30  -4.405   9.928   7.729
  195    HG3  MET  30           2HG      MET  30  -5.095   8.322   7.950
  196    HE1  MET  30           3HE      MET  30  -5.270  12.099   9.017
  197    HE2  MET  30           1HE      MET  30  -6.282  11.422   7.740
  198    HE3  MET  30           2HE      MET  30  -7.017  11.995   9.237
  199    H    HIS  31           H        HIS  31  -1.523   6.105   8.369
  200    HA   HIS  31           HA       HIS  31   0.299   6.376  10.627
  201    HB2  HIS  31           1HB      HIS  31  -0.901   4.448  10.971
  202    HB3  HIS  31           2HB      HIS  31  -1.053   4.107   9.250
  203    HD1  HIS  31           HD1      HIS  31   1.038   3.392  12.212
  204    HD2  HIS  31           HD2      HIS  31   1.202   2.785   8.105
  205    HE1  HIS  31           HE1      HIS  31   2.859   1.694  11.855
  206    H    GLN  32           H        GLN  32   0.416   4.947   7.359
  207    HA   GLN  32           HA       GLN  32   2.996   4.269   7.082
  208    HB2  GLN  32           1HB      GLN  32   1.059   5.521   5.207
  209    HB3  GLN  32           2HB      GLN  32   2.739   5.442   4.694
  210    HG2  GLN  32           1HG      GLN  32   2.600   2.957   5.317
  211    HG3  GLN  32           2HG      GLN  32   0.854   3.200   5.306
  212   HE21  GLN  32          1HE2      GLN  32  -0.129   3.922   3.335
  213   HE22  GLN  32          2HE2      GLN  32   0.600   3.542   1.816
  214    H    ARG  33           H        ARG  33   1.804   7.510   7.457
  215    HA   ARG  33           HA       ARG  33   3.866   9.050   6.483
  216    HB2  ARG  33           1HB      ARG  33   3.176  10.767   8.023
  217    HB3  ARG  33           2HB      ARG  33   1.746   9.914   7.459
  218    HG2  ARG  33           1HG      ARG  33   1.786   8.582   9.558
  219    HG3  ARG  33           2HG      ARG  33   3.110   9.604  10.122
  220    HD2  ARG  33           1HD      ARG  33   0.749  10.213  10.878
  221    HD3  ARG  33           2HD      ARG  33   1.751  11.507  10.220
  222    HE   ARG  33           HE       ARG  33   0.059  10.213   8.280
  223   HH11  ARG  33          1HH1      ARG  33   0.317  12.758  10.640
  224   HH12  ARG  33          2HH1      ARG  33  -0.930  13.726   9.925
  225   HH21  ARG  33          1HH2      ARG  33  -1.584  11.477   7.329
  226   HH22  ARG  33          2HH2      ARG  33  -2.011  12.996   8.042
  227    H    ILE  34           H        ILE  34   3.624   7.535   9.688
  228    HA   ILE  34           HA       ILE  34   5.876   8.490  10.907
  229    HB   ILE  34           HB       ILE  34   5.955   6.484  12.234
  230   HG12  ILE  34          1HG1      ILE  34   3.901   5.106  10.563
  231   HG13  ILE  34          2HG1      ILE  34   5.575   5.066  10.019
  232   HG21  ILE  34          1HG2      ILE  34   3.512   7.902  11.668
  233   HG22  ILE  34          2HG2      ILE  34   3.176   6.262  12.220
  234   HG23  ILE  34          3HG2      ILE  34   4.154   7.343  13.213
  235   HD11  ILE  34          3HD1      ILE  34   5.345   4.419  12.826
  236   HD12  ILE  34          1HD1      ILE  34   4.375   3.348  11.816
  237   HD13  ILE  34          2HD1      ILE  34   6.104   3.518  11.514
  238    H    HIS  35           H        HIS  35   5.696   6.383   8.181
  239    HA   HIS  35           HA       HIS  35   8.467   5.533   8.415
  240    HB2  HIS  35           1HB      HIS  35   6.337   4.971   6.346
  241    HB3  HIS  35           2HB      HIS  35   7.982   4.351   6.248
  242    HD1  HIS  35           HD1      HIS  35   8.680   2.910   8.529
  243    HD2  HIS  35           HD2      HIS  35   4.650   3.269   7.586
  244    HE1  HIS  35           HE1      HIS  35   7.530   1.053   9.776
  245    H    ARG  36           H        ARG  36   6.515   7.807   6.614
  246    HA   ARG  36           HA       ARG  36   8.205   8.436   4.514
  247    HB2  ARG  36           1HB      ARG  36   6.331  10.195   6.099
  248    HB3  ARG  36           2HB      ARG  36   7.144  10.726   4.632
  249    HG2  ARG  36           1HG      ARG  36   6.047   8.911   3.389
  250    HG3  ARG  36           2HG      ARG  36   5.199   8.440   4.863
  251    HD2  ARG  36           1HD      ARG  36   3.783   9.816   3.427
  252    HD3  ARG  36           2HD      ARG  36   4.125  10.628   4.954
  253    HE   ARG  36           HE       ARG  36   6.026  11.643   3.383
  254   HH11  ARG  36          1HH1      ARG  36   2.614  11.200   2.852
  255   HH12  ARG  36          2HH1      ARG  36   2.469  12.565   1.794
  256   HH21  ARG  36          1HH2      ARG  36   5.848  13.442   1.992
  257   HH22  ARG  36          2HH2      ARG  36   4.309  13.839   1.305
  258    H    GLY  37           H        GLY  37  10.327   8.797   4.714
  259    HA2  GLY  37           1HA      GLY  37  11.575   9.881   7.004
  260    HA3  GLY  37           2HA      GLY  37  12.319   9.694   5.422
  261    H    GLU  38           H        GLU  38  12.733  11.869   7.224
  262    HA   GLU  38           HA       GLU  38  11.584  14.070   5.636
  263    HB2  GLU  38           1HB      GLU  38  12.276  14.048   8.578
  264    HB3  GLU  38           2HB      GLU  38  11.789  15.477   7.678
  265    HG2  GLU  38           1HG      GLU  38   9.609  14.674   7.365
  266    HG3  GLU  38           2HG      GLU  38  10.058  13.034   7.829
  267    H    LYS  39           H        LYS  39  14.365  13.002   7.555
  268    HA   LYS  39           HA       LYS  39  16.089  15.122   6.974
  269    HB2  LYS  39           1HB      LYS  39  16.807  12.223   7.447
  270    HB3  LYS  39           2HB      LYS  39  17.906  13.589   7.581
  271    HG2  LYS  39           1HG      LYS  39  15.421  13.395   9.247
  272    HG3  LYS  39           2HG      LYS  39  16.936  12.632   9.732
  273    HD2  LYS  39           1HD      LYS  39  16.836  15.532   8.975
  274    HD3  LYS  39           2HD      LYS  39  16.416  15.001  10.605
  275    HE2  LYS  39           1HE      LYS  39  18.973  14.097   9.348
  276    HE3  LYS  39           2HE      LYS  39  18.862  15.709  10.054
  277    HZ1  LYS  39           3HZ      LYS  39  19.399  14.679  11.944
  278    HZ2  LYS  39           1HZ      LYS  39  19.006  13.143  11.351
  279    HZ3  LYS  39           2HZ      LYS  39  17.794  14.144  11.975
  280    HA   PRO  40           HA       PRO  40  17.093  14.600   2.722
  281    HB2  PRO  40           1HB      PRO  40  19.523  15.810   2.690
  282    HB3  PRO  40           2HB      PRO  40  18.005  16.706   2.831
  283    HG2  PRO  40           1HG      PRO  40  19.935  15.901   4.973
  284    HG3  PRO  40           2HG      PRO  40  19.091  17.445   4.749
  285    HD2  PRO  40           1HD      PRO  40  18.264  15.576   6.526
  286    HD3  PRO  40           2HD      PRO  40  17.136  16.654   5.680
  287    H    SER  41           H        SER  41  18.643  12.990   5.210
  288    HA   SER  41           HA       SER  41  20.588  11.680   3.456
  289    HB2  SER  41           1HB      SER  41  20.198  11.443   6.450
  290    HB3  SER  41           2HB      SER  41  21.497  10.695   5.520
  291    HG   SER  41           HG       SER  41  21.320  13.207   6.486
  292    H    GLY  42           H        GLY  42  20.824   9.252   3.839
  293    HA2  GLY  42           1HA      GLY  42  19.646   7.205   4.494
  294    HA3  GLY  42           2HA      GLY  42  18.148   8.021   4.067
  295    HA   PRO  43           HA       PRO  43  20.520   6.816  -0.011
  296    HB2  PRO  43           1HB      PRO  43  22.255   4.749   0.284
  297    HB3  PRO  43           2HB      PRO  43  22.743   6.441   0.430
  298    HG2  PRO  43           1HG      PRO  43  22.117   4.458   2.584
  299    HG3  PRO  43           2HG      PRO  43  23.437   5.639   2.500
  300    HD2  PRO  43           1HD      PRO  43  21.197   6.061   3.960
  301    HD3  PRO  43           2HD      PRO  43  22.090   7.381   3.181
  302    H    SER  44           H        SER  44  20.245   4.907  -1.421
  303    HA   SER  44           HA       SER  44  17.885   3.492  -0.781
  304    HB2  SER  44           1HB      SER  44  19.837   3.458  -3.041
  305    HB3  SER  44           2HB      SER  44  18.712   2.108  -2.891
  306    HG   SER  44           HG       SER  44  17.018   3.487  -3.130
  307    H    SER  45           H        SER  45  18.064   2.210   1.005
  308    HA   SER  45           HA       SER  45  20.114   0.670   1.898
  309    HB2  SER  45           1HB      SER  45  17.229  -0.243   1.897
  310    HB3  SER  45           2HB      SER  45  18.490  -0.719   3.034
  311    HG   SER  45           HG       SER  45  16.883   1.116   3.523
  312    H    GLY  46           H        GLY  46  21.388  -0.657   0.784
  313    HA2  GLY  46           1HA      GLY  46  20.097  -2.694  -0.918
  314    HA3  GLY  46           2HA      GLY  46  21.513  -1.815  -1.477
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1   9.996 -22.527  -0.463
    2    HA2  GLY   1           1HA      GLY   1   8.453 -20.836  -0.286
    3    HA3  GLY   1           2HA      GLY   1   7.662 -21.540  -1.689
    4    H    SER   2           H        SER   2   6.476 -20.322   0.687
    5    HA   SER   2           HA       SER   2   5.113 -22.639   1.878
    6    HB2  SER   2           1HB      SER   2   5.159 -19.769   2.841
    7    HB3  SER   2           2HB      SER   2   4.442 -21.142   3.684
    8    HG   SER   2           HG       SER   2   7.142 -21.268   2.951
    9    H    SER   3           H        SER   3   2.873 -22.768   1.916
   10    HA   SER   3           HA       SER   3   1.335 -20.727   0.508
   11    HB2  SER   3           1HB      SER   3   1.421 -23.632  -0.339
   12    HB3  SER   3           2HB      SER   3   0.238 -22.459  -0.918
   13    HG   SER   3           HG       SER   3   1.879 -22.499  -2.398
   14    H    GLY   4           H        GLY   4  -0.835 -20.659   1.067
   15    HA2  GLY   4           1HA      GLY   4  -2.698 -22.081   2.051
   16    HA3  GLY   4           2HA      GLY   4  -1.557 -22.380   3.354
   17    H    SER   5           H        SER   5  -2.512 -19.440   1.581
   18    HA   SER   5           HA       SER   5  -3.397 -18.283   4.133
   19    HB2  SER   5           1HB      SER   5  -2.271 -16.197   3.665
   20    HB3  SER   5           2HB      SER   5  -1.085 -17.499   3.570
   21    HG   SER   5           HG       SER   5  -2.087 -17.248   1.161
   22    H    SER   6           H        SER   6  -5.088 -19.394   2.245
   23    HA   SER   6           HA       SER   6  -6.495 -17.001   1.287
   24    HB2  SER   6           1HB      SER   6  -7.173 -18.263  -0.756
   25    HB3  SER   6           2HB      SER   6  -5.439 -17.955  -0.677
   26    HG   SER   6           HG       SER   6  -5.667 -20.079  -1.215
   27    H    GLY   7           H        GLY   7  -8.824 -17.551   0.703
   28    HA2  GLY   7           1HA      GLY   7 -10.861 -18.516   1.211
   29    HA3  GLY   7           2HA      GLY   7  -9.996 -19.862   1.938
   30    H    THR   8           H        THR   8 -12.357 -18.274   2.839
   31    HA   THR   8           HA       THR   8 -13.123 -17.117   4.682
   32    HB   THR   8           HB       THR   8 -12.461 -18.262   6.827
   33    HG1  THR   8           HG1      THR   8 -10.867 -19.792   5.023
   34   HG21  THR   8          3HG2      THR   8 -13.391 -20.511   6.103
   35   HG22  THR   8          1HG2      THR   8 -13.409 -19.868   4.462
   36   HG23  THR   8          2HG2      THR   8 -14.379 -19.101   5.719
   37    H    GLY   9           H        GLY   9 -11.002 -15.696   3.545
   38    HA2  GLY   9           1HA      GLY   9  -9.346 -14.869   5.827
   39    HA3  GLY   9           2HA      GLY   9  -9.042 -14.475   4.141
   40    H    GLU  10           H        GLU  10  -8.793 -12.403   5.685
   41    HA   GLU  10           HA       GLU  10 -11.329 -10.925   5.423
   42    HB2  GLU  10           1HB      GLU  10 -10.514 -11.402   7.800
   43    HB3  GLU  10           2HB      GLU  10  -9.202 -10.284   7.458
   44    HG2  GLU  10           1HG      GLU  10 -10.914  -9.106   8.622
   45    HG3  GLU  10           2HG      GLU  10 -10.887  -8.539   6.954
   46    H    ARG  11           H        ARG  11 -11.248  -9.339   3.989
   47    HA   ARG  11           HA       ARG  11  -8.736  -8.505   2.853
   48    HB2  ARG  11           1HB      ARG  11 -10.084  -7.193   1.317
   49    HB3  ARG  11           2HB      ARG  11 -10.751  -8.814   1.461
   50    HG2  ARG  11           1HG      ARG  11 -12.630  -8.097   2.552
   51    HG3  ARG  11           2HG      ARG  11 -11.834  -6.665   3.209
   52    HD2  ARG  11           1HD      ARG  11 -13.245  -5.780   1.594
   53    HD3  ARG  11           2HD      ARG  11 -11.701  -5.894   0.749
   54    HE   ARG  11           HE       ARG  11 -12.964  -8.253   0.201
   55   HH11  ARG  11          1HH1      ARG  11 -13.746  -4.884  -0.193
   56   HH12  ARG  11          2HH1      ARG  11 -14.729  -5.142  -1.596
   57   HH21  ARG  11          1HH2      ARG  11 -14.256  -8.606  -1.646
   58   HH22  ARG  11          2HH2      ARG  11 -15.018  -7.259  -2.421
   59    H    HIS  12           H        HIS  12  -7.733  -6.545   3.045
   60    HA   HIS  12           HA       HIS  12  -8.852  -4.245   4.216
   61    HB2  HIS  12           1HB      HIS  12  -7.229  -4.395   6.290
   62    HB3  HIS  12           2HB      HIS  12  -8.842  -5.100   6.356
   63    HD1  HIS  12           HD1      HIS  12  -8.510  -7.083   7.825
   64    HD2  HIS  12           HD2      HIS  12  -5.619  -6.828   4.852
   65    HE1  HIS  12           HE1      HIS  12  -7.176  -9.208   8.000
   66    H    TYR  13           H        TYR  13  -6.982  -2.699   4.957
   67    HA   TYR  13           HA       TYR  13  -4.927  -2.877   2.872
   68    HB2  TYR  13           1HB      TYR  13  -5.570  -0.448   4.538
   69    HB3  TYR  13           2HB      TYR  13  -4.731  -0.515   2.992
   70    HD1  TYR  13           HD2      TYR  13  -8.018  -0.764   4.638
   71    HD2  TYR  13           HD1      TYR  13  -5.944  -0.579   0.928
   72    HE1  TYR  13           HE2      TYR  13 -10.147  -0.360   3.475
   73    HE2  TYR  13           HE1      TYR  13  -8.067  -0.173  -0.246
   74    HH   TYR  13           HH       TYR  13 -11.085   0.279   1.522
   75    H    GLU  14           H        GLU  14  -3.131  -3.841   3.577
   76    HA   GLU  14           HA       GLU  14  -2.224  -3.375   6.321
   77    HB2  GLU  14           1HB      GLU  14  -2.387  -5.694   5.050
   78    HB3  GLU  14           2HB      GLU  14  -0.802  -5.220   4.455
   79    HG2  GLU  14           1HG      GLU  14  -0.001  -4.999   6.750
   80    HG3  GLU  14           2HG      GLU  14  -1.590  -5.471   7.349
   81    H    CYS  15           H        CYS  15  -0.518  -2.141   6.799
   82    HA   CYS  15           HA       CYS  15   0.619  -0.390   4.948
   83    HB2  CYS  15           1HB      CYS  15   0.556  -0.093   7.444
   84    HB3  CYS  15           2HB      CYS  15   1.872  -1.257   7.559
   85    H    SER  16           H        SER  16   2.004  -0.764   3.362
   86    HA   SER  16           HA       SER  16   3.539  -3.214   3.288
   87    HB2  SER  16           1HB      SER  16   2.364  -2.202   1.281
   88    HB3  SER  16           2HB      SER  16   3.609  -0.953   1.283
   89    HG   SER  16           HG       SER  16   4.154  -3.734   1.149
   90    H    GLU  17           H        GLU  17   4.260  -1.397   5.369
   91    HA   GLU  17           HA       GLU  17   7.028  -0.808   4.558
   92    HB2  GLU  17           1HB      GLU  17   5.211   0.873   6.288
   93    HB3  GLU  17           2HB      GLU  17   6.951   1.107   6.198
   94    HG2  GLU  17           1HG      GLU  17   5.408   1.085   3.663
   95    HG3  GLU  17           2HG      GLU  17   5.282   2.497   4.711
   96    H    CYS  18           H        CYS  18   4.854  -1.386   7.309
   97    HA   CYS  18           HA       CYS  18   7.098  -2.712   8.686
   98    HB2  CYS  18           1HB      CYS  18   5.922  -2.124  10.815
   99    HB3  CYS  18           2HB      CYS  18   6.504  -0.728   9.913
  100    H    GLY  19           H        GLY  19   3.555  -2.677   8.338
  101    HA2  GLY  19           1HA      GLY  19   2.616  -4.891   7.641
  102    HA3  GLY  19           2HA      GLY  19   3.580  -5.570   8.944
  103    H    LYS  20           H        LYS  20   1.190  -2.959   8.492
  104    HA   LYS  20           HA       LYS  20  -0.170  -3.938  10.915
  105    HB2  LYS  20           1HB      LYS  20   1.114  -1.697  11.077
  106    HB3  LYS  20           2HB      LYS  20  -0.192  -1.046  10.095
  107    HG2  LYS  20           1HG      LYS  20  -1.792  -1.439  11.762
  108    HG3  LYS  20           2HG      LYS  20  -0.718  -2.519  12.655
  109    HD2  LYS  20           1HD      LYS  20   0.772  -0.582  13.099
  110    HD3  LYS  20           2HD      LYS  20  -0.415   0.465  12.317
  111    HE2  LYS  20           1HE      LYS  20  -0.951   0.679  14.561
  112    HE3  LYS  20           2HE      LYS  20  -2.078  -0.561  14.014
  113    HZ1  LYS  20           3HZ      LYS  20  -0.066  -0.734  16.000
  114    HZ2  LYS  20           1HZ      LYS  20   0.201  -1.900  14.804
  115    HZ3  LYS  20           2HZ      LYS  20  -1.282  -1.845  15.615
  116    H    ALA  21           H        ALA  21  -2.293  -4.331  10.729
  117    HA   ALA  21           HA       ALA  21  -3.540  -3.899   8.135
  118    HB1  ALA  21           3HB      ALA  21  -5.232  -5.433   8.861
  119    HB2  ALA  21           1HB      ALA  21  -3.656  -6.105   9.280
  120    HB3  ALA  21           2HB      ALA  21  -4.656  -5.356  10.526
  121    H    PHE  22           H        PHE  22  -5.334  -2.657   7.766
  122    HA   PHE  22           HA       PHE  22  -6.435  -1.142  10.028
  123    HB2  PHE  22           1HB      PHE  22  -5.580   0.033   7.374
  124    HB3  PHE  22           2HB      PHE  22  -6.453   0.904   8.631
  125    HD1  PHE  22           HD1      PHE  22  -5.345   1.287  10.841
  126    HD2  PHE  22           HD2      PHE  22  -3.246  -0.212   7.455
  127    HE1  PHE  22           HE1      PHE  22  -3.209   1.914  11.891
  128    HE2  PHE  22           HE2      PHE  22  -1.108   0.411   8.500
  129    HZ   PHE  22           HZ       PHE  22  -1.087   1.475  10.721
  130    H    ILE  23           H        ILE  23  -8.602  -0.801   9.967
  131    HA   ILE  23           HA       ILE  23 -10.209  -2.416   8.333
  132    HB   ILE  23           HB       ILE  23 -11.035  -1.706  10.473
  133   HG12  ILE  23          1HG1      ILE  23 -13.243  -0.619   9.739
  134   HG13  ILE  23          2HG1      ILE  23 -12.578  -0.646   8.110
  135   HG21  ILE  23          1HG2      ILE  23 -10.682   1.059   9.364
  136   HG22  ILE  23          2HG2      ILE  23 -11.761   0.736  10.721
  137   HG23  ILE  23          3HG2      ILE  23 -10.040   0.375  10.858
  138   HD11  ILE  23          3HD1      ILE  23 -13.728  -2.600   8.091
  139   HD12  ILE  23          1HD1      ILE  23 -12.181  -3.186   8.702
  140   HD13  ILE  23          2HD1      ILE  23 -13.511  -2.877   9.819
  141    H    GLN  24           H        GLN  24  -9.172   0.918   8.013
  142    HA   GLN  24           HA       GLN  24 -10.575   1.047   5.425
  143    HB2  GLN  24           1HB      GLN  24  -9.956   3.275   7.368
  144    HB3  GLN  24           2HB      GLN  24 -10.561   3.533   5.738
  145    HG2  GLN  24           1HG      GLN  24 -11.973   2.065   7.954
  146    HG3  GLN  24           2HG      GLN  24 -12.358   3.675   7.347
  147   HE21  GLN  24          1HE2      GLN  24 -13.746   0.945   7.437
  148   HE22  GLN  24          2HE2      GLN  24 -14.367   0.759   5.836
  149    H    LYS  25           H        LYS  25  -9.512   2.640   3.889
  150    HA   LYS  25           HA       LYS  25  -6.731   1.909   3.646
  151    HB2  LYS  25           1HB      LYS  25  -8.172   1.913   1.671
  152    HB3  LYS  25           2HB      LYS  25  -8.493   3.629   1.889
  153    HG2  LYS  25           1HG      LYS  25  -6.420   4.254   1.139
  154    HG3  LYS  25           2HG      LYS  25  -5.674   2.719   1.588
  155    HD2  LYS  25           1HD      LYS  25  -6.875   1.614  -0.248
  156    HD3  LYS  25           2HD      LYS  25  -7.590   3.162  -0.703
  157    HE2  LYS  25           1HE      LYS  25  -5.471   4.055  -1.304
  158    HE3  LYS  25           2HE      LYS  25  -4.619   2.694  -0.578
  159    HZ1  LYS  25           3HZ      LYS  25  -6.207   1.477  -2.373
  160    HZ2  LYS  25           1HZ      LYS  25  -4.597   1.910  -2.657
  161    HZ3  LYS  25           2HZ      LYS  25  -5.849   2.920  -3.178
  162    H    SER  26           H        SER  26  -8.537   4.975   3.834
  163    HA   SER  26           HA       SER  26  -6.403   6.730   3.835
  164    HB2  SER  26           1HB      SER  26  -8.794   7.400   3.733
  165    HB3  SER  26           2HB      SER  26  -8.949   7.023   5.448
  166    HG   SER  26           HG       SER  26  -7.465   8.652   5.901
  167    H    THR  27           H        THR  27  -7.865   5.028   6.576
  168    HA   THR  27           HA       THR  27  -6.539   6.172   8.688
  169    HB   THR  27           HB       THR  27  -7.044   3.204   8.420
  170    HG1  THR  27           HG1      THR  27  -8.759   5.383   8.966
  171   HG21  THR  27          3HG2      THR  27  -6.276   3.095  10.507
  172   HG22  THR  27          1HG2      THR  27  -7.568   4.182  11.016
  173   HG23  THR  27          2HG2      THR  27  -6.005   4.837  10.529
  174    H    LEU  28           H        LEU  28  -5.351   3.677   6.482
  175    HA   LEU  28           HA       LEU  28  -2.919   3.187   7.845
  176    HB2  LEU  28           1HB      LEU  28  -3.413   1.497   6.390
  177    HB3  LEU  28           2HB      LEU  28  -4.022   2.594   5.153
  178    HG   LEU  28           HG       LEU  28  -1.634   3.240   4.697
  179   HD11  LEU  28          1HD1      LEU  28  -0.794   2.407   6.908
  180   HD12  LEU  28          2HD1      LEU  28   0.142   1.886   5.507
  181   HD13  LEU  28          3HD1      LEU  28  -0.979   0.768   6.284
  182   HD21  LEU  28          3HD2      LEU  28  -1.445   0.465   4.060
  183   HD22  LEU  28          1HD2      LEU  28  -1.846   1.821   3.006
  184   HD23  LEU  28          2HD2      LEU  28  -3.123   0.983   3.887
  185    H    SER  29           H        SER  29  -3.711   5.226   5.041
  186    HA   SER  29           HA       SER  29  -1.219   6.181   4.400
  187    HB2  SER  29           1HB      SER  29  -3.939   7.458   4.301
  188    HB3  SER  29           2HB      SER  29  -2.507   8.353   3.791
  189    HG   SER  29           HG       SER  29  -2.863   7.374   1.961
  190    H    MET  30           H        MET  30  -3.360   7.261   6.990
  191    HA   MET  30           HA       MET  30  -1.836   9.501   7.783
  192    HB2  MET  30           1HB      MET  30  -3.620   7.815   9.543
  193    HB3  MET  30           2HB      MET  30  -3.165   9.496   9.793
  194    HG2  MET  30           1HG      MET  30  -4.308   9.842   7.470
  195    HG3  MET  30           2HG      MET  30  -5.107   8.323   7.866
  196    HE1  MET  30           3HE      MET  30  -7.547   9.898   7.704
  197    HE2  MET  30           1HE      MET  30  -7.290   8.383   8.571
  198    HE3  MET  30           2HE      MET  30  -8.149   9.711   9.351
  199    H    HIS  31           H        HIS  31  -1.605   6.092   8.496
  200    HA   HIS  31           HA       HIS  31   0.232   6.431  10.686
  201    HB2  HIS  31           1HB      HIS  31  -0.919   4.456  10.951
  202    HB3  HIS  31           2HB      HIS  31  -0.953   4.118   9.223
  203    HD1  HIS  31           HD1      HIS  31   0.977   3.466  12.302
  204    HD2  HIS  31           HD2      HIS  31   1.436   2.921   8.209
  205    HE1  HIS  31           HE1      HIS  31   2.895   1.859  12.048
  206    H    GLN  32           H        GLN  32   0.491   5.247   7.339
  207    HA   GLN  32           HA       GLN  32   3.109   4.595   7.148
  208    HB2  GLN  32           1HB      GLN  32   1.271   5.978   5.234
  209    HB3  GLN  32           2HB      GLN  32   2.960   5.753   4.797
  210    HG2  GLN  32           1HG      GLN  32   2.490   3.272   5.482
  211    HG3  GLN  32           2HG      GLN  32   0.814   3.729   5.182
  212   HE21  GLN  32          1HE2      GLN  32   0.185   3.123   3.250
  213   HE22  GLN  32          2HE2      GLN  32   1.130   3.168   1.805
  214    H    ARG  33           H        ARG  33   1.830   7.744   7.742
  215    HA   ARG  33           HA       ARG  33   3.807   9.442   6.867
  216    HB2  ARG  33           1HB      ARG  33   3.021  11.019   8.428
  217    HB3  ARG  33           2HB      ARG  33   1.627  10.006   8.075
  218    HG2  ARG  33           1HG      ARG  33   1.966   8.778  10.141
  219    HG3  ARG  33           2HG      ARG  33   3.407   9.736  10.488
  220    HD2  ARG  33           1HD      ARG  33   1.758  11.752  10.229
  221    HD3  ARG  33           2HD      ARG  33   0.531  10.530  10.559
  222    HE   ARG  33           HE       ARG  33   1.225  10.469  12.742
  223   HH11  ARG  33          1HH1      ARG  33   3.619  12.108  10.820
  224   HH12  ARG  33          2HH1      ARG  33   4.546  12.633  12.187
  225   HH21  ARG  33          1HH2      ARG  33   2.436  11.153  14.549
  226   HH22  ARG  33          2HH2      ARG  33   3.873  12.088  14.307
  227    H    ILE  34           H        ILE  34   3.769   7.470   9.801
  228    HA   ILE  34           HA       ILE  34   6.073   8.474  11.017
  229    HB   ILE  34           HB       ILE  34   6.176   6.423  12.278
  230   HG12  ILE  34          1HG1      ILE  34   3.998   5.174  10.653
  231   HG13  ILE  34          2HG1      ILE  34   5.657   5.066  10.074
  232   HG21  ILE  34          1HG2      ILE  34   3.742   7.922  11.896
  233   HG22  ILE  34          2HG2      ILE  34   3.399   6.278  12.431
  234   HG23  ILE  34          3HG2      ILE  34   4.464   7.311  13.384
  235   HD11  ILE  34          3HD1      ILE  34   5.783   4.349  12.759
  236   HD12  ILE  34          1HD1      ILE  34   4.330   3.567  12.136
  237   HD13  ILE  34          2HD1      ILE  34   5.888   3.282  11.359
  238    H    HIS  35           H        HIS  35   5.688   6.391   8.279
  239    HA   HIS  35           HA       HIS  35   8.411   5.424   8.331
  240    HB2  HIS  35           1HB      HIS  35   6.170   5.156   6.327
  241    HB3  HIS  35           2HB      HIS  35   7.779   4.495   6.055
  242    HD1  HIS  35           HD1      HIS  35   8.444   3.150   8.631
  243    HD2  HIS  35           HD2      HIS  35   4.623   3.051   7.002
  244    HE1  HIS  35           HE1      HIS  35   7.336   1.129   9.638
  245    H    ARG  36           H        ARG  36   6.553   7.902   6.674
  246    HA   ARG  36           HA       ARG  36   8.983   8.742   5.244
  247    HB2  ARG  36           1HB      ARG  36   7.351  10.124   3.877
  248    HB3  ARG  36           2HB      ARG  36   7.239   8.380   3.685
  249    HG2  ARG  36           1HG      ARG  36   5.344   8.377   5.285
  250    HG3  ARG  36           2HG      ARG  36   5.419  10.140   5.311
  251    HD2  ARG  36           1HD      ARG  36   5.165   8.653   2.724
  252    HD3  ARG  36           2HD      ARG  36   3.746   8.973   3.720
  253    HE   ARG  36           HE       ARG  36   5.387  11.280   3.122
  254   HH11  ARG  36          1HH1      ARG  36   2.654   9.328   2.207
  255   HH12  ARG  36          2HH1      ARG  36   1.899  10.586   1.284
  256   HH21  ARG  36          1HH2      ARG  36   4.403  12.944   1.911
  257   HH22  ARG  36          2HH2      ARG  36   2.896  12.642   1.116
  258    H    GLY  37           H        GLY  37   9.987   9.932   6.851
  259    HA2  GLY  37           1HA      GLY  37   8.651  12.473   7.497
  260    HA3  GLY  37           2HA      GLY  37   9.367  11.522   8.789
  261    H    GLU  38           H        GLU  38  10.781  13.231   9.312
  262    HA   GLU  38           HA       GLU  38  12.426  14.683   7.694
  263    HB2  GLU  38           1HB      GLU  38  13.142  13.483  10.375
  264    HB3  GLU  38           2HB      GLU  38  14.011  14.796   9.593
  265    HG2  GLU  38           1HG      GLU  38  11.242  14.810  10.739
  266    HG3  GLU  38           2HG      GLU  38  12.622  15.818  11.174
  267    H    LYS  39           H        LYS  39  14.699  14.484   7.148
  268    HA   LYS  39           HA       LYS  39  15.333  11.763   6.282
  269    HB2  LYS  39           1HB      LYS  39  16.507  14.434   5.489
  270    HB3  LYS  39           2HB      LYS  39  17.038  12.884   4.849
  271    HG2  LYS  39           1HG      LYS  39  15.179  12.620   3.559
  272    HG3  LYS  39           2HG      LYS  39  14.154  13.560   4.646
  273    HD2  LYS  39           1HD      LYS  39  15.561  15.576   3.909
  274    HD3  LYS  39           2HD      LYS  39  16.116  14.539   2.593
  275    HE2  LYS  39           1HE      LYS  39  14.284  15.775   1.746
  276    HE3  LYS  39           2HE      LYS  39  13.688  14.143   2.041
  277    HZ1  LYS  39           3HZ      LYS  39  12.506  16.399   2.917
  278    HZ2  LYS  39           1HZ      LYS  39  13.385  15.927   4.283
  279    HZ3  LYS  39           2HZ      LYS  39  12.268  14.864   3.587
  280    HA   PRO  40           HA       PRO  40  18.468  11.229   9.326
  281    HB2  PRO  40           1HB      PRO  40  20.002   9.388   8.050
  282    HB3  PRO  40           2HB      PRO  40  18.429   9.002   8.759
  283    HG2  PRO  40           1HG      PRO  40  19.130   9.581   5.907
  284    HG3  PRO  40           2HG      PRO  40  18.060   8.329   6.564
  285    HD2  PRO  40           1HD      PRO  40  17.122  10.636   5.500
  286    HD3  PRO  40           2HD      PRO  40  16.301   9.795   6.831
  287    H    SER  41           H        SER  41  19.148  12.336   6.127
  288    HA   SER  41           HA       SER  41  21.831  13.210   6.979
  289    HB2  SER  41           1HB      SER  41  20.744  12.524   4.249
  290    HB3  SER  41           2HB      SER  41  22.237  13.438   4.462
  291    HG   SER  41           HG       SER  41  23.228  11.687   5.137
  292    H    GLY  42           H        GLY  42  20.982  15.083   8.006
  293    HA2  GLY  42           1HA      GLY  42  21.019  17.407   6.473
  294    HA3  GLY  42           2HA      GLY  42  19.330  16.969   6.687
  295    HA   PRO  43           HA       PRO  43  19.267  18.996  10.570
  296    HB2  PRO  43           1HB      PRO  43  17.508  17.465  11.960
  297    HB3  PRO  43           2HB      PRO  43  17.016  18.541  10.647
  298    HG2  PRO  43           1HG      PRO  43  17.479  15.584  10.599
  299    HG3  PRO  43           2HG      PRO  43  16.172  16.524   9.855
  300    HD2  PRO  43           1HD      PRO  43  18.303  15.624   8.448
  301    HD3  PRO  43           2HD      PRO  43  17.472  17.144   8.056
  302    H    SER  44           H        SER  44  19.263  18.408  13.047
  303    HA   SER  44           HA       SER  44  21.715  17.009  13.528
  304    HB2  SER  44           1HB      SER  44  20.759  19.084  14.767
  305    HB3  SER  44           2HB      SER  44  19.840  17.905  15.702
  306    HG   SER  44           HG       SER  44  21.834  16.925  16.264
  307    H    SER  45           H        SER  45  22.009  15.206  14.930
  308    HA   SER  45           HA       SER  45  19.900  13.231  14.645
  309    HB2  SER  45           1HB      SER  45  22.485  12.915  14.278
  310    HB3  SER  45           2HB      SER  45  22.500  12.666  16.023
  311    HG   SER  45           HG       SER  45  21.165  10.923  15.785
  312    H    GLY  46           H        GLY  46  18.665  12.424  16.249
  313    HA2  GLY  46           1HA      GLY  46  18.984  11.987  18.833
  314    HA3  GLY  46           2HA      GLY  46  18.855  13.740  18.852
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1   3.849 -30.116  -7.777
    2    HA2  GLY   1           1HA      GLY   1   3.324 -30.287  -5.291
    3    HA3  GLY   1           2HA      GLY   1   5.070 -30.336  -5.100
    4    H    SER   2           H        SER   2   2.517 -28.374  -4.780
    5    HA   SER   2           HA       SER   2   4.146 -26.006  -4.770
    6    HB2  SER   2           1HB      SER   2   1.823 -26.190  -6.704
    7    HB3  SER   2           2HB      SER   2   2.707 -24.714  -6.317
    8    HG   SER   2           HG       SER   2   3.308 -26.542  -8.132
    9    H    SER   3           H        SER   3   2.928 -24.106  -3.956
   10    HA   SER   3           HA       SER   3   0.761 -24.983  -2.164
   11    HB2  SER   3           1HB      SER   3   2.601 -24.304  -0.826
   12    HB3  SER   3           2HB      SER   3   2.904 -22.884  -1.828
   13    HG   SER   3           HG       SER   3   1.789 -21.998  -0.240
   14    H    GLY   4           H        GLY   4  -1.171 -23.992  -2.249
   15    HA2  GLY   4           1HA      GLY   4  -1.421 -21.712  -4.107
   16    HA3  GLY   4           2HA      GLY   4  -2.681 -22.903  -3.822
   17    H    SER   5           H        SER   5  -4.256 -21.470  -3.192
   18    HA   SER   5           HA       SER   5  -4.120 -20.582  -0.461
   19    HB2  SER   5           1HB      SER   5  -3.009 -18.738  -1.838
   20    HB3  SER   5           2HB      SER   5  -4.602 -18.442  -2.535
   21    HG   SER   5           HG       SER   5  -4.342 -18.556   0.252
   22    H    SER   6           H        SER   6  -6.221 -19.278   0.047
   23    HA   SER   6           HA       SER   6  -8.444 -20.478  -1.471
   24    HB2  SER   6           1HB      SER   6  -7.980 -20.326   1.489
   25    HB3  SER   6           2HB      SER   6  -9.629 -20.348   0.864
   26    HG   SER   6           HG       SER   6  -8.384 -22.435   1.367
   27    H    GLY   7           H        GLY   7 -10.575 -19.320  -0.963
   28    HA2  GLY   7           1HA      GLY   7 -10.115 -16.478  -1.403
   29    HA3  GLY   7           2HA      GLY   7 -11.636 -17.333  -1.614
   30    H    THR   8           H        THR   8  -9.412 -16.047   0.813
   31    HA   THR   8           HA       THR   8 -11.565 -16.089   2.801
   32    HB   THR   8           HB       THR   8  -9.748 -15.386   4.400
   33    HG1  THR   8           HG1      THR   8  -7.576 -16.024   3.381
   34   HG21  THR   8          3HG2      THR   8  -8.652 -17.625   4.429
   35   HG22  THR   8          1HG2      THR   8  -9.418 -17.973   2.880
   36   HG23  THR   8          2HG2      THR   8 -10.410 -17.698   4.312
   37    H    GLY   9           H        GLY   9 -12.479 -14.271   3.618
   38    HA2  GLY   9           1HA      GLY   9 -12.344 -11.872   2.139
   39    HA3  GLY   9           2HA      GLY   9 -13.140 -12.074   3.693
   40    H    GLU  10           H        GLU  10 -12.434 -10.648   5.122
   41    HA   GLU  10           HA       GLU  10 -11.086  -9.210   6.264
   42    HB2  GLU  10           1HB      GLU  10  -9.114 -11.418   5.666
   43    HB3  GLU  10           2HB      GLU  10  -8.771 -10.075   6.747
   44    HG2  GLU  10           1HG      GLU  10 -11.203 -11.726   7.215
   45    HG3  GLU  10           2HG      GLU  10  -9.625 -12.360   7.676
   46    H    ARG  11           H        ARG  11 -11.429  -8.612   3.530
   47    HA   ARG  11           HA       ARG  11  -8.940  -7.963   2.299
   48    HB2  ARG  11           1HB      ARG  11 -11.731  -6.937   1.744
   49    HB3  ARG  11           2HB      ARG  11 -10.331  -6.660   0.716
   50    HG2  ARG  11           1HG      ARG  11 -10.247  -8.860   0.012
   51    HG3  ARG  11           2HG      ARG  11 -11.161  -9.446   1.403
   52    HD2  ARG  11           1HD      ARG  11 -12.258  -7.765  -0.849
   53    HD3  ARG  11           2HD      ARG  11 -12.492  -9.501  -0.655
   54    HE   ARG  11           HE       ARG  11 -13.359  -7.968   1.613
   55   HH11  ARG  11          1HH1      ARG  11 -14.257  -9.189  -1.521
   56   HH12  ARG  11          2HH1      ARG  11 -15.957  -9.157  -1.191
   57   HH21  ARG  11          1HH2      ARG  11 -15.595  -7.921   2.060
   58   HH22  ARG  11          2HH2      ARG  11 -16.717  -8.435   0.846
   59    H    HIS  12           H        HIS  12  -7.893  -6.858   4.070
   60    HA   HIS  12           HA       HIS  12  -8.818  -4.081   4.407
   61    HB2  HIS  12           1HB      HIS  12  -7.643  -4.065   6.559
   62    HB3  HIS  12           2HB      HIS  12  -8.848  -5.348   6.508
   63    HD1  HIS  12           HD1      HIS  12  -8.046  -7.683   6.943
   64    HD2  HIS  12           HD2      HIS  12  -4.923  -5.024   6.282
   65    HE1  HIS  12           HE1      HIS  12  -5.949  -8.965   7.472
   66    H    TYR  13           H        TYR  13  -7.038  -2.500   4.809
   67    HA   TYR  13           HA       TYR  13  -4.940  -2.929   2.839
   68    HB2  TYR  13           1HB      TYR  13  -5.937  -0.502   4.319
   69    HB3  TYR  13           2HB      TYR  13  -4.461  -0.463   3.362
   70    HD1  TYR  13           HD2      TYR  13  -8.086  -1.292   3.107
   71    HD2  TYR  13           HD1      TYR  13  -4.572  -0.001   1.083
   72    HE1  TYR  13           HE2      TYR  13  -9.416  -0.859   1.084
   73    HE2  TYR  13           HE1      TYR  13  -5.893   0.436  -0.945
   74    HH   TYR  13           HH       TYR  13  -8.850   0.942  -1.139
   75    H    GLU  14           H        GLU  14  -2.976  -3.582   3.380
   76    HA   GLU  14           HA       GLU  14  -2.124  -3.343   6.179
   77    HB2  GLU  14           1HB      GLU  14  -1.003  -5.072   3.967
   78    HB3  GLU  14           2HB      GLU  14  -0.484  -5.086   5.646
   79    HG2  GLU  14           1HG      GLU  14  -1.884  -6.884   5.625
   80    HG3  GLU  14           2HG      GLU  14  -3.005  -5.611   6.105
   81    H    CYS  15           H        CYS  15  -0.105  -2.507   6.732
   82    HA   CYS  15           HA       CYS  15   0.862  -0.447   4.970
   83    HB2  CYS  15           1HB      CYS  15   0.669  -0.108   7.418
   84    HB3  CYS  15           2HB      CYS  15   1.917  -1.325   7.666
   85    H    SER  16           H        SER  16   2.441  -0.644   3.536
   86    HA   SER  16           HA       SER  16   4.007  -3.079   3.439
   87    HB2  SER  16           1HB      SER  16   3.054  -2.141   1.368
   88    HB3  SER  16           2HB      SER  16   4.012  -0.678   1.592
   89    HG   SER  16           HG       SER  16   5.500  -1.706   0.537
   90    H    GLU  17           H        GLU  17   4.479  -1.244   5.643
   91    HA   GLU  17           HA       GLU  17   7.312  -0.634   5.118
   92    HB2  GLU  17           1HB      GLU  17   5.421   0.937   6.877
   93    HB3  GLU  17           2HB      GLU  17   7.136   1.264   6.669
   94    HG2  GLU  17           1HG      GLU  17   5.424   1.194   4.247
   95    HG3  GLU  17           2HG      GLU  17   5.290   2.581   5.326
   96    H    CYS  18           H        CYS  18   4.933  -1.242   7.696
   97    HA   CYS  18           HA       CYS  18   7.064  -2.583   9.227
   98    HB2  CYS  18           1HB      CYS  18   5.547  -2.177  11.213
   99    HB3  CYS  18           2HB      CYS  18   6.261  -0.735  10.497
  100    H    GLY  19           H        GLY  19   3.564  -2.716   8.562
  101    HA2  GLY  19           1HA      GLY  19   2.913  -4.995   7.639
  102    HA3  GLY  19           2HA      GLY  19   3.674  -5.617   9.096
  103    H    LYS  20           H        LYS  20   1.838  -2.655   9.125
  104    HA   LYS  20           HA       LYS  20   0.038  -3.765  11.089
  105    HB2  LYS  20           1HB      LYS  20   1.075  -1.329  10.869
  106    HB3  LYS  20           2HB      LYS  20  -0.382  -1.052   9.923
  107    HG2  LYS  20           1HG      LYS  20  -0.996  -0.408  12.060
  108    HG3  LYS  20           2HG      LYS  20  -1.627  -2.052  11.939
  109    HD2  LYS  20           1HD      LYS  20   1.125  -1.692  13.001
  110    HD3  LYS  20           2HD      LYS  20  -0.227  -1.233  14.039
  111    HE2  LYS  20           1HE      LYS  20  -1.145  -3.591  13.286
  112    HE3  LYS  20           2HE      LYS  20   0.567  -3.912  13.011
  113    HZ1  LYS  20           3HZ      LYS  20   0.355  -2.685  15.494
  114    HZ2  LYS  20           1HZ      LYS  20   0.768  -4.293  15.168
  115    HZ3  LYS  20           2HZ      LYS  20  -0.847  -3.874  15.446
  116    H    ALA  21           H        ALA  21  -2.309  -3.539  10.921
  117    HA   ALA  21           HA       ALA  21  -3.293  -3.682   8.150
  118    HB1  ALA  21           3HB      ALA  21  -3.432  -5.718  10.246
  119    HB2  ALA  21           1HB      ALA  21  -4.978  -5.372   9.471
  120    HB3  ALA  21           2HB      ALA  21  -3.595  -5.873   8.497
  121    H    PHE  22           H        PHE  22  -4.847  -2.254   7.773
  122    HA   PHE  22           HA       PHE  22  -6.560  -1.408  10.014
  123    HB2  PHE  22           1HB      PHE  22  -5.805   0.436   7.760
  124    HB3  PHE  22           2HB      PHE  22  -6.472   0.845   9.337
  125    HD1  PHE  22           HD2      PHE  22  -3.442  -0.224   7.546
  126    HD2  PHE  22           HD1      PHE  22  -5.070   1.150  11.231
  127    HE1  PHE  22           HE2      PHE  22  -1.169   0.179   8.397
  128    HE2  PHE  22           HE1      PHE  22  -2.800   1.557  12.087
  129    HZ   PHE  22           HZ       PHE  22  -0.845   1.070  10.670
  130    H    ILE  23           H        ILE  23  -8.721  -0.995   9.550
  131    HA   ILE  23           HA       ILE  23  -9.769  -2.432   7.289
  132    HB   ILE  23           HB       ILE  23 -10.912  -2.567   9.437
  133   HG12  ILE  23          1HG1      ILE  23 -13.230  -1.687   8.575
  134   HG13  ILE  23          2HG1      ILE  23 -12.339  -1.364   7.092
  135   HG21  ILE  23          1HG2      ILE  23 -11.627  -0.803  10.668
  136   HG22  ILE  23          2HG2      ILE  23 -10.324   0.011   9.803
  137   HG23  ILE  23          3HG2      ILE  23 -11.990   0.181   9.250
  138   HD11  ILE  23          3HD1      ILE  23 -11.651  -3.967   7.826
  139   HD12  ILE  23          1HD1      ILE  23 -13.390  -3.837   8.089
  140   HD13  ILE  23          2HD1      ILE  23 -12.707  -3.462   6.507
  141    H    GLN  24           H        GLN  24  -9.380   0.926   8.228
  142    HA   GLN  24           HA       GLN  24 -10.735   1.790   5.773
  143    HB2  GLN  24           1HB      GLN  24  -9.998   3.203   8.323
  144    HB3  GLN  24           2HB      GLN  24 -10.411   4.103   6.870
  145    HG2  GLN  24           1HG      GLN  24 -12.595   3.044   6.809
  146    HG3  GLN  24           2HG      GLN  24 -12.184   2.090   8.234
  147   HE21  GLN  24          1HE2      GLN  24 -12.449   2.954  10.208
  148   HE22  GLN  24          2HE2      GLN  24 -13.000   4.563  10.509
  149    H    LYS  25           H        LYS  25  -9.571   2.328   4.059
  150    HA   LYS  25           HA       LYS  25  -6.844   2.145   3.823
  151    HB2  LYS  25           1HB      LYS  25  -8.778   2.529   2.052
  152    HB3  LYS  25           2HB      LYS  25  -8.245   4.201   2.173
  153    HG2  LYS  25           1HG      LYS  25  -6.288   1.995   1.655
  154    HG3  LYS  25           2HG      LYS  25  -7.230   2.712   0.345
  155    HD2  LYS  25           1HD      LYS  25  -6.270   4.837   0.681
  156    HD3  LYS  25           2HD      LYS  25  -5.623   4.384   2.259
  157    HE2  LYS  25           1HE      LYS  25  -3.797   4.403   0.739
  158    HE3  LYS  25           2HE      LYS  25  -4.173   2.712   1.070
  159    HZ1  LYS  25           3HZ      LYS  25  -5.664   3.603  -1.153
  160    HZ2  LYS  25           1HZ      LYS  25  -4.508   2.370  -1.077
  161    HZ3  LYS  25           2HZ      LYS  25  -4.030   3.960  -1.402
  162    H    SER  26           H        SER  26  -8.681   5.187   4.148
  163    HA   SER  26           HA       SER  26  -6.625   6.985   4.241
  164    HB2  SER  26           1HB      SER  26  -9.175   7.376   4.428
  165    HB3  SER  26           2HB      SER  26  -8.928   7.220   6.166
  166    HG   SER  26           HG       SER  26  -8.500   9.343   4.626
  167    H    THR  27           H        THR  27  -7.875   5.041   6.927
  168    HA   THR  27           HA       THR  27  -6.385   6.100   9.007
  169    HB   THR  27           HB       THR  27  -7.146   3.199   8.610
  170    HG1  THR  27           HG1      THR  27  -8.843   4.045  10.190
  171   HG21  THR  27          3HG2      THR  27  -5.425   4.137  10.478
  172   HG22  THR  27          1HG2      THR  27  -6.490   2.754  10.727
  173   HG23  THR  27          2HG2      THR  27  -6.961   4.348  11.317
  174    H    LEU  28           H        LEU  28  -5.443   3.775   6.541
  175    HA   LEU  28           HA       LEU  28  -2.931   3.127   7.742
  176    HB2  LEU  28           1HB      LEU  28  -3.649   1.459   6.339
  177    HB3  LEU  28           2HB      LEU  28  -4.261   2.590   5.134
  178    HG   LEU  28           HG       LEU  28  -1.891   3.086   4.510
  179   HD11  LEU  28          1HD1      LEU  28  -0.127   1.664   5.249
  180   HD12  LEU  28          2HD1      LEU  28  -1.247   0.648   6.157
  181   HD13  LEU  28          3HD1      LEU  28  -0.934   2.302   6.682
  182   HD21  LEU  28          3HD2      LEU  28  -3.482   1.308   3.473
  183   HD22  LEU  28          1HD2      LEU  28  -2.371   0.152   4.209
  184   HD23  LEU  28          2HD2      LEU  28  -1.774   1.319   3.029
  185    H    SER  29           H        SER  29  -3.847   5.088   4.911
  186    HA   SER  29           HA       SER  29  -1.368   6.000   4.156
  187    HB2  SER  29           1HB      SER  29  -3.756   6.462   3.172
  188    HB3  SER  29           2HB      SER  29  -3.676   7.915   4.169
  189    HG   SER  29           HG       SER  29  -2.745   8.591   2.359
  190    H    MET  30           H        MET  30  -3.472   7.273   6.698
  191    HA   MET  30           HA       MET  30  -1.809   9.485   7.347
  192    HB2  MET  30           1HB      MET  30  -3.235   9.806   9.236
  193    HB3  MET  30           2HB      MET  30  -4.251   9.284   7.900
  194    HG2  MET  30           1HG      MET  30  -4.627   7.202   8.824
  195    HG3  MET  30           2HG      MET  30  -3.191   7.282   9.841
  196    HE1  MET  30           3HE      MET  30  -7.159   7.449  10.423
  197    HE2  MET  30           1HE      MET  30  -7.244   9.211  10.412
  198    HE3  MET  30           2HE      MET  30  -6.586   8.352   9.019
  199    H    HIS  31           H        HIS  31  -1.652   6.141   8.043
  200    HA   HIS  31           HA       HIS  31  -0.005   6.474  10.413
  201    HB2  HIS  31           1HB      HIS  31  -1.310   4.583  10.670
  202    HB3  HIS  31           2HB      HIS  31  -1.206   4.150   8.966
  203    HD1  HIS  31           HD1      HIS  31   0.240   3.405  12.229
  204    HD2  HIS  31           HD2      HIS  31   1.368   2.975   8.254
  205    HE1  HIS  31           HE1      HIS  31   2.132   1.748  12.242
  206    H    GLN  32           H        GLN  32   0.365   5.135   7.135
  207    HA   GLN  32           HA       GLN  32   2.952   4.337   7.123
  208    HB2  GLN  32           1HB      GLN  32   1.318   5.742   5.040
  209    HB3  GLN  32           2HB      GLN  32   3.002   5.351   4.718
  210    HG2  GLN  32           1HG      GLN  32   2.419   2.967   5.347
  211    HG3  GLN  32           2HG      GLN  32   0.731   3.471   5.268
  212   HE21  GLN  32          1HE2      GLN  32   3.295   2.228   3.553
  213   HE22  GLN  32          2HE2      GLN  32   2.700   2.485   1.952
  214    H    ARG  33           H        ARG  33   1.814   7.568   7.511
  215    HA   ARG  33           HA       ARG  33   3.935   9.111   6.670
  216    HB2  ARG  33           1HB      ARG  33   3.133  10.815   8.077
  217    HB3  ARG  33           2HB      ARG  33   1.712   9.852   7.695
  218    HG2  ARG  33           1HG      ARG  33   1.787   8.782   9.839
  219    HG3  ARG  33           2HG      ARG  33   3.323   9.563  10.220
  220    HD2  ARG  33           1HD      ARG  33   0.727  11.010   9.709
  221    HD3  ARG  33           2HD      ARG  33   1.378  10.643  11.306
  222    HE   ARG  33           HE       ARG  33   3.170  12.121   9.598
  223   HH11  ARG  33          1HH1      ARG  33   0.617  12.308  11.958
  224   HH12  ARG  33          2HH1      ARG  33   1.026  13.915  12.464
  225   HH21  ARG  33          1HH2      ARG  33   3.717  14.236  10.254
  226   HH22  ARG  33          2HH2      ARG  33   2.788  15.010  11.493
  227    H    ILE  34           H        ILE  34   3.577   7.355   9.721
  228    HA   ILE  34           HA       ILE  34   5.790   8.279  11.090
  229    HB   ILE  34           HB       ILE  34   5.782   6.215  12.341
  230   HG12  ILE  34          1HG1      ILE  34   3.721   4.986  10.565
  231   HG13  ILE  34          2HG1      ILE  34   5.408   4.893  10.071
  232   HG21  ILE  34          1HG2      ILE  34   3.222   6.031  12.717
  233   HG22  ILE  34          2HG2      ILE  34   4.041   7.551  13.069
  234   HG23  ILE  34          3HG2      ILE  34   3.134   7.366  11.568
  235   HD11  ILE  34          3HD1      ILE  34   5.298   4.153  12.788
  236   HD12  ILE  34          1HD1      ILE  34   4.002   3.296  11.955
  237   HD13  ILE  34          2HD1      ILE  34   5.666   3.143  11.390
  238    H    HIS  35           H        HIS  35   5.684   6.397   8.234
  239    HA   HIS  35           HA       HIS  35   8.463   5.524   8.548
  240    HB2  HIS  35           1HB      HIS  35   6.433   4.834   6.412
  241    HB3  HIS  35           2HB      HIS  35   8.054   4.157   6.539
  242    HD1  HIS  35           HD1      HIS  35   8.437   2.956   9.055
  243    HD2  HIS  35           HD2      HIS  35   4.580   3.235   7.537
  244    HE1  HIS  35           HE1      HIS  35   7.097   1.233  10.304
  245    H    ARG  36           H        ARG  36   6.409   7.615   6.624
  246    HA   ARG  36           HA       ARG  36   8.369   8.254   4.660
  247    HB2  ARG  36           1HB      ARG  36   5.775   9.531   5.500
  248    HB3  ARG  36           2HB      ARG  36   6.804  10.257   4.273
  249    HG2  ARG  36           1HG      ARG  36   5.337   9.042   2.993
  250    HG3  ARG  36           2HG      ARG  36   6.677   7.907   3.164
  251    HD2  ARG  36           1HD      ARG  36   5.533   6.672   4.833
  252    HD3  ARG  36           2HD      ARG  36   4.305   7.924   5.014
  253    HE   ARG  36           HE       ARG  36   4.395   5.854   3.017
  254   HH11  ARG  36          1HH1      ARG  36   3.162   9.005   3.836
  255   HH12  ARG  36          2HH1      ARG  36   1.816   8.904   2.751
  256   HH21  ARG  36          1HH2      ARG  36   2.626   5.709   1.585
  257   HH22  ARG  36          2HH2      ARG  36   1.511   7.028   1.471
  258    H    GLY  37           H        GLY  37   7.296   9.803   7.663
  259    HA2  GLY  37           1HA      GLY  37   8.476  11.208   9.070
  260    HA3  GLY  37           2HA      GLY  37   9.860  11.055   7.998
  261    H    GLU  38           H        GLU  38   9.396  13.471   9.090
  262    HA   GLU  38           HA       GLU  38   7.981  15.044   7.058
  263    HB2  GLU  38           1HB      GLU  38   8.693  15.484   9.914
  264    HB3  GLU  38           2HB      GLU  38   8.616  16.896   8.870
  265    HG2  GLU  38           1HG      GLU  38   6.360  14.940   8.929
  266    HG3  GLU  38           2HG      GLU  38   6.517  16.168  10.184
  267    H    LYS  39           H        LYS  39   9.763  14.602   5.548
  268    HA   LYS  39           HA       LYS  39  11.691  16.752   5.633
  269    HB2  LYS  39           1HB      LYS  39  13.661  15.388   5.416
  270    HB3  LYS  39           2HB      LYS  39  12.807  14.902   6.874
  271    HG2  LYS  39           1HG      LYS  39  11.786  13.041   5.513
  272    HG3  LYS  39           2HG      LYS  39  12.937  13.460   4.242
  273    HD2  LYS  39           1HD      LYS  39  14.794  13.026   5.739
  274    HD3  LYS  39           2HD      LYS  39  13.678  12.703   7.068
  275    HE2  LYS  39           1HE      LYS  39  14.082  10.563   6.398
  276    HE3  LYS  39           2HE      LYS  39  12.719  10.936   5.344
  277    HZ1  LYS  39           3HZ      LYS  39  15.506  11.390   4.473
  278    HZ2  LYS  39           1HZ      LYS  39  14.115  11.233   3.523
  279    HZ3  LYS  39           2HZ      LYS  39  14.765   9.879   4.299
  280    HA   PRO  40           HA       PRO  40  10.978  16.647   1.296
  281    HB2  PRO  40           1HB      PRO  40  13.226  17.889   0.419
  282    HB3  PRO  40           2HB      PRO  40  11.911  18.745   1.232
  283    HG2  PRO  40           1HG      PRO  40  14.510  17.767   2.349
  284    HG3  PRO  40           2HG      PRO  40  13.685  19.312   2.624
  285    HD2  PRO  40           1HD      PRO  40  13.582  17.270   4.399
  286    HD3  PRO  40           2HD      PRO  40  12.238  18.408   4.174
  287    H    SER  41           H        SER  41  11.131  14.333   1.075
  288    HA   SER  41           HA       SER  41  13.658  13.491  -0.179
  289    HB2  SER  41           1HB      SER  41  13.678  12.359   1.904
  290    HB3  SER  41           2HB      SER  41  11.958  11.982   1.805
  291    HG   SER  41           HG       SER  41  14.114  10.829   0.403
  292    H    GLY  42           H        GLY  42  13.490  12.088  -1.937
  293    HA2  GLY  42           1HA      GLY  42  12.391  10.815  -3.565
  294    HA3  GLY  42           2HA      GLY  42  10.855  11.222  -2.814
  295    HA   PRO  43           HA       PRO  43  11.592  13.721  -6.748
  296    HB2  PRO  43           1HB      PRO  43   9.541  12.673  -8.185
  297    HB3  PRO  43           2HB      PRO  43  11.171  11.988  -8.197
  298    HG2  PRO  43           1HG      PRO  43   8.759  11.112  -6.654
  299    HG3  PRO  43           2HG      PRO  43   9.954  10.126  -7.518
  300    HD2  PRO  43           1HD      PRO  43  10.011  10.461  -4.832
  301    HD3  PRO  43           2HD      PRO  43  11.484  10.249  -5.799
  302    H    SER  44           H        SER  44  10.722  15.686  -6.646
  303    HA   SER  44           HA       SER  44   8.656  16.457  -4.986
  304    HB2  SER  44           1HB      SER  44  10.232  18.065  -5.917
  305    HB3  SER  44           2HB      SER  44   9.597  17.786  -7.539
  306    HG   SER  44           HG       SER  44   7.657  18.461  -5.742
  307    H    SER  45           H        SER  45   6.479  16.696  -5.162
  308    HA   SER  45           HA       SER  45   5.235  15.743  -7.658
  309    HB2  SER  45           1HB      SER  45   5.035  14.134  -5.751
  310    HB3  SER  45           2HB      SER  45   4.141  15.366  -4.861
  311    HG   SER  45           HG       SER  45   3.303  14.637  -7.439
  312    H    GLY  46           H        GLY  46   4.654  17.687  -4.729
  313    HA2  GLY  46           1HA      GLY  46   3.657  19.753  -4.504
  314    HA3  GLY  46           2HA      GLY  46   3.636  19.878  -6.257
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1  -3.056 -31.740  -2.839
    2    HA2  GLY   1           1HA      GLY   1  -2.469 -30.999  -0.424
    3    HA3  GLY   1           2HA      GLY   1  -1.691 -29.666  -1.264
    4    H    SER   2           H        SER   2  -2.939 -28.065  -2.221
    5    HA   SER   2           HA       SER   2  -5.845 -28.254  -1.911
    6    HB2  SER   2           1HB      SER   2  -4.148 -25.992  -0.831
    7    HB3  SER   2           2HB      SER   2  -5.908 -25.968  -0.928
    8    HG   SER   2           HG       SER   2  -5.496 -26.679   1.086
    9    H    SER   3           H        SER   3  -7.038 -26.876  -3.275
   10    HA   SER   3           HA       SER   3  -5.460 -25.638  -5.436
   11    HB2  SER   3           1HB      SER   3  -6.481 -27.554  -6.396
   12    HB3  SER   3           2HB      SER   3  -8.011 -27.245  -5.575
   13    HG   SER   3           HG       SER   3  -6.852 -25.742  -7.683
   14    H    GLY   4           H        GLY   4  -5.996 -23.610  -6.073
   15    HA2  GLY   4           1HA      GLY   4  -7.457 -21.759  -6.337
   16    HA3  GLY   4           2HA      GLY   4  -8.488 -22.427  -5.081
   17    H    SER   5           H        SER   5  -7.124 -19.749  -5.516
   18    HA   SER   5           HA       SER   5  -5.705 -19.620  -2.936
   19    HB2  SER   5           1HB      SER   5  -4.365 -19.008  -4.968
   20    HB3  SER   5           2HB      SER   5  -5.478 -17.667  -5.236
   21    HG   SER   5           HG       SER   5  -3.396 -17.403  -3.914
   22    H    SER   6           H        SER   6  -6.005 -17.659  -1.674
   23    HA   SER   6           HA       SER   6  -8.620 -17.079  -1.079
   24    HB2  SER   6           1HB      SER   6  -6.205 -15.290  -0.710
   25    HB3  SER   6           2HB      SER   6  -7.759 -15.061   0.091
   26    HG   SER   6           HG       SER   6  -7.466 -16.990   1.170
   27    H    GLY   7           H        GLY   7 -10.181 -15.811  -1.882
   28    HA2  GLY   7           1HA      GLY   7 -10.195 -14.817  -4.434
   29    HA3  GLY   7           2HA      GLY   7 -11.240 -14.213  -3.157
   30    H    THR   8           H        THR   8  -9.692 -12.952  -5.466
   31    HA   THR   8           HA       THR   8  -7.700 -11.280  -4.338
   32    HB   THR   8           HB       THR   8  -9.346 -10.816  -6.833
   33    HG1  THR   8           HG1      THR   8  -8.185 -12.401  -7.598
   34   HG21  THR   8          3HG2      THR   8  -8.174  -8.808  -5.984
   35   HG22  THR   8          1HG2      THR   8  -7.540  -9.359  -7.533
   36   HG23  THR   8          2HG2      THR   8  -6.653  -9.697  -6.047
   37    H    GLY   9           H        GLY   9  -7.784  -9.080  -3.788
   38    HA2  GLY   9           1HA      GLY   9  -8.981  -7.014  -3.506
   39    HA3  GLY   9           2HA      GLY   9 -10.474  -7.938  -3.423
   40    H    GLU  10           H        GLU  10  -7.376  -7.582  -1.699
   41    HA   GLU  10           HA       GLU  10  -7.946  -8.742   0.687
   42    HB2  GLU  10           1HB      GLU  10  -6.361  -6.300  -0.010
   43    HB3  GLU  10           2HB      GLU  10  -6.579  -6.731   1.680
   44    HG2  GLU  10           1HG      GLU  10  -4.499  -7.623   0.884
   45    HG3  GLU  10           2HG      GLU  10  -5.615  -8.945   1.219
   46    H    ARG  11           H        ARG  11  -9.608  -8.579   2.025
   47    HA   ARG  11           HA       ARG  11 -11.614  -6.674   1.923
   48    HB2  ARG  11           1HB      ARG  11 -12.319  -7.508   4.119
   49    HB3  ARG  11           2HB      ARG  11 -11.882  -8.829   3.044
   50    HG2  ARG  11           1HG      ARG  11  -9.984  -9.352   4.234
   51    HG3  ARG  11           2HG      ARG  11  -9.844  -7.734   4.923
   52    HD2  ARG  11           1HD      ARG  11 -10.618  -8.846   6.754
   53    HD3  ARG  11           2HD      ARG  11 -12.158  -8.400   6.021
   54    HE   ARG  11           HE       ARG  11 -12.545 -10.617   5.537
   55   HH11  ARG  11          1HH1      ARG  11  -9.246 -10.190   6.564
   56   HH12  ARG  11          2HH1      ARG  11  -8.933 -11.888   6.705
   57   HH21  ARG  11          1HH2      ARG  11 -12.145 -12.855   5.718
   58   HH22  ARG  11          2HH2      ARG  11 -10.582 -13.403   6.222
   59    H    HIS  12           H        HIS  12  -8.504  -6.499   3.404
   60    HA   HIS  12           HA       HIS  12  -9.147  -3.805   4.375
   61    HB2  HIS  12           1HB      HIS  12  -7.633  -4.264   6.353
   62    HB3  HIS  12           2HB      HIS  12  -9.188  -5.089   6.380
   63    HD1  HIS  12           HD1      HIS  12  -8.976  -7.421   7.135
   64    HD2  HIS  12           HD2      HIS  12  -5.593  -6.166   5.075
   65    HE1  HIS  12           HE1      HIS  12  -7.410  -9.389   7.151
   66    H    TYR  13           H        TYR  13  -6.933  -2.738   5.094
   67    HA   TYR  13           HA       TYR  13  -4.978  -3.306   2.962
   68    HB2  TYR  13           1HB      TYR  13  -5.426  -0.582   4.169
   69    HB3  TYR  13           2HB      TYR  13  -4.579  -0.990   2.681
   70    HD1  TYR  13           HD1      TYR  13  -5.822  -1.521   0.646
   71    HD2  TYR  13           HD2      TYR  13  -7.838  -0.425   4.229
   72    HE1  TYR  13           HE1      TYR  13  -7.882  -1.132  -0.640
   73    HE2  TYR  13           HE2      TYR  13  -9.904  -0.034   2.953
   74    HH   TYR  13           HH       TYR  13  -9.958   0.111  -0.458
   75    H    GLU  14           H        GLU  14  -2.894  -3.549   3.533
   76    HA   GLU  14           HA       GLU  14  -2.223  -3.149   6.372
   77    HB2  GLU  14           1HB      GLU  14  -0.798  -4.986   4.452
   78    HB3  GLU  14           2HB      GLU  14  -0.662  -4.945   6.204
   79    HG2  GLU  14           1HG      GLU  14  -2.025  -6.739   5.991
   80    HG3  GLU  14           2HG      GLU  14  -3.247  -5.470   6.058
   81    H    CYS  15           H        CYS  15  -0.072  -2.437   6.886
   82    HA   CYS  15           HA       CYS  15   0.844  -0.387   5.074
   83    HB2  CYS  15           1HB      CYS  15   0.711  -0.005   7.519
   84    HB3  CYS  15           2HB      CYS  15   1.958  -1.225   7.758
   85    H    SER  16           H        SER  16   2.254  -0.755   3.508
   86    HA   SER  16           HA       SER  16   3.874  -3.145   3.493
   87    HB2  SER  16           1HB      SER  16   2.739  -2.191   1.447
   88    HB3  SER  16           2HB      SER  16   3.916  -0.878   1.492
   89    HG   SER  16           HG       SER  16   4.326  -2.921   0.176
   90    H    GLU  17           H        GLU  17   4.529  -1.432   5.619
   91    HA   GLU  17           HA       GLU  17   7.281  -0.710   4.875
   92    HB2  GLU  17           1HB      GLU  17   5.452   0.872   6.691
   93    HB3  GLU  17           2HB      GLU  17   7.160   1.205   6.439
   94    HG2  GLU  17           1HG      GLU  17   5.396   1.091   4.057
   95    HG3  GLU  17           2HG      GLU  17   5.275   2.492   5.120
   96    H    CYS  18           H        CYS  18   5.052  -1.461   7.532
   97    HA   CYS  18           HA       CYS  18   7.311  -2.709   8.957
   98    HB2  CYS  18           1HB      CYS  18   5.982  -2.250  11.054
   99    HB3  CYS  18           2HB      CYS  18   6.619  -0.822  10.245
  100    H    GLY  19           H        GLY  19   3.773  -2.821   8.545
  101    HA2  GLY  19           1HA      GLY  19   2.987  -5.076   7.736
  102    HA3  GLY  19           2HA      GLY  19   3.911  -5.723   9.084
  103    H    LYS  20           H        LYS  20   1.500  -3.135   8.607
  104    HA   LYS  20           HA       LYS  20   0.127  -4.119  11.020
  105    HB2  LYS  20           1HB      LYS  20   0.539  -1.390   9.886
  106    HB3  LYS  20           2HB      LYS  20  -0.943  -1.704  10.780
  107    HG2  LYS  20           1HG      LYS  20   0.704  -2.669  12.572
  108    HG3  LYS  20           2HG      LYS  20   1.876  -1.646  11.736
  109    HD2  LYS  20           1HD      LYS  20   0.739   0.309  12.276
  110    HD3  LYS  20           2HD      LYS  20  -0.777  -0.541  12.583
  111    HE2  LYS  20           1HE      LYS  20  -0.057  -0.025  14.720
  112    HE3  LYS  20           2HE      LYS  20   0.539  -1.670  14.510
  113    HZ1  LYS  20           3HZ      LYS  20   2.095   0.845  14.284
  114    HZ2  LYS  20           1HZ      LYS  20   2.695  -0.668  13.822
  115    HZ3  LYS  20           2HZ      LYS  20   2.282  -0.379  15.437
  116    H    ALA  21           H        ALA  21  -2.299  -3.455  10.970
  117    HA   ALA  21           HA       ALA  21  -3.437  -3.859   8.296
  118    HB1  ALA  21           3HB      ALA  21  -3.641  -6.039   8.935
  119    HB2  ALA  21           1HB      ALA  21  -3.732  -5.645  10.652
  120    HB3  ALA  21           2HB      ALA  21  -5.137  -5.397   9.613
  121    H    PHE  22           H        PHE  22  -4.952  -2.396   7.896
  122    HA   PHE  22           HA       PHE  22  -6.334  -1.148  10.179
  123    HB2  PHE  22           1HB      PHE  22  -5.838   0.074   7.458
  124    HB3  PHE  22           2HB      PHE  22  -6.527   0.877   8.865
  125    HD1  PHE  22           HD2      PHE  22  -3.439  -0.801   7.662
  126    HD2  PHE  22           HD1      PHE  22  -5.158   2.016  10.350
  127    HE1  PHE  22           HE2      PHE  22  -1.187  -0.094   8.355
  128    HE2  PHE  22           HE1      PHE  22  -2.908   2.729  11.047
  129    HZ   PHE  22           HZ       PHE  22  -0.919   1.673  10.050
  130    H    ILE  23           H        ILE  23  -8.419   0.058   9.148
  131    HA   ILE  23           HA       ILE  23  -9.981  -2.122   7.952
  132    HB   ILE  23           HB       ILE  23 -10.842  -1.343  10.083
  133   HG12  ILE  23          1HG1      ILE  23 -12.661  -0.238   7.946
  134   HG13  ILE  23          2HG1      ILE  23 -12.379  -1.965   8.135
  135   HG21  ILE  23          1HG2      ILE  23  -9.962   0.880  10.169
  136   HG22  ILE  23          2HG2      ILE  23 -10.909   1.364   8.763
  137   HG23  ILE  23          3HG2      ILE  23 -11.718   0.984  10.283
  138   HD11  ILE  23          3HD1      ILE  23 -13.419  -0.192  10.327
  139   HD12  ILE  23          1HD1      ILE  23 -14.446  -1.111   9.226
  140   HD13  ILE  23          2HD1      ILE  23 -13.339  -1.954  10.311
  141    H    GLN  24           H        GLN  24  -8.962   1.175   7.484
  142    HA   GLN  24           HA       GLN  24 -10.194   1.126   4.820
  143    HB2  GLN  24           1HB      GLN  24 -10.280   3.413   6.790
  144    HB3  GLN  24           2HB      GLN  24 -10.665   3.584   5.082
  145    HG2  GLN  24           1HG      GLN  24 -12.094   1.706   6.946
  146    HG3  GLN  24           2HG      GLN  24 -12.637   3.343   6.581
  147   HE21  GLN  24          1HE2      GLN  24 -13.079   0.202   5.826
  148   HE22  GLN  24          2HE2      GLN  24 -13.707   0.362   4.225
  149    H    LYS  25           H        LYS  25  -9.239   2.845   3.379
  150    HA   LYS  25           HA       LYS  25  -6.433   2.551   3.299
  151    HB2  LYS  25           1HB      LYS  25  -8.467   4.057   1.736
  152    HB3  LYS  25           2HB      LYS  25  -6.792   4.570   1.584
  153    HG2  LYS  25           1HG      LYS  25  -7.568   1.700   1.232
  154    HG3  LYS  25           2HG      LYS  25  -7.705   2.859  -0.091
  155    HD2  LYS  25           1HD      LYS  25  -5.308   3.410   0.200
  156    HD3  LYS  25           2HD      LYS  25  -5.200   2.158   1.440
  157    HE2  LYS  25           1HE      LYS  25  -6.009   0.524  -0.290
  158    HE3  LYS  25           2HE      LYS  25  -5.824   1.806  -1.487
  159    HZ1  LYS  25           3HZ      LYS  25  -3.459   1.638   0.003
  160    HZ2  LYS  25           1HZ      LYS  25  -3.689   1.306  -1.640
  161    HZ3  LYS  25           2HZ      LYS  25  -3.867   0.074  -0.495
  162    H    SER  26           H        SER  26  -8.329   5.553   3.670
  163    HA   SER  26           HA       SER  26  -6.382   7.338   4.245
  164    HB2  SER  26           1HB      SER  26  -8.040   8.496   5.741
  165    HB3  SER  26           2HB      SER  26  -8.680   8.047   4.160
  166    HG   SER  26           HG       SER  26  -9.851   7.511   6.309
  167    H    THR  27           H        THR  27  -8.069   5.494   6.793
  168    HA   THR  27           HA       THR  27  -6.655   6.217   8.989
  169    HB   THR  27           HB       THR  27  -7.542   3.404   8.322
  170    HG1  THR  27           HG1      THR  27  -8.920   5.120  10.063
  171   HG21  THR  27          3HG2      THR  27  -5.866   4.001  10.330
  172   HG22  THR  27          1HG2      THR  27  -7.103   2.752  10.454
  173   HG23  THR  27          2HG2      THR  27  -7.401   4.357  11.121
  174    H    LEU  28           H        LEU  28  -5.685   3.734   6.643
  175    HA   LEU  28           HA       LEU  28  -3.296   2.999   7.964
  176    HB2  LEU  28           1HB      LEU  28  -3.947   1.416   6.448
  177    HB3  LEU  28           2HB      LEU  28  -4.444   2.610   5.252
  178    HG   LEU  28           HG       LEU  28  -1.988   3.051   4.853
  179   HD11  LEU  28          1HD1      LEU  28  -1.702   0.495   6.425
  180   HD12  LEU  28          2HD1      LEU  28  -1.141   2.088   6.930
  181   HD13  LEU  28          3HD1      LEU  28  -0.423   1.307   5.522
  182   HD21  LEU  28          3HD2      LEU  28  -3.582   1.534   3.510
  183   HD22  LEU  28          1HD2      LEU  28  -2.696   0.202   4.253
  184   HD23  LEU  28          2HD2      LEU  28  -1.845   1.375   3.247
  185    H    SER  29           H        SER  29  -3.984   5.305   5.364
  186    HA   SER  29           HA       SER  29  -1.371   6.042   4.747
  187    HB2  SER  29           1HB      SER  29  -4.019   7.435   4.541
  188    HB3  SER  29           2HB      SER  29  -2.538   8.321   4.177
  189    HG   SER  29           HG       SER  29  -3.791   6.931   2.485
  190    H    MET  30           H        MET  30  -3.549   7.257   7.253
  191    HA   MET  30           HA       MET  30  -2.011   9.407   8.145
  192    HB2  MET  30           1HB      MET  30  -3.745   7.624   9.860
  193    HB3  MET  30           2HB      MET  30  -3.290   9.290  10.194
  194    HG2  MET  30           1HG      MET  30  -4.850   8.545   7.747
  195    HG3  MET  30           2HG      MET  30  -5.634   8.842   9.297
  196    HE1  MET  30           3HE      MET  30  -6.741  11.184   9.602
  197    HE2  MET  30           1HE      MET  30  -5.339  11.020  10.660
  198    HE3  MET  30           2HE      MET  30  -5.616  12.530   9.791
  199    H    HIS  31           H        HIS  31  -1.638   5.991   8.634
  200    HA   HIS  31           HA       HIS  31   0.310   6.355  10.767
  201    HB2  HIS  31           1HB      HIS  31  -0.890   4.454  11.253
  202    HB3  HIS  31           2HB      HIS  31  -1.110   4.029   9.558
  203    HD1  HIS  31           HD1      HIS  31   1.069   3.424  12.472
  204    HD2  HIS  31           HD2      HIS  31   1.125   2.677   8.385
  205    HE1  HIS  31           HE1      HIS  31   2.880   1.713  12.126
  206    H    GLN  32           H        GLN  32   0.243   4.826   7.545
  207    HA   GLN  32           HA       GLN  32   2.828   4.126   7.193
  208    HB2  GLN  32           1HB      GLN  32   0.766   5.210   5.346
  209    HB3  GLN  32           2HB      GLN  32   2.417   5.123   4.747
  210    HG2  GLN  32           1HG      GLN  32   2.485   2.744   5.202
  211    HG3  GLN  32           2HG      GLN  32   0.861   2.811   5.883
  212   HE21  GLN  32          1HE2      GLN  32   1.748   1.190   3.705
  213   HE22  GLN  32          2HE2      GLN  32   0.834   1.655   2.315
  214    H    ARG  33           H        ARG  33   1.567   7.384   7.272
  215    HA   ARG  33           HA       ARG  33   3.591   8.847   6.128
  216    HB2  ARG  33           1HB      ARG  33   2.826  10.707   7.361
  217    HB3  ARG  33           2HB      ARG  33   1.413   9.680   7.156
  218    HG2  ARG  33           1HG      ARG  33   1.721   8.815   9.427
  219    HG3  ARG  33           2HG      ARG  33   3.120   9.871   9.629
  220    HD2  ARG  33           1HD      ARG  33   0.883  10.673  10.572
  221    HD3  ARG  33           2HD      ARG  33   1.810  11.807   9.589
  222    HE   ARG  33           HE       ARG  33  -0.722  10.567   8.910
  223   HH11  ARG  33          1HH1      ARG  33   2.047  12.371   7.817
  224   HH12  ARG  33          2HH1      ARG  33   1.249  12.998   6.414
  225   HH21  ARG  33          1HH2      ARG  33  -1.785  11.386   7.066
  226   HH22  ARG  33          2HH2      ARG  33  -0.932  12.438   5.987
  227    H    ILE  34           H        ILE  34   3.447   7.559   9.426
  228    HA   ILE  34           HA       ILE  34   5.634   8.683  10.595
  229    HB   ILE  34           HB       ILE  34   5.805   6.807  12.030
  230   HG12  ILE  34          1HG1      ILE  34   4.316   5.186   9.954
  231   HG13  ILE  34          2HG1      ILE  34   6.052   5.108  10.231
  232   HG21  ILE  34          1HG2      ILE  34   3.816   7.314  12.870
  233   HG22  ILE  34          2HG2      ILE  34   3.273   7.877  11.290
  234   HG23  ILE  34          3HG2      ILE  34   3.062   6.186  11.744
  235   HD11  ILE  34          3HD1      ILE  34   5.087   4.652  12.727
  236   HD12  ILE  34          1HD1      ILE  34   3.849   3.900  11.721
  237   HD13  ILE  34          2HD1      ILE  34   5.534   3.399  11.569
  238    H    HIS  35           H        HIS  35   5.599   6.209   8.114
  239    HA   HIS  35           HA       HIS  35   8.419   5.665   8.302
  240    HB2  HIS  35           1HB      HIS  35   6.401   4.924   6.174
  241    HB3  HIS  35           2HB      HIS  35   8.053   4.317   6.256
  242    HD1  HIS  35           HD1      HIS  35   8.574   2.534   8.044
  243    HD2  HIS  35           HD2      HIS  35   4.615   3.795   8.017
  244    HE1  HIS  35           HE1      HIS  35   7.331   0.879   9.473
  245    H    ARG  36           H        ARG  36   6.331   7.726   6.392
  246    HA   ARG  36           HA       ARG  36   8.459   8.487   4.582
  247    HB2  ARG  36           1HB      ARG  36   5.616   9.456   4.904
  248    HB3  ARG  36           2HB      ARG  36   6.730  10.088   3.699
  249    HG2  ARG  36           1HG      ARG  36   6.881   7.933   2.637
  250    HG3  ARG  36           2HG      ARG  36   5.893   7.204   3.904
  251    HD2  ARG  36           1HD      ARG  36   4.146   8.999   3.203
  252    HD3  ARG  36           2HD      ARG  36   5.092   9.080   1.717
  253    HE   ARG  36           HE       ARG  36   3.389   6.913   2.585
  254   HH11  ARG  36          1HH1      ARG  36   5.971   7.915   0.475
  255   HH12  ARG  36          2HH1      ARG  36   5.710   6.637  -0.665
  256   HH21  ARG  36          1HH2      ARG  36   3.037   5.226   1.091
  257   HH22  ARG  36          2HH2      ARG  36   4.041   5.109  -0.315
  258    H    GLY  37           H        GLY  37   9.360   9.003   7.061
  259    HA2  GLY  37           1HA      GLY  37   8.758  11.487   8.193
  260    HA3  GLY  37           2HA      GLY  37  10.297  10.654   8.349
  261    H    GLU  38           H        GLU  38  11.416  12.638   8.273
  262    HA   GLU  38           HA       GLU  38  11.279  14.118   5.749
  263    HB2  GLU  38           1HB      GLU  38  12.408  14.755   8.462
  264    HB3  GLU  38           2HB      GLU  38  12.866  15.691   7.046
  265    HG2  GLU  38           1HG      GLU  38  10.065  15.325   8.086
  266    HG3  GLU  38           2HG      GLU  38  11.067  16.761   8.287
  267    H    LYS  39           H        LYS  39  12.765  13.860   4.224
  268    HA   LYS  39           HA       LYS  39  14.740  11.937   4.249
  269    HB2  LYS  39           1HB      LYS  39  15.507  12.836   2.208
  270    HB3  LYS  39           2HB      LYS  39  13.791  13.218   2.260
  271    HG2  LYS  39           1HG      LYS  39  15.832  15.192   3.204
  272    HG3  LYS  39           2HG      LYS  39  15.443  15.030   1.490
  273    HD2  LYS  39           1HD      LYS  39  13.015  15.332   2.157
  274    HD3  LYS  39           2HD      LYS  39  13.611  15.809   3.749
  275    HE2  LYS  39           1HE      LYS  39  14.666  17.127   1.278
  276    HE3  LYS  39           2HE      LYS  39  13.121  17.630   1.962
  277    HZ1  LYS  39           3HZ      LYS  39  15.240  17.419   3.899
  278    HZ2  LYS  39           1HZ      LYS  39  14.125  18.666   3.646
  279    HZ3  LYS  39           2HZ      LYS  39  15.530  18.584   2.708
  280    HA   PRO  40           HA       PRO  40  18.016  13.555   6.705
  281    HB2  PRO  40           1HB      PRO  40  20.084  12.150   5.647
  282    HB3  PRO  40           2HB      PRO  40  18.869  11.422   6.704
  283    HG2  PRO  40           1HG      PRO  40  19.064  11.359   3.718
  284    HG3  PRO  40           2HG      PRO  40  18.662  10.047   4.840
  285    HD2  PRO  40           1HD      PRO  40  16.776  11.400   3.446
  286    HD3  PRO  40           2HD      PRO  40  16.476  10.741   5.067
  287    H    SER  41           H        SER  41  18.655  13.313   3.210
  288    HA   SER  41           HA       SER  41  20.255  15.778   3.405
  289    HB2  SER  41           1HB      SER  41  21.453  13.765   2.551
  290    HB3  SER  41           2HB      SER  41  20.312  13.695   1.208
  291    HG   SER  41           HG       SER  41  22.136  14.810   0.546
  292    H    GLY  42           H        GLY  42  19.805  17.510   2.098
  293    HA2  GLY  42           1HA      GLY  42  18.374  17.692  -0.204
  294    HA3  GLY  42           2HA      GLY  42  17.128  17.632   1.034
  295    HA   PRO  43           HA       PRO  43  19.741  21.708   1.574
  296    HB2  PRO  43           1HB      PRO  43  20.941  22.554  -0.710
  297    HB3  PRO  43           2HB      PRO  43  21.751  21.525   0.477
  298    HG2  PRO  43           1HG      PRO  43  20.426  20.766  -2.098
  299    HG3  PRO  43           2HG      PRO  43  21.965  20.200  -1.423
  300    HD2  PRO  43           1HD      PRO  43  19.683  18.751  -1.264
  301    HD3  PRO  43           2HD      PRO  43  20.936  18.700  -0.007
  302    H    SER  44           H        SER  44  19.195  23.899   0.902
  303    HA   SER  44           HA       SER  44  16.704  23.940  -0.644
  304    HB2  SER  44           1HB      SER  44  17.800  25.565   1.597
  305    HB3  SER  44           2HB      SER  44  16.746  26.384   0.445
  306    HG   SER  44           HG       SER  44  16.106  23.992   1.836
  307    H    SER  45           H        SER  45  19.773  25.689  -0.301
  308    HA   SER  45           HA       SER  45  20.919  27.060  -1.710
  309    HB2  SER  45           1HB      SER  45  19.439  25.604  -3.911
  310    HB3  SER  45           2HB      SER  45  20.990  26.434  -4.039
  311    HG   SER  45           HG       SER  45  20.408  23.923  -3.090
  312    H    GLY  46           H        GLY  46  18.605  28.174  -0.643
  313    HA2  GLY  46           1HA      GLY  46  17.834  29.991  -2.834
  314    HA3  GLY  46           2HA      GLY  46  16.613  29.333  -1.754
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1   5.868 -29.140  -4.107
    2    HA2  GLY   1           1HA      GLY   1   7.668 -27.439  -3.160
    3    HA3  GLY   1           2HA      GLY   1   6.317 -26.342  -3.407
    4    H    SER   2           H        SER   2   5.182 -25.964  -1.638
    5    HA   SER   2           HA       SER   2   5.230 -27.937   0.527
    6    HB2  SER   2           1HB      SER   2   5.905 -25.640   1.095
    7    HB3  SER   2           2HB      SER   2   4.338 -25.042   0.549
    8    HG   SER   2           HG       SER   2   4.075 -25.296   2.688
    9    H    SER   3           H        SER   3   2.874 -25.751  -1.023
   10    HA   SER   3           HA       SER   3   0.641 -25.946  -1.409
   11    HB2  SER   3           1HB      SER   3   1.299 -28.897  -1.267
   12    HB3  SER   3           2HB      SER   3  -0.247 -28.247  -1.810
   13    HG   SER   3           HG       SER   3   1.838 -28.673  -3.285
   14    H    GLY   4           H        GLY   4   1.338 -25.387   1.197
   15    HA2  GLY   4           1HA      GLY   4  -0.884 -26.667   2.635
   16    HA3  GLY   4           2HA      GLY   4   0.703 -26.615   3.389
   17    H    SER   5           H        SER   5  -0.931 -24.131   1.459
   18    HA   SER   5           HA       SER   5  -0.238 -22.071   3.279
   19    HB2  SER   5           1HB      SER   5  -1.809 -20.681   1.875
   20    HB3  SER   5           2HB      SER   5  -0.538 -21.500   0.968
   21    HG   SER   5           HG       SER   5  -3.214 -22.404   1.266
   22    H    SER   6           H        SER   6  -1.025 -22.402   5.314
   23    HA   SER   6           HA       SER   6  -3.542 -23.344   6.021
   24    HB2  SER   6           1HB      SER   6  -1.691 -23.133   7.622
   25    HB3  SER   6           2HB      SER   6  -1.804 -21.375   7.530
   26    HG   SER   6           HG       SER   6  -3.405 -21.439   8.883
   27    H    GLY   7           H        GLY   7  -2.472 -19.937   5.941
   28    HA2  GLY   7           1HA      GLY   7  -4.902 -18.736   6.493
   29    HA3  GLY   7           2HA      GLY   7  -3.639 -18.006   5.513
   30    H    THR   8           H        THR   8  -6.603 -17.944   5.287
   31    HA   THR   8           HA       THR   8  -7.169 -19.416   2.858
   32    HB   THR   8           HB       THR   8  -9.395 -18.303   2.979
   33    HG1  THR   8           HG1      THR   8  -8.864 -17.373   5.550
   34   HG21  THR   8          3HG2      THR   8  -9.381 -20.383   4.024
   35   HG22  THR   8          1HG2      THR   8  -9.985 -19.317   5.291
   36   HG23  THR   8          2HG2      THR   8  -8.301 -19.842   5.308
   37    H    GLY   9           H        GLY   9  -6.860 -16.009   3.832
   38    HA2  GLY   9           1HA      GLY   9  -5.478 -14.905   1.872
   39    HA3  GLY   9           2HA      GLY   9  -6.996 -15.184   1.031
   40    H    GLU  10           H        GLU  10  -5.289 -13.191   3.239
   41    HA   GLU  10           HA       GLU  10  -7.621 -11.761   4.164
   42    HB2  GLU  10           1HB      GLU  10  -4.673 -11.539   4.604
   43    HB3  GLU  10           2HB      GLU  10  -5.694 -10.158   4.979
   44    HG2  GLU  10           1HG      GLU  10  -6.962 -11.454   6.552
   45    HG3  GLU  10           2HG      GLU  10  -6.097 -12.921   6.098
   46    H    ARG  11           H        ARG  11  -8.452  -9.919   3.361
   47    HA   ARG  11           HA       ARG  11  -7.008  -8.612   1.150
   48    HB2  ARG  11           1HB      ARG  11  -9.289  -8.111   0.190
   49    HB3  ARG  11           2HB      ARG  11  -8.796  -9.798   0.128
   50    HG2  ARG  11           1HG      ARG  11 -10.423  -8.846   2.434
   51    HG3  ARG  11           2HG      ARG  11 -11.206  -9.137   0.880
   52    HD2  ARG  11           1HD      ARG  11 -10.636 -11.409   0.891
   53    HD3  ARG  11           2HD      ARG  11  -9.412 -11.185   2.140
   54    HE   ARG  11           HE       ARG  11 -11.061 -11.283   3.750
   55   HH11  ARG  11          1HH1      ARG  11 -12.487 -11.116   0.579
   56   HH12  ARG  11          2HH1      ARG  11 -14.082 -11.503   1.133
   57   HH21  ARG  11          1HH2      ARG  11 -13.157 -11.793   4.492
   58   HH22  ARG  11          2HH2      ARG  11 -14.462 -11.887   3.359
   59    H    HIS  12           H        HIS  12  -6.201  -7.160   2.797
   60    HA   HIS  12           HA       HIS  12  -8.078  -4.975   3.289
   61    HB2  HIS  12           1HB      HIS  12  -7.242  -4.732   5.624
   62    HB3  HIS  12           2HB      HIS  12  -8.156  -6.214   5.362
   63    HD1  HIS  12           HD1      HIS  12  -7.035  -7.506   7.253
   64    HD2  HIS  12           HD2      HIS  12  -4.354  -6.027   4.445
   65    HE1  HIS  12           HE1      HIS  12  -4.838  -8.615   7.772
   66    H    TYR  13           H        TYR  13  -6.734  -3.094   4.391
   67    HA   TYR  13           HA       TYR  13  -4.482  -2.636   2.600
   68    HB2  TYR  13           1HB      TYR  13  -5.476  -0.589   4.543
   69    HB3  TYR  13           2HB      TYR  13  -4.812  -0.365   2.929
   70    HD1  TYR  13           HD1      TYR  13  -6.412  -1.966   1.196
   71    HD2  TYR  13           HD2      TYR  13  -7.628   0.232   4.630
   72    HE1  TYR  13           HE1      TYR  13  -8.689  -1.806   0.279
   73    HE2  TYR  13           HE2      TYR  13  -9.909   0.398   3.723
   74    HH   TYR  13           HH       TYR  13 -10.667  -0.481   0.485
   75    H    GLU  14           H        GLU  14  -2.846  -3.872   3.517
   76    HA   GLU  14           HA       GLU  14  -2.062  -3.262   6.271
   77    HB2  GLU  14           1HB      GLU  14  -2.236  -5.653   5.143
   78    HB3  GLU  14           2HB      GLU  14  -0.610  -5.263   4.601
   79    HG2  GLU  14           1HG      GLU  14  -0.276  -4.664   7.144
   80    HG3  GLU  14           2HG      GLU  14  -1.627  -5.779   7.341
   81    H    CYS  15           H        CYS  15  -0.412  -1.961   6.725
   82    HA   CYS  15           HA       CYS  15   0.902  -0.432   4.798
   83    HB2  CYS  15           1HB      CYS  15   0.666   0.186   7.196
   84    HB3  CYS  15           2HB      CYS  15   1.864  -1.039   7.601
   85    H    SER  16           H        SER  16   2.448  -0.935   3.407
   86    HA   SER  16           HA       SER  16   3.892  -3.426   3.655
   87    HB2  SER  16           1HB      SER  16   2.957  -2.387   1.482
   88    HB3  SER  16           2HB      SER  16   4.380  -1.346   1.532
   89    HG   SER  16           HG       SER  16   5.504  -3.521   1.821
   90    H    GLU  17           H        GLU  17   4.486  -1.589   5.714
   91    HA   GLU  17           HA       GLU  17   7.336  -1.119   5.164
   92    HB2  GLU  17           1HB      GLU  17   5.459   0.726   6.649
   93    HB3  GLU  17           2HB      GLU  17   7.207   0.909   6.612
   94    HG2  GLU  17           1HG      GLU  17   5.766   0.751   4.024
   95    HG3  GLU  17           2HG      GLU  17   5.628   2.233   4.969
   96    H    CYS  18           H        CYS  18   4.874  -1.393   7.717
   97    HA   CYS  18           HA       CYS  18   6.917  -2.614   9.451
   98    HB2  CYS  18           1HB      CYS  18   5.285  -2.058  11.309
   99    HB3  CYS  18           2HB      CYS  18   6.042  -0.678  10.521
  100    H    GLY  19           H        GLY  19   3.463  -2.838   8.600
  101    HA2  GLY  19           1HA      GLY  19   2.776  -5.125   7.847
  102    HA3  GLY  19           2HA      GLY  19   3.600  -5.710   9.284
  103    H    LYS  20           H        LYS  20   1.502  -2.877   8.978
  104    HA   LYS  20           HA       LYS  20  -0.259  -4.079  11.004
  105    HB2  LYS  20           1HB      LYS  20   1.000  -1.784  11.292
  106    HB3  LYS  20           2HB      LYS  20  -0.329  -1.169  10.317
  107    HG2  LYS  20           1HG      LYS  20  -1.926  -1.739  11.937
  108    HG3  LYS  20           2HG      LYS  20  -0.797  -2.785  12.801
  109    HD2  LYS  20           1HD      LYS  20   0.484  -0.891  13.536
  110    HD3  LYS  20           2HD      LYS  20  -0.468   0.201  12.527
  111    HE2  LYS  20           1HE      LYS  20  -2.482  -0.520  13.870
  112    HE3  LYS  20           2HE      LYS  20  -1.358  -1.314  14.972
  113    HZ1  LYS  20           3HZ      LYS  20  -1.817   0.818  15.851
  114    HZ2  LYS  20           1HZ      LYS  20  -1.546   1.582  14.365
  115    HZ3  LYS  20           2HZ      LYS  20  -0.252   0.898  15.213
  116    H    ALA  21           H        ALA  21  -2.341  -4.479  10.556
  117    HA   ALA  21           HA       ALA  21  -3.308  -3.781   7.876
  118    HB1  ALA  21           3HB      ALA  21  -4.013  -5.883   7.833
  119    HB2  ALA  21           1HB      ALA  21  -3.507  -6.118   9.506
  120    HB3  ALA  21           2HB      ALA  21  -5.127  -5.516   9.150
  121    H    PHE  22           H        PHE  22  -4.763  -2.226   7.623
  122    HA   PHE  22           HA       PHE  22  -6.362  -1.411   9.960
  123    HB2  PHE  22           1HB      PHE  22  -5.638   0.349   7.616
  124    HB3  PHE  22           2HB      PHE  22  -6.334   0.841   9.157
  125    HD1  PHE  22           HD2      PHE  22  -3.284  -0.235   7.440
  126    HD2  PHE  22           HD1      PHE  22  -4.968   1.099  11.114
  127    HE1  PHE  22           HE2      PHE  22  -1.024   0.177   8.321
  128    HE2  PHE  22           HE1      PHE  22  -2.711   1.514  12.001
  129    HZ   PHE  22           HZ       PHE  22  -0.736   1.052  10.605
  130    H    ILE  23           H        ILE  23  -8.542  -0.964   9.685
  131    HA   ILE  23           HA       ILE  23  -9.842  -2.419   7.595
  132    HB   ILE  23           HB       ILE  23 -10.830  -2.337   9.814
  133   HG12  ILE  23          1HG1      ILE  23 -13.129  -1.237   9.018
  134   HG13  ILE  23          2HG1      ILE  23 -12.308  -1.264   7.460
  135   HG21  ILE  23          1HG2      ILE  23 -11.770  -0.309  10.743
  136   HG22  ILE  23          2HG2      ILE  23 -10.053  -0.078  10.415
  137   HG23  ILE  23          3HG2      ILE  23 -11.259   0.607   9.326
  138   HD11  ILE  23          3HD1      ILE  23 -11.961  -3.793   8.705
  139   HD12  ILE  23          1HD1      ILE  23 -13.669  -3.359   8.767
  140   HD13  ILE  23          2HD1      ILE  23 -12.823  -3.395   7.219
  141    H    GLN  24           H        GLN  24  -9.385   1.005   8.346
  142    HA   GLN  24           HA       GLN  24 -10.700   1.715   5.819
  143    HB2  GLN  24           1HB      GLN  24  -9.960   3.411   8.208
  144    HB3  GLN  24           2HB      GLN  24 -10.677   4.038   6.730
  145    HG2  GLN  24           1HG      GLN  24 -12.489   2.181   7.275
  146    HG3  GLN  24           2HG      GLN  24 -11.898   2.454   8.913
  147   HE21  GLN  24          1HE2      GLN  24 -12.815   4.029  10.015
  148   HE22  GLN  24          2HE2      GLN  24 -13.714   5.346   9.350
  149    H    LYS  25           H        LYS  25  -9.593   2.551   4.153
  150    HA   LYS  25           HA       LYS  25  -6.832   2.304   3.949
  151    HB2  LYS  25           1HB      LYS  25  -8.908   3.759   2.359
  152    HB3  LYS  25           2HB      LYS  25  -7.208   4.016   1.988
  153    HG2  LYS  25           1HG      LYS  25  -7.194   1.365   1.998
  154    HG3  LYS  25           2HG      LYS  25  -8.896   1.612   1.603
  155    HD2  LYS  25           1HD      LYS  25  -8.338   2.881  -0.339
  156    HD3  LYS  25           2HD      LYS  25  -6.634   2.943   0.120
  157    HE2  LYS  25           1HE      LYS  25  -6.543   1.251  -1.403
  158    HE3  LYS  25           2HE      LYS  25  -6.903   0.309   0.043
  159    HZ1  LYS  25           3HZ      LYS  25  -9.202   1.319  -1.415
  160    HZ2  LYS  25           1HZ      LYS  25  -8.957  -0.188  -0.685
  161    HZ3  LYS  25           2HZ      LYS  25  -8.298   0.130  -2.210
  162    H    SER  26           H        SER  26  -8.789   5.185   4.620
  163    HA   SER  26           HA       SER  26  -6.818   7.117   4.611
  164    HB2  SER  26           1HB      SER  26  -9.186   7.663   4.866
  165    HB3  SER  26           2HB      SER  26  -9.207   6.911   6.461
  166    HG   SER  26           HG       SER  26  -7.430   9.018   5.857
  167    H    THR  27           H        THR  27  -7.768   4.961   7.257
  168    HA   THR  27           HA       THR  27  -6.128   6.009   9.255
  169    HB   THR  27           HB       THR  27  -6.908   3.111   8.879
  170    HG1  THR  27           HG1      THR  27  -8.615   4.837   9.013
  171   HG21  THR  27          3HG2      THR  27  -6.657   3.002  11.339
  172   HG22  THR  27          1HG2      THR  27  -6.023   4.647  11.325
  173   HG23  THR  27          2HG2      THR  27  -5.137   3.354  10.517
  174    H    LEU  28           H        LEU  28  -5.374   3.981   6.534
  175    HA   LEU  28           HA       LEU  28  -2.782   3.203   7.542
  176    HB2  LEU  28           1HB      LEU  28  -3.612   1.573   6.160
  177    HB3  LEU  28           2HB      LEU  28  -4.345   2.734   5.055
  178    HG   LEU  28           HG       LEU  28  -2.065   3.266   4.204
  179   HD11  LEU  28          1HD1      LEU  28  -0.193   1.948   4.771
  180   HD12  LEU  28          2HD1      LEU  28  -1.177   0.803   5.682
  181   HD13  LEU  28          3HD1      LEU  28  -0.923   2.434   6.301
  182   HD21  LEU  28          3HD2      LEU  28  -3.628   1.610   3.148
  183   HD22  LEU  28          1HD2      LEU  28  -2.731   0.338   3.979
  184   HD23  LEU  28          2HD2      LEU  28  -1.918   1.358   2.791
  185    H    SER  29           H        SER  29  -3.836   5.072   4.689
  186    HA   SER  29           HA       SER  29  -1.437   6.065   3.857
  187    HB2  SER  29           1HB      SER  29  -4.017   7.647   3.959
  188    HB3  SER  29           2HB      SER  29  -2.652   7.944   2.883
  189    HG   SER  29           HG       SER  29  -4.666   6.093   2.697
  190    H    MET  30           H        MET  30  -3.416   7.241   6.528
  191    HA   MET  30           HA       MET  30  -1.755   9.510   7.066
  192    HB2  MET  30           1HB      MET  30  -3.130   9.844   9.009
  193    HB3  MET  30           2HB      MET  30  -4.172   9.379   7.672
  194    HG2  MET  30           1HG      MET  30  -5.027   8.091   9.347
  195    HG3  MET  30           2HG      MET  30  -3.854   6.978   8.646
  196    HE1  MET  30           3HE      MET  30  -5.435   8.107  11.410
  197    HE2  MET  30           1HE      MET  30  -4.430   7.716  12.806
  198    HE3  MET  30           2HE      MET  30  -4.369   9.331  12.101
  199    H    HIS  31           H        HIS  31  -1.788   6.174   8.017
  200    HA   HIS  31           HA       HIS  31  -0.078   6.511  10.300
  201    HB2  HIS  31           1HB      HIS  31  -1.308   4.588  10.553
  202    HB3  HIS  31           2HB      HIS  31  -1.269   4.208   8.833
  203    HD1  HIS  31           HD1      HIS  31   0.365   3.435  12.020
  204    HD2  HIS  31           HD2      HIS  31   1.221   3.002   7.978
  205    HE1  HIS  31           HE1      HIS  31   2.247   1.771  11.906
  206    H    GLN  32           H        GLN  32   0.355   5.315   6.982
  207    HA   GLN  32           HA       GLN  32   2.949   4.512   6.992
  208    HB2  GLN  32           1HB      GLN  32   1.303   5.939   4.943
  209    HB3  GLN  32           2HB      GLN  32   3.011   5.666   4.625
  210    HG2  GLN  32           1HG      GLN  32   2.506   3.212   5.212
  211    HG3  GLN  32           2HG      GLN  32   0.819   3.664   4.972
  212   HE21  GLN  32          1HE2      GLN  32   0.968   2.031   3.266
  213   HE22  GLN  32          2HE2      GLN  32   1.543   2.510   1.709
  214    H    ARG  33           H        ARG  33   1.789   7.705   7.526
  215    HA   ARG  33           HA       ARG  33   3.913   9.297   6.760
  216    HB2  ARG  33           1HB      ARG  33   3.089  10.938   8.243
  217    HB3  ARG  33           2HB      ARG  33   1.679  10.007   7.754
  218    HG2  ARG  33           1HG      ARG  33   1.728   8.781   9.844
  219    HG3  ARG  33           2HG      ARG  33   3.191   9.640  10.332
  220    HD2  ARG  33           1HD      ARG  33   0.544  10.956   9.739
  221    HD3  ARG  33           2HD      ARG  33   1.116  10.541  11.354
  222    HE   ARG  33           HE       ARG  33   2.890  12.221   9.805
  223   HH11  ARG  33          1HH1      ARG  33   0.305  12.073  12.132
  224   HH12  ARG  33          2HH1      ARG  33   0.615  13.653  12.771
  225   HH21  ARG  33          1HH2      ARG  33   3.308  14.303  10.638
  226   HH22  ARG  33          2HH2      ARG  33   2.323  14.921  11.920
  227    H    ILE  34           H        ILE  34   3.544   7.336   9.668
  228    HA   ILE  34           HA       ILE  34   5.757   8.256  11.100
  229    HB   ILE  34           HB       ILE  34   5.677   6.201  12.349
  230   HG12  ILE  34          1HG1      ILE  34   3.628   5.004  10.536
  231   HG13  ILE  34          2HG1      ILE  34   5.323   4.882  10.077
  232   HG21  ILE  34          1HG2      ILE  34   3.935   7.369  13.186
  233   HG22  ILE  34          2HG2      ILE  34   3.183   7.586  11.607
  234   HG23  ILE  34          3HG2      ILE  34   2.995   6.060  12.470
  235   HD11  ILE  34          3HD1      ILE  34   5.284   4.126  12.738
  236   HD12  ILE  34          1HD1      ILE  34   3.830   3.401  12.051
  237   HD13  ILE  34          2HD1      ILE  34   5.407   3.063  11.336
  238    H    HIS  35           H        HIS  35   5.626   6.487   8.198
  239    HA   HIS  35           HA       HIS  35   8.350   5.458   8.524
  240    HB2  HIS  35           1HB      HIS  35   6.282   4.953   6.375
  241    HB3  HIS  35           2HB      HIS  35   7.897   4.251   6.392
  242    HD1  HIS  35           HD1      HIS  35   8.358   2.377   8.119
  243    HD2  HIS  35           HD2      HIS  35   4.456   3.802   8.149
  244    HE1  HIS  35           HE1      HIS  35   7.046   0.714   9.474
  245    H    ARG  36           H        ARG  36   7.216   8.312   7.840
  246    HA   ARG  36           HA       ARG  36   8.824   8.777   5.427
  247    HB2  ARG  36           1HB      ARG  36   6.515  10.187   6.688
  248    HB3  ARG  36           2HB      ARG  36   7.651  11.131   5.733
  249    HG2  ARG  36           1HG      ARG  36   5.819  10.470   4.341
  250    HG3  ARG  36           2HG      ARG  36   7.264   9.594   3.833
  251    HD2  ARG  36           1HD      ARG  36   5.504   8.309   5.848
  252    HD3  ARG  36           2HD      ARG  36   4.919   8.392   4.187
  253    HE   ARG  36           HE       ARG  36   6.830   6.596   5.170
  254   HH11  ARG  36          1HH1      ARG  36   6.313   8.708   2.451
  255   HH12  ARG  36          2HH1      ARG  36   7.252   7.746   1.358
  256   HH21  ARG  36          1HH2      ARG  36   8.069   5.321   3.741
  257   HH22  ARG  36          2HH2      ARG  36   8.250   5.819   2.093
  258    H    GLY  37           H        GLY  37  10.830   8.623   6.598
  259    HA2  GLY  37           1HA      GLY  37  11.486  10.243   8.808
  260    HA3  GLY  37           2HA      GLY  37  12.637   9.506   7.703
  261    H    GLU  38           H        GLU  38  13.950  11.382   7.862
  262    HA   GLU  38           HA       GLU  38  12.977  13.958   7.120
  263    HB2  GLU  38           1HB      GLU  38  15.118  13.215   8.492
  264    HB3  GLU  38           2HB      GLU  38  15.873  13.271   6.905
  265    HG2  GLU  38           1HG      GLU  38  16.091  15.357   8.250
  266    HG3  GLU  38           2HG      GLU  38  15.378  15.575   6.653
  267    H    LYS  39           H        LYS  39  14.001  15.195   5.282
  268    HA   LYS  39           HA       LYS  39  14.015  15.520   3.021
  269    HB2  LYS  39           1HB      LYS  39  15.920  13.301   3.564
  270    HB3  LYS  39           2HB      LYS  39  15.516  13.623   1.882
  271    HG2  LYS  39           1HG      LYS  39  17.331  14.973   2.113
  272    HG3  LYS  39           2HG      LYS  39  16.061  16.104   2.584
  273    HD2  LYS  39           1HD      LYS  39  16.483  15.600   4.939
  274    HD3  LYS  39           2HD      LYS  39  17.743  14.455   4.473
  275    HE2  LYS  39           1HE      LYS  39  18.885  16.426   5.047
  276    HE3  LYS  39           2HE      LYS  39  18.857  16.409   3.285
  277    HZ1  LYS  39           3HZ      LYS  39  17.923  18.399   3.360
  278    HZ2  LYS  39           1HZ      LYS  39  17.825  18.354   5.048
  279    HZ3  LYS  39           2HZ      LYS  39  16.563  17.730   4.111
  280    HA   PRO  40           HA       PRO  40  10.893  12.009   2.391
  281    HB2  PRO  40           1HB      PRO  40   8.642  13.506   2.639
  282    HB3  PRO  40           2HB      PRO  40   9.414  12.697   4.008
  283    HG2  PRO  40           1HG      PRO  40   9.601  15.558   3.149
  284    HG3  PRO  40           2HG      PRO  40   9.415  14.890   4.781
  285    HD2  PRO  40           1HD      PRO  40  11.798  15.743   3.819
  286    HD3  PRO  40           2HD      PRO  40  11.659  14.401   4.973
  287    H    SER  41           H        SER  41  10.448  15.422   1.437
  288    HA   SER  41           HA       SER  41  10.768  14.830  -1.337
  289    HB2  SER  41           1HB      SER  41   8.516  15.339  -2.095
  290    HB3  SER  41           2HB      SER  41   8.455  13.989  -0.962
  291    HG   SER  41           HG       SER  41   7.961  15.635   0.669
  292    H    GLY  42           H        GLY  42  11.730  16.565  -2.149
  293    HA2  GLY  42           1HA      GLY  42  12.396  18.740  -2.458
  294    HA3  GLY  42           2HA      GLY  42  10.743  19.173  -2.048
  295    HA   PRO  43           HA       PRO  43  13.324  19.229   2.064
  296    HB2  PRO  43           1HB      PRO  43  16.020  19.246   1.752
  297    HB3  PRO  43           2HB      PRO  43  15.085  17.759   1.944
  298    HG2  PRO  43           1HG      PRO  43  16.141  19.023  -0.555
  299    HG3  PRO  43           2HG      PRO  43  16.142  17.315  -0.079
  300    HD2  PRO  43           1HD      PRO  43  14.331  18.343  -1.809
  301    HD3  PRO  43           2HD      PRO  43  13.945  17.009  -0.704
  302    H    SER  44           H        SER  44  15.058  20.702  -0.682
  303    HA   SER  44           HA       SER  44  15.925  22.808  -0.955
  304    HB2  SER  44           1HB      SER  44  14.199  24.600  -0.617
  305    HB3  SER  44           2HB      SER  44  13.628  23.224  -1.561
  306    HG   SER  44           HG       SER  44  12.499  22.494   0.200
  307    H    SER  45           H        SER  45  16.880  21.695   1.392
  308    HA   SER  45           HA       SER  45  17.350  24.104   2.961
  309    HB2  SER  45           1HB      SER  45  16.336  21.520   4.167
  310    HB3  SER  45           2HB      SER  45  17.007  22.857   5.102
  311    HG   SER  45           HG       SER  45  14.984  23.497   3.316
  312    H    GLY  46           H        GLY  46  19.335  24.139   4.011
  313    HA2  GLY  46           1HA      GLY  46  21.411  22.645   2.856
  314    HA3  GLY  46           2HA      GLY  46  21.551  23.625   4.308
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1 -23.751 -22.905 -16.169
    2    HA2  GLY   1           1HA      GLY   1 -22.083 -25.300 -15.808
    3    HA3  GLY   1           2HA      GLY   1 -21.347 -23.712 -15.643
    4    H    SER   2           H        SER   2 -20.809 -23.912 -13.494
    5    HA   SER   2           HA       SER   2 -22.959 -23.444 -11.628
    6    HB2  SER   2           1HB      SER   2 -22.989 -25.864 -11.616
    7    HB3  SER   2           2HB      SER   2 -21.239 -25.925 -11.405
    8    HG   SER   2           HG       SER   2 -21.562 -25.764  -9.346
    9    H    SER   3           H        SER   3 -22.232 -21.737 -10.559
   10    HA   SER   3           HA       SER   3 -19.421 -21.725  -9.676
   11    HB2  SER   3           1HB      SER   3 -19.325 -19.332 -10.016
   12    HB3  SER   3           2HB      SER   3 -19.872 -20.087 -11.513
   13    HG   SER   3           HG       SER   3 -21.120 -18.239 -10.912
   14    H    GLY   4           H        GLY   4 -18.981 -20.805  -7.646
   15    HA2  GLY   4           1HA      GLY   4 -21.201 -21.007  -5.786
   16    HA3  GLY   4           2HA      GLY   4 -19.504 -20.820  -5.371
   17    H    SER   5           H        SER   5 -19.564 -19.117  -4.008
   18    HA   SER   5           HA       SER   5 -20.325 -16.543  -5.162
   19    HB2  SER   5           1HB      SER   5 -21.439 -15.919  -2.979
   20    HB3  SER   5           2HB      SER   5 -22.315 -17.101  -3.952
   21    HG   SER   5           HG       SER   5 -20.524 -18.194  -2.173
   22    H    SER   6           H        SER   6 -19.451 -14.707  -3.954
   23    HA   SER   6           HA       SER   6 -17.078 -15.436  -2.365
   24    HB2  SER   6           1HB      SER   6 -15.851 -13.607  -3.409
   25    HB3  SER   6           2HB      SER   6 -16.463 -14.697  -4.654
   26    HG   SER   6           HG       SER   6 -17.221 -12.084  -4.034
   27    H    GLY   7           H        GLY   7 -17.410 -14.804  -0.339
   28    HA2  GLY   7           1HA      GLY   7 -17.712 -12.126   0.411
   29    HA3  GLY   7           2HA      GLY   7 -19.305 -12.869   0.452
   30    H    THR   8           H        THR   8 -16.155 -14.274   1.274
   31    HA   THR   8           HA       THR   8 -17.168 -14.690   4.013
   32    HB   THR   8           HB       THR   8 -15.267 -16.470   2.474
   33    HG1  THR   8           HG1      THR   8 -17.017 -17.881   2.369
   34   HG21  THR   8          3HG2      THR   8 -16.231 -16.432   5.293
   35   HG22  THR   8          1HG2      THR   8 -14.644 -16.851   4.652
   36   HG23  THR   8          2HG2      THR   8 -15.982 -17.991   4.509
   37    H    GLY   9           H        GLY   9 -14.096 -14.586   2.188
   38    HA2  GLY   9           1HA      GLY   9 -12.755 -13.544   4.570
   39    HA3  GLY   9           2HA      GLY   9 -11.971 -14.116   3.105
   40    H    GLU  10           H        GLU  10 -11.498 -11.647   4.560
   41    HA   GLU  10           HA       GLU  10 -12.055  -9.769   2.368
   42    HB2  GLU  10           1HB      GLU  10 -12.480  -7.976   3.927
   43    HB3  GLU  10           2HB      GLU  10 -13.567  -9.311   4.283
   44    HG2  GLU  10           1HG      GLU  10 -12.293  -9.950   6.184
   45    HG3  GLU  10           2HG      GLU  10 -10.993  -8.839   5.759
   46    H    ARG  11           H        ARG  11 -10.460  -8.219   1.967
   47    HA   ARG  11           HA       ARG  11  -7.882  -8.748   3.292
   48    HB2  ARG  11           1HB      ARG  11  -8.569  -8.123   0.438
   49    HB3  ARG  11           2HB      ARG  11  -6.971  -7.745   1.069
   50    HG2  ARG  11           1HG      ARG  11  -6.363  -9.930   1.233
   51    HG3  ARG  11           2HG      ARG  11  -8.015 -10.483   1.518
   52    HD2  ARG  11           1HD      ARG  11  -8.542 -10.032  -0.848
   53    HD3  ARG  11           2HD      ARG  11  -6.864  -9.558  -1.112
   54    HE   ARG  11           HE       ARG  11  -7.893 -12.243  -0.811
   55   HH11  ARG  11          1HH1      ARG  11  -5.092 -10.175  -0.754
   56   HH12  ARG  11          2HH1      ARG  11  -3.973 -11.464  -1.050
   57   HH21  ARG  11          1HH2      ARG  11  -6.429 -13.948  -1.202
   58   HH22  ARG  11          2HH2      ARG  11  -4.734 -13.610  -1.306
   59    H    HIS  12           H        HIS  12  -7.764  -7.176   4.807
   60    HA   HIS  12           HA       HIS  12  -8.668  -4.500   4.352
   61    HB2  HIS  12           1HB      HIS  12  -7.450  -4.074   6.554
   62    HB3  HIS  12           2HB      HIS  12  -8.771  -5.237   6.597
   63    HD1  HIS  12           HD1      HIS  12  -8.197  -7.180   7.993
   64    HD2  HIS  12           HD2      HIS  12  -4.862  -5.670   6.029
   65    HE1  HIS  12           HE1      HIS  12  -6.280  -8.646   8.698
   66    H    TYR  13           H        TYR  13  -7.184  -2.609   4.709
   67    HA   TYR  13           HA       TYR  13  -4.993  -2.802   2.844
   68    HB2  TYR  13           1HB      TYR  13  -5.778  -0.387   4.475
   69    HB3  TYR  13           2HB      TYR  13  -4.890  -0.420   2.956
   70    HD1  TYR  13           HD2      TYR  13  -8.215  -0.993   4.480
   71    HD2  TYR  13           HD1      TYR  13  -6.025  -0.408   0.880
   72    HE1  TYR  13           HE2      TYR  13 -10.325  -0.715   3.249
   73    HE2  TYR  13           HE1      TYR  13  -8.129  -0.127  -0.362
   74    HH   TYR  13           HH       TYR  13 -10.376  -0.385  -0.260
   75    H    GLU  14           H        GLU  14  -3.280  -3.878   3.687
   76    HA   GLU  14           HA       GLU  14  -2.308  -3.167   6.348
   77    HB2  GLU  14           1HB      GLU  14  -2.525  -5.580   5.349
   78    HB3  GLU  14           2HB      GLU  14  -0.993  -5.194   4.578
   79    HG2  GLU  14           1HG      GLU  14  -0.306  -4.507   7.015
   80    HG3  GLU  14           2HG      GLU  14  -1.622  -5.593   7.455
   81    H    CYS  15           H        CYS  15  -0.394  -2.159   6.745
   82    HA   CYS  15           HA       CYS  15   0.659  -0.410   4.839
   83    HB2  CYS  15           1HB      CYS  15   0.844  -0.157   7.323
   84    HB3  CYS  15           2HB      CYS  15   2.070  -1.422   7.315
   85    H    SER  16           H        SER  16   2.864  -0.337   3.989
   86    HA   SER  16           HA       SER  16   3.714  -3.002   3.101
   87    HB2  SER  16           1HB      SER  16   4.181  -0.249   1.941
   88    HB3  SER  16           2HB      SER  16   4.961  -1.707   1.326
   89    HG   SER  16           HG       SER  16   2.183  -1.722   1.622
   90    H    GLU  17           H        GLU  17   4.713  -0.247   4.931
   91    HA   GLU  17           HA       GLU  17   7.520  -0.811   4.874
   92    HB2  GLU  17           1HB      GLU  17   5.790   0.980   6.565
   93    HB3  GLU  17           2HB      GLU  17   7.507   0.783   6.888
   94    HG2  GLU  17           1HG      GLU  17   6.347   1.733   4.279
   95    HG3  GLU  17           2HG      GLU  17   6.986   2.780   5.544
   96    H    CYS  18           H        CYS  18   5.273  -0.841   7.644
   97    HA   CYS  18           HA       CYS  18   6.945  -2.841   8.946
   98    HB2  CYS  18           1HB      CYS  18   5.434  -2.437  10.899
   99    HB3  CYS  18           2HB      CYS  18   6.269  -0.994  10.333
  100    H    GLY  19           H        GLY  19   3.526  -2.421   8.036
  101    HA2  GLY  19           1HA      GLY  19   2.434  -4.294   6.895
  102    HA3  GLY  19           2HA      GLY  19   3.305  -5.366   7.982
  103    H    LYS  20           H        LYS  20   1.689  -2.379   8.910
  104    HA   LYS  20           HA       LYS  20   0.193  -3.786  10.931
  105    HB2  LYS  20           1HB      LYS  20   1.244  -1.378  10.992
  106    HB3  LYS  20           2HB      LYS  20  -0.280  -0.910  10.252
  107    HG2  LYS  20           1HG      LYS  20  -1.515  -1.767  12.129
  108    HG3  LYS  20           2HG      LYS  20  -0.038  -2.412  12.850
  109    HD2  LYS  20           1HD      LYS  20   0.822  -0.222  13.233
  110    HD3  LYS  20           2HD      LYS  20  -0.459   0.515  12.268
  111    HE2  LYS  20           1HE      LYS  20  -1.021   0.858  14.551
  112    HE3  LYS  20           2HE      LYS  20  -2.100  -0.394  13.937
  113    HZ1  LYS  20           3HZ      LYS  20  -0.244  -1.953  14.868
  114    HZ2  LYS  20           1HZ      LYS  20  -1.429  -1.320  15.896
  115    HZ3  LYS  20           2HZ      LYS  20   0.110  -0.622  15.850
  116    H    ALA  21           H        ALA  21  -1.952  -4.241  10.963
  117    HA   ALA  21           HA       ALA  21  -3.382  -3.965   8.433
  118    HB1  ALA  21           3HB      ALA  21  -4.403  -5.449  10.828
  119    HB2  ALA  21           1HB      ALA  21  -4.755  -5.716   9.120
  120    HB3  ALA  21           2HB      ALA  21  -3.174  -6.148   9.773
  121    H    PHE  22           H        PHE  22  -5.018  -2.592   8.123
  122    HA   PHE  22           HA       PHE  22  -6.160  -1.242  10.480
  123    HB2  PHE  22           1HB      PHE  22  -5.764  -0.035   7.735
  124    HB3  PHE  22           2HB      PHE  22  -6.374   0.789   9.167
  125    HD1  PHE  22           HD1      PHE  22  -4.851   1.232  11.072
  126    HD2  PHE  22           HD2      PHE  22  -3.446  -0.305   7.360
  127    HE1  PHE  22           HE1      PHE  22  -2.557   1.889  11.672
  128    HE2  PHE  22           HE2      PHE  22  -1.150   0.348   7.954
  129    HZ   PHE  22           HZ       PHE  22  -0.703   1.446  10.113
  130    H    ILE  23           H        ILE  23  -8.277  -0.004   9.642
  131    HA   ILE  23           HA       ILE  23  -9.974  -2.124   8.539
  132    HB   ILE  23           HB       ILE  23 -10.682  -1.259  10.694
  133   HG12  ILE  23          1HG1      ILE  23 -12.980  -0.293   9.909
  134   HG13  ILE  23          2HG1      ILE  23 -12.376  -0.646   8.294
  135   HG21  ILE  23          1HG2      ILE  23 -10.802   1.420   9.316
  136   HG22  ILE  23          2HG2      ILE  23 -11.419   1.083  10.933
  137   HG23  ILE  23          3HG2      ILE  23  -9.693   0.945  10.602
  138   HD11  ILE  23          3HD1      ILE  23 -12.365  -2.747  10.419
  139   HD12  ILE  23          1HD1      ILE  23 -13.825  -2.394   9.494
  140   HD13  ILE  23          2HD1      ILE  23 -12.364  -2.931   8.665
  141    H    GLN  24           H        GLN  24  -9.176   1.294   8.115
  142    HA   GLN  24           HA       GLN  24 -10.581   1.231   5.526
  143    HB2  GLN  24           1HB      GLN  24  -9.985   3.589   7.320
  144    HB3  GLN  24           2HB      GLN  24 -10.720   3.702   5.726
  145    HG2  GLN  24           1HG      GLN  24 -12.720   2.849   6.432
  146    HG3  GLN  24           2HG      GLN  24 -11.992   1.947   7.760
  147   HE21  GLN  24          1HE2      GLN  24 -13.084   2.674   9.474
  148   HE22  GLN  24          2HE2      GLN  24 -13.185   4.330   9.957
  149    H    LYS  25           H        LYS  25  -9.593   2.292   3.740
  150    HA   LYS  25           HA       LYS  25  -6.843   1.791   3.467
  151    HB2  LYS  25           1HB      LYS  25  -8.736   2.070   1.677
  152    HB3  LYS  25           2HB      LYS  25  -8.260   3.763   1.710
  153    HG2  LYS  25           1HG      LYS  25  -6.134   1.716   1.377
  154    HG3  LYS  25           2HG      LYS  25  -7.198   2.055   0.010
  155    HD2  LYS  25           1HD      LYS  25  -6.658   4.518   0.431
  156    HD3  LYS  25           2HD      LYS  25  -5.346   3.929   1.455
  157    HE2  LYS  25           1HE      LYS  25  -4.673   2.514  -0.583
  158    HE3  LYS  25           2HE      LYS  25  -5.731   3.586  -1.501
  159    HZ1  LYS  25           3HZ      LYS  25  -4.303   5.298  -1.315
  160    HZ2  LYS  25           1HZ      LYS  25  -3.156   4.076  -1.082
  161    HZ3  LYS  25           2HZ      LYS  25  -3.812   4.885   0.251
  162    H    SER  26           H        SER  26  -8.613   4.848   3.870
  163    HA   SER  26           HA       SER  26  -6.434   6.580   3.748
  164    HB2  SER  26           1HB      SER  26  -8.776   7.341   3.703
  165    HB3  SER  26           2HB      SER  26  -8.956   6.885   5.397
  166    HG   SER  26           HG       SER  26  -7.176   8.840   4.362
  167    H    THR  27           H        THR  27  -7.950   5.099   6.608
  168    HA   THR  27           HA       THR  27  -6.514   6.144   8.649
  169    HB   THR  27           HB       THR  27  -7.132   3.197   8.358
  170    HG1  THR  27           HG1      THR  27  -8.972   4.080   9.782
  171   HG21  THR  27          3HG2      THR  27  -6.102   4.863  10.565
  172   HG22  THR  27          1HG2      THR  27  -5.922   3.134  10.270
  173   HG23  THR  27          2HG2      THR  27  -7.409   3.757  10.986
  174    H    LEU  28           H        LEU  28  -5.404   3.654   6.403
  175    HA   LEU  28           HA       LEU  28  -2.956   3.106   7.711
  176    HB2  LEU  28           1HB      LEU  28  -3.512   1.455   6.229
  177    HB3  LEU  28           2HB      LEU  28  -4.102   2.592   5.019
  178    HG   LEU  28           HG       LEU  28  -1.702   3.190   4.560
  179   HD11  LEU  28          1HD1      LEU  28  -0.963   2.190   6.805
  180   HD12  LEU  28          2HD1      LEU  28   0.057   1.912   5.394
  181   HD13  LEU  28          3HD1      LEU  28  -1.015   0.637   5.971
  182   HD21  LEU  28          3HD2      LEU  28  -1.675   1.674   2.900
  183   HD22  LEU  28          1HD2      LEU  28  -3.268   1.240   3.519
  184   HD23  LEU  28          2HD2      LEU  28  -1.851   0.308   4.002
  185    H    SER  29           H        SER  29  -3.709   5.140   4.885
  186    HA   SER  29           HA       SER  29  -1.220   6.092   4.271
  187    HB2  SER  29           1HB      SER  29  -3.210   6.659   2.966
  188    HB3  SER  29           2HB      SER  29  -3.809   7.664   4.285
  189    HG   SER  29           HG       SER  29  -1.808   8.892   4.007
  190    H    MET  30           H        MET  30  -3.419   7.336   6.762
  191    HA   MET  30           HA       MET  30  -1.839   9.500   7.589
  192    HB2  MET  30           1HB      MET  30  -3.669   7.884   9.364
  193    HB3  MET  30           2HB      MET  30  -3.213   9.572   9.552
  194    HG2  MET  30           1HG      MET  30  -4.881   8.437   7.319
  195    HG3  MET  30           2HG      MET  30  -5.483   9.337   8.709
  196    HE1  MET  30           3HE      MET  30  -3.875  12.859   8.131
  197    HE2  MET  30           1HE      MET  30  -5.231  12.072   8.940
  198    HE3  MET  30           2HE      MET  30  -3.584  11.520   9.242
  199    H    HIS  31           H        HIS  31  -1.615   6.100   8.239
  200    HA   HIS  31           HA       HIS  31   0.171   6.420  10.489
  201    HB2  HIS  31           1HB      HIS  31  -1.000   4.468  10.782
  202    HB3  HIS  31           2HB      HIS  31  -1.078   4.130   9.055
  203    HD1  HIS  31           HD1      HIS  31   0.906   3.440  12.096
  204    HD2  HIS  31           HD2      HIS  31   1.245   2.851   7.997
  205    HE1  HIS  31           HE1      HIS  31   2.769   1.775  11.807
  206    H    GLN  32           H        GLN  32   0.438   5.172   7.165
  207    HA   GLN  32           HA       GLN  32   3.015   4.440   6.969
  208    HB2  GLN  32           1HB      GLN  32   1.205   5.876   5.097
  209    HB3  GLN  32           2HB      GLN  32   2.907   5.784   4.663
  210    HG2  GLN  32           1HG      GLN  32   2.530   3.229   5.254
  211    HG3  GLN  32           2HG      GLN  32   0.870   3.643   4.830
  212   HE21  GLN  32          1HE2      GLN  32   0.425   3.124   2.823
  213   HE22  GLN  32          2HE2      GLN  32   1.489   3.261   1.469
  214    H    ARG  33           H        ARG  33   1.881   7.661   7.563
  215    HA   ARG  33           HA       ARG  33   4.060   9.195   6.800
  216    HB2  ARG  33           1HB      ARG  33   3.182  10.896   8.120
  217    HB3  ARG  33           2HB      ARG  33   1.771   9.898   7.796
  218    HG2  ARG  33           1HG      ARG  33   1.990   8.854   9.984
  219    HG3  ARG  33           2HG      ARG  33   3.429   9.822  10.309
  220    HD2  ARG  33           1HD      ARG  33   0.885  11.188   9.557
  221    HD3  ARG  33           2HD      ARG  33   1.079  10.571  11.198
  222    HE   ARG  33           HE       ARG  33   2.680  12.192  11.602
  223   HH11  ARG  33          1HH1      ARG  33   1.770  12.184   8.241
  224   HH12  ARG  33          2HH1      ARG  33   2.548  13.692   7.892
  225   HH21  ARG  33          1HH2      ARG  33   3.708  14.178  11.155
  226   HH22  ARG  33          2HH2      ARG  33   3.651  14.825   9.550
  227    H    ILE  34           H        ILE  34   3.487   7.559   9.904
  228    HA   ILE  34           HA       ILE  34   5.643   8.364  11.363
  229    HB   ILE  34           HB       ILE  34   5.516   6.351  12.615
  230   HG12  ILE  34          1HG1      ILE  34   3.948   5.055  10.386
  231   HG13  ILE  34          2HG1      ILE  34   5.691   4.872  10.552
  232   HG21  ILE  34          1HG2      ILE  34   2.738   6.120  11.965
  233   HG22  ILE  34          2HG2      ILE  34   3.496   6.881  13.363
  234   HG23  ILE  34          3HG2      ILE  34   3.229   7.812  11.890
  235   HD11  ILE  34          3HD1      ILE  34   4.530   2.974  11.497
  236   HD12  ILE  34          1HD1      ILE  34   5.365   3.877  12.761
  237   HD13  ILE  34          2HD1      ILE  34   3.619   4.039  12.568
  238    H    HIS  35           H        HIS  35   5.641   6.252   8.593
  239    HA   HIS  35           HA       HIS  35   8.333   5.314   8.991
  240    HB2  HIS  35           1HB      HIS  35   6.398   5.111   6.684
  241    HB3  HIS  35           2HB      HIS  35   8.033   4.460   6.613
  242    HD1  HIS  35           HD1      HIS  35   8.555   2.657   8.630
  243    HD2  HIS  35           HD2      HIS  35   4.577   3.362   7.660
  244    HE1  HIS  35           HE1      HIS  35   7.279   0.699   9.559
  245    H    ARG  36           H        ARG  36   6.737   7.780   7.038
  246    HA   ARG  36           HA       ARG  36   9.365   8.681   6.077
  247    HB2  ARG  36           1HB      ARG  36   8.110   9.938   4.367
  248    HB3  ARG  36           2HB      ARG  36   7.776   8.213   4.300
  249    HG2  ARG  36           1HG      ARG  36   5.734   8.793   5.776
  250    HG3  ARG  36           2HG      ARG  36   6.012  10.443   5.215
  251    HD2  ARG  36           1HD      ARG  36   5.886   8.197   3.247
  252    HD3  ARG  36           2HD      ARG  36   4.396   8.871   3.906
  253    HE   ARG  36           HE       ARG  36   6.251  10.808   2.824
  254   HH11  ARG  36          1HH1      ARG  36   3.513   8.744   2.220
  255   HH12  ARG  36          2HH1      ARG  36   2.959   9.659   0.857
  256   HH21  ARG  36          1HH2      ARG  36   5.532  12.019   1.030
  257   HH22  ARG  36          2HH2      ARG  36   4.109  11.521   0.180
  258    H    GLY  37           H        GLY  37  10.022   9.847   7.887
  259    HA2  GLY  37           1HA      GLY  37   8.418  12.268   8.438
  260    HA3  GLY  37           2HA      GLY  37   9.284  11.401   9.698
  261    H    GLU  38           H        GLU  38  11.661  11.284   9.473
  262    HA   GLU  38           HA       GLU  38  12.674  13.885   8.671
  263    HB2  GLU  38           1HB      GLU  38  14.804  13.016   9.749
  264    HB3  GLU  38           2HB      GLU  38  13.416  13.210  10.810
  265    HG2  GLU  38           1HG      GLU  38  13.045  10.903  10.935
  266    HG3  GLU  38           2HG      GLU  38  14.076  10.576   9.543
  267    H    LYS  39           H        LYS  39  12.222  13.208   6.359
  268    HA   LYS  39           HA       LYS  39  12.854  12.252   4.346
  269    HB2  LYS  39           1HB      LYS  39  15.378  13.553   5.380
  270    HB3  LYS  39           2HB      LYS  39  15.137  13.055   3.711
  271    HG2  LYS  39           1HG      LYS  39  13.588  14.714   3.298
  272    HG3  LYS  39           2HG      LYS  39  13.187  14.908   5.006
  273    HD2  LYS  39           1HD      LYS  39  15.388  15.908   5.405
  274    HD3  LYS  39           2HD      LYS  39  15.785  15.715   3.696
  275    HE2  LYS  39           1HE      LYS  39  13.404  17.287   4.654
  276    HE3  LYS  39           2HE      LYS  39  14.994  18.011   4.419
  277    HZ1  LYS  39           3HZ      LYS  39  14.249  18.358   2.351
  278    HZ2  LYS  39           1HZ      LYS  39  13.039  17.180   2.461
  279    HZ3  LYS  39           2HZ      LYS  39  14.627  16.729   2.094
  280    HA   PRO  40           HA       PRO  40  15.075   8.604   6.378
  281    HB2  PRO  40           1HB      PRO  40  13.009   6.848   6.241
  282    HB3  PRO  40           2HB      PRO  40  13.278   7.909   7.629
  283    HG2  PRO  40           1HG      PRO  40  11.386   8.237   5.333
  284    HG3  PRO  40           2HG      PRO  40  11.110   8.527   7.061
  285    HD2  PRO  40           1HD      PRO  40  11.618  10.529   5.310
  286    HD3  PRO  40           2HD      PRO  40  12.137  10.590   7.007
  287    H    SER  41           H        SER  41  12.581   8.424   3.830
  288    HA   SER  41           HA       SER  41  14.574   7.230   2.044
  289    HB2  SER  41           1HB      SER  41  11.806   6.098   2.516
  290    HB3  SER  41           2HB      SER  41  12.931   5.546   1.275
  291    HG   SER  41           HG       SER  41  12.776   4.615   3.661
  292    H    GLY  42           H        GLY  42  14.006   7.369  -0.225
  293    HA2  GLY  42           1HA      GLY  42  12.320   9.725  -0.741
  294    HA3  GLY  42           2HA      GLY  42  13.621   9.156  -1.777
  295    HA   PRO  43           HA       PRO  43   9.358   7.634  -3.198
  296    HB2  PRO  43           1HB      PRO  43   9.147   9.175  -5.424
  297    HB3  PRO  43           2HB      PRO  43   8.535   9.680  -3.844
  298    HG2  PRO  43           1HG      PRO  43  11.092  10.423  -5.212
  299    HG3  PRO  43           2HG      PRO  43   9.964  11.454  -4.312
  300    HD2  PRO  43           1HD      PRO  43  12.265  10.523  -3.231
  301    HD3  PRO  43           2HD      PRO  43  10.801  10.800  -2.267
  302    H    SER  44           H        SER  44  12.544   7.681  -4.113
  303    HA   SER  44           HA       SER  44  12.749   6.890  -6.711
  304    HB2  SER  44           1HB      SER  44  14.555   7.064  -4.825
  305    HB3  SER  44           2HB      SER  44  14.253   5.337  -4.628
  306    HG   SER  44           HG       SER  44  15.965   5.969  -6.153
  307    H    SER  45           H        SER  45  12.266   4.636  -3.987
  308    HA   SER  45           HA       SER  45  12.053   2.248  -5.148
  309    HB2  SER  45           1HB      SER  45  10.266   3.480  -3.063
  310    HB3  SER  45           2HB      SER  45  10.030   1.814  -3.589
  311    HG   SER  45           HG       SER  45  11.420   2.009  -1.752
  312    H    GLY  46           H        GLY  46   9.209   4.404  -4.953
  313    HA2  GLY  46           1HA      GLY  46   7.866   4.877  -6.896
  314    HA3  GLY  46           2HA      GLY  46   8.332   3.311  -7.544
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1   2.353 -14.042 -21.613
    2    HA2  GLY   1           1HA      GLY   1   2.825 -16.498 -20.119
    3    HA3  GLY   1           2HA      GLY   1   2.968 -14.858 -19.503
    4    H    SER   2           H        SER   2   1.762 -15.228 -17.658
    5    HA   SER   2           HA       SER   2  -1.106 -15.722 -18.121
    6    HB2  SER   2           1HB      SER   2  -1.263 -16.920 -16.071
    7    HB3  SER   2           2HB      SER   2   0.158 -17.563 -16.895
    8    HG   SER   2           HG       SER   2   1.151 -15.667 -15.527
    9    H    SER   3           H        SER   3  -2.571 -14.644 -16.678
   10    HA   SER   3           HA       SER   3  -1.749 -12.710 -14.791
   11    HB2  SER   3           1HB      SER   3  -2.460 -10.676 -16.106
   12    HB3  SER   3           2HB      SER   3  -0.950 -11.412 -16.643
   13    HG   SER   3           HG       SER   3  -3.489 -11.910 -17.811
   14    H    GLY   4           H        GLY   4  -3.523 -11.601 -13.817
   15    HA2  GLY   4           1HA      GLY   4  -6.196 -12.377 -14.749
   16    HA3  GLY   4           2HA      GLY   4  -5.720 -12.822 -13.117
   17    H    SER   5           H        SER   5  -7.449 -11.569 -12.286
   18    HA   SER   5           HA       SER   5  -6.718  -8.801 -11.865
   19    HB2  SER   5           1HB      SER   5  -8.987  -7.965 -12.515
   20    HB3  SER   5           2HB      SER   5  -8.034  -8.552 -13.878
   21    HG   SER   5           HG       SER   5  -9.519 -10.526 -12.749
   22    H    SER   6           H        SER   6  -8.489  -7.744 -10.408
   23    HA   SER   6           HA       SER   6  -9.972  -9.542  -8.730
   24    HB2  SER   6           1HB      SER   6  -8.746  -9.089  -6.657
   25    HB3  SER   6           2HB      SER   6  -7.695  -9.873  -7.837
   26    HG   SER   6           HG       SER   6  -6.454  -8.191  -7.767
   27    H    GLY   7           H        GLY   7 -11.423  -8.476  -7.365
   28    HA2  GLY   7           1HA      GLY   7 -12.184  -5.867  -8.209
   29    HA3  GLY   7           2HA      GLY   7 -12.904  -6.780  -6.892
   30    H    THR   8           H        THR   8 -13.054  -5.014  -5.520
   31    HA   THR   8           HA       THR   8 -11.018  -3.184  -4.960
   32    HB   THR   8           HB       THR   8 -13.259  -2.689  -4.257
   33    HG1  THR   8           HG1      THR   8 -12.826  -2.127  -2.066
   34   HG21  THR   8          3HG2      THR   8 -13.773  -4.207  -1.998
   35   HG22  THR   8          1HG2      THR   8 -13.134  -5.376  -3.153
   36   HG23  THR   8          2HG2      THR   8 -14.538  -4.394  -3.575
   37    H    GLY   9           H        GLY   9 -11.137  -6.470  -4.274
   38    HA2  GLY   9           1HA      GLY   9  -9.480  -7.756  -3.267
   39    HA3  GLY   9           2HA      GLY   9  -8.744  -6.282  -2.658
   40    H    GLU  10           H        GLU  10 -10.928  -8.873  -2.007
   41    HA   GLU  10           HA       GLU  10 -12.407  -8.054   0.126
   42    HB2  GLU  10           1HB      GLU  10 -11.099 -10.644  -0.558
   43    HB3  GLU  10           2HB      GLU  10 -11.808 -10.473   1.041
   44    HG2  GLU  10           1HG      GLU  10 -13.546 -11.374  -0.155
   45    HG3  GLU  10           2HG      GLU  10 -13.899  -9.649  -0.248
   46    H    ARG  11           H        ARG  11  -9.006  -9.049   0.191
   47    HA   ARG  11           HA       ARG  11  -8.571  -8.961   2.932
   48    HB2  ARG  11           1HB      ARG  11  -6.205  -8.619   2.393
   49    HB3  ARG  11           2HB      ARG  11  -6.926  -9.836   1.348
   50    HG2  ARG  11           1HG      ARG  11  -6.880  -8.449  -0.512
   51    HG3  ARG  11           2HG      ARG  11  -6.734  -6.985   0.463
   52    HD2  ARG  11           1HD      ARG  11  -4.472  -7.567   1.071
   53    HD3  ARG  11           2HD      ARG  11  -4.612  -9.115   0.239
   54    HE   ARG  11           HE       ARG  11  -5.133  -7.075  -1.602
   55   HH11  ARG  11          1HH1      ARG  11  -2.494  -8.328   0.292
   56   HH12  ARG  11          2HH1      ARG  11  -1.276  -7.830  -0.836
   57   HH21  ARG  11          1HH2      ARG  11  -3.539  -6.414  -3.094
   58   HH22  ARG  11          2HH2      ARG  11  -1.872  -6.741  -2.761
   59    H    HIS  12           H        HIS  12  -7.601  -7.354   4.280
   60    HA   HIS  12           HA       HIS  12  -8.671  -4.715   3.785
   61    HB2  HIS  12           1HB      HIS  12  -7.494  -4.327   6.099
   62    HB3  HIS  12           2HB      HIS  12  -8.972  -5.280   6.008
   63    HD1  HIS  12           HD1      HIS  12  -8.379  -6.613   8.129
   64    HD2  HIS  12           HD2      HIS  12  -5.582  -6.968   5.077
   65    HE1  HIS  12           HE1      HIS  12  -6.886  -8.521   8.804
   66    H    TYR  13           H        TYR  13  -7.159  -2.835   4.557
   67    HA   TYR  13           HA       TYR  13  -4.863  -2.902   2.779
   68    HB2  TYR  13           1HB      TYR  13  -6.043  -0.632   4.394
   69    HB3  TYR  13           2HB      TYR  13  -4.743  -0.474   3.219
   70    HD1  TYR  13           HD2      TYR  13  -8.252  -1.733   3.462
   71    HD2  TYR  13           HD1      TYR  13  -5.279   0.126   1.051
   72    HE1  TYR  13           HE2      TYR  13  -9.912  -1.405   1.677
   73    HE2  TYR  13           HE1      TYR  13  -6.932   0.461  -0.740
   74    HH   TYR  13           HH       TYR  13 -10.205   0.211  -0.289
   75    H    GLU  14           H        GLU  14  -2.982  -3.606   3.528
   76    HA   GLU  14           HA       GLU  14  -2.296  -3.088   6.343
   77    HB2  GLU  14           1HB      GLU  14  -1.651  -5.319   4.464
   78    HB3  GLU  14           2HB      GLU  14  -0.501  -4.929   5.735
   79    HG2  GLU  14           1HG      GLU  14  -1.896  -5.616   7.406
   80    HG3  GLU  14           2HG      GLU  14  -3.355  -5.286   6.475
   81    H    CYS  15           H        CYS  15  -0.275  -2.263   6.879
   82    HA   CYS  15           HA       CYS  15   0.867  -0.487   4.956
   83    HB2  CYS  15           1HB      CYS  15   0.711   0.014   7.394
   84    HB3  CYS  15           2HB      CYS  15   1.921  -1.230   7.692
   85    H    SER  16           H        SER  16   2.323  -0.986   3.472
   86    HA   SER  16           HA       SER  16   3.762  -3.489   3.598
   87    HB2  SER  16           1HB      SER  16   2.731  -2.408   1.493
   88    HB3  SER  16           2HB      SER  16   4.152  -1.364   1.498
   89    HG   SER  16           HG       SER  16   4.358  -3.311   0.217
   90    H    GLU  17           H        GLU  17   4.463  -1.694   5.662
   91    HA   GLU  17           HA       GLU  17   7.287  -1.229   4.987
   92    HB2  GLU  17           1HB      GLU  17   5.477   0.600   6.570
   93    HB3  GLU  17           2HB      GLU  17   7.226   0.765   6.502
   94    HG2  GLU  17           1HG      GLU  17   5.733   0.679   3.940
   95    HG3  GLU  17           2HG      GLU  17   5.630   2.141   4.920
   96    H    CYS  18           H        CYS  18   5.061  -1.259   7.776
   97    HA   CYS  18           HA       CYS  18   7.145  -2.545   9.378
   98    HB2  CYS  18           1HB      CYS  18   5.478  -2.127  11.263
   99    HB3  CYS  18           2HB      CYS  18   6.194  -0.702  10.516
  100    H    GLY  19           H        GLY  19   3.705  -2.980   8.557
  101    HA2  GLY  19           1HA      GLY  19   3.158  -5.302   7.796
  102    HA3  GLY  19           2HA      GLY  19   4.027  -5.841   9.226
  103    H    LYS  20           H        LYS  20   1.743  -3.152   8.932
  104    HA   LYS  20           HA       LYS  20   0.066  -4.483  10.952
  105    HB2  LYS  20           1HB      LYS  20   1.208  -2.111  11.256
  106    HB3  LYS  20           2HB      LYS  20  -0.198  -1.572  10.349
  107    HG2  LYS  20           1HG      LYS  20  -1.673  -2.543  12.018
  108    HG3  LYS  20           2HG      LYS  20  -0.278  -3.143  12.917
  109    HD2  LYS  20           1HD      LYS  20   0.431  -0.948  13.460
  110    HD3  LYS  20           2HD      LYS  20  -0.685  -0.225  12.299
  111    HE2  LYS  20           1HE      LYS  20  -1.563  -1.809  14.707
  112    HE3  LYS  20           2HE      LYS  20  -1.386  -0.055  14.703
  113    HZ1  LYS  20           3HZ      LYS  20  -3.047   0.099  12.982
  114    HZ2  LYS  20           1HZ      LYS  20  -3.676  -0.767  14.292
  115    HZ3  LYS  20           2HZ      LYS  20  -3.180  -1.585  12.898
  116    H    ALA  21           H        ALA  21  -2.289  -3.923  10.825
  117    HA   ALA  21           HA       ALA  21  -3.168  -3.750   8.016
  118    HB1  ALA  21           3HB      ALA  21  -4.903  -5.339   8.453
  119    HB2  ALA  21           1HB      ALA  21  -3.374  -6.033   8.993
  120    HB3  ALA  21           2HB      ALA  21  -4.508  -5.374  10.172
  121    H    PHE  22           H        PHE  22  -4.969  -2.528   7.565
  122    HA   PHE  22           HA       PHE  22  -6.260  -1.143   9.811
  123    HB2  PHE  22           1HB      PHE  22  -5.494   0.268   7.256
  124    HB3  PHE  22           2HB      PHE  22  -6.088   0.984   8.751
  125    HD1  PHE  22           HD2      PHE  22  -3.256  -1.118   7.536
  126    HD2  PHE  22           HD1      PHE  22  -4.565   1.976  10.149
  127    HE1  PHE  22           HE2      PHE  22  -0.938  -0.776   8.287
  128    HE2  PHE  22           HE1      PHE  22  -2.249   2.324  10.903
  129    HZ   PHE  22           HZ       PHE  22  -0.432   0.946   9.973
  130    H    ILE  23           H        ILE  23  -8.423  -0.860   9.622
  131    HA   ILE  23           HA       ILE  23  -9.816  -2.350   7.638
  132    HB   ILE  23           HB       ILE  23 -10.744  -2.149   9.865
  133   HG12  ILE  23          1HG1      ILE  23 -13.041  -1.087   9.163
  134   HG13  ILE  23          2HG1      ILE  23 -12.295  -1.003   7.571
  135   HG21  ILE  23          1HG2      ILE  23  -9.918   0.028  10.483
  136   HG22  ILE  23          2HG2      ILE  23 -10.934   0.798   9.266
  137   HG23  ILE  23          3HG2      ILE  23 -11.672   0.004  10.657
  138   HD11  ILE  23          3HD1      ILE  23 -12.162  -3.311   7.378
  139   HD12  ILE  23          1HD1      ILE  23 -12.341  -3.563   9.114
  140   HD13  ILE  23          2HD1      ILE  23 -13.725  -3.046   8.151
  141    H    GLN  24           H        GLN  24  -9.333   1.110   8.217
  142    HA   GLN  24           HA       GLN  24 -10.660   1.689   5.661
  143    HB2  GLN  24           1HB      GLN  24 -10.154   3.302   8.133
  144    HB3  GLN  24           2HB      GLN  24 -10.398   4.120   6.596
  145    HG2  GLN  24           1HG      GLN  24 -12.556   2.897   6.369
  146    HG3  GLN  24           2HG      GLN  24 -12.316   2.282   8.003
  147   HE21  GLN  24          1HE2      GLN  24 -13.177   4.992   6.062
  148   HE22  GLN  24          2HE2      GLN  24 -13.643   6.043   7.351
  149    H    LYS  25           H        LYS  25  -9.598   2.636   3.994
  150    HA   LYS  25           HA       LYS  25  -6.824   2.361   3.778
  151    HB2  LYS  25           1HB      LYS  25  -8.191   2.392   1.801
  152    HB3  LYS  25           2HB      LYS  25  -8.776   4.009   2.168
  153    HG2  LYS  25           1HG      LYS  25  -7.205   4.333   0.483
  154    HG3  LYS  25           2HG      LYS  25  -6.337   4.743   1.964
  155    HD2  LYS  25           1HD      LYS  25  -5.273   2.571   1.985
  156    HD3  LYS  25           2HD      LYS  25  -6.216   2.063   0.582
  157    HE2  LYS  25           1HE      LYS  25  -4.532   4.514   0.382
  158    HE3  LYS  25           2HE      LYS  25  -3.748   2.936   0.319
  159    HZ1  LYS  25           3HZ      LYS  25  -4.210   3.456  -1.888
  160    HZ2  LYS  25           1HZ      LYS  25  -5.748   4.067  -1.539
  161    HZ3  LYS  25           2HZ      LYS  25  -5.462   2.402  -1.463
  162    H    SER  26           H        SER  26  -8.803   5.239   4.401
  163    HA   SER  26           HA       SER  26  -6.797   7.158   4.379
  164    HB2  SER  26           1HB      SER  26  -9.329   7.014   6.027
  165    HB3  SER  26           2HB      SER  26  -8.304   8.446   5.933
  166    HG   SER  26           HG       SER  26  -9.828   7.223   3.898
  167    H    THR  27           H        THR  27  -7.938   5.143   7.066
  168    HA   THR  27           HA       THR  27  -6.339   6.238   9.081
  169    HB   THR  27           HB       THR  27  -7.293   3.380   8.818
  170    HG1  THR  27           HG1      THR  27  -8.875   4.369  10.422
  171   HG21  THR  27          3HG2      THR  27  -5.598   4.627  10.748
  172   HG22  THR  27          1HG2      THR  27  -6.204   2.971  10.718
  173   HG23  THR  27          2HG2      THR  27  -7.139   4.239  11.512
  174    H    LEU  28           H        LEU  28  -5.553   4.105   6.473
  175    HA   LEU  28           HA       LEU  28  -3.074   3.196   7.647
  176    HB2  LEU  28           1HB      LEU  28  -3.825   1.563   6.261
  177    HB3  LEU  28           2HB      LEU  28  -4.581   2.704   5.150
  178    HG   LEU  28           HG       LEU  28  -2.281   3.250   4.300
  179   HD11  LEU  28          1HD1      LEU  28  -1.521   1.657   6.511
  180   HD12  LEU  28          2HD1      LEU  28  -0.487   2.463   5.332
  181   HD13  LEU  28          3HD1      LEU  28  -1.028   0.809   5.046
  182   HD21  LEU  28          3HD2      LEU  28  -3.902   1.655   3.223
  183   HD22  LEU  28          1HD2      LEU  28  -3.013   0.345   4.001
  184   HD23  LEU  28          2HD2      LEU  28  -2.203   1.387   2.831
  185    H    SER  29           H        SER  29  -3.951   5.191   4.824
  186    HA   SER  29           HA       SER  29  -1.443   5.982   4.029
  187    HB2  SER  29           1HB      SER  29  -3.759   6.530   3.009
  188    HB3  SER  29           2HB      SER  29  -3.728   7.942   4.066
  189    HG   SER  29           HG       SER  29  -1.439   8.058   2.984
  190    H    MET  30           H        MET  30  -3.429   7.319   6.624
  191    HA   MET  30           HA       MET  30  -1.699   9.493   7.220
  192    HB2  MET  30           1HB      MET  30  -3.043   9.823   9.173
  193    HB3  MET  30           2HB      MET  30  -4.117   9.353   7.863
  194    HG2  MET  30           1HG      MET  30  -4.265   7.112   8.724
  195    HG3  MET  30           2HG      MET  30  -3.074   7.477   9.970
  196    HE1  MET  30           3HE      MET  30  -4.611   6.273  11.312
  197    HE2  MET  30           1HE      MET  30  -4.742   7.464  12.607
  198    HE3  MET  30           2HE      MET  30  -6.200   6.785  11.883
  199    H    HIS  31           H        HIS  31  -1.825   6.146   8.190
  200    HA   HIS  31           HA       HIS  31  -0.055   6.413  10.421
  201    HB2  HIS  31           1HB      HIS  31  -1.320   4.502  10.637
  202    HB3  HIS  31           2HB      HIS  31  -1.275   4.147   8.913
  203    HD1  HIS  31           HD1      HIS  31   0.610   3.607  12.087
  204    HD2  HIS  31           HD2      HIS  31   0.933   2.638   8.060
  205    HE1  HIS  31           HE1      HIS  31   2.409   1.854  11.960
  206    H    GLN  32           H        GLN  32   0.354   5.037   7.155
  207    HA   GLN  32           HA       GLN  32   2.961   4.328   7.158
  208    HB2  GLN  32           1HB      GLN  32   1.195   5.511   5.082
  209    HB3  GLN  32           2HB      GLN  32   2.916   5.449   4.728
  210    HG2  GLN  32           1HG      GLN  32   2.970   3.110   4.846
  211    HG3  GLN  32           2HG      GLN  32   1.402   3.031   5.647
  212   HE21  GLN  32          1HE2      GLN  32   2.608   1.967   3.047
  213   HE22  GLN  32          2HE2      GLN  32   1.408   2.345   1.862
  214    H    ARG  33           H        ARG  33   1.727   7.539   7.455
  215    HA   ARG  33           HA       ARG  33   3.797   9.128   6.592
  216    HB2  ARG  33           1HB      ARG  33   2.925  10.831   7.929
  217    HB3  ARG  33           2HB      ARG  33   1.541   9.778   7.664
  218    HG2  ARG  33           1HG      ARG  33   1.859   8.780   9.859
  219    HG3  ARG  33           2HG      ARG  33   3.278   9.796  10.124
  220    HD2  ARG  33           1HD      ARG  33   1.611  11.744   9.619
  221    HD3  ARG  33           2HD      ARG  33   0.388  10.547  10.045
  222    HE   ARG  33           HE       ARG  33   2.537  10.858  11.958
  223   HH11  ARG  33          1HH1      ARG  33  -0.663  11.821  10.982
  224   HH12  ARG  33          2HH1      ARG  33  -1.117  12.380  12.558
  225   HH21  ARG  33          1HH2      ARG  33   1.951  11.591  14.037
  226   HH22  ARG  33          2HH2      ARG  33   0.371  12.249  14.295
  227    H    ILE  34           H        ILE  34   3.484   7.510   9.737
  228    HA   ILE  34           HA       ILE  34   5.712   8.498  11.022
  229    HB   ILE  34           HB       ILE  34   5.732   6.502  12.373
  230   HG12  ILE  34          1HG1      ILE  34   3.685   5.165  10.654
  231   HG13  ILE  34          2HG1      ILE  34   5.379   5.053  10.190
  232   HG21  ILE  34          1HG2      ILE  34   3.981   7.735  13.143
  233   HG22  ILE  34          2HG2      ILE  34   3.136   7.705  11.596
  234   HG23  ILE  34          3HG2      ILE  34   3.102   6.289  12.646
  235   HD11  ILE  34          3HD1      ILE  34   4.000   3.958  12.596
  236   HD12  ILE  34          1HD1      ILE  34   5.072   3.153  11.450
  237   HD13  ILE  34          2HD1      ILE  34   5.733   4.281  12.634
  238    H    HIS  35           H        HIS  35   5.569   6.410   8.294
  239    HA   HIS  35           HA       HIS  35   8.301   5.469   8.612
  240    HB2  HIS  35           1HB      HIS  35   6.240   5.011   6.450
  241    HB3  HIS  35           2HB      HIS  35   7.861   4.325   6.421
  242    HD1  HIS  35           HD1      HIS  35   8.326   2.325   7.942
  243    HD2  HIS  35           HD2      HIS  35   4.497   3.880   8.368
  244    HE1  HIS  35           HE1      HIS  35   7.063   0.635   9.310
  245    H    ARG  36           H        ARG  36   6.458   7.698   6.597
  246    HA   ARG  36           HA       ARG  36   8.278   8.332   4.644
  247    HB2  ARG  36           1HB      ARG  36   6.292  10.058   6.110
  248    HB3  ARG  36           2HB      ARG  36   7.260  10.680   4.781
  249    HG2  ARG  36           1HG      ARG  36   6.331   8.755   3.407
  250    HG3  ARG  36           2HG      ARG  36   5.168   8.533   4.715
  251    HD2  ARG  36           1HD      ARG  36   5.522  10.900   2.901
  252    HD3  ARG  36           2HD      ARG  36   4.085   9.908   3.144
  253    HE   ARG  36           HE       ARG  36   4.952  11.289   5.511
  254   HH11  ARG  36          1HH1      ARG  36   3.053  11.506   2.602
  255   HH12  ARG  36          2HH1      ARG  36   2.008  12.741   3.220
  256   HH21  ARG  36          1HH2      ARG  36   3.582  12.915   6.337
  257   HH22  ARG  36          2HH2      ARG  36   2.310  13.542   5.345
  258    H    GLY  37           H        GLY  37   8.173   9.504   7.978
  259    HA2  GLY  37           1HA      GLY  37  10.670  10.989   7.505
  260    HA3  GLY  37           2HA      GLY  37   9.581  11.232   8.863
  261    H    GLU  38           H        GLU  38  12.461   9.863   7.885
  262    HA   GLU  38           HA       GLU  38  12.499   8.075  10.228
  263    HB2  GLU  38           1HB      GLU  38  13.940   7.834   7.587
  264    HB3  GLU  38           2HB      GLU  38  14.353   6.871   8.998
  265    HG2  GLU  38           1HG      GLU  38  12.011   6.027   9.022
  266    HG3  GLU  38           2HG      GLU  38  11.748   6.871   7.497
  267    H    LYS  39           H        LYS  39  14.876   9.698   8.119
  268    HA   LYS  39           HA       LYS  39  16.774  10.027  10.199
  269    HB2  LYS  39           1HB      LYS  39  17.302   9.957   7.751
  270    HB3  LYS  39           2HB      LYS  39  16.600  11.563   7.601
  271    HG2  LYS  39           1HG      LYS  39  18.281  12.391   9.229
  272    HG3  LYS  39           2HG      LYS  39  19.028  10.791   9.204
  273    HD2  LYS  39           1HD      LYS  39  19.782  11.033   7.034
  274    HD3  LYS  39           2HD      LYS  39  18.557  12.238   6.632
  275    HE2  LYS  39           1HE      LYS  39  20.819  12.727   8.561
  276    HE3  LYS  39           2HE      LYS  39  20.897  13.121   6.845
  277    HZ1  LYS  39           3HZ      LYS  39  19.805  14.994   7.224
  278    HZ2  LYS  39           1HZ      LYS  39  19.860  14.679   8.885
  279    HZ3  LYS  39           2HZ      LYS  39  18.530  14.172   7.972
  280    HA   PRO  40           HA       PRO  40  15.193  13.607  12.230
  281    HB2  PRO  40           1HB      PRO  40  17.483  14.423  13.438
  282    HB3  PRO  40           2HB      PRO  40  16.556  13.020  13.984
  283    HG2  PRO  40           1HG      PRO  40  19.014  13.120  12.278
  284    HG3  PRO  40           2HG      PRO  40  18.624  12.022  13.615
  285    HD2  PRO  40           1HD      PRO  40  18.361  11.306  11.017
  286    HD3  PRO  40           2HD      PRO  40  17.294  10.682  12.292
  287    H    SER  41           H        SER  41  14.700  14.964  10.484
  288    HA   SER  41           HA       SER  41  16.423  16.270   8.782
  289    HB2  SER  41           1HB      SER  41  14.654  17.800   8.320
  290    HB3  SER  41           2HB      SER  41  13.882  16.267   8.725
  291    HG   SER  41           HG       SER  41  13.797  17.198  10.945
  292    H    GLY  42           H        GLY  42  17.926  17.795   8.997
  293    HA2  GLY  42           1HA      GLY  42  18.932  19.740   9.802
  294    HA3  GLY  42           2HA      GLY  42  17.714  19.818  11.066
  295    HA   PRO  43           HA       PRO  43  21.897  17.912  12.469
  296    HB2  PRO  43           1HB      PRO  43  23.177  20.132  13.365
  297    HB3  PRO  43           2HB      PRO  43  23.363  19.515  11.719
  298    HG2  PRO  43           1HG      PRO  43  21.639  21.748  12.722
  299    HG3  PRO  43           2HG      PRO  43  22.644  21.678  11.262
  300    HD2  PRO  43           1HD      PRO  43  19.963  21.298  11.206
  301    HD3  PRO  43           2HD      PRO  43  21.068  20.479  10.083
  302    H    SER  44           H        SER  44  22.734  18.002  14.735
  303    HA   SER  44           HA       SER  44  22.074  17.560  16.909
  304    HB2  SER  44           1HB      SER  44  21.820  19.676  18.175
  305    HB3  SER  44           2HB      SER  44  23.159  19.743  17.030
  306    HG   SER  44           HG       SER  44  21.104  21.384  17.204
  307    H    SER  45           H        SER  45  19.961  16.916  15.211
  308    HA   SER  45           HA       SER  45  17.598  17.949  16.628
  309    HB2  SER  45           1HB      SER  45  17.855  18.065  14.033
  310    HB3  SER  45           2HB      SER  45  17.444  16.351  14.090
  311    HG   SER  45           HG       SER  45  15.449  16.860  14.506
  312    H    GLY  46           H        GLY  46  15.743  16.160  16.478
  313    HA2  GLY  46           1HA      GLY  46  16.637  14.042  18.189
  314    HA3  GLY  46           2HA      GLY  46  14.996  14.294  17.614
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1   1.971 -28.931 -13.860
    2    HA2  GLY   1           1HA      GLY   1   1.096 -26.822 -14.497
    3    HA3  GLY   1           2HA      GLY   1   0.080 -27.630 -15.681
    4    H    SER   2           H        SER   2   0.186 -26.199 -12.643
    5    HA   SER   2           HA       SER   2  -2.599 -26.859 -12.180
    6    HB2  SER   2           1HB      SER   2  -2.154 -27.490  -9.790
    7    HB3  SER   2           2HB      SER   2  -1.563 -28.665 -10.965
    8    HG   SER   2           HG       SER   2  -0.069 -26.746  -9.513
    9    H    SER   3           H        SER   3  -3.693 -25.258 -11.142
   10    HA   SER   3           HA       SER   3  -2.425 -22.716 -10.924
   11    HB2  SER   3           1HB      SER   3  -4.677 -21.993 -10.034
   12    HB3  SER   3           2HB      SER   3  -4.718 -22.765 -11.619
   13    HG   SER   3           HG       SER   3  -5.229 -24.081  -9.155
   14    H    GLY   4           H        GLY   4  -2.780 -21.336  -8.910
   15    HA2  GLY   4           1HA      GLY   4  -2.949 -22.550  -6.358
   16    HA3  GLY   4           2HA      GLY   4  -1.261 -22.346  -6.803
   17    H    SER   5           H        SER   5  -4.178 -20.337  -7.212
   18    HA   SER   5           HA       SER   5  -2.780 -18.189  -5.762
   19    HB2  SER   5           1HB      SER   5  -3.680 -16.548  -7.320
   20    HB3  SER   5           2HB      SER   5  -2.764 -17.763  -8.210
   21    HG   SER   5           HG       SER   5  -5.417 -17.135  -8.343
   22    H    SER   6           H        SER   6  -4.172 -16.621  -4.741
   23    HA   SER   6           HA       SER   6  -6.732 -17.813  -3.929
   24    HB2  SER   6           1HB      SER   6  -6.538 -16.633  -1.870
   25    HB3  SER   6           2HB      SER   6  -4.939 -17.303  -2.194
   26    HG   SER   6           HG       SER   6  -4.505 -15.242  -1.721
   27    H    GLY   7           H        GLY   7  -8.582 -16.445  -3.650
   28    HA2  GLY   7           1HA      GLY   7  -8.605 -14.247  -5.600
   29    HA3  GLY   7           2HA      GLY   7 -10.016 -15.126  -5.028
   30    H    THR   8           H        THR   8 -10.979 -14.551  -3.078
   31    HA   THR   8           HA       THR   8 -10.211 -11.886  -2.110
   32    HB   THR   8           HB       THR   8 -12.508 -11.815  -1.129
   33    HG1  THR   8           HG1      THR   8 -13.860 -13.550  -2.374
   34   HG21  THR   8          3HG2      THR   8 -11.800 -11.072  -3.530
   35   HG22  THR   8          1HG2      THR   8 -13.509 -11.125  -3.098
   36   HG23  THR   8          2HG2      THR   8 -12.796 -12.434  -4.041
   37    H    GLY   9           H        GLY   9  -8.543 -12.633  -0.714
   38    HA2  GLY   9           1HA      GLY   9  -9.439 -14.267   1.564
   39    HA3  GLY   9           2HA      GLY   9  -7.766 -14.014   1.090
   40    H    GLU  10           H        GLU  10  -7.475 -11.362   0.918
   41    HA   GLU  10           HA       GLU  10  -7.848 -10.526   3.691
   42    HB2  GLU  10           1HB      GLU  10  -6.124  -8.911   3.296
   43    HB3  GLU  10           2HB      GLU  10  -5.589 -10.443   2.619
   44    HG2  GLU  10           1HG      GLU  10  -6.327  -9.647   0.386
   45    HG3  GLU  10           2HG      GLU  10  -6.682  -8.081   1.112
   46    H    ARG  11           H        ARG  11  -9.355  -9.113   4.264
   47    HA   ARG  11           HA       ARG  11 -10.562  -7.429   2.168
   48    HB2  ARG  11           1HB      ARG  11 -11.749  -8.776   4.577
   49    HB3  ARG  11           2HB      ARG  11 -12.529  -7.376   3.855
   50    HG2  ARG  11           1HG      ARG  11 -12.472  -8.655   1.666
   51    HG3  ARG  11           2HG      ARG  11 -12.038 -10.069   2.628
   52    HD2  ARG  11           1HD      ARG  11 -14.393 -10.128   2.338
   53    HD3  ARG  11           2HD      ARG  11 -14.094  -9.636   4.004
   54    HE   ARG  11           HE       ARG  11 -14.975  -7.556   3.528
   55   HH11  ARG  11          1HH1      ARG  11 -14.577  -9.393   0.597
   56   HH12  ARG  11          2HH1      ARG  11 -15.501  -8.293  -0.371
   57   HH21  ARG  11          1HH2      ARG  11 -16.193  -6.101   2.263
   58   HH22  ARG  11          2HH2      ARG  11 -16.419  -6.420   0.577
   59    H    HIS  12           H        HIS  12  -8.242  -6.585   3.452
   60    HA   HIS  12           HA       HIS  12  -9.133  -4.088   4.543
   61    HB2  HIS  12           1HB      HIS  12  -7.824  -4.336   6.678
   62    HB3  HIS  12           2HB      HIS  12  -9.287  -5.313   6.595
   63    HD1  HIS  12           HD1      HIS  12  -9.022  -7.763   6.987
   64    HD2  HIS  12           HD2      HIS  12  -5.397  -5.887   6.213
   65    HE1  HIS  12           HE1      HIS  12  -7.261  -9.513   7.387
   66    H    TYR  13           H        TYR  13  -7.361  -2.579   4.883
   67    HA   TYR  13           HA       TYR  13  -5.227  -3.057   2.981
   68    HB2  TYR  13           1HB      TYR  13  -5.895  -0.598   4.612
   69    HB3  TYR  13           2HB      TYR  13  -4.685  -0.677   3.336
   70    HD1  TYR  13           HD2      TYR  13  -8.270  -0.606   4.082
   71    HD2  TYR  13           HD1      TYR  13  -5.340  -0.761   1.001
   72    HE1  TYR  13           HE2      TYR  13  -9.993  -0.035   2.423
   73    HE2  TYR  13           HE1      TYR  13  -7.055  -0.190  -0.667
   74    HH   TYR  13           HH       TYR  13  -9.732   1.192  -0.153
   75    H    GLU  14           H        GLU  14  -3.060  -3.155   3.430
   76    HA   GLU  14           HA       GLU  14  -2.297  -3.193   6.274
   77    HB2  GLU  14           1HB      GLU  14  -1.807  -5.205   4.132
   78    HB3  GLU  14           2HB      GLU  14  -0.533  -4.938   5.313
   79    HG2  GLU  14           1HG      GLU  14  -2.009  -5.517   7.117
   80    HG3  GLU  14           2HG      GLU  14  -3.375  -5.636   6.009
   81    H    CYS  15           H        CYS  15  -0.256  -2.416   6.793
   82    HA   CYS  15           HA       CYS  15   0.820  -0.497   4.937
   83    HB2  CYS  15           1HB      CYS  15   0.629  -0.046   7.376
   84    HB3  CYS  15           2HB      CYS  15   1.840  -1.289   7.673
   85    H    SER  16           H        SER  16   2.199  -1.041   3.393
   86    HA   SER  16           HA       SER  16   3.771  -3.462   3.577
   87    HB2  SER  16           1HB      SER  16   3.122  -1.486   1.446
   88    HB3  SER  16           2HB      SER  16   4.623  -2.396   1.276
   89    HG   SER  16           HG       SER  16   3.028  -4.244   1.857
   90    H    GLU  17           H        GLU  17   4.490  -1.646   5.555
   91    HA   GLU  17           HA       GLU  17   7.227  -0.975   4.714
   92    HB2  GLU  17           1HB      GLU  17   5.387   0.711   6.417
   93    HB3  GLU  17           2HB      GLU  17   7.113   1.002   6.253
   94    HG2  GLU  17           1HG      GLU  17   5.485   0.823   3.779
   95    HG3  GLU  17           2HG      GLU  17   5.337   2.269   4.776
   96    H    CYS  18           H        CYS  18   5.091  -1.431   7.525
   97    HA   CYS  18           HA       CYS  18   7.367  -2.655   8.942
   98    HB2  CYS  18           1HB      CYS  18   6.129  -2.055  11.039
   99    HB3  CYS  18           2HB      CYS  18   6.681  -0.669  10.103
  100    H    GLY  19           H        GLY  19   3.852  -2.821   8.460
  101    HA2  GLY  19           1HA      GLY  19   3.105  -5.150   7.854
  102    HA3  GLY  19           2HA      GLY  19   3.968  -5.651   9.300
  103    H    LYS  20           H        LYS  20   1.739  -2.952   8.643
  104    HA   LYS  20           HA       LYS  20   0.191  -3.784  10.998
  105    HB2  LYS  20           1HB      LYS  20   0.408  -1.126   9.581
  106    HB3  LYS  20           2HB      LYS  20  -0.752  -1.448  10.863
  107    HG2  LYS  20           1HG      LYS  20   2.087  -2.045  11.441
  108    HG3  LYS  20           2HG      LYS  20   1.626  -0.346  11.311
  109    HD2  LYS  20           1HD      LYS  20   1.191  -0.652  13.523
  110    HD3  LYS  20           2HD      LYS  20  -0.363  -1.182  12.874
  111    HE2  LYS  20           1HE      LYS  20   0.467  -2.753  14.542
  112    HE3  LYS  20           2HE      LYS  20   0.398  -3.504  12.948
  113    HZ1  LYS  20           3HZ      LYS  20   2.650  -3.070  14.650
  114    HZ2  LYS  20           1HZ      LYS  20   2.914  -2.453  13.097
  115    HZ3  LYS  20           2HZ      LYS  20   2.500  -4.080  13.302
  116    H    ALA  21           H        ALA  21  -2.211  -3.110  10.812
  117    HA   ALA  21           HA       ALA  21  -3.288  -3.506   8.129
  118    HB1  ALA  21           3HB      ALA  21  -4.923  -5.184   9.485
  119    HB2  ALA  21           1HB      ALA  21  -3.531  -5.703   8.534
  120    HB3  ALA  21           2HB      ALA  21  -3.382  -5.504  10.281
  121    H    PHE  22           H        PHE  22  -4.933  -2.167   7.791
  122    HA   PHE  22           HA       PHE  22  -6.451  -1.194  10.121
  123    HB2  PHE  22           1HB      PHE  22  -5.724   0.395   7.651
  124    HB3  PHE  22           2HB      PHE  22  -6.642   0.985   9.032
  125    HD1  PHE  22           HD2      PHE  22  -3.321  -0.146   7.907
  126    HD2  PHE  22           HD1      PHE  22  -5.562   1.731  11.001
  127    HE1  PHE  22           HE2      PHE  22  -1.228   0.561   8.990
  128    HE2  PHE  22           HE1      PHE  22  -3.473   2.442  12.088
  129    HZ   PHE  22           HZ       PHE  22  -1.302   1.856  11.084
  130    H    ILE  23           H        ILE  23  -8.626  -0.333   9.539
  131    HA   ILE  23           HA       ILE  23  -9.982  -2.247   7.862
  132    HB   ILE  23           HB       ILE  23 -10.972  -1.553   9.996
  133   HG12  ILE  23          1HG1      ILE  23 -12.785  -0.498   7.847
  134   HG13  ILE  23          2HG1      ILE  23 -12.316  -2.195   7.861
  135   HG21  ILE  23          1HG2      ILE  23 -11.690   0.616  10.472
  136   HG22  ILE  23          2HG2      ILE  23 -10.112   0.847   9.720
  137   HG23  ILE  23          3HG2      ILE  23 -11.583   1.121   8.786
  138   HD11  ILE  23          3HD1      ILE  23 -14.470  -1.826   8.943
  139   HD12  ILE  23          1HD1      ILE  23 -13.273  -2.460  10.072
  140   HD13  ILE  23          2HD1      ILE  23 -13.700  -0.748  10.107
  141    H    GLN  24           H        GLN  24  -9.442   1.257   7.848
  142    HA   GLN  24           HA       GLN  24 -10.463   1.335   5.087
  143    HB2  GLN  24           1HB      GLN  24 -10.447   3.371   7.290
  144    HB3  GLN  24           2HB      GLN  24 -10.532   3.886   5.611
  145    HG2  GLN  24           1HG      GLN  24 -12.467   1.992   6.925
  146    HG3  GLN  24           2HG      GLN  24 -12.735   3.720   6.702
  147   HE21  GLN  24          1HE2      GLN  24 -14.196   1.381   5.671
  148   HE22  GLN  24          2HE2      GLN  24 -14.223   1.572   3.954
  149    H    LYS  25           H        LYS  25  -9.266   2.336   3.485
  150    HA   LYS  25           HA       LYS  25  -6.482   2.130   3.631
  151    HB2  LYS  25           1HB      LYS  25  -7.826   2.088   1.533
  152    HB3  LYS  25           2HB      LYS  25  -8.082   3.820   1.701
  153    HG2  LYS  25           1HG      LYS  25  -5.907   4.334   1.165
  154    HG3  LYS  25           2HG      LYS  25  -5.299   2.754   1.665
  155    HD2  LYS  25           1HD      LYS  25  -6.276   1.714  -0.282
  156    HD3  LYS  25           2HD      LYS  25  -7.043   3.234  -0.751
  157    HE2  LYS  25           1HE      LYS  25  -4.977   4.229  -1.286
  158    HE3  LYS  25           2HE      LYS  25  -4.064   2.975  -0.449
  159    HZ1  LYS  25           3HZ      LYS  25  -5.514   2.757  -3.022
  160    HZ2  LYS  25           1HZ      LYS  25  -4.994   1.399  -2.157
  161    HZ3  LYS  25           2HZ      LYS  25  -3.864   2.520  -2.730
  162    H    SER  26           H        SER  26  -8.573   4.997   3.802
  163    HA   SER  26           HA       SER  26  -6.652   6.974   3.927
  164    HB2  SER  26           1HB      SER  26  -9.284   7.079   3.983
  165    HB3  SER  26           2HB      SER  26  -9.038   7.162   5.728
  166    HG   SER  26           HG       SER  26  -7.815   8.889   3.835
  167    H    THR  27           H        THR  27  -8.027   5.105   6.619
  168    HA   THR  27           HA       THR  27  -6.681   6.317   8.720
  169    HB   THR  27           HB       THR  27  -7.508   3.425   8.417
  170    HG1  THR  27           HG1      THR  27  -9.318   4.111   9.571
  171   HG21  THR  27          3HG2      THR  27  -5.727   3.771  10.138
  172   HG22  THR  27          1HG2      THR  27  -7.257   3.189  10.792
  173   HG23  THR  27          2HG2      THR  27  -6.813   4.888  10.964
  174    H    LEU  28           H        LEU  28  -5.624   3.682   6.604
  175    HA   LEU  28           HA       LEU  28  -3.221   3.097   7.947
  176    HB2  LEU  28           1HB      LEU  28  -3.754   1.447   6.471
  177    HB3  LEU  28           2HB      LEU  28  -4.347   2.576   5.255
  178    HG   LEU  28           HG       LEU  28  -1.968   3.150   4.742
  179   HD11  LEU  28          1HD1      LEU  28  -0.871   2.524   6.762
  180   HD12  LEU  28          2HD1      LEU  28  -0.270   1.471   5.481
  181   HD13  LEU  28          3HD1      LEU  28  -1.457   0.865   6.635
  182   HD21  LEU  28          3HD2      LEU  28  -3.472   0.835   4.050
  183   HD22  LEU  28          1HD2      LEU  28  -1.766   0.394   4.124
  184   HD23  LEU  28          2HD2      LEU  28  -2.290   1.716   3.081
  185    H    SER  29           H        SER  29  -3.934   5.281   5.244
  186    HA   SER  29           HA       SER  29  -1.369   6.099   4.615
  187    HB2  SER  29           1HB      SER  29  -3.535   6.713   3.433
  188    HB3  SER  29           2HB      SER  29  -3.747   7.962   4.660
  189    HG   SER  29           HG       SER  29  -1.273   7.899   3.424
  190    H    MET  30           H        MET  30  -3.501   7.233   7.189
  191    HA   MET  30           HA       MET  30  -1.929   9.410   8.035
  192    HB2  MET  30           1HB      MET  30  -3.722   7.718   9.779
  193    HB3  MET  30           2HB      MET  30  -3.253   9.393  10.042
  194    HG2  MET  30           1HG      MET  30  -4.872   8.465   7.686
  195    HG3  MET  30           2HG      MET  30  -5.574   9.055   9.191
  196    HE1  MET  30           3HE      MET  30  -6.499  10.842   9.331
  197    HE2  MET  30           1HE      MET  30  -5.597  12.355   9.430
  198    HE3  MET  30           2HE      MET  30  -6.615  12.026   8.029
  199    H    HIS  31           H        HIS  31  -1.631   5.998   8.523
  200    HA   HIS  31           HA       HIS  31   0.238   6.294  10.730
  201    HB2  HIS  31           1HB      HIS  31  -0.999   4.383  11.093
  202    HB3  HIS  31           2HB      HIS  31  -1.112   4.002   9.377
  203    HD1  HIS  31           HD1      HIS  31   0.926   3.372  12.398
  204    HD2  HIS  31           HD2      HIS  31   1.158   2.646   8.314
  205    HE1  HIS  31           HE1      HIS  31   2.754   1.667  12.121
  206    H    GLN  32           H        GLN  32   0.277   5.072   7.390
  207    HA   GLN  32           HA       GLN  32   2.872   4.293   7.120
  208    HB2  GLN  32           1HB      GLN  32   0.911   5.540   5.264
  209    HB3  GLN  32           2HB      GLN  32   2.585   5.456   4.731
  210    HG2  GLN  32           1HG      GLN  32   2.476   2.983   5.324
  211    HG3  GLN  32           2HG      GLN  32   0.730   3.204   5.414
  212   HE21  GLN  32          1HE2      GLN  32  -0.421   3.686   3.534
  213   HE22  GLN  32          2HE2      GLN  32   0.241   3.409   1.963
  214    H    ARG  33           H        ARG  33   1.724   7.480   7.698
  215    HA   ARG  33           HA       ARG  33   3.721   9.072   6.628
  216    HB2  ARG  33           1HB      ARG  33   3.033  10.762   8.127
  217    HB3  ARG  33           2HB      ARG  33   1.595   9.796   7.824
  218    HG2  ARG  33           1HG      ARG  33   1.853   8.670   9.942
  219    HG3  ARG  33           2HG      ARG  33   3.373   9.516  10.237
  220    HD2  ARG  33           1HD      ARG  33   0.688  10.849   9.903
  221    HD3  ARG  33           2HD      ARG  33   1.452  10.497  11.453
  222    HE   ARG  33           HE       ARG  33   3.339  11.946  10.219
  223   HH11  ARG  33          1HH1      ARG  33  -0.079  12.458  10.639
  224   HH12  ARG  33          2HH1      ARG  33   0.047  14.186  10.639
  225   HH21  ARG  33          1HH2      ARG  33   3.518  14.220  10.218
  226   HH22  ARG  33          2HH2      ARG  33   2.094  15.187  10.399
  227    H    ILE  34           H        ILE  34   3.662   7.362   9.731
  228    HA   ILE  34           HA       ILE  34   5.945   8.312  10.915
  229    HB   ILE  34           HB       ILE  34   6.100   6.272  12.147
  230   HG12  ILE  34          1HG1      ILE  34   4.217   4.961  10.186
  231   HG13  ILE  34          2HG1      ILE  34   5.967   4.818  10.061
  232   HG21  ILE  34          1HG2      ILE  34   4.126   7.720  12.548
  233   HG22  ILE  34          2HG2      ILE  34   3.194   6.686  11.467
  234   HG23  ILE  34          3HG2      ILE  34   3.852   6.028  12.965
  235   HD11  ILE  34          3HD1      ILE  34   4.988   4.185  12.717
  236   HD12  ILE  34          1HD1      ILE  34   4.290   3.156  11.465
  237   HD13  ILE  34          2HD1      ILE  34   6.042   3.264  11.644
  238    H    HIS  35           H        HIS  35   5.677   6.309   8.105
  239    HA   HIS  35           HA       HIS  35   8.475   5.532   8.156
  240    HB2  HIS  35           1HB      HIS  35   6.363   5.080   6.036
  241    HB3  HIS  35           2HB      HIS  35   7.966   4.351   6.064
  242    HD1  HIS  35           HD1      HIS  35   8.277   3.150   8.711
  243    HD2  HIS  35           HD2      HIS  35   4.585   3.213   6.808
  244    HE1  HIS  35           HE1      HIS  35   6.941   1.304   9.775
  245    H    ARG  36           H        ARG  36   6.343   7.665   6.308
  246    HA   ARG  36           HA       ARG  36   8.719   8.814   5.003
  247    HB2  ARG  36           1HB      ARG  36   7.157   9.679   3.294
  248    HB3  ARG  36           2HB      ARG  36   7.125   7.924   3.407
  249    HG2  ARG  36           1HG      ARG  36   4.895   8.327   3.319
  250    HG3  ARG  36           2HG      ARG  36   5.127   8.432   5.065
  251    HD2  ARG  36           1HD      ARG  36   4.931  10.725   5.090
  252    HD3  ARG  36           2HD      ARG  36   5.440  10.891   3.410
  253    HE   ARG  36           HE       ARG  36   2.898   9.569   3.803
  254   HH11  ARG  36          1HH1      ARG  36   4.562  12.574   3.236
  255   HH12  ARG  36          2HH1      ARG  36   3.174  13.368   2.570
  256   HH21  ARG  36          1HH2      ARG  36   1.063  10.604   2.928
  257   HH22  ARG  36          2HH2      ARG  36   1.184  12.247   2.396
  258    H    GLY  37           H        GLY  37   7.925   9.480   7.683
  259    HA2  GLY  37           1HA      GLY  37   6.582  12.041   7.563
  260    HA3  GLY  37           2HA      GLY  37   7.243  11.273   8.999
  261    H    GLU  38           H        GLU  38   8.588  12.707   9.884
  262    HA   GLU  38           HA       GLU  38  10.346  14.281   8.155
  263    HB2  GLU  38           1HB      GLU  38   9.015  15.433   9.909
  264    HB3  GLU  38           2HB      GLU  38   9.883  14.515  11.132
  265    HG2  GLU  38           1HG      GLU  38  10.716  16.827  10.808
  266    HG3  GLU  38           2HG      GLU  38  11.940  15.580  10.582
  267    H    LYS  39           H        LYS  39  12.087  13.098   7.603
  268    HA   LYS  39           HA       LYS  39  13.525  11.659   9.728
  269    HB2  LYS  39           1HB      LYS  39  13.434  11.316   6.740
  270    HB3  LYS  39           2HB      LYS  39  14.732  10.620   7.701
  271    HG2  LYS  39           1HG      LYS  39  11.858  10.082   8.351
  272    HG3  LYS  39           2HG      LYS  39  12.721   9.146   7.128
  273    HD2  LYS  39           1HD      LYS  39  14.353   8.438   8.752
  274    HD3  LYS  39           2HD      LYS  39  13.648   9.494   9.978
  275    HE2  LYS  39           1HE      LYS  39  12.275   7.147   8.670
  276    HE3  LYS  39           2HE      LYS  39  12.978   7.155  10.287
  277    HZ1  LYS  39           3HZ      LYS  39  11.259   9.322  10.161
  278    HZ2  LYS  39           1HZ      LYS  39  11.041   7.887  11.031
  279    HZ3  LYS  39           2HZ      LYS  39  10.422   8.029   9.463
  280    HA   PRO  40           HA       PRO  40  16.770  14.632   9.620
  281    HB2  PRO  40           1HB      PRO  40  18.795  13.094  10.572
  282    HB3  PRO  40           2HB      PRO  40  17.487  13.699  11.594
  283    HG2  PRO  40           1HG      PRO  40  17.822  10.998  10.348
  284    HG3  PRO  40           2HG      PRO  40  17.284  11.416  11.985
  285    HD2  PRO  40           1HD      PRO  40  15.558  10.736  10.013
  286    HD3  PRO  40           2HD      PRO  40  15.138  11.892  11.294
  287    H    SER  41           H        SER  41  19.083  14.845   8.833
  288    HA   SER  41           HA       SER  41  19.355  14.638   6.176
  289    HB2  SER  41           1HB      SER  41  21.851  14.517   6.524
  290    HB3  SER  41           2HB      SER  41  21.039  15.780   7.448
  291    HG   SER  41           HG       SER  41  22.491  14.638   8.761
  292    H    GLY  42           H        GLY  42  19.617  13.122   4.654
  293    HA2  GLY  42           1HA      GLY  42  20.788  10.547   5.287
  294    HA3  GLY  42           2HA      GLY  42  19.074  10.497   4.901
  295    HA   PRO  43           HA       PRO  43  21.514  11.942   0.947
  296    HB2  PRO  43           1HB      PRO  43  24.144  11.269   0.936
  297    HB3  PRO  43           2HB      PRO  43  23.553  12.825   1.531
  298    HG2  PRO  43           1HG      PRO  43  24.320  10.376   3.072
  299    HG3  PRO  43           2HG      PRO  43  24.690  12.076   3.416
  300    HD2  PRO  43           1HD      PRO  43  22.706  10.733   4.678
  301    HD3  PRO  43           2HD      PRO  43  22.614  12.472   4.336
  302    H    SER  44           H        SER  44  21.248   9.092   2.572
  303    HA   SER  44           HA       SER  44  20.856   6.959   1.853
  304    HB2  SER  44           1HB      SER  44  21.582   7.814  -0.947
  305    HB3  SER  44           2HB      SER  44  20.538   6.483  -0.450
  306    HG   SER  44           HG       SER  44  19.950   9.201   0.093
  307    H    SER  45           H        SER  45  23.272   7.570   2.963
  308    HA   SER  45           HA       SER  45  25.624   7.109   1.709
  309    HB2  SER  45           1HB      SER  45  25.206   7.437   4.207
  310    HB3  SER  45           2HB      SER  45  24.957   5.693   4.291
  311    HG   SER  45           HG       SER  45  27.165   5.922   2.996
  312    H    GLY  46           H        GLY  46  26.698   5.460   0.758
  313    HA2  GLY  46           1HA      GLY  46  25.177   2.998   0.306
  314    HA3  GLY  46           2HA      GLY  46  26.553   3.551  -0.636
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1   3.520 -25.664 -16.471
    2    HA2  GLY   1           1HA      GLY   1   6.209 -24.712 -16.205
    3    HA3  GLY   1           2HA      GLY   1   5.408 -24.037 -17.615
    4    H    SER   2           H        SER   2   5.697 -21.966 -16.573
    5    HA   SER   2           HA       SER   2   4.706 -21.232 -14.093
    6    HB2  SER   2           1HB      SER   2   6.103 -19.785 -15.562
    7    HB3  SER   2           2HB      SER   2   4.695 -19.521 -16.591
    8    HG   SER   2           HG       SER   2   5.195 -18.615 -13.981
    9    H    SER   3           H        SER   3   2.799 -19.774 -13.696
   10    HA   SER   3           HA       SER   3   0.438 -20.861 -15.083
   11    HB2  SER   3           1HB      SER   3   0.762 -19.894 -12.236
   12    HB3  SER   3           2HB      SER   3  -0.794 -20.290 -12.964
   13    HG   SER   3           HG       SER   3  -0.234 -22.170 -12.094
   14    H    GLY   4           H        GLY   4   1.743 -17.944 -13.531
   15    HA2  GLY   4           1HA      GLY   4   1.468 -15.963 -15.139
   16    HA3  GLY   4           2HA      GLY   4  -0.242 -16.347 -15.012
   17    H    SER   5           H        SER   5  -1.264 -14.970 -13.737
   18    HA   SER   5           HA       SER   5  -0.098 -13.152 -12.009
   19    HB2  SER   5           1HB      SER   5  -2.332 -12.741 -12.697
   20    HB3  SER   5           2HB      SER   5  -2.887 -14.303 -12.095
   21    HG   SER   5           HG       SER   5  -3.350 -13.263 -10.338
   22    H    SER   6           H        SER   6   0.132 -13.030  -9.765
   23    HA   SER   6           HA       SER   6  -0.108 -15.564  -8.293
   24    HB2  SER   6           1HB      SER   6   2.248 -15.261  -8.982
   25    HB3  SER   6           2HB      SER   6   2.274 -13.697  -8.168
   26    HG   SER   6           HG       SER   6   2.887 -15.953  -7.097
   27    H    GLY   7           H        GLY   7  -1.725 -15.080  -6.923
   28    HA2  GLY   7           1HA      GLY   7  -1.507 -13.787  -4.594
   29    HA3  GLY   7           2HA      GLY   7  -1.875 -12.455  -5.681
   30    H    THR   8           H        THR   8  -3.458 -13.384  -3.462
   31    HA   THR   8           HA       THR   8  -5.749 -14.706  -4.686
   32    HB   THR   8           HB       THR   8  -6.719 -14.716  -2.431
   33    HG1  THR   8           HG1      THR   8  -4.294 -13.469  -1.600
   34   HG21  THR   8          3HG2      THR   8  -3.877 -15.688  -2.669
   35   HG22  THR   8          1HG2      THR   8  -5.361 -16.602  -2.937
   36   HG23  THR   8          2HG2      THR   8  -4.922 -16.090  -1.307
   37    H    GLY   9           H        GLY   9  -5.118 -11.698  -2.868
   38    HA2  GLY   9           1HA      GLY   9  -6.059  -9.696  -4.157
   39    HA3  GLY   9           2HA      GLY   9  -7.575 -10.578  -4.050
   40    H    GLU  10           H        GLU  10  -5.061  -8.987  -2.155
   41    HA   GLU  10           HA       GLU  10  -6.122  -9.193   0.382
   42    HB2  GLU  10           1HB      GLU  10  -4.936  -7.102   0.901
   43    HB3  GLU  10           2HB      GLU  10  -3.941  -8.200  -0.045
   44    HG2  GLU  10           1HG      GLU  10  -4.065  -6.891  -1.945
   45    HG3  GLU  10           2HG      GLU  10  -5.525  -6.065  -1.403
   46    H    ARG  11           H        ARG  11  -7.710  -8.208   1.527
   47    HA   ARG  11           HA       ARG  11  -9.556  -6.511   0.001
   48    HB2  ARG  11           1HB      ARG  11  -9.896  -8.388   2.310
   49    HB3  ARG  11           2HB      ARG  11 -11.061  -7.093   2.067
   50    HG2  ARG  11           1HG      ARG  11 -11.298  -7.971  -0.310
   51    HG3  ARG  11           2HG      ARG  11 -10.432  -9.400   0.258
   52    HD2  ARG  11           1HD      ARG  11 -12.980  -8.318   1.456
   53    HD3  ARG  11           2HD      ARG  11 -12.884  -9.672   0.332
   54    HE   ARG  11           HE       ARG  11 -11.282  -9.965   2.715
   55   HH11  ARG  11          1HH1      ARG  11 -14.376 -10.517   1.217
   56   HH12  ARG  11          2HH1      ARG  11 -14.810 -11.808   2.287
   57   HH21  ARG  11          1HH2      ARG  11 -11.842 -11.664   4.130
   58   HH22  ARG  11          2HH2      ARG  11 -13.368 -12.460   3.944
   59    H    HIS  12           H        HIS  12  -8.050  -6.779   3.211
   60    HA   HIS  12           HA       HIS  12  -8.861  -4.089   3.911
   61    HB2  HIS  12           1HB      HIS  12  -7.445  -4.607   5.989
   62    HB3  HIS  12           2HB      HIS  12  -8.902  -5.565   5.744
   63    HD1  HIS  12           HD1      HIS  12  -8.468  -7.902   6.384
   64    HD2  HIS  12           HD2      HIS  12  -5.163  -6.176   4.551
   65    HE1  HIS  12           HE1      HIS  12  -6.730  -9.718   6.283
   66    H    TYR  13           H        TYR  13  -7.326  -2.446   4.570
   67    HA   TYR  13           HA       TYR  13  -4.990  -2.428   2.809
   68    HB2  TYR  13           1HB      TYR  13  -6.282  -0.171   4.354
   69    HB3  TYR  13           2HB      TYR  13  -4.951  -0.003   3.215
   70    HD1  TYR  13           HD1      TYR  13  -5.339  -0.387   0.796
   71    HD2  TYR  13           HD2      TYR  13  -8.539  -0.372   3.601
   72    HE1  TYR  13           HE1      TYR  13  -6.945  -0.105  -1.046
   73    HE2  TYR  13           HE2      TYR  13 -10.153  -0.091   1.767
   74    HH   TYR  13           HH       TYR  13  -9.797   1.002  -0.845
   75    H    GLU  14           H        GLU  14  -3.373  -3.487   3.848
   76    HA   GLU  14           HA       GLU  14  -2.687  -2.591   6.566
   77    HB2  GLU  14           1HB      GLU  14  -1.300  -4.724   6.604
   78    HB3  GLU  14           2HB      GLU  14  -3.046  -4.922   6.624
   79    HG2  GLU  14           1HG      GLU  14  -2.989  -5.347   4.193
   80    HG3  GLU  14           2HG      GLU  14  -1.230  -5.252   4.249
   81    H    CYS  15           H        CYS  15  -0.684  -1.793   7.012
   82    HA   CYS  15           HA       CYS  15   0.775  -0.523   5.015
   83    HB2  CYS  15           1HB      CYS  15   0.776  -0.158   7.583
   84    HB3  CYS  15           2HB      CYS  15   2.046  -1.377   7.602
   85    H    SER  16           H        SER  16   2.990  -0.890   4.319
   86    HA   SER  16           HA       SER  16   3.577  -3.764   4.045
   87    HB2  SER  16           1HB      SER  16   3.753  -1.478   2.143
   88    HB3  SER  16           2HB      SER  16   4.977  -2.741   2.012
   89    HG   SER  16           HG       SER  16   2.413  -3.687   2.279
   90    H    GLU  17           H        GLU  17   4.757  -0.706   5.091
   91    HA   GLU  17           HA       GLU  17   7.537  -1.300   5.039
   92    HB2  GLU  17           1HB      GLU  17   5.894   0.740   6.527
   93    HB3  GLU  17           2HB      GLU  17   7.634   0.610   6.738
   94    HG2  GLU  17           1HG      GLU  17   7.111   2.347   5.150
   95    HG3  GLU  17           2HG      GLU  17   7.950   1.022   4.346
   96    H    CYS  18           H        CYS  18   5.311  -1.023   7.816
   97    HA   CYS  18           HA       CYS  18   7.136  -2.601   9.440
   98    HB2  CYS  18           1HB      CYS  18   5.516  -2.095  11.273
   99    HB3  CYS  18           2HB      CYS  18   6.180  -0.660  10.499
  100    H    GLY  19           H        GLY  19   3.763  -2.769   8.322
  101    HA2  GLY  19           1HA      GLY  19   3.101  -5.014   7.461
  102    HA3  GLY  19           2HA      GLY  19   3.827  -5.662   8.925
  103    H    LYS  20           H        LYS  20   2.247  -2.725   9.461
  104    HA   LYS  20           HA       LYS  20   0.313  -3.905  11.162
  105    HB2  LYS  20           1HB      LYS  20   0.917  -1.140  10.216
  106    HB3  LYS  20           2HB      LYS  20  -0.648  -1.439  10.961
  107    HG2  LYS  20           1HG      LYS  20   0.877  -2.593  12.801
  108    HG3  LYS  20           2HG      LYS  20   2.060  -1.452  12.157
  109    HD2  LYS  20           1HD      LYS  20   1.100  -0.144  13.767
  110    HD3  LYS  20           2HD      LYS  20   0.038   0.235  12.409
  111    HE2  LYS  20           1HE      LYS  20  -0.652  -2.075  14.155
  112    HE3  LYS  20           2HE      LYS  20  -0.927  -0.447  14.771
  113    HZ1  LYS  20           3HZ      LYS  20  -2.531  -1.903  13.026
  114    HZ2  LYS  20           1HZ      LYS  20  -1.893  -0.615  12.135
  115    HZ3  LYS  20           2HZ      LYS  20  -2.757  -0.313  13.558
  116    H    ALA  21           H        ALA  21  -2.008  -3.742  10.988
  117    HA   ALA  21           HA       ALA  21  -2.971  -3.699   8.203
  118    HB1  ALA  21           3HB      ALA  21  -2.831  -6.000   9.081
  119    HB2  ALA  21           1HB      ALA  21  -3.936  -5.549  10.380
  120    HB3  ALA  21           2HB      ALA  21  -4.484  -5.516   8.703
  121    H    PHE  22           H        PHE  22  -4.927  -2.729   7.814
  122    HA   PHE  22           HA       PHE  22  -6.408  -1.650  10.103
  123    HB2  PHE  22           1HB      PHE  22  -5.712   0.020   7.684
  124    HB3  PHE  22           2HB      PHE  22  -6.521   0.554   9.153
  125    HD1  PHE  22           HD2      PHE  22  -3.305  -0.649   7.789
  126    HD2  PHE  22           HD1      PHE  22  -5.296   1.265  11.028
  127    HE1  PHE  22           HE2      PHE  22  -1.129  -0.028   8.755
  128    HE2  PHE  22           HE1      PHE  22  -3.123   1.890  11.999
  129    HZ   PHE  22           HZ       PHE  22  -1.036   1.242  10.863
  130    H    ILE  23           H        ILE  23  -8.540  -0.680   9.360
  131    HA   ILE  23           HA       ILE  23  -9.779  -2.573   7.524
  132    HB   ILE  23           HB       ILE  23 -10.877  -2.239   9.666
  133   HG12  ILE  23          1HG1      ILE  23 -12.613  -0.881   7.614
  134   HG13  ILE  23          2HG1      ILE  23 -12.166  -2.577   7.459
  135   HG21  ILE  23          1HG2      ILE  23 -11.895  -0.087  10.251
  136   HG22  ILE  23          2HG2      ILE  23 -10.141   0.032  10.123
  137   HG23  ILE  23          3HG2      ILE  23 -11.162   0.642   8.822
  138   HD11  ILE  23          3HD1      ILE  23 -13.214  -3.056   9.600
  139   HD12  ILE  23          1HD1      ILE  23 -13.641  -1.355   9.779
  140   HD13  ILE  23          2HD1      ILE  23 -14.356  -2.313   8.482
  141    H    GLN  24           H        GLN  24  -9.442   0.931   7.947
  142    HA   GLN  24           HA       GLN  24 -10.611   1.361   5.299
  143    HB2  GLN  24           1HB      GLN  24  -9.955   3.229   7.572
  144    HB3  GLN  24           2HB      GLN  24 -10.429   3.807   5.981
  145    HG2  GLN  24           1HG      GLN  24 -12.460   2.175   6.372
  146    HG3  GLN  24           2HG      GLN  24 -12.041   2.442   8.064
  147   HE21  GLN  24          1HE2      GLN  24 -13.655   3.645   5.366
  148   HE22  GLN  24          2HE2      GLN  24 -14.053   5.208   5.986
  149    H    LYS  25           H        LYS  25  -9.544   2.745   3.760
  150    HA   LYS  25           HA       LYS  25  -6.754   2.145   3.525
  151    HB2  LYS  25           1HB      LYS  25  -8.106   2.174   1.530
  152    HB3  LYS  25           2HB      LYS  25  -8.615   3.828   1.842
  153    HG2  LYS  25           1HG      LYS  25  -6.609   4.719   1.166
  154    HG3  LYS  25           2HG      LYS  25  -5.713   3.237   1.507
  155    HD2  LYS  25           1HD      LYS  25  -7.200   2.246  -0.401
  156    HD3  LYS  25           2HD      LYS  25  -7.396   3.939  -0.861
  157    HE2  LYS  25           1HE      LYS  25  -4.922   4.154  -0.904
  158    HE3  LYS  25           2HE      LYS  25  -4.802   2.425  -0.585
  159    HZ1  LYS  25           3HZ      LYS  25  -4.808   2.234  -2.794
  160    HZ2  LYS  25           1HZ      LYS  25  -5.401   3.799  -3.040
  161    HZ3  LYS  25           2HZ      LYS  25  -6.471   2.531  -2.707
  162    H    SER  26           H        SER  26  -8.573   5.207   3.724
  163    HA   SER  26           HA       SER  26  -6.443   6.957   3.834
  164    HB2  SER  26           1HB      SER  26  -9.041   7.220   5.368
  165    HB3  SER  26           2HB      SER  26  -7.956   8.535   4.917
  166    HG   SER  26           HG       SER  26  -9.905   7.987   3.532
  167    H    THR  27           H        THR  27  -7.995   5.215   6.502
  168    HA   THR  27           HA       THR  27  -6.686   6.332   8.656
  169    HB   THR  27           HB       THR  27  -7.473   3.437   8.275
  170    HG1  THR  27           HG1      THR  27  -9.239   4.300   9.713
  171   HG21  THR  27          3HG2      THR  27  -7.571   4.272  10.993
  172   HG22  THR  27          1HG2      THR  27  -5.969   4.647  10.360
  173   HG23  THR  27          2HG2      THR  27  -6.589   2.998  10.271
  174    H    LEU  28           H        LEU  28  -5.574   3.740   6.514
  175    HA   LEU  28           HA       LEU  28  -3.208   3.132   7.916
  176    HB2  LEU  28           1HB      LEU  28  -3.732   1.500   6.409
  177    HB3  LEU  28           2HB      LEU  28  -4.250   2.652   5.179
  178    HG   LEU  28           HG       LEU  28  -1.803   3.196   4.839
  179   HD11  LEU  28          1HD1      LEU  28  -0.982   2.289   6.956
  180   HD12  LEU  28          2HD1      LEU  28  -0.182   1.539   5.576
  181   HD13  LEU  28          3HD1      LEU  28  -1.447   0.668   6.443
  182   HD21  LEU  28          3HD2      LEU  28  -3.295   1.598   3.475
  183   HD22  LEU  28          1HD2      LEU  28  -2.376   0.313   4.259
  184   HD23  LEU  28          2HD2      LEU  28  -1.546   1.507   3.261
  185    H    SER  29           H        SER  29  -3.847   5.334   5.208
  186    HA   SER  29           HA       SER  29  -1.274   6.157   4.642
  187    HB2  SER  29           1HB      SER  29  -3.881   7.680   4.561
  188    HB3  SER  29           2HB      SER  29  -2.366   8.353   3.959
  189    HG   SER  29           HG       SER  29  -3.431   5.876   3.088
  190    H    MET  30           H        MET  30  -3.506   7.482   7.068
  191    HA   MET  30           HA       MET  30  -1.918   9.561   8.006
  192    HB2  MET  30           1HB      MET  30  -3.720   7.870   9.738
  193    HB3  MET  30           2HB      MET  30  -3.283   9.557   9.973
  194    HG2  MET  30           1HG      MET  30  -4.420   9.887   7.655
  195    HG3  MET  30           2HG      MET  30  -5.192   8.348   8.031
  196    HE1  MET  30           3HE      MET  30  -7.456   8.833  10.814
  197    HE2  MET  30           1HE      MET  30  -6.146   7.826  10.196
  198    HE3  MET  30           2HE      MET  30  -5.855   8.918  11.550
  199    H    HIS  31           H        HIS  31  -1.604   6.152   8.455
  200    HA   HIS  31           HA       HIS  31   0.235   6.446  10.694
  201    HB2  HIS  31           1HB      HIS  31  -0.981   4.539  11.084
  202    HB3  HIS  31           2HB      HIS  31  -1.158   4.172   9.371
  203    HD1  HIS  31           HD1      HIS  31   1.030   3.551  12.307
  204    HD2  HIS  31           HD2      HIS  31   0.989   2.718   8.236
  205    HE1  HIS  31           HE1      HIS  31   2.802   1.801  11.961
  206    H    GLN  32           H        GLN  32   0.293   5.128   7.385
  207    HA   GLN  32           HA       GLN  32   2.873   4.346   7.124
  208    HB2  GLN  32           1HB      GLN  32   0.971   5.658   5.239
  209    HB3  GLN  32           2HB      GLN  32   2.643   5.463   4.729
  210    HG2  GLN  32           1HG      GLN  32   2.344   3.004   5.411
  211    HG3  GLN  32           2HG      GLN  32   0.618   3.360   5.376
  212   HE21  GLN  32          1HE2      GLN  32  -0.219   4.291   3.355
  213   HE22  GLN  32          2HE2      GLN  32   0.465   3.757   1.862
  214    H    ARG  33           H        ARG  33   1.758   7.567   7.634
  215    HA   ARG  33           HA       ARG  33   3.774   9.128   6.590
  216    HB2  ARG  33           1HB      ARG  33   3.117  10.819   8.098
  217    HB3  ARG  33           2HB      ARG  33   1.666   9.866   7.816
  218    HG2  ARG  33           1HG      ARG  33   2.114   8.656   9.935
  219    HG3  ARG  33           2HG      ARG  33   3.464   9.754  10.226
  220    HD2  ARG  33           1HD      ARG  33   2.037  11.619  10.422
  221    HD3  ARG  33           2HD      ARG  33   0.672  10.745   9.728
  222    HE   ARG  33           HE       ARG  33   1.701   9.684  12.219
  223   HH11  ARG  33          1HH1      ARG  33  -0.614  11.765  10.661
  224   HH12  ARG  33          2HH1      ARG  33  -1.714  11.762  12.000
  225   HH21  ARG  33          1HH2      ARG  33   0.262   9.671  13.988
  226   HH22  ARG  33          2HH2      ARG  33  -1.214  10.571  13.892
  227    H    ILE  34           H        ILE  34   3.720   7.415   9.694
  228    HA   ILE  34           HA       ILE  34   6.077   8.341  10.797
  229    HB   ILE  34           HB       ILE  34   6.156   6.351  12.127
  230   HG12  ILE  34          1HG1      ILE  34   4.058   5.063  10.395
  231   HG13  ILE  34          2HG1      ILE  34   5.772   4.852  10.057
  232   HG21  ILE  34          1HG2      ILE  34   4.425   7.275  13.176
  233   HG22  ILE  34          2HG2      ILE  34   3.692   7.786  11.657
  234   HG23  ILE  34          3HG2      ILE  34   3.390   6.164  12.281
  235   HD11  ILE  34          3HD1      ILE  34   6.089   3.900  12.283
  236   HD12  ILE  34          1HD1      ILE  34   4.368   4.101  12.609
  237   HD13  ILE  34          2HD1      ILE  34   4.903   2.995  11.344
  238    H    HIS  35           H        HIS  35   5.622   6.262   8.082
  239    HA   HIS  35           HA       HIS  35   8.354   5.277   8.119
  240    HB2  HIS  35           1HB      HIS  35   6.082   4.887   6.164
  241    HB3  HIS  35           2HB      HIS  35   7.680   4.173   5.965
  242    HD1  HIS  35           HD1      HIS  35   8.357   2.871   8.469
  243    HD2  HIS  35           HD2      HIS  35   4.415   3.029   7.166
  244    HE1  HIS  35           HE1      HIS  35   7.179   0.999   9.665
  245    H    ARG  36           H        ARG  36   6.417   7.678   6.461
  246    HA   ARG  36           HA       ARG  36   8.785   8.475   4.902
  247    HB2  ARG  36           1HB      ARG  36   7.150   9.671   3.433
  248    HB3  ARG  36           2HB      ARG  36   6.968   7.922   3.441
  249    HG2  ARG  36           1HG      ARG  36   4.789   8.753   3.534
  250    HG3  ARG  36           2HG      ARG  36   5.158   8.280   5.193
  251    HD2  ARG  36           1HD      ARG  36   5.397  10.487   5.898
  252    HD3  ARG  36           2HD      ARG  36   5.634  11.084   4.256
  253    HE   ARG  36           HE       ARG  36   3.134  10.666   5.603
  254   HH11  ARG  36          1HH1      ARG  36   4.712  10.848   2.505
  255   HH12  ARG  36          2HH1      ARG  36   3.269  11.283   1.649
  256   HH21  ARG  36          1HH2      ARG  36   1.228  11.238   4.488
  257   HH22  ARG  36          2HH2      ARG  36   1.288  11.505   2.778
  258    H    GLY  37           H        GLY  37   8.494   9.192   7.635
  259    HA2  GLY  37           1HA      GLY  37   7.660  12.000   7.581
  260    HA3  GLY  37           2HA      GLY  37   8.039  11.061   9.017
  261    H    GLU  38           H        GLU  38   9.603  12.311   6.071
  262    HA   GLU  38           HA       GLU  38  12.228  12.197   7.096
  263    HB2  GLU  38           1HB      GLU  38  10.978  13.779   4.857
  264    HB3  GLU  38           2HB      GLU  38  12.687  13.905   5.248
  265    HG2  GLU  38           1HG      GLU  38  13.098  11.671   4.662
  266    HG3  GLU  38           2HG      GLU  38  11.381  11.271   4.659
  267    H    LYS  39           H        LYS  39  13.621  14.178   7.379
  268    HA   LYS  39           HA       LYS  39  12.338  15.920   9.325
  269    HB2  LYS  39           1HB      LYS  39  15.215  15.430   8.569
  270    HB3  LYS  39           2HB      LYS  39  14.738  16.705   9.682
  271    HG2  LYS  39           1HG      LYS  39  14.191  15.246  11.344
  272    HG3  LYS  39           2HG      LYS  39  13.769  13.951  10.221
  273    HD2  LYS  39           1HD      LYS  39  15.764  13.255  11.266
  274    HD3  LYS  39           2HD      LYS  39  16.246  13.828   9.668
  275    HE2  LYS  39           1HE      LYS  39  16.560  16.106  10.959
  276    HE3  LYS  39           2HE      LYS  39  16.719  15.035  12.350
  277    HZ1  LYS  39           3HZ      LYS  39  18.868  15.096  11.677
  278    HZ2  LYS  39           1HZ      LYS  39  18.488  15.371  10.052
  279    HZ3  LYS  39           2HZ      LYS  39  18.354  13.815  10.700
  280    HA   PRO  40           HA       PRO  40  11.988  19.403   6.664
  281    HB2  PRO  40           1HB      PRO  40  12.134  21.400   8.498
  282    HB3  PRO  40           2HB      PRO  40  10.715  20.361   8.319
  283    HG2  PRO  40           1HG      PRO  40  12.944  20.197  10.311
  284    HG3  PRO  40           2HG      PRO  40  11.199  20.002  10.565
  285    HD2  PRO  40           1HD      PRO  40  12.887  17.894  10.367
  286    HD3  PRO  40           2HD      PRO  40  11.204  17.826   9.805
  287    H    SER  41           H        SER  41  13.107  21.411   6.030
  288    HA   SER  41           HA       SER  41  15.740  21.094   5.414
  289    HB2  SER  41           1HB      SER  41  13.982  23.483   5.680
  290    HB3  SER  41           2HB      SER  41  15.715  23.764   5.514
  291    HG   SER  41           HG       SER  41  15.215  23.584   3.462
  292    H    GLY  42           H        GLY  42  14.509  22.972   8.187
  293    HA2  GLY  42           1HA      GLY  42  16.932  23.734   9.289
  294    HA3  GLY  42           2HA      GLY  42  15.467  23.453  10.218
  295    HA   PRO  43           HA       PRO  43  18.831  19.998  10.654
  296    HB2  PRO  43           1HB      PRO  43  20.598  21.087  12.404
  297    HB3  PRO  43           2HB      PRO  43  20.799  21.183  10.650
  298    HG2  PRO  43           1HG      PRO  43  19.721  23.231  12.548
  299    HG3  PRO  43           2HG      PRO  43  20.838  23.445  11.188
  300    HD2  PRO  43           1HD      PRO  43  18.200  24.031  11.013
  301    HD3  PRO  43           2HD      PRO  43  19.140  23.436   9.629
  302    H    SER  44           H        SER  44  18.340  18.533  12.173
  303    HA   SER  44           HA       SER  44  16.649  19.283  14.374
  304    HB2  SER  44           1HB      SER  44  16.643  17.093  12.905
  305    HB3  SER  44           2HB      SER  44  17.808  16.535  14.106
  306    HG   SER  44           HG       SER  44  15.909  17.581  15.508
  307    H    SER  45           H        SER  45  17.125  19.340  16.517
  308    HA   SER  45           HA       SER  45  19.933  18.855  17.272
  309    HB2  SER  45           1HB      SER  45  19.621  20.694  18.962
  310    HB3  SER  45           2HB      SER  45  19.574  21.235  17.284
  311    HG   SER  45           HG       SER  45  17.843  22.174  18.238
  312    H    GLY  46           H        GLY  46  18.024  16.847  17.435
  313    HA2  GLY  46           1HA      GLY  46  18.028  16.386  20.314
  314    HA3  GLY  46           2HA      GLY  46  16.455  16.385  19.530
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1  -2.097 -20.890 -15.111
    2    HA2  GLY   1           1HA      GLY   1  -0.136 -21.318 -12.962
    3    HA3  GLY   1           2HA      GLY   1  -0.228 -19.898 -13.994
    4    H    SER   2           H        SER   2  -2.661 -18.943 -13.807
    5    HA   SER   2           HA       SER   2  -2.776 -17.903 -11.152
    6    HB2  SER   2           1HB      SER   2  -3.393 -16.695 -13.332
    7    HB3  SER   2           2HB      SER   2  -4.924 -17.566 -13.242
    8    HG   SER   2           HG       SER   2  -4.505 -15.328 -12.143
    9    H    SER   3           H        SER   3  -4.444 -18.102  -9.628
   10    HA   SER   3           HA       SER   3  -5.912 -20.638  -9.820
   11    HB2  SER   3           1HB      SER   3  -4.282 -19.979  -7.861
   12    HB3  SER   3           2HB      SER   3  -5.680 -19.079  -7.272
   13    HG   SER   3           HG       SER   3  -5.253 -21.538  -6.801
   14    H    GLY   4           H        GLY   4  -7.938 -20.428 -10.504
   15    HA2  GLY   4           1HA      GLY   4  -9.431 -18.121 -10.706
   16    HA3  GLY   4           2HA      GLY   4 -10.126 -19.731 -10.592
   17    H    SER   5           H        SER   5 -10.704 -16.923  -9.419
   18    HA   SER   5           HA       SER   5 -11.267 -17.915  -6.709
   19    HB2  SER   5           1HB      SER   5 -10.787 -15.670  -5.800
   20    HB3  SER   5           2HB      SER   5  -9.361 -16.383  -6.554
   21    HG   SER   5           HG       SER   5 -10.140 -14.060  -7.053
   22    H    SER   6           H        SER   6 -13.370 -18.390  -7.578
   23    HA   SER   6           HA       SER   6 -15.013 -16.064  -8.265
   24    HB2  SER   6           1HB      SER   6 -15.447 -19.036  -8.573
   25    HB3  SER   6           2HB      SER   6 -16.734 -17.859  -8.834
   26    HG   SER   6           HG       SER   6 -15.474 -16.925 -10.468
   27    H    GLY   7           H        GLY   7 -14.220 -16.189  -5.609
   28    HA2  GLY   7           1HA      GLY   7 -16.782 -16.189  -4.306
   29    HA3  GLY   7           2HA      GLY   7 -15.743 -17.497  -3.760
   30    H    THR   8           H        THR   8 -13.426 -16.709  -3.224
   31    HA   THR   8           HA       THR   8 -13.579 -15.001  -1.021
   32    HB   THR   8           HB       THR   8 -11.787 -16.661  -1.295
   33    HG1  THR   8           HG1      THR   8 -10.110 -15.285  -0.527
   34   HG21  THR   8          3HG2      THR   8 -10.492 -16.764  -3.107
   35   HG22  THR   8          1HG2      THR   8 -10.005 -15.080  -2.919
   36   HG23  THR   8          2HG2      THR   8 -11.471 -15.479  -3.814
   37    H    GLY   9           H        GLY   9 -12.707 -12.904  -0.659
   38    HA2  GLY   9           1HA      GLY   9 -11.557 -11.190  -2.476
   39    HA3  GLY   9           2HA      GLY   9 -13.284 -11.062  -2.771
   40    H    GLU  10           H        GLU  10 -11.470 -11.458   0.260
   41    HA   GLU  10           HA       GLU  10 -12.411  -8.810   1.106
   42    HB2  GLU  10           1HB      GLU  10 -12.955 -11.440   2.402
   43    HB3  GLU  10           2HB      GLU  10 -12.664 -10.052   3.440
   44    HG2  GLU  10           1HG      GLU  10 -14.593  -9.007   2.829
   45    HG3  GLU  10           2HG      GLU  10 -14.622  -9.752   1.232
   46    H    ARG  11           H        ARG  11 -10.559  -7.726   1.338
   47    HA   ARG  11           HA       ARG  11  -8.550  -8.816   3.164
   48    HB2  ARG  11           1HB      ARG  11  -8.061  -7.900   0.343
   49    HB3  ARG  11           2HB      ARG  11  -6.791  -7.811   1.556
   50    HG2  ARG  11           1HG      ARG  11  -6.547 -10.077   1.672
   51    HG3  ARG  11           2HG      ARG  11  -8.220 -10.391   1.206
   52    HD2  ARG  11           1HD      ARG  11  -6.971 -11.062  -0.651
   53    HD3  ARG  11           2HD      ARG  11  -7.560  -9.458  -1.083
   54    HE   ARG  11           HE       ARG  11  -5.397  -8.706  -1.103
   55   HH11  ARG  11          1HH1      ARG  11  -5.526 -11.782   0.523
   56   HH12  ARG  11          2HH1      ARG  11  -3.805 -11.947   0.625
   57   HH21  ARG  11          1HH2      ARG  11  -3.129  -8.912  -0.975
   58   HH22  ARG  11          2HH2      ARG  11  -2.442 -10.314  -0.226
   59    H    HIS  12           H        HIS  12  -7.446  -7.285   4.358
   60    HA   HIS  12           HA       HIS  12  -8.611  -4.602   4.290
   61    HB2  HIS  12           1HB      HIS  12  -7.342  -4.415   6.526
   62    HB3  HIS  12           2HB      HIS  12  -8.747  -5.475   6.463
   63    HD1  HIS  12           HD1      HIS  12  -8.075  -7.154   8.208
   64    HD2  HIS  12           HD2      HIS  12  -5.136  -6.569   5.330
   65    HE1  HIS  12           HE1      HIS  12  -6.344  -8.925   8.646
   66    H    TYR  13           H        TYR  13  -7.156  -2.748   4.730
   67    HA   TYR  13           HA       TYR  13  -4.929  -2.820   2.909
   68    HB2  TYR  13           1HB      TYR  13  -5.639  -0.505   4.697
   69    HB3  TYR  13           2HB      TYR  13  -4.864  -0.472   3.117
   70    HD1  TYR  13           HD2      TYR  13  -8.070  -0.953   4.875
   71    HD2  TYR  13           HD1      TYR  13  -6.155  -0.462   1.107
   72    HE1  TYR  13           HE2      TYR  13 -10.259  -0.585   3.817
   73    HE2  TYR  13           HE1      TYR  13  -8.339  -0.091   0.039
   74    HH   TYR  13           HH       TYR  13 -11.316   0.054   1.946
   75    H    GLU  14           H        GLU  14  -3.156  -3.848   3.626
   76    HA   GLU  14           HA       GLU  14  -2.244  -3.392   6.369
   77    HB2  GLU  14           1HB      GLU  14  -1.710  -5.474   4.297
   78    HB3  GLU  14           2HB      GLU  14  -0.481  -5.171   5.517
   79    HG2  GLU  14           1HG      GLU  14  -1.949  -5.768   7.275
   80    HG3  GLU  14           2HG      GLU  14  -3.342  -5.780   6.195
   81    H    CYS  15           H        CYS  15  -0.320  -2.434   6.872
   82    HA   CYS  15           HA       CYS  15   0.782  -0.635   4.945
   83    HB2  CYS  15           1HB      CYS  15   0.573  -0.188   7.422
   84    HB3  CYS  15           2HB      CYS  15   1.908  -1.309   7.667
   85    H    SER  16           H        SER  16   2.253  -1.117   3.470
   86    HA   SER  16           HA       SER  16   3.800  -3.558   3.674
   87    HB2  SER  16           1HB      SER  16   2.676  -2.502   1.544
   88    HB3  SER  16           2HB      SER  16   4.168  -1.566   1.466
   89    HG   SER  16           HG       SER  16   4.714  -3.327   0.370
   90    H    GLU  17           H        GLU  17   4.370  -1.451   5.580
   91    HA   GLU  17           HA       GLU  17   7.171  -0.903   4.847
   92    HB2  GLU  17           1HB      GLU  17   5.323   0.821   6.507
   93    HB3  GLU  17           2HB      GLU  17   7.036   1.129   6.259
   94    HG2  GLU  17           1HG      GLU  17   5.303   0.836   3.867
   95    HG3  GLU  17           2HG      GLU  17   5.186   2.319   4.813
   96    H    CYS  18           H        CYS  18   4.910  -1.453   7.524
   97    HA   CYS  18           HA       CYS  18   7.163  -2.504   9.107
   98    HB2  CYS  18           1HB      CYS  18   5.705  -2.013  11.103
   99    HB3  CYS  18           2HB      CYS  18   6.268  -0.592  10.229
  100    H    GLY  19           H        GLY  19   3.676  -2.903   8.502
  101    HA2  GLY  19           1HA      GLY  19   3.114  -5.266   7.810
  102    HA3  GLY  19           2HA      GLY  19   3.974  -5.740   9.267
  103    H    LYS  20           H        LYS  20   1.789  -2.992   8.920
  104    HA   LYS  20           HA       LYS  20   0.139  -4.122  11.059
  105    HB2  LYS  20           1HB      LYS  20   1.162  -1.685  10.947
  106    HB3  LYS  20           2HB      LYS  20  -0.275  -1.366   9.984
  107    HG2  LYS  20           1HG      LYS  20  -1.689  -1.621  11.750
  108    HG3  LYS  20           2HG      LYS  20  -0.625  -2.757  12.582
  109    HD2  LYS  20           1HD      LYS  20   0.948  -0.717  12.843
  110    HD3  LYS  20           2HD      LYS  20  -0.495   0.235  12.486
  111    HE2  LYS  20           1HE      LYS  20  -0.476   0.111  14.813
  112    HE3  LYS  20           2HE      LYS  20  -1.615  -1.148  14.338
  113    HZ1  LYS  20           3HZ      LYS  20  -0.350  -2.687  15.282
  114    HZ2  LYS  20           1HZ      LYS  20   0.591  -1.448  15.946
  115    HZ3  LYS  20           2HZ      LYS  20   1.040  -2.157  14.478
  116    H    ALA  21           H        ALA  21  -2.271  -3.392  10.857
  117    HA   ALA  21           HA       ALA  21  -3.233  -3.667   8.105
  118    HB1  ALA  21           3HB      ALA  21  -4.496  -5.330  10.248
  119    HB2  ALA  21           1HB      ALA  21  -4.563  -5.524   8.496
  120    HB3  ALA  21           2HB      ALA  21  -3.083  -5.917   9.372
  121    H    PHE  22           H        PHE  22  -4.800  -2.256   7.689
  122    HA   PHE  22           HA       PHE  22  -6.323  -1.151   9.957
  123    HB2  PHE  22           1HB      PHE  22  -5.490   0.251   7.408
  124    HB3  PHE  22           2HB      PHE  22  -6.481   0.957   8.681
  125    HD1  PHE  22           HD1      PHE  22  -5.506   1.583  10.814
  126    HD2  PHE  22           HD2      PHE  22  -3.119  -0.039   7.686
  127    HE1  PHE  22           HE1      PHE  22  -3.475   2.353  11.970
  128    HE2  PHE  22           HE2      PHE  22  -1.084   0.727   8.838
  129    HZ   PHE  22           HZ       PHE  22  -1.260   1.924  10.983
  130    H    ILE  23           H        ILE  23  -8.518  -0.638   9.606
  131    HA   ILE  23           HA       ILE  23  -9.854  -2.440   7.821
  132    HB   ILE  23           HB       ILE  23 -10.789  -1.965  10.028
  133   HG12  ILE  23          1HG1      ILE  23 -13.132  -1.395   9.283
  134   HG13  ILE  23          2HG1      ILE  23 -12.473  -1.071   7.683
  135   HG21  ILE  23          1HG2      ILE  23 -11.409   0.104  10.791
  136   HG22  ILE  23          2HG2      ILE  23 -10.025   0.536   9.788
  137   HG23  ILE  23          3HG2      ILE  23 -11.663   0.748   9.169
  138   HD11  ILE  23          3HD1      ILE  23 -12.578  -3.214   7.169
  139   HD12  ILE  23          1HD1      ILE  23 -11.595  -3.639   8.571
  140   HD13  ILE  23          2HD1      ILE  23 -13.348  -3.517   8.727
  141    H    GLN  24           H        GLN  24  -9.136   0.986   7.873
  142    HA   GLN  24           HA       GLN  24 -10.581   1.307   5.328
  143    HB2  GLN  24           1HB      GLN  24  -9.940   3.214   7.551
  144    HB3  GLN  24           2HB      GLN  24 -10.219   3.824   5.925
  145    HG2  GLN  24           1HG      GLN  24 -12.424   2.738   5.919
  146    HG3  GLN  24           2HG      GLN  24 -12.143   2.201   7.575
  147   HE21  GLN  24          1HE2      GLN  24 -13.407   4.611   5.642
  148   HE22  GLN  24          2HE2      GLN  24 -13.605   5.837   6.842
  149    H    LYS  25           H        LYS  25  -9.573   2.842   3.776
  150    HA   LYS  25           HA       LYS  25  -6.785   2.153   3.430
  151    HB2  LYS  25           1HB      LYS  25  -8.208   2.039   1.487
  152    HB3  LYS  25           2HB      LYS  25  -8.728   3.704   1.712
  153    HG2  LYS  25           1HG      LYS  25  -7.190   4.019   0.077
  154    HG3  LYS  25           2HG      LYS  25  -6.132   4.162   1.483
  155    HD2  LYS  25           1HD      LYS  25  -6.574   1.465   0.296
  156    HD3  LYS  25           2HD      LYS  25  -5.512   2.595  -0.547
  157    HE2  LYS  25           1HE      LYS  25  -4.296   2.895   1.645
  158    HE3  LYS  25           2HE      LYS  25  -5.236   1.535   2.258
  159    HZ1  LYS  25           3HZ      LYS  25  -3.284   0.566   1.514
  160    HZ2  LYS  25           1HZ      LYS  25  -3.179   1.552   0.143
  161    HZ3  LYS  25           2HZ      LYS  25  -4.333   0.317   0.210
  162    H    SER  26           H        SER  26  -8.710   5.016   4.117
  163    HA   SER  26           HA       SER  26  -6.587   6.886   3.851
  164    HB2  SER  26           1HB      SER  26  -9.180   7.102   5.400
  165    HB3  SER  26           2HB      SER  26  -8.104   8.447   5.022
  166    HG   SER  26           HG       SER  26  -8.902   8.512   3.080
  167    H    THR  27           H        THR  27  -8.170   5.494   6.725
  168    HA   THR  27           HA       THR  27  -6.734   6.618   8.738
  169    HB   THR  27           HB       THR  27  -7.685   3.766   8.489
  170    HG1  THR  27           HG1      THR  27  -9.072   5.828   8.721
  171   HG21  THR  27          3HG2      THR  27  -6.215   5.122  10.704
  172   HG22  THR  27          1HG2      THR  27  -6.107   3.456  10.137
  173   HG23  THR  27          2HG2      THR  27  -7.489   3.971  11.104
  174    H    LEU  28           H        LEU  28  -5.687   3.990   6.631
  175    HA   LEU  28           HA       LEU  28  -3.300   3.378   8.017
  176    HB2  LEU  28           1HB      LEU  28  -3.876   1.704   6.575
  177    HB3  LEU  28           2HB      LEU  28  -4.413   2.821   5.322
  178    HG   LEU  28           HG       LEU  28  -1.995   3.322   4.866
  179   HD11  LEU  28          1HD1      LEU  28  -1.056   2.608   6.983
  180   HD12  LEU  28          2HD1      LEU  28  -0.346   1.686   5.658
  181   HD13  LEU  28          3HD1      LEU  28  -1.579   0.951   6.682
  182   HD21  LEU  28          3HD2      LEU  28  -3.610   1.297   3.954
  183   HD22  LEU  28          1HD2      LEU  28  -2.126   0.449   4.391
  184   HD23  LEU  28          2HD2      LEU  28  -2.072   1.789   3.244
  185    H    SER  29           H        SER  29  -3.968   5.472   5.228
  186    HA   SER  29           HA       SER  29  -1.412   6.258   4.579
  187    HB2  SER  29           1HB      SER  29  -4.067   7.644   4.436
  188    HB3  SER  29           2HB      SER  29  -2.601   8.528   4.013
  189    HG   SER  29           HG       SER  29  -3.347   6.034   2.883
  190    H    MET  30           H        MET  30  -3.460   7.403   7.203
  191    HA   MET  30           HA       MET  30  -1.815   9.573   7.984
  192    HB2  MET  30           1HB      MET  30  -3.680   8.001   9.762
  193    HB3  MET  30           2HB      MET  30  -3.150   9.664   9.977
  194    HG2  MET  30           1HG      MET  30  -4.287   9.999   7.641
  195    HG3  MET  30           2HG      MET  30  -5.163   8.540   8.099
  196    HE1  MET  30           3HE      MET  30  -6.337  11.912   7.754
  197    HE2  MET  30           1HE      MET  30  -6.011  12.745   9.274
  198    HE3  MET  30           2HE      MET  30  -4.673  12.150   8.290
  199    H    HIS  31           H        HIS  31  -1.657   6.164   8.518
  200    HA   HIS  31           HA       HIS  31   0.181   6.396  10.753
  201    HB2  HIS  31           1HB      HIS  31  -1.123   4.517  11.061
  202    HB3  HIS  31           2HB      HIS  31  -1.180   4.144   9.341
  203    HD1  HIS  31           HD1      HIS  31   0.978   3.714  12.380
  204    HD2  HIS  31           HD2      HIS  31   0.849   2.488   8.412
  205    HE1  HIS  31           HE1      HIS  31   2.715   1.907  12.178
  206    H    GLN  32           H        GLN  32   0.266   5.227   7.397
  207    HA   GLN  32           HA       GLN  32   2.860   4.390   7.195
  208    HB2  GLN  32           1HB      GLN  32   1.063   5.789   5.240
  209    HB3  GLN  32           2HB      GLN  32   2.709   5.365   4.790
  210    HG2  GLN  32           1HG      GLN  32   2.138   2.999   5.492
  211    HG3  GLN  32           2HG      GLN  32   0.458   3.531   5.544
  212   HE21  GLN  32          1HE2      GLN  32  -0.323   2.368   3.869
  213   HE22  GLN  32          2HE2      GLN  32   0.188   2.563   2.230
  214    H    ARG  33           H        ARG  33   1.749   7.579   7.774
  215    HA   ARG  33           HA       ARG  33   3.765   9.159   6.719
  216    HB2  ARG  33           1HB      ARG  33   3.093  10.845   8.238
  217    HB3  ARG  33           2HB      ARG  33   1.645   9.908   7.896
  218    HG2  ARG  33           1HG      ARG  33   1.872   8.733  10.003
  219    HG3  ARG  33           2HG      ARG  33   3.377   9.591  10.339
  220    HD2  ARG  33           1HD      ARG  33   0.742  10.978   9.895
  221    HD3  ARG  33           2HD      ARG  33   1.323  10.491  11.487
  222    HE   ARG  33           HE       ARG  33   3.195  12.098  10.012
  223   HH11  ARG  33          1HH1      ARG  33   0.458  12.135  12.163
  224   HH12  ARG  33          2HH1      ARG  33   0.806  13.712  12.789
  225   HH21  ARG  33          1HH2      ARG  33   3.664  14.176  10.829
  226   HH22  ARG  33          2HH2      ARG  33   2.629  14.873  12.029
  227    H    ILE  34           H        ILE  34   3.759   7.158   9.595
  228    HA   ILE  34           HA       ILE  34   6.076   8.179  10.820
  229    HB   ILE  34           HB       ILE  34   6.135   6.183  12.130
  230   HG12  ILE  34          1HG1      ILE  34   4.127   4.914  10.269
  231   HG13  ILE  34          2HG1      ILE  34   5.861   4.663  10.103
  232   HG21  ILE  34          1HG2      ILE  34   3.601   5.923  12.638
  233   HG22  ILE  34          2HG2      ILE  34   4.388   7.477  12.911
  234   HG23  ILE  34          3HG2      ILE  34   3.415   7.224  11.463
  235   HD11  ILE  34          3HD1      ILE  34   5.935   3.716  12.351
  236   HD12  ILE  34          1HD1      ILE  34   4.196   3.963  12.510
  237   HD13  ILE  34          2HD1      ILE  34   4.821   2.835  11.306
  238    H    HIS  35           H        HIS  35   5.743   6.613   7.889
  239    HA   HIS  35           HA       HIS  35   8.466   5.511   7.977
  240    HB2  HIS  35           1HB      HIS  35   6.329   5.068   5.883
  241    HB3  HIS  35           2HB      HIS  35   7.874   4.232   5.999
  242    HD1  HIS  35           HD1      HIS  35   7.991   3.264   8.799
  243    HD2  HIS  35           HD2      HIS  35   4.445   3.293   6.634
  244    HE1  HIS  35           HE1      HIS  35   6.511   1.562   9.911
  245    H    ARG  36           H        ARG  36   6.460   7.931   6.502
  246    HA   ARG  36           HA       ARG  36   8.039   8.562   4.269
  247    HB2  ARG  36           1HB      ARG  36   6.646  10.358   3.975
  248    HB3  ARG  36           2HB      ARG  36   5.651   9.387   5.052
  249    HG2  ARG  36           1HG      ARG  36   6.549  10.713   6.962
  250    HG3  ARG  36           2HG      ARG  36   7.352  11.756   5.786
  251    HD2  ARG  36           1HD      ARG  36   4.440  11.242   5.467
  252    HD3  ARG  36           2HD      ARG  36   4.960  12.334   6.751
  253    HE   ARG  36           HE       ARG  36   6.270  13.162   4.472
  254   HH11  ARG  36          1HH1      ARG  36   2.968  12.782   5.506
  255   HH12  ARG  36          2HH1      ARG  36   2.370  14.065   4.507
  256   HH21  ARG  36          1HH2      ARG  36   5.495  14.853   3.152
  257   HH22  ARG  36          2HH2      ARG  36   3.808  15.242   3.167
  258    H    GLY  37           H        GLY  37   8.369   9.344   7.646
  259    HA2  GLY  37           1HA      GLY  37  11.062  10.156   7.353
  260    HA3  GLY  37           2HA      GLY  37  10.037  11.575   7.514
  261    H    GLU  38           H        GLU  38  11.454   8.867   9.121
  262    HA   GLU  38           HA       GLU  38  11.060  10.087  11.680
  263    HB2  GLU  38           1HB      GLU  38   8.880   8.822  11.149
  264    HB3  GLU  38           2HB      GLU  38   9.827   7.359  11.381
  265    HG2  GLU  38           1HG      GLU  38   9.905   9.437  13.500
  266    HG3  GLU  38           2HG      GLU  38   8.455   8.447  13.344
  267    H    LYS  39           H        LYS  39  13.136   9.930  12.263
  268    HA   LYS  39           HA       LYS  39  14.268   7.252  12.568
  269    HB2  LYS  39           1HB      LYS  39  15.506   9.506  11.007
  270    HB3  LYS  39           2HB      LYS  39  16.501   8.260  11.750
  271    HG2  LYS  39           1HG      LYS  39  14.259   7.645   9.846
  272    HG3  LYS  39           2HG      LYS  39  15.925   7.913   9.328
  273    HD2  LYS  39           1HD      LYS  39  16.697   6.000  10.428
  274    HD3  LYS  39           2HD      LYS  39  15.260   5.896  11.448
  275    HE2  LYS  39           1HE      LYS  39  15.024   5.633   8.478
  276    HE3  LYS  39           2HE      LYS  39  15.546   4.258   9.449
  277    HZ1  LYS  39           3HZ      LYS  39  13.261   4.010   9.331
  278    HZ2  LYS  39           1HZ      LYS  39  12.955   5.667   9.488
  279    HZ3  LYS  39           2HZ      LYS  39  13.465   4.771  10.829
  280    HA   PRO  40           HA       PRO  40  15.648   8.761  16.453
  281    HB2  PRO  40           1HB      PRO  40  17.897   7.285  16.820
  282    HB3  PRO  40           2HB      PRO  40  16.271   6.602  16.935
  283    HG2  PRO  40           1HG      PRO  40  18.206   6.513  14.653
  284    HG3  PRO  40           2HG      PRO  40  17.176   5.221  15.297
  285    HD2  PRO  40           1HD      PRO  40  16.534   6.623  13.071
  286    HD3  PRO  40           2HD      PRO  40  15.307   5.984  14.184
  287    H    SER  41           H        SER  41  16.254  10.880  16.252
  288    HA   SER  41           HA       SER  41  18.357  11.919  14.780
  289    HB2  SER  41           1HB      SER  41  17.279  12.966  17.409
  290    HB3  SER  41           2HB      SER  41  18.208  13.893  16.231
  291    HG   SER  41           HG       SER  41  16.402  14.263  15.249
  292    H    GLY  42           H        GLY  42  20.511  12.067  15.032
  293    HA2  GLY  42           1HA      GLY  42  21.648  10.879  17.483
  294    HA3  GLY  42           2HA      GLY  42  22.418  10.839  15.904
  295    HA   PRO  43           HA       PRO  43  24.828  14.248  17.331
  296    HB2  PRO  43           1HB      PRO  43  25.928  14.932  14.945
  297    HB3  PRO  43           2HB      PRO  43  26.440  13.514  15.867
  298    HG2  PRO  43           1HG      PRO  43  24.579  13.683  13.529
  299    HG3  PRO  43           2HG      PRO  43  25.861  12.503  13.855
  300    HD2  PRO  43           1HD      PRO  43  23.245  11.975  14.311
  301    HD3  PRO  43           2HD      PRO  43  24.545  11.285  15.303
  302    H    SER  44           H        SER  44  22.301  14.450  15.007
  303    HA   SER  44           HA       SER  44  22.412  17.156  14.300
  304    HB2  SER  44           1HB      SER  44  20.076  16.928  13.671
  305    HB3  SER  44           2HB      SER  44  20.944  15.463  13.214
  306    HG   SER  44           HG       SER  44  19.001  15.851  15.168
  307    H    SER  45           H        SER  45  21.522  19.004  15.163
  308    HA   SER  45           HA       SER  45  21.177  18.998  18.028
  309    HB2  SER  45           1HB      SER  45  21.066  21.445  17.799
  310    HB3  SER  45           2HB      SER  45  22.458  20.790  16.937
  311    HG   SER  45           HG       SER  45  20.942  20.810  15.051
  312    H    GLY  46           H        GLY  46  19.233  17.810  18.259
  313    HA2  GLY  46           1HA      GLY  46  16.928  19.227  18.664
  314    HA3  GLY  46           2HA      GLY  46  16.805  18.679  16.998
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1  -1.938  -6.141 -24.372
    2    HA2  GLY   1           1HA      GLY   1   0.025  -7.720 -24.405
    3    HA3  GLY   1           2HA      GLY   1   0.343  -6.223 -23.542
    4    H    SER   2           H        SER   2   1.947  -7.322 -22.315
    5    HA   SER   2           HA       SER   2   1.404  -9.609 -20.747
    6    HB2  SER   2           1HB      SER   2   3.686  -8.588 -21.412
    7    HB3  SER   2           2HB      SER   2   3.466  -7.543 -20.009
    8    HG   SER   2           HG       SER   2   4.591  -9.730 -19.817
    9    H    SER   3           H        SER   3   0.496  -9.852 -18.798
   10    HA   SER   3           HA       SER   3  -0.936  -7.683 -17.629
   11    HB2  SER   3           1HB      SER   3  -1.726  -9.296 -16.018
   12    HB3  SER   3           2HB      SER   3  -1.692 -10.076 -17.599
   13    HG   SER   3           HG       SER   3  -0.212 -11.406 -16.906
   14    H    GLY   4           H        GLY   4  -0.781  -7.184 -15.256
   15    HA2  GLY   4           1HA      GLY   4   1.683  -7.596 -13.883
   16    HA3  GLY   4           2HA      GLY   4   1.635  -6.003 -14.624
   17    H    SER   5           H        SER   5  -0.594  -8.084 -12.769
   18    HA   SER   5           HA       SER   5  -1.129  -5.767 -11.029
   19    HB2  SER   5           1HB      SER   5  -3.471  -6.631 -10.807
   20    HB3  SER   5           2HB      SER   5  -3.072  -6.071 -12.431
   21    HG   SER   5           HG       SER   5  -2.456  -8.494 -12.622
   22    H    SER   6           H        SER   6   0.143  -6.365  -9.332
   23    HA   SER   6           HA       SER   6  -0.522  -8.929  -8.038
   24    HB2  SER   6           1HB      SER   6   1.868  -8.557  -9.051
   25    HB3  SER   6           2HB      SER   6   2.124  -7.586  -7.601
   26    HG   SER   6           HG       SER   6   1.842  -9.356  -6.351
   27    H    GLY   7           H        GLY   7  -1.574  -8.660  -6.191
   28    HA2  GLY   7           1HA      GLY   7  -0.923  -6.294  -4.546
   29    HA3  GLY   7           2HA      GLY   7  -2.581  -6.820  -4.793
   30    H    THR   8           H        THR   8  -0.363  -6.714  -2.518
   31    HA   THR   8           HA       THR   8  -0.477  -9.436  -1.545
   32    HB   THR   8           HB       THR   8   0.607  -6.950  -0.205
   33    HG1  THR   8           HG1      THR   8   1.794  -8.962  -1.821
   34   HG21  THR   8          3HG2      THR   8   0.036  -9.478   0.878
   35   HG22  THR   8          1HG2      THR   8   0.989  -8.188   1.609
   36   HG23  THR   8          2HG2      THR   8   1.783  -9.432   0.645
   37    H    GLY   9           H        GLY   9  -1.714  -6.265  -0.494
   38    HA2  GLY   9           1HA      GLY   9  -3.364  -7.557   1.536
   39    HA3  GLY   9           2HA      GLY   9  -3.165  -5.827   1.301
   40    H    GLU  10           H        GLU  10  -4.886  -8.689   0.288
   41    HA   GLU  10           HA       GLU  10  -6.584  -7.147  -1.513
   42    HB2  GLU  10           1HB      GLU  10  -5.926  -9.296  -2.346
   43    HB3  GLU  10           2HB      GLU  10  -6.437 -10.090  -0.864
   44    HG2  GLU  10           1HG      GLU  10  -8.411  -8.601  -2.540
   45    HG3  GLU  10           2HG      GLU  10  -7.926 -10.242  -2.965
   46    H    ARG  11           H        ARG  11  -7.016  -9.311   1.289
   47    HA   ARG  11           HA       ARG  11  -9.729  -8.840   1.694
   48    HB2  ARG  11           1HB      ARG  11  -7.486  -9.749   3.448
   49    HB3  ARG  11           2HB      ARG  11  -9.035  -9.360   4.185
   50    HG2  ARG  11           1HG      ARG  11 -10.145 -11.060   3.001
   51    HG3  ARG  11           2HG      ARG  11  -8.795 -11.272   1.885
   52    HD2  ARG  11           1HD      ARG  11  -8.662 -13.093   3.364
   53    HD3  ARG  11           2HD      ARG  11  -7.427 -11.961   3.913
   54    HE   ARG  11           HE       ARG  11  -8.557 -11.767   5.884
   55   HH11  ARG  11          1HH1      ARG  11 -10.729 -13.028   3.474
   56   HH12  ARG  11          2HH1      ARG  11 -12.022 -13.303   4.595
   57   HH21  ARG  11          1HH2      ARG  11 -10.250 -12.124   7.370
   58   HH22  ARG  11          2HH2      ARG  11 -11.749 -12.787   6.810
   59    H    HIS  12           H        HIS  12  -7.012  -7.360   3.475
   60    HA   HIS  12           HA       HIS  12  -8.602  -4.907   3.721
   61    HB2  HIS  12           1HB      HIS  12  -7.689  -4.717   6.101
   62    HB3  HIS  12           2HB      HIS  12  -8.978  -5.888   5.837
   63    HD1  HIS  12           HD1      HIS  12  -8.533  -8.196   6.638
   64    HD2  HIS  12           HD2      HIS  12  -5.036  -5.998   6.186
   65    HE1  HIS  12           HE1      HIS  12  -6.696  -9.662   7.534
   66    H    TYR  13           H        TYR  13  -7.317  -3.003   4.239
   67    HA   TYR  13           HA       TYR  13  -4.948  -2.880   2.697
   68    HB2  TYR  13           1HB      TYR  13  -5.731  -0.818   4.744
   69    HB3  TYR  13           2HB      TYR  13  -4.897  -0.581   3.212
   70    HD1  TYR  13           HD2      TYR  13  -8.165  -1.255   4.777
   71    HD2  TYR  13           HD1      TYR  13  -6.113  -0.318   1.169
   72    HE1  TYR  13           HE2      TYR  13 -10.313  -0.738   3.695
   73    HE2  TYR  13           HE1      TYR  13  -8.254   0.202   0.078
   74    HH   TYR  13           HH       TYR  13 -11.274  -0.586   1.487
   75    H    GLU  14           H        GLU  14  -2.952  -3.436   3.232
   76    HA   GLU  14           HA       GLU  14  -2.220  -3.477   6.087
   77    HB2  GLU  14           1HB      GLU  14  -1.473  -5.357   3.856
   78    HB3  GLU  14           2HB      GLU  14  -0.537  -5.261   5.341
   79    HG2  GLU  14           1HG      GLU  14  -2.662  -5.750   6.588
   80    HG3  GLU  14           2HG      GLU  14  -3.407  -6.089   5.027
   81    H    CYS  15           H        CYS  15  -0.244  -2.655   6.687
   82    HA   CYS  15           HA       CYS  15   0.906  -0.711   4.929
   83    HB2  CYS  15           1HB      CYS  15   0.687  -0.421   7.408
   84    HB3  CYS  15           2HB      CYS  15   1.938  -1.642   7.615
   85    H    SER  16           H        SER  16   2.679  -0.847   3.693
   86    HA   SER  16           HA       SER  16   3.953  -3.428   3.401
   87    HB2  SER  16           1HB      SER  16   3.389  -2.217   1.379
   88    HB3  SER  16           2HB      SER  16   4.321  -0.818   1.912
   89    HG   SER  16           HG       SER  16   5.895  -2.969   1.969
   90    H    GLU  17           H        GLU  17   4.493  -0.645   5.213
   91    HA   GLU  17           HA       GLU  17   7.380  -0.805   5.231
   92    HB2  GLU  17           1HB      GLU  17   5.439   0.828   6.873
   93    HB3  GLU  17           2HB      GLU  17   7.188   0.945   7.011
   94    HG2  GLU  17           1HG      GLU  17   5.582   1.525   4.532
   95    HG3  GLU  17           2HG      GLU  17   6.256   2.728   5.630
   96    H    CYS  18           H        CYS  18   5.079  -0.843   7.948
   97    HA   CYS  18           HA       CYS  18   6.870  -2.595   9.423
   98    HB2  CYS  18           1HB      CYS  18   5.225  -2.231  11.286
   99    HB3  CYS  18           2HB      CYS  18   5.967  -0.758  10.672
  100    H    GLY  19           H        GLY  19   3.493  -2.601   8.303
  101    HA2  GLY  19           1HA      GLY  19   2.780  -4.742   7.249
  102    HA3  GLY  19           2HA      GLY  19   3.508  -5.538   8.636
  103    H    LYS  20           H        LYS  20   2.027  -2.665   9.543
  104    HA   LYS  20           HA       LYS  20   0.015  -4.029  11.034
  105    HB2  LYS  20           1HB      LYS  20   1.277  -1.739  11.463
  106    HB3  LYS  20           2HB      LYS  20  -0.104  -1.079  10.598
  107    HG2  LYS  20           1HG      LYS  20  -1.511  -2.449  12.278
  108    HG3  LYS  20           2HG      LYS  20  -0.025  -2.495  13.229
  109    HD2  LYS  20           1HD      LYS  20   0.019  -0.161  13.475
  110    HD3  LYS  20           2HD      LYS  20  -1.138   0.085  12.165
  111    HE2  LYS  20           1HE      LYS  20  -2.409   0.441  14.080
  112    HE3  LYS  20           2HE      LYS  20  -2.775  -1.230  13.655
  113    HZ1  LYS  20           3HZ      LYS  20  -1.911  -1.954  15.555
  114    HZ2  LYS  20           1HZ      LYS  20  -1.903  -0.346  16.080
  115    HZ3  LYS  20           2HZ      LYS  20  -0.512  -1.017  15.391
  116    H    ALA  21           H        ALA  21  -2.121  -4.280  10.643
  117    HA   ALA  21           HA       ALA  21  -3.073  -3.511   7.981
  118    HB1  ALA  21           3HB      ALA  21  -4.351  -5.418   9.933
  119    HB2  ALA  21           1HB      ALA  21  -4.752  -5.202   8.229
  120    HB3  ALA  21           2HB      ALA  21  -3.196  -5.894   8.688
  121    H    PHE  22           H        PHE  22  -4.839  -2.237   7.650
  122    HA   PHE  22           HA       PHE  22  -6.169  -1.140  10.037
  123    HB2  PHE  22           1HB      PHE  22  -5.496   0.436   7.546
  124    HB3  PHE  22           2HB      PHE  22  -6.196   1.057   9.038
  125    HD1  PHE  22           HD2      PHE  22  -3.170  -0.755   7.831
  126    HD2  PHE  22           HD1      PHE  22  -4.809   2.062  10.569
  127    HE1  PHE  22           HE2      PHE  22  -0.913  -0.276   8.685
  128    HE2  PHE  22           HE1      PHE  22  -2.555   2.546  11.426
  129    HZ   PHE  22           HZ       PHE  22  -0.603   1.375  10.485
  130    H    ILE  23           H        ILE  23  -8.352  -0.890   9.936
  131    HA   ILE  23           HA       ILE  23  -9.808  -2.406   8.065
  132    HB   ILE  23           HB       ILE  23 -10.669  -1.982  10.303
  133   HG12  ILE  23          1HG1      ILE  23 -12.999  -1.236   9.650
  134   HG13  ILE  23          2HG1      ILE  23 -12.361  -0.907   8.042
  135   HG21  ILE  23          1HG2      ILE  23 -11.154   0.865   9.452
  136   HG22  ILE  23          2HG2      ILE  23 -11.427   0.152  11.041
  137   HG23  ILE  23          3HG2      ILE  23  -9.783   0.357  10.438
  138   HD11  ILE  23          3HD1      ILE  23 -12.850  -3.501   9.399
  139   HD12  ILE  23          1HD1      ILE  23 -13.197  -3.004   7.743
  140   HD13  ILE  23          2HD1      ILE  23 -11.544  -3.395   8.219
  141    H    GLN  24           H        GLN  24  -9.385   1.105   8.407
  142    HA   GLN  24           HA       GLN  24 -10.757   1.516   5.858
  143    HB2  GLN  24           1HB      GLN  24 -10.031   3.271   8.162
  144    HB3  GLN  24           2HB      GLN  24 -10.236   4.006   6.578
  145    HG2  GLN  24           1HG      GLN  24 -12.497   3.063   6.449
  146    HG3  GLN  24           2HG      GLN  24 -12.287   2.375   8.058
  147   HE21  GLN  24          1HE2      GLN  24 -12.552   5.347   6.230
  148   HE22  GLN  24          2HE2      GLN  24 -13.025   6.347   7.557
  149    H    LYS  25           H        LYS  25  -9.805   2.735   4.162
  150    HA   LYS  25           HA       LYS  25  -7.087   2.084   3.666
  151    HB2  LYS  25           1HB      LYS  25  -9.079   2.517   2.014
  152    HB3  LYS  25           2HB      LYS  25  -8.539   4.189   2.106
  153    HG2  LYS  25           1HG      LYS  25  -6.608   1.996   1.466
  154    HG3  LYS  25           2HG      LYS  25  -7.645   2.688   0.216
  155    HD2  LYS  25           1HD      LYS  25  -6.770   4.938   0.824
  156    HD3  LYS  25           2HD      LYS  25  -5.645   4.153   1.935
  157    HE2  LYS  25           1HE      LYS  25  -4.847   2.809  -0.069
  158    HE3  LYS  25           2HE      LYS  25  -5.760   3.943  -1.064
  159    HZ1  LYS  25           3HZ      LYS  25  -4.445   5.750  -0.062
  160    HZ2  LYS  25           1HZ      LYS  25  -3.491   4.652  -0.926
  161    HZ3  LYS  25           2HZ      LYS  25  -3.516   4.603   0.764
  162    H    SER  26           H        SER  26  -8.727   5.194   4.236
  163    HA   SER  26           HA       SER  26  -6.500   6.847   4.116
  164    HB2  SER  26           1HB      SER  26  -9.067   7.372   4.421
  165    HB3  SER  26           2HB      SER  26  -8.640   7.412   6.132
  166    HG   SER  26           HG       SER  26  -8.171   9.418   5.610
  167    H    THR  27           H        THR  27  -7.939   5.297   6.980
  168    HA   THR  27           HA       THR  27  -6.360   6.207   8.986
  169    HB   THR  27           HB       THR  27  -7.168   3.316   8.614
  170    HG1  THR  27           HG1      THR  27  -8.743   5.299   8.739
  171   HG21  THR  27          3HG2      THR  27  -6.770   4.694  11.245
  172   HG22  THR  27          1HG2      THR  27  -5.404   3.966  10.401
  173   HG23  THR  27          2HG2      THR  27  -6.777   2.969  10.882
  174    H    LEU  28           H        LEU  28  -5.432   3.982   6.454
  175    HA   LEU  28           HA       LEU  28  -2.936   3.253   7.683
  176    HB2  LEU  28           1HB      LEU  28  -3.702   1.589   6.290
  177    HB3  LEU  28           2HB      LEU  28  -4.271   2.728   5.071
  178    HG   LEU  28           HG       LEU  28  -1.904   3.147   4.437
  179   HD11  LEU  28          1HD1      LEU  28  -1.271   0.771   6.172
  180   HD12  LEU  28          2HD1      LEU  28  -0.970   2.441   6.651
  181   HD13  LEU  28          3HD1      LEU  28  -0.147   1.765   5.246
  182   HD21  LEU  28          3HD2      LEU  28  -2.274   1.622   2.870
  183   HD22  LEU  28          1HD2      LEU  28  -3.535   0.912   3.879
  184   HD23  LEU  28          2HD2      LEU  28  -1.875   0.327   4.000
  185    H    SER  29           H        SER  29  -3.846   5.214   4.850
  186    HA   SER  29           HA       SER  29  -1.347   6.093   4.093
  187    HB2  SER  29           1HB      SER  29  -3.527   6.530   2.902
  188    HB3  SER  29           2HB      SER  29  -3.828   7.821   4.065
  189    HG   SER  29           HG       SER  29  -1.478   7.694   2.492
  190    H    MET  30           H        MET  30  -3.422   7.308   6.667
  191    HA   MET  30           HA       MET  30  -1.753   9.552   7.279
  192    HB2  MET  30           1HB      MET  30  -3.205   9.906   9.160
  193    HB3  MET  30           2HB      MET  30  -4.196   9.453   7.780
  194    HG2  MET  30           1HG      MET  30  -4.401   7.196   8.630
  195    HG3  MET  30           2HG      MET  30  -3.339   7.589   9.980
  196    HE1  MET  30           3HE      MET  30  -4.412   6.974  11.694
  197    HE2  MET  30           1HE      MET  30  -5.452   8.075  12.598
  198    HE3  MET  30           2HE      MET  30  -6.161   6.740  11.691
  199    H    HIS  31           H        HIS  31  -1.641   6.221   7.983
  200    HA   HIS  31           HA       HIS  31  -0.069   6.543  10.408
  201    HB2  HIS  31           1HB      HIS  31  -1.367   4.661  10.664
  202    HB3  HIS  31           2HB      HIS  31  -1.295   4.247   8.954
  203    HD1  HIS  31           HD1      HIS  31   0.623   3.885  12.157
  204    HD2  HIS  31           HD2      HIS  31   0.797   2.569   8.220
  205    HE1  HIS  31           HE1      HIS  31   2.365   2.072  12.131
  206    H    GLN  32           H        GLN  32   0.381   5.174   7.152
  207    HA   GLN  32           HA       GLN  32   2.963   4.357   7.227
  208    HB2  GLN  32           1HB      GLN  32   1.545   5.865   5.033
  209    HB3  GLN  32           2HB      GLN  32   3.129   5.132   4.823
  210    HG2  GLN  32           1HG      GLN  32   2.174   2.940   5.356
  211    HG3  GLN  32           2HG      GLN  32   0.586   3.685   5.529
  212   HE21  GLN  32          1HE2      GLN  32   3.123   2.828   3.295
  213   HE22  GLN  32          2HE2      GLN  32   2.171   2.949   1.859
  214    H    ARG  33           H        ARG  33   1.833   7.596   7.545
  215    HA   ARG  33           HA       ARG  33   3.987   9.115   6.732
  216    HB2  ARG  33           1HB      ARG  33   3.143  10.850   8.067
  217    HB3  ARG  33           2HB      ARG  33   1.730   9.873   7.688
  218    HG2  ARG  33           1HG      ARG  33   1.774   8.864   9.865
  219    HG3  ARG  33           2HG      ARG  33   3.299   9.664  10.248
  220    HD2  ARG  33           1HD      ARG  33   0.938  11.311   9.466
  221    HD3  ARG  33           2HD      ARG  33   1.021  10.644  11.096
  222    HE   ARG  33           HE       ARG  33   2.619  12.778  10.008
  223   HH11  ARG  33          1HH1      ARG  33   2.387  10.317  12.458
  224   HH12  ARG  33          2HH1      ARG  33   3.469  11.117  13.549
  225   HH21  ARG  33          1HH2      ARG  33   4.045  13.841  11.435
  226   HH22  ARG  33          2HH2      ARG  33   4.411  13.122  12.967
  227    H    ILE  34           H        ILE  34   3.541   7.368   9.770
  228    HA   ILE  34           HA       ILE  34   5.722   8.321  11.193
  229    HB   ILE  34           HB       ILE  34   5.629   6.328  12.519
  230   HG12  ILE  34          1HG1      ILE  34   3.799   5.054  10.490
  231   HG13  ILE  34          2HG1      ILE  34   5.542   4.815  10.445
  232   HG21  ILE  34          1HG2      ILE  34   3.712   7.026  13.387
  233   HG22  ILE  34          2HG2      ILE  34   3.370   7.891  11.890
  234   HG23  ILE  34          3HG2      ILE  34   2.808   6.233  12.097
  235   HD11  ILE  34          3HD1      ILE  34   3.542   3.840  12.414
  236   HD12  ILE  34          1HD1      ILE  34   4.875   2.986  11.637
  237   HD13  ILE  34          2HD1      ILE  34   5.199   4.125  12.945
  238    H    HIS  35           H        HIS  35   5.660   6.361   8.386
  239    HA   HIS  35           HA       HIS  35   8.383   5.389   8.797
  240    HB2  HIS  35           1HB      HIS  35   6.437   4.884   6.536
  241    HB3  HIS  35           2HB      HIS  35   8.016   4.124   6.709
  242    HD1  HIS  35           HD1      HIS  35   8.137   3.009   9.390
  243    HD2  HIS  35           HD2      HIS  35   4.544   3.136   7.307
  244    HE1  HIS  35           HE1      HIS  35   6.681   1.257  10.454
  245    H    ARG  36           H        ARG  36   7.441   8.257   8.169
  246    HA   ARG  36           HA       ARG  36   9.240   8.683   5.874
  247    HB2  ARG  36           1HB      ARG  36   6.770  10.208   6.701
  248    HB3  ARG  36           2HB      ARG  36   7.927  10.818   5.525
  249    HG2  ARG  36           1HG      ARG  36   7.516   8.744   4.181
  250    HG3  ARG  36           2HG      ARG  36   6.204   8.365   5.300
  251    HD2  ARG  36           1HD      ARG  36   5.064  10.412   4.720
  252    HD3  ARG  36           2HD      ARG  36   6.414  10.914   3.704
  253    HE   ARG  36           HE       ARG  36   5.479   8.433   2.796
  254   HH11  ARG  36          1HH1      ARG  36   4.466  11.758   2.983
  255   HH12  ARG  36          2HH1      ARG  36   3.459  11.667   1.576
  256   HH21  ARG  36          1HH2      ARG  36   4.157   8.299   0.943
  257   HH22  ARG  36          2HH2      ARG  36   3.283   9.699   0.417
  258    H    GLY  37           H        GLY  37  11.090   8.936   7.145
  259    HA2  GLY  37           1HA      GLY  37  12.664  10.243   8.203
  260    HA3  GLY  37           2HA      GLY  37  11.518  11.574   8.143
  261    H    GLU  38           H        GLU  38  13.069   9.317  10.117
  262    HA   GLU  38           HA       GLU  38  11.326  10.063  12.371
  263    HB2  GLU  38           1HB      GLU  38  11.153   7.634  11.605
  264    HB3  GLU  38           2HB      GLU  38  12.799   7.440  12.190
  265    HG2  GLU  38           1HG      GLU  38  12.052   8.153  14.430
  266    HG3  GLU  38           2HG      GLU  38  10.400   8.235  13.822
  267    H    LYS  39           H        LYS  39  12.369  10.203  14.438
  268    HA   LYS  39           HA       LYS  39  15.138  11.101  14.196
  269    HB2  LYS  39           1HB      LYS  39  13.652  12.669  15.254
  270    HB3  LYS  39           2HB      LYS  39  13.074  11.442  16.374
  271    HG2  LYS  39           1HG      LYS  39  15.353  11.322  17.342
  272    HG3  LYS  39           2HG      LYS  39  15.827  12.658  16.289
  273    HD2  LYS  39           1HD      LYS  39  13.934  13.977  17.323
  274    HD3  LYS  39           2HD      LYS  39  13.794  12.679  18.511
  275    HE2  LYS  39           1HE      LYS  39  16.374  14.133  17.980
  276    HE3  LYS  39           2HE      LYS  39  15.202  14.682  19.176
  277    HZ1  LYS  39           3HZ      LYS  39  16.540  13.384  20.462
  278    HZ2  LYS  39           1HZ      LYS  39  16.922  12.311  19.211
  279    HZ3  LYS  39           2HZ      LYS  39  15.417  12.215  19.977
  280    HA   PRO  40           HA       PRO  40  16.704   7.415  16.059
  281    HB2  PRO  40           1HB      PRO  40  19.165   8.352  16.719
  282    HB3  PRO  40           2HB      PRO  40  18.702   7.951  15.061
  283    HG2  PRO  40           1HG      PRO  40  18.806  10.624  16.404
  284    HG3  PRO  40           2HG      PRO  40  19.345  10.168  14.778
  285    HD2  PRO  40           1HD      PRO  40  16.987  11.419  15.235
  286    HD3  PRO  40           2HD      PRO  40  17.211  10.259  13.910
  287    H    SER  41           H        SER  41  15.787   6.898  17.967
  288    HA   SER  41           HA       SER  41  16.476   8.531  20.320
  289    HB2  SER  41           1HB      SER  41  14.417   7.738  21.353
  290    HB3  SER  41           2HB      SER  41  14.052   8.445  19.779
  291    HG   SER  41           HG       SER  41  14.584   5.720  19.826
  292    H    GLY  42           H        GLY  42  17.676   7.631  21.867
  293    HA2  GLY  42           1HA      GLY  42  18.181   5.804  23.347
  294    HA3  GLY  42           2HA      GLY  42  17.773   4.693  22.048
  295    HA   PRO  43           HA       PRO  43  22.370   4.897  22.224
  296    HB2  PRO  43           1HB      PRO  43  22.721   2.246  21.757
  297    HB3  PRO  43           2HB      PRO  43  22.438   2.908  23.371
  298    HG2  PRO  43           1HG      PRO  43  20.504   1.607  21.492
  299    HG3  PRO  43           2HG      PRO  43  20.682   1.389  23.243
  300    HD2  PRO  43           1HD      PRO  43  18.760   2.957  22.158
  301    HD3  PRO  43           2HD      PRO  43  19.508   3.312  23.729
  302    H    SER  44           H        SER  44  20.011   4.090  19.911
  303    HA   SER  44           HA       SER  44  19.997   3.984  17.638
  304    HB2  SER  44           1HB      SER  44  21.140   6.202  17.962
  305    HB3  SER  44           2HB      SER  44  22.684   5.366  17.795
  306    HG   SER  44           HG       SER  44  21.408   6.361  15.857
  307    H    SER  45           H        SER  45  20.659   1.633  18.661
  308    HA   SER  45           HA       SER  45  23.075   0.445  18.190
  309    HB2  SER  45           1HB      SER  45  21.864  -1.672  17.923
  310    HB3  SER  45           2HB      SER  45  21.155  -0.710  19.219
  311    HG   SER  45           HG       SER  45  19.659   0.047  17.498
  312    H    GLY  46           H        GLY  46  20.864   1.676  15.862
  313    HA2  GLY  46           1HA      GLY  46  21.357   2.090  13.611
  314    HA3  GLY  46           2HA      GLY  46  22.723   0.991  13.732
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1   7.127 -26.813   0.335
    2    HA2  GLY   1           1HA      GLY   1   6.479 -24.260   0.174
    3    HA3  GLY   1           2HA      GLY   1   5.705 -24.843  -1.292
    4    H    SER   2           H        SER   2   3.724 -24.068  -0.299
    5    HA   SER   2           HA       SER   2   2.254 -26.165   0.908
    6    HB2  SER   2           1HB      SER   2   1.722 -25.014   3.057
    7    HB3  SER   2           2HB      SER   2   3.406 -25.523   2.943
    8    HG   SER   2           HG       SER   2   2.429 -22.909   2.419
    9    H    SER   3           H        SER   3   0.003 -25.639   1.184
   10    HA   SER   3           HA       SER   3  -0.827 -23.064   0.049
   11    HB2  SER   3           1HB      SER   3  -1.895 -25.749  -0.858
   12    HB3  SER   3           2HB      SER   3  -2.458 -24.173  -1.411
   13    HG   SER   3           HG       SER   3   0.247 -24.942  -1.657
   14    H    GLY   4           H        GLY   4  -3.238 -22.738   0.305
   15    HA2  GLY   4           1HA      GLY   4  -5.089 -23.948   1.731
   16    HA3  GLY   4           2HA      GLY   4  -3.961 -23.556   3.020
   17    H    SER   5           H        SER   5  -3.461 -21.102   1.038
   18    HA   SER   5           HA       SER   5  -5.161 -19.329   2.552
   19    HB2  SER   5           1HB      SER   5  -2.786 -18.780   1.972
   20    HB3  SER   5           2HB      SER   5  -3.277 -18.645   0.283
   21    HG   SER   5           HG       SER   5  -3.279 -16.717   1.930
   22    H    SER   6           H        SER   6  -6.770 -20.984   1.109
   23    HA   SER   6           HA       SER   6  -7.606 -19.522  -1.280
   24    HB2  SER   6           1HB      SER   6  -7.411 -22.000  -1.375
   25    HB3  SER   6           2HB      SER   6  -8.678 -22.121  -0.154
   26    HG   SER   6           HG       SER   6  -9.372 -20.536  -2.269
   27    H    GLY   7           H        GLY   7  -8.528 -17.672  -0.388
   28    HA2  GLY   7           1HA      GLY   7 -11.156 -17.418  -0.036
   29    HA3  GLY   7           2HA      GLY   7 -10.672 -17.965   1.563
   30    H    THR   8           H        THR   8 -11.769 -15.364   0.443
   31    HA   THR   8           HA       THR   8  -9.761 -13.620   1.708
   32    HB   THR   8           HB       THR   8  -9.736 -13.247  -0.724
   33    HG1  THR   8           HG1      THR   8 -10.567 -10.898  -0.464
   34   HG21  THR   8          3HG2      THR   8 -12.603 -12.357  -0.421
   35   HG22  THR   8          1HG2      THR   8 -12.117 -13.907  -1.106
   36   HG23  THR   8          2HG2      THR   8 -11.650 -12.405  -1.904
   37    H    GLY   9           H        GLY   9 -10.511 -12.403   3.328
   38    HA2  GLY   9           1HA      GLY   9 -13.403 -12.414   3.819
   39    HA3  GLY   9           2HA      GLY   9 -12.158 -12.064   5.008
   40    H    GLU  10           H        GLU  10 -11.409  -9.989   5.252
   41    HA   GLU  10           HA       GLU  10 -12.975  -7.937   3.860
   42    HB2  GLU  10           1HB      GLU  10 -12.291  -6.445   5.696
   43    HB3  GLU  10           2HB      GLU  10 -13.118  -7.879   6.286
   44    HG2  GLU  10           1HG      GLU  10 -10.963  -8.883   6.859
   45    HG3  GLU  10           2HG      GLU  10 -10.142  -7.433   6.284
   46    H    ARG  11           H        ARG  11  -9.688  -8.960   4.544
   47    HA   ARG  11           HA       ARG  11  -7.690  -8.414   3.602
   48    HB2  ARG  11           1HB      ARG  11  -9.036  -8.743   1.493
   49    HB3  ARG  11           2HB      ARG  11  -9.290  -7.003   1.466
   50    HG2  ARG  11           1HG      ARG  11  -6.941  -6.603   1.209
   51    HG3  ARG  11           2HG      ARG  11  -6.584  -8.317   1.427
   52    HD2  ARG  11           1HD      ARG  11  -7.673  -8.873  -0.629
   53    HD3  ARG  11           2HD      ARG  11  -8.291  -7.232  -0.804
   54    HE   ARG  11           HE       ARG  11  -5.412  -7.447  -0.708
   55   HH11  ARG  11          1HH1      ARG  11  -8.255  -7.382  -2.716
   56   HH12  ARG  11          2HH1      ARG  11  -7.398  -6.891  -4.139
   57   HH21  ARG  11          1HH2      ARG  11  -4.272  -6.801  -2.576
   58   HH22  ARG  11          2HH2      ARG  11  -5.132  -6.562  -4.059
   59    H    HIS  12           H        HIS  12  -8.305  -6.859   5.668
   60    HA   HIS  12           HA       HIS  12  -8.586  -4.140   5.392
   61    HB2  HIS  12           1HB      HIS  12  -6.909  -4.158   7.467
   62    HB3  HIS  12           2HB      HIS  12  -8.572  -4.721   7.604
   63    HD1  HIS  12           HD1      HIS  12  -8.270  -6.496   9.355
   64    HD2  HIS  12           HD2      HIS  12  -5.628  -6.918   6.177
   65    HE1  HIS  12           HE1      HIS  12  -7.139  -8.713   9.712
   66    H    TYR  13           H        TYR  13  -7.306  -2.438   4.865
   67    HA   TYR  13           HA       TYR  13  -5.142  -2.808   3.141
   68    HB2  TYR  13           1HB      TYR  13  -6.052  -0.401   4.716
   69    HB3  TYR  13           2HB      TYR  13  -4.717  -0.336   3.571
   70    HD1  TYR  13           HD2      TYR  13  -8.348  -0.964   3.891
   71    HD2  TYR  13           HD1      TYR  13  -5.111  -0.199   1.238
   72    HE1  TYR  13           HE2      TYR  13  -9.946  -0.589   2.059
   73    HE2  TYR  13           HE1      TYR  13  -6.700   0.179  -0.601
   74    HH   TYR  13           HH       TYR  13  -9.027   0.786  -0.927
   75    H    GLU  14           H        GLU  14  -3.437  -3.973   3.869
   76    HA   GLU  14           HA       GLU  14  -2.260  -3.428   6.459
   77    HB2  GLU  14           1HB      GLU  14  -1.907  -5.480   4.338
   78    HB3  GLU  14           2HB      GLU  14  -0.527  -5.154   5.377
   79    HG2  GLU  14           1HG      GLU  14  -2.302  -5.440   7.287
   80    HG3  GLU  14           2HG      GLU  14  -3.167  -6.344   6.046
   81    H    CYS  15           H        CYS  15  -0.364  -2.394   6.855
   82    HA   CYS  15           HA       CYS  15   0.599  -0.577   4.873
   83    HB2  CYS  15           1HB      CYS  15   0.521  -0.046   7.300
   84    HB3  CYS  15           2HB      CYS  15   1.786  -1.239   7.576
   85    H    SER  16           H        SER  16   1.907  -1.134   3.272
   86    HA   SER  16           HA       SER  16   3.556  -3.496   3.428
   87    HB2  SER  16           1HB      SER  16   2.808  -1.544   1.301
   88    HB3  SER  16           2HB      SER  16   4.292  -2.472   1.083
   89    HG   SER  16           HG       SER  16   1.699  -3.270   0.868
   90    H    GLU  17           H        GLU  17   4.299  -1.609   5.348
   91    HA   GLU  17           HA       GLU  17   7.000  -0.928   4.408
   92    HB2  GLU  17           1HB      GLU  17   5.234   0.800   6.152
   93    HB3  GLU  17           2HB      GLU  17   6.926   1.122   5.799
   94    HG2  GLU  17           1HG      GLU  17   5.067   0.777   3.513
   95    HG3  GLU  17           2HG      GLU  17   4.972   2.267   4.449
   96    H    CYS  18           H        CYS  18   4.899  -1.504   7.202
   97    HA   CYS  18           HA       CYS  18   7.250  -2.532   8.653
   98    HB2  CYS  18           1HB      CYS  18   5.889  -1.994  10.738
   99    HB3  CYS  18           2HB      CYS  18   6.523  -0.616   9.843
  100    H    GLY  19           H        GLY  19   3.703  -2.842   8.431
  101    HA2  GLY  19           1HA      GLY  19   3.081  -5.238   7.786
  102    HA3  GLY  19           2HA      GLY  19   3.993  -5.667   9.225
  103    H    LYS  20           H        LYS  20   1.776  -2.946   8.757
  104    HA   LYS  20           HA       LYS  20   0.229  -3.917  11.052
  105    HB2  LYS  20           1HB      LYS  20   1.262  -1.501  10.759
  106    HB3  LYS  20           2HB      LYS  20  -0.207  -1.225   9.832
  107    HG2  LYS  20           1HG      LYS  20  -1.556  -1.356  11.660
  108    HG3  LYS  20           2HG      LYS  20  -0.477  -2.460  12.516
  109    HD2  LYS  20           1HD      LYS  20   1.108  -0.572  12.836
  110    HD3  LYS  20           2HD      LYS  20  -0.083   0.504  12.102
  111    HE2  LYS  20           1HE      LYS  20  -0.548   0.796  14.332
  112    HE3  LYS  20           2HE      LYS  20  -1.668  -0.504  13.926
  113    HZ1  LYS  20           3HZ      LYS  20  -0.735  -1.466  15.713
  114    HZ2  LYS  20           1HZ      LYS  20   0.684  -0.548  15.624
  115    HZ3  LYS  20           2HZ      LYS  20   0.487  -1.900  14.626
  116    H    ALA  21           H        ALA  21  -2.185  -3.082  10.875
  117    HA   ALA  21           HA       ALA  21  -3.256  -3.550   8.195
  118    HB1  ALA  21           3HB      ALA  21  -3.412  -5.743   8.912
  119    HB2  ALA  21           1HB      ALA  21  -3.743  -5.283  10.582
  120    HB3  ALA  21           2HB      ALA  21  -4.992  -5.095   9.351
  121    H    PHE  22           H        PHE  22  -5.064  -2.401   7.761
  122    HA   PHE  22           HA       PHE  22  -6.460  -1.103   9.996
  123    HB2  PHE  22           1HB      PHE  22  -5.644   0.300   7.443
  124    HB3  PHE  22           2HB      PHE  22  -6.527   1.013   8.789
  125    HD1  PHE  22           HD1      PHE  22  -5.401   1.543  10.876
  126    HD2  PHE  22           HD2      PHE  22  -3.274  -0.078   7.565
  127    HE1  PHE  22           HE1      PHE  22  -3.274   2.207  11.921
  128    HE2  PHE  22           HE2      PHE  22  -1.144   0.582   8.605
  129    HZ   PHE  22           HZ       PHE  22  -1.142   1.726  10.786
  130    H    ILE  23           H        ILE  23  -8.646  -0.671   9.663
  131    HA   ILE  23           HA       ILE  23  -9.971  -2.428   7.851
  132    HB   ILE  23           HB       ILE  23 -10.958  -1.930  10.017
  133   HG12  ILE  23          1HG1      ILE  23 -13.249  -1.026   9.087
  134   HG13  ILE  23          2HG1      ILE  23 -12.448  -1.188   7.528
  135   HG21  ILE  23          1HG2      ILE  23 -10.187   0.664   9.526
  136   HG22  ILE  23          2HG2      ILE  23 -11.942   0.733   9.376
  137   HG23  ILE  23          3HG2      ILE  23 -11.207   0.124  10.859
  138   HD11  ILE  23          3HD1      ILE  23 -13.138  -3.320   9.511
  139   HD12  ILE  23          1HD1      ILE  23 -13.601  -3.189   7.815
  140   HD13  ILE  23          2HD1      ILE  23 -11.937  -3.582   8.247
  141    H    GLN  24           H        GLN  24  -9.268   1.011   7.893
  142    HA   GLN  24           HA       GLN  24 -10.519   1.245   5.236
  143    HB2  GLN  24           1HB      GLN  24 -10.409   3.114   7.556
  144    HB3  GLN  24           2HB      GLN  24 -10.391   3.802   5.938
  145    HG2  GLN  24           1HG      GLN  24 -12.461   1.774   6.604
  146    HG3  GLN  24           2HG      GLN  24 -12.637   3.412   7.231
  147   HE21  GLN  24          1HE2      GLN  24 -13.288   5.007   5.900
  148   HE22  GLN  24          2HE2      GLN  24 -13.657   4.792   4.226
  149    H    LYS  25           H        LYS  25  -9.437   2.480   3.649
  150    HA   LYS  25           HA       LYS  25  -6.634   2.144   3.603
  151    HB2  LYS  25           1HB      LYS  25  -7.857   2.137   1.537
  152    HB3  LYS  25           2HB      LYS  25  -8.494   3.747   1.845
  153    HG2  LYS  25           1HG      LYS  25  -6.786   3.958   0.217
  154    HG3  LYS  25           2HG      LYS  25  -6.148   4.606   1.730
  155    HD2  LYS  25           1HD      LYS  25  -5.025   2.435   2.133
  156    HD3  LYS  25           2HD      LYS  25  -5.591   1.882   0.556
  157    HE2  LYS  25           1HE      LYS  25  -3.985   4.399   0.853
  158    HE3  LYS  25           2HE      LYS  25  -3.206   2.822   0.733
  159    HZ1  LYS  25           3HZ      LYS  25  -4.776   2.626  -1.340
  160    HZ2  LYS  25           1HZ      LYS  25  -3.281   3.410  -1.450
  161    HZ3  LYS  25           2HZ      LYS  25  -4.701   4.316  -1.293
  162    H    SER  26           H        SER  26  -8.559   5.150   3.644
  163    HA   SER  26           HA       SER  26  -6.605   7.019   3.864
  164    HB2  SER  26           1HB      SER  26  -9.294   6.887   5.224
  165    HB3  SER  26           2HB      SER  26  -8.248   8.300   5.360
  166    HG   SER  26           HG       SER  26  -8.438   8.658   3.204
  167    H    THR  27           H        THR  27  -8.020   5.226   6.591
  168    HA   THR  27           HA       THR  27  -6.622   6.339   8.680
  169    HB   THR  27           HB       THR  27  -7.409   3.442   8.323
  170    HG1  THR  27           HG1      THR  27  -9.257   4.589   8.410
  171   HG21  THR  27          3HG2      THR  27  -5.615   3.966  10.081
  172   HG22  THR  27          1HG2      THR  27  -7.047   3.087  10.614
  173   HG23  THR  27          2HG2      THR  27  -6.896   4.812  10.948
  174    H    LEU  28           H        LEU  28  -5.597   3.664   6.580
  175    HA   LEU  28           HA       LEU  28  -3.162   3.117   7.851
  176    HB2  LEU  28           1HB      LEU  28  -3.711   1.472   6.376
  177    HB3  LEU  28           2HB      LEU  28  -4.326   2.605   5.174
  178    HG   LEU  28           HG       LEU  28  -1.938   3.198   4.659
  179   HD11  LEU  28          1HD1      LEU  28  -1.095   2.277   6.861
  180   HD12  LEU  28          2HD1      LEU  28  -0.165   1.850   5.425
  181   HD13  LEU  28          3HD1      LEU  28  -1.265   0.674   6.145
  182   HD21  LEU  28          3HD2      LEU  28  -3.405   1.538   3.402
  183   HD22  LEU  28          1HD2      LEU  28  -2.494   0.277   4.233
  184   HD23  LEU  28          2HD2      LEU  28  -1.661   1.407   3.165
  185    H    SER  29           H        SER  29  -3.869   5.219   5.069
  186    HA   SER  29           HA       SER  29  -1.336   6.079   4.448
  187    HB2  SER  29           1HB      SER  29  -3.344   6.702   3.163
  188    HB3  SER  29           2HB      SER  29  -3.852   7.767   4.474
  189    HG   SER  29           HG       SER  29  -2.766   8.931   2.852
  190    H    MET  30           H        MET  30  -3.490   7.334   6.966
  191    HA   MET  30           HA       MET  30  -1.897   9.478   7.802
  192    HB2  MET  30           1HB      MET  30  -3.712   7.802   9.541
  193    HB3  MET  30           2HB      MET  30  -3.200   9.457   9.842
  194    HG2  MET  30           1HG      MET  30  -4.966   8.513   7.596
  195    HG3  MET  30           2HG      MET  30  -5.473   9.403   9.030
  196    HE1  MET  30           3HE      MET  30  -6.223  12.277   7.371
  197    HE2  MET  30           1HE      MET  30  -6.271  11.252   8.806
  198    HE3  MET  30           2HE      MET  30  -5.180  12.637   8.747
  199    H    HIS  31           H        HIS  31  -1.740   6.060   8.520
  200    HA   HIS  31           HA       HIS  31   0.156   6.375  10.669
  201    HB2  HIS  31           1HB      HIS  31  -1.024   4.442  11.026
  202    HB3  HIS  31           2HB      HIS  31  -1.184   4.094   9.307
  203    HD1  HIS  31           HD1      HIS  31   0.672   3.113  12.260
  204    HD2  HIS  31           HD2      HIS  31   1.318   3.049   8.157
  205    HE1  HIS  31           HE1      HIS  31   2.555   1.486  11.902
  206    H    GLN  32           H        GLN  32   0.282   5.122   7.339
  207    HA   GLN  32           HA       GLN  32   2.849   4.347   7.071
  208    HB2  GLN  32           1HB      GLN  32   1.195   5.998   5.165
  209    HB3  GLN  32           2HB      GLN  32   2.764   5.333   4.728
  210    HG2  GLN  32           1HG      GLN  32   1.891   3.071   5.240
  211    HG3  GLN  32           2HG      GLN  32   0.306   3.790   5.519
  212   HE21  GLN  32          1HE2      GLN  32   2.372   2.442   3.255
  213   HE22  GLN  32          2HE2      GLN  32   1.506   2.872   1.824
  214    H    ARG  33           H        ARG  33   1.762   7.575   7.677
  215    HA   ARG  33           HA       ARG  33   3.857   9.128   6.786
  216    HB2  ARG  33           1HB      ARG  33   3.146  10.784   8.294
  217    HB3  ARG  33           2HB      ARG  33   1.697   9.848   7.955
  218    HG2  ARG  33           1HG      ARG  33   1.892   8.689  10.053
  219    HG3  ARG  33           2HG      ARG  33   3.439   9.472  10.379
  220    HD2  ARG  33           1HD      ARG  33   0.883  11.004   9.968
  221    HD3  ARG  33           2HD      ARG  33   1.418  10.445  11.552
  222    HE   ARG  33           HE       ARG  33   2.558  12.597   9.980
  223   HH11  ARG  33          1HH1      ARG  33   2.920  10.428  12.680
  224   HH12  ARG  33          2HH1      ARG  33   4.093  11.417  13.485
  225   HH21  ARG  33          1HH2      ARG  33   4.102  13.908  11.030
  226   HH22  ARG  33          2HH2      ARG  33   4.764  13.397  12.546
  227    H    ILE  34           H        ILE  34   3.616   7.318   9.826
  228    HA   ILE  34           HA       ILE  34   5.852   8.124  11.158
  229    HB   ILE  34           HB       ILE  34   5.973   5.944  12.196
  230   HG12  ILE  34          1HG1      ILE  34   3.899   4.834  10.349
  231   HG13  ILE  34          2HG1      ILE  34   5.583   4.825   9.835
  232   HG21  ILE  34          1HG2      ILE  34   4.221   6.897  13.242
  233   HG22  ILE  34          2HG2      ILE  34   3.392   7.278  11.734
  234   HG23  ILE  34          3HG2      ILE  34   3.298   5.650  12.405
  235   HD11  ILE  34          3HD1      ILE  34   6.044   3.080  11.117
  236   HD12  ILE  34          1HD1      ILE  34   5.289   3.822  12.527
  237   HD13  ILE  34          2HD1      ILE  34   4.307   2.918  11.373
  238    H    HIS  35           H        HIS  35   5.728   6.455   8.158
  239    HA   HIS  35           HA       HIS  35   8.501   5.584   8.301
  240    HB2  HIS  35           1HB      HIS  35   6.478   5.367   6.061
  241    HB3  HIS  35           2HB      HIS  35   8.086   4.648   6.053
  242    HD1  HIS  35           HD1      HIS  35   8.377   2.436   7.238
  243    HD2  HIS  35           HD2      HIS  35   4.654   4.154   7.908
  244    HE1  HIS  35           HE1      HIS  35   7.018   0.665   8.395
  245    H    ARG  36           H        ARG  36   6.513   7.921   6.539
  246    HA   ARG  36           HA       ARG  36   8.980   9.146   5.500
  247    HB2  ARG  36           1HB      ARG  36   7.415  10.258   3.847
  248    HB3  ARG  36           2HB      ARG  36   7.611   8.520   3.668
  249    HG2  ARG  36           1HG      ARG  36   5.368   9.461   5.354
  250    HG3  ARG  36           2HG      ARG  36   5.240   9.710   3.612
  251    HD2  ARG  36           1HD      ARG  36   5.792   7.276   3.326
  252    HD3  ARG  36           2HD      ARG  36   5.637   7.107   5.074
  253    HE   ARG  36           HE       ARG  36   3.348   7.284   4.869
  254   HH11  ARG  36          1HH1      ARG  36   4.882   8.067   1.843
  255   HH12  ARG  36          2HH1      ARG  36   3.403   8.052   0.940
  256   HH21  ARG  36          1HH2      ARG  36   1.395   7.262   3.691
  257   HH22  ARG  36          2HH2      ARG  36   1.420   7.595   1.993
  258    H    GLY  37           H        GLY  37   9.467  10.440   7.267
  259    HA2  GLY  37           1HA      GLY  37   7.566  12.082   8.593
  260    HA3  GLY  37           2HA      GLY  37   9.314  12.238   8.692
  261    H    GLU  38           H        GLU  38  10.344  13.789   7.517
  262    HA   GLU  38           HA       GLU  38   9.270  16.141   6.878
  263    HB2  GLU  38           1HB      GLU  38  11.421  14.732   5.292
  264    HB3  GLU  38           2HB      GLU  38  11.056  16.446   5.155
  265    HG2  GLU  38           1HG      GLU  38  11.601  16.725   7.540
  266    HG3  GLU  38           2HG      GLU  38  12.039  15.019   7.616
  267    H    LYS  39           H        LYS  39   8.321  17.189   5.128
  268    HA   LYS  39           HA       LYS  39   6.683  17.325   3.531
  269    HB2  LYS  39           1HB      LYS  39   8.917  15.750   2.308
  270    HB3  LYS  39           2HB      LYS  39   7.449  16.029   1.381
  271    HG2  LYS  39           1HG      LYS  39   7.744  18.396   1.494
  272    HG3  LYS  39           2HG      LYS  39   9.084  18.225   2.630
  273    HD2  LYS  39           1HD      LYS  39  10.335  16.988   0.865
  274    HD3  LYS  39           2HD      LYS  39   9.024  17.355  -0.259
  275    HE2  LYS  39           1HE      LYS  39   9.416  19.797   0.316
  276    HE3  LYS  39           2HE      LYS  39  10.903  19.270   1.104
  277    HZ1  LYS  39           3HZ      LYS  39  10.927  20.020  -1.369
  278    HZ2  LYS  39           1HZ      LYS  39  10.383  18.446  -1.667
  279    HZ3  LYS  39           2HZ      LYS  39  11.860  18.696  -0.881
  280    HA   PRO  40           HA       PRO  40   5.018  13.025   4.563
  281    HB2  PRO  40           1HB      PRO  40   3.115  13.835   6.322
  282    HB3  PRO  40           2HB      PRO  40   4.763  13.422   6.812
  283    HG2  PRO  40           1HG      PRO  40   3.548  16.116   6.332
  284    HG3  PRO  40           2HG      PRO  40   4.625  15.591   7.639
  285    HD2  PRO  40           1HD      PRO  40   5.510  16.987   5.493
  286    HD3  PRO  40           2HD      PRO  40   6.513  15.785   6.330
  287    H    SER  41           H        SER  41   3.790  16.102   3.586
  288    HA   SER  41           HA       SER  41   1.743  14.772   1.985
  289    HB2  SER  41           1HB      SER  41   1.112  17.172   3.718
  290    HB3  SER  41           2HB      SER  41  -0.005  16.327   2.646
  291    HG   SER  41           HG       SER  41  -0.387  15.032   4.241
  292    H    GLY  42           H        GLY  42   2.415  15.294  -0.001
  293    HA2  GLY  42           1HA      GLY  42   3.083  18.127  -0.518
  294    HA3  GLY  42           2HA      GLY  42   3.873  16.788  -1.336
  295    HA   PRO  43           HA       PRO  43   0.969  17.063  -4.605
  296    HB2  PRO  43           1HB      PRO  43   0.829  14.475  -5.411
  297    HB3  PRO  43           2HB      PRO  43   2.238  15.498  -5.709
  298    HG2  PRO  43           1HG      PRO  43   1.805  13.447  -3.572
  299    HG3  PRO  43           2HG      PRO  43   3.246  13.745  -4.561
  300    HD2  PRO  43           1HD      PRO  43   3.017  14.636  -2.014
  301    HD3  PRO  43           2HD      PRO  43   3.929  15.518  -3.256
  302    H    SER  44           H        SER  44  -1.186  16.656  -5.190
  303    HA   SER  44           HA       SER  44  -3.404  16.435  -4.690
  304    HB2  SER  44           1HB      SER  44  -2.207  13.757  -4.067
  305    HB3  SER  44           2HB      SER  44  -3.921  14.038  -3.762
  306    HG   SER  44           HG       SER  44  -4.049  13.493  -5.805
  307    H    SER  45           H        SER  45  -2.047  17.853  -2.732
  308    HA   SER  45           HA       SER  45  -2.208  17.057  -0.116
  309    HB2  SER  45           1HB      SER  45  -1.395  19.298  -1.097
  310    HB3  SER  45           2HB      SER  45  -3.071  19.824  -0.943
  311    HG   SER  45           HG       SER  45  -2.759  18.976   1.341
  312    H    GLY  46           H        GLY  46  -3.766  17.201   1.531
  313    HA2  GLY  46           1HA      GLY  46  -6.080  17.953   2.096
  314    HA3  GLY  46           2HA      GLY  46  -6.551  17.282   0.541
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1  -0.575 -29.313 -13.869
    2    HA2  GLY   1           1HA      GLY   1  -2.724 -30.643 -12.350
    3    HA3  GLY   1           2HA      GLY   1  -1.122 -30.283 -11.723
    4    H    SER   2           H        SER   2  -4.032 -29.537 -11.010
    5    HA   SER   2           HA       SER   2  -3.604 -26.628 -10.835
    6    HB2  SER   2           1HB      SER   2  -6.039 -26.411 -10.598
    7    HB3  SER   2           2HB      SER   2  -5.629 -27.260 -12.088
    8    HG   SER   2           HG       SER   2  -7.351 -28.151 -10.612
    9    H    SER   3           H        SER   3  -2.445 -26.529  -8.945
   10    HA   SER   3           HA       SER   3  -3.720 -27.653  -6.541
   11    HB2  SER   3           1HB      SER   3  -0.849 -26.997  -7.181
   12    HB3  SER   3           2HB      SER   3  -1.397 -27.224  -5.520
   13    HG   SER   3           HG       SER   3  -2.213 -29.196  -7.247
   14    H    GLY   4           H        GLY   4  -3.619 -26.363  -4.571
   15    HA2  GLY   4           1HA      GLY   4  -4.209 -23.572  -5.159
   16    HA3  GLY   4           2HA      GLY   4  -4.511 -24.404  -3.641
   17    H    SER   5           H        SER   5  -1.884 -23.153  -5.675
   18    HA   SER   5           HA       SER   5  -0.337 -22.664  -3.214
   19    HB2  SER   5           1HB      SER   5   0.632 -24.257  -4.954
   20    HB3  SER   5           2HB      SER   5   0.818 -22.848  -5.998
   21    HG   SER   5           HG       SER   5   2.011 -23.295  -3.465
   22    H    SER   6           H        SER   6  -1.390 -20.655  -2.863
   23    HA   SER   6           HA       SER   6  -0.126 -18.465  -4.244
   24    HB2  SER   6           1HB      SER   6  -2.291 -17.342  -4.810
   25    HB3  SER   6           2HB      SER   6  -1.982 -18.796  -5.758
   26    HG   SER   6           HG       SER   6  -4.038 -19.022  -5.076
   27    H    GLY   7           H        GLY   7  -0.457 -16.417  -3.180
   28    HA2  GLY   7           1HA      GLY   7  -0.835 -16.763  -0.325
   29    HA3  GLY   7           2HA      GLY   7  -0.247 -15.318  -1.134
   30    H    THR   8           H        THR   8  -2.935 -16.882   0.264
   31    HA   THR   8           HA       THR   8  -4.707 -14.703  -0.632
   32    HB   THR   8           HB       THR   8  -6.605 -16.220  -0.083
   33    HG1  THR   8           HG1      THR   8  -5.429 -18.569  -0.188
   34   HG21  THR   8          3HG2      THR   8  -6.381 -17.645  -2.057
   35   HG22  THR   8          1HG2      THR   8  -4.647 -17.327  -2.100
   36   HG23  THR   8          2HG2      THR   8  -5.791 -16.016  -2.389
   37    H    GLY   9           H        GLY   9  -6.157 -13.795   0.908
   38    HA2  GLY   9           1HA      GLY   9  -6.976 -13.840   3.240
   39    HA3  GLY   9           2HA      GLY   9  -5.330 -14.238   3.711
   40    H    GLU  10           H        GLU  10  -6.491 -11.801   1.408
   41    HA   GLU  10           HA       GLU  10  -5.393  -9.721   3.179
   42    HB2  GLU  10           1HB      GLU  10  -4.880 -10.209   0.274
   43    HB3  GLU  10           2HB      GLU  10  -4.882  -8.556   0.873
   44    HG2  GLU  10           1HG      GLU  10  -3.248  -9.514   2.668
   45    HG3  GLU  10           2HG      GLU  10  -3.006 -10.788   1.475
   46    H    ARG  11           H        ARG  11  -7.572  -9.389   3.888
   47    HA   ARG  11           HA       ARG  11  -9.295  -8.083   1.887
   48    HB2  ARG  11           1HB      ARG  11 -10.045  -9.422   4.493
   49    HB3  ARG  11           2HB      ARG  11 -11.170  -8.583   3.434
   50    HG2  ARG  11           1HG      ARG  11 -10.626 -10.197   1.642
   51    HG3  ARG  11           2HG      ARG  11  -9.601 -11.068   2.785
   52    HD2  ARG  11           1HD      ARG  11 -11.704 -12.181   2.728
   53    HD3  ARG  11           2HD      ARG  11 -11.611 -11.313   4.260
   54    HE   ARG  11           HE       ARG  11 -12.896  -9.550   2.708
   55   HH11  ARG  11          1HH1      ARG  11 -13.387 -12.955   3.241
   56   HH12  ARG  11          2HH1      ARG  11 -15.096 -12.885   2.966
   57   HH21  ARG  11          1HH2      ARG  11 -15.145  -9.445   2.343
   58   HH22  ARG  11          2HH2      ARG  11 -16.095 -10.888   2.454
   59    H    HIS  12           H        HIS  12  -7.240  -6.593   2.932
   60    HA   HIS  12           HA       HIS  12  -8.595  -4.353   3.969
   61    HB2  HIS  12           1HB      HIS  12  -7.239  -4.328   6.181
   62    HB3  HIS  12           2HB      HIS  12  -8.708  -5.297   6.100
   63    HD1  HIS  12           HD1      HIS  12  -8.169  -7.180   7.646
   64    HD2  HIS  12           HD2      HIS  12  -5.128  -6.468   4.906
   65    HE1  HIS  12           HE1      HIS  12  -6.523  -9.054   7.966
   66    H    TYR  13           H        TYR  13  -7.044  -2.580   4.580
   67    HA   TYR  13           HA       TYR  13  -4.828  -2.628   2.710
   68    HB2  TYR  13           1HB      TYR  13  -5.703  -0.348   4.486
   69    HB3  TYR  13           2HB      TYR  13  -4.703  -0.253   3.041
   70    HD1  TYR  13           HD2      TYR  13  -8.130  -1.032   4.233
   71    HD2  TYR  13           HD1      TYR  13  -5.680   0.021   0.918
   72    HE1  TYR  13           HE2      TYR  13 -10.144  -0.649   2.874
   73    HE2  TYR  13           HE1      TYR  13  -7.686   0.408  -0.450
   74    HH   TYR  13           HH       TYR  13  -9.902   0.416  -0.509
   75    H    GLU  14           H        GLU  14  -3.272  -3.931   3.641
   76    HA   GLU  14           HA       GLU  14  -2.318  -3.284   6.320
   77    HB2  GLU  14           1HB      GLU  14  -1.930  -5.564   4.430
   78    HB3  GLU  14           2HB      GLU  14  -0.699  -5.264   5.649
   79    HG2  GLU  14           1HG      GLU  14  -2.510  -5.353   7.373
   80    HG3  GLU  14           2HG      GLU  14  -3.605  -5.883   6.098
   81    H    CYS  15           H        CYS  15  -0.409  -2.321   6.764
   82    HA   CYS  15           HA       CYS  15   0.863  -0.785   4.762
   83    HB2  CYS  15           1HB      CYS  15   0.774  -0.138   7.152
   84    HB3  CYS  15           2HB      CYS  15   1.867  -1.464   7.534
   85    H    SER  16           H        SER  16   3.077  -0.890   4.067
   86    HA   SER  16           HA       SER  16   3.998  -3.662   3.778
   87    HB2  SER  16           1HB      SER  16   4.599  -1.183   2.150
   88    HB3  SER  16           2HB      SER  16   5.350  -2.754   1.872
   89    HG   SER  16           HG       SER  16   2.874  -3.339   1.897
   90    H    GLU  17           H        GLU  17   4.927  -0.512   4.949
   91    HA   GLU  17           HA       GLU  17   7.694  -0.949   5.223
   92    HB2  GLU  17           1HB      GLU  17   5.743   0.898   6.566
   93    HB3  GLU  17           2HB      GLU  17   7.421   0.833   7.088
   94    HG2  GLU  17           1HG      GLU  17   6.677   1.303   4.224
   95    HG3  GLU  17           2HG      GLU  17   6.769   2.619   5.393
   96    H    CYS  18           H        CYS  18   5.242  -0.937   7.817
   97    HA   CYS  18           HA       CYS  18   6.999  -2.600   9.447
   98    HB2  CYS  18           1HB      CYS  18   5.387  -2.131  11.261
   99    HB3  CYS  18           2HB      CYS  18   6.006  -0.656  10.525
  100    H    GLY  19           H        GLY  19   3.686  -2.634   8.160
  101    HA2  GLY  19           1HA      GLY  19   2.850  -4.704   7.194
  102    HA3  GLY  19           2HA      GLY  19   3.728  -5.572   8.445
  103    H    LYS  20           H        LYS  20   1.802  -2.684   8.989
  104    HA   LYS  20           HA       LYS  20   0.257  -4.070  10.993
  105    HB2  LYS  20           1HB      LYS  20   1.120  -1.653  11.111
  106    HB3  LYS  20           2HB      LYS  20  -0.215  -1.253  10.039
  107    HG2  LYS  20           1HG      LYS  20  -1.810  -1.677  11.641
  108    HG3  LYS  20           2HG      LYS  20  -0.755  -2.757  12.557
  109    HD2  LYS  20           1HD      LYS  20   0.505  -0.932  13.414
  110    HD3  LYS  20           2HD      LYS  20  -0.259   0.203  12.300
  111    HE2  LYS  20           1HE      LYS  20  -1.283   0.555  14.400
  112    HE3  LYS  20           2HE      LYS  20  -2.447  -0.353  13.435
  113    HZ1  LYS  20           3HZ      LYS  20  -1.754  -1.021  15.912
  114    HZ2  LYS  20           1HZ      LYS  20  -0.626  -1.940  15.047
  115    HZ3  LYS  20           2HZ      LYS  20  -2.281  -2.145  14.762
  116    H    ALA  21           H        ALA  21  -2.187  -3.554  11.040
  117    HA   ALA  21           HA       ALA  21  -3.339  -3.817   8.347
  118    HB1  ALA  21           3HB      ALA  21  -3.327  -6.046   9.097
  119    HB2  ALA  21           1HB      ALA  21  -3.834  -5.588  10.723
  120    HB3  ALA  21           2HB      ALA  21  -4.971  -5.472   9.380
  121    H    PHE  22           H        PHE  22  -4.939  -2.429   7.988
  122    HA   PHE  22           HA       PHE  22  -6.335  -1.274  10.313
  123    HB2  PHE  22           1HB      PHE  22  -5.838   0.127   7.683
  124    HB3  PHE  22           2HB      PHE  22  -6.480   0.830   9.164
  125    HD1  PHE  22           HD2      PHE  22  -3.465  -0.449   7.504
  126    HD2  PHE  22           HD1      PHE  22  -5.039   1.502  10.944
  127    HE1  PHE  22           HE2      PHE  22  -1.187   0.181   8.186
  128    HE2  PHE  22           HE1      PHE  22  -2.763   2.136  11.631
  129    HZ   PHE  22           HZ       PHE  22  -0.833   1.474  10.252
  130    H    ILE  23           H        ILE  23  -8.435  -0.090   9.408
  131    HA   ILE  23           HA       ILE  23  -9.922  -2.174   7.972
  132    HB   ILE  23           HB       ILE  23 -10.932  -1.738  10.067
  133   HG12  ILE  23          1HG1      ILE  23 -12.524  -0.041   8.145
  134   HG13  ILE  23          2HG1      ILE  23 -12.423  -1.792   8.004
  135   HG21  ILE  23          1HG2      ILE  23 -11.600   0.547  10.770
  136   HG22  ILE  23          2HG2      ILE  23  -9.855   0.330  10.644
  137   HG23  ILE  23          3HG2      ILE  23 -10.730   1.189   9.377
  138   HD11  ILE  23          3HD1      ILE  23 -14.246  -1.793   9.283
  139   HD12  ILE  23          1HD1      ILE  23 -13.133  -1.479  10.614
  140   HD13  ILE  23          2HD1      ILE  23 -13.977  -0.140   9.835
  141    H    GLN  24           H        GLN  24  -9.292   1.300   8.004
  142    HA   GLN  24           HA       GLN  24 -10.590   1.504   5.369
  143    HB2  GLN  24           1HB      GLN  24 -10.159   3.557   7.534
  144    HB3  GLN  24           2HB      GLN  24 -10.613   3.997   5.893
  145    HG2  GLN  24           1HG      GLN  24 -12.570   2.358   6.232
  146    HG3  GLN  24           2HG      GLN  24 -12.190   2.505   7.947
  147   HE21  GLN  24          1HE2      GLN  24 -14.369   3.378   8.067
  148   HE22  GLN  24          2HE2      GLN  24 -14.622   5.055   7.738
  149    H    LYS  25           H        LYS  25  -9.552   2.674   3.715
  150    HA   LYS  25           HA       LYS  25  -6.788   2.265   3.495
  151    HB2  LYS  25           1HB      LYS  25  -8.231   2.438   1.540
  152    HB3  LYS  25           2HB      LYS  25  -8.594   4.114   1.927
  153    HG2  LYS  25           1HG      LYS  25  -7.003   4.414   0.330
  154    HG3  LYS  25           2HG      LYS  25  -5.979   4.367   1.767
  155    HD2  LYS  25           1HD      LYS  25  -5.500   2.015   1.372
  156    HD3  LYS  25           2HD      LYS  25  -6.574   2.015  -0.029
  157    HE2  LYS  25           1HE      LYS  25  -4.249   3.901   0.153
  158    HE3  LYS  25           2HE      LYS  25  -4.039   2.247  -0.420
  159    HZ1  LYS  25           3HZ      LYS  25  -5.942   2.824  -2.011
  160    HZ2  LYS  25           1HZ      LYS  25  -4.408   3.456  -2.344
  161    HZ3  LYS  25           2HZ      LYS  25  -5.593   4.437  -1.641
  162    H    SER  26           H        SER  26  -8.647   5.190   4.238
  163    HA   SER  26           HA       SER  26  -6.544   7.019   4.277
  164    HB2  SER  26           1HB      SER  26  -8.851   7.764   4.362
  165    HB3  SER  26           2HB      SER  26  -9.087   6.972   5.920
  166    HG   SER  26           HG       SER  26  -7.289   8.419   6.622
  167    H    THR  27           H        THR  27  -7.868   5.047   6.919
  168    HA   THR  27           HA       THR  27  -6.342   5.965   9.021
  169    HB   THR  27           HB       THR  27  -7.211   3.119   8.485
  170    HG1  THR  27           HG1      THR  27  -8.903   4.703   8.655
  171   HG21  THR  27          3HG2      THR  27  -5.343   3.559  10.228
  172   HG22  THR  27          1HG2      THR  27  -6.727   2.572  10.695
  173   HG23  THR  27          2HG2      THR  27  -6.639   4.260  11.197
  174    H    LEU  28           H        LEU  28  -5.428   3.778   6.433
  175    HA   LEU  28           HA       LEU  28  -2.937   3.005   7.615
  176    HB2  LEU  28           1HB      LEU  28  -3.697   1.431   6.121
  177    HB3  LEU  28           2HB      LEU  28  -4.255   2.642   4.968
  178    HG   LEU  28           HG       LEU  28  -1.821   3.103   4.465
  179   HD11  LEU  28          1HD1      LEU  28  -0.985   2.023   6.559
  180   HD12  LEU  28          2HD1      LEU  28  -0.177   1.495   5.084
  181   HD13  LEU  28          3HD1      LEU  28  -1.387   0.462   5.844
  182   HD21  LEU  28          3HD2      LEU  28  -3.168   1.861   2.916
  183   HD22  LEU  28          1HD2      LEU  28  -2.998   0.391   3.876
  184   HD23  LEU  28          2HD2      LEU  28  -1.596   1.070   3.049
  185    H    SER  29           H        SER  29  -3.876   5.242   5.018
  186    HA   SER  29           HA       SER  29  -1.335   6.117   4.298
  187    HB2  SER  29           1HB      SER  29  -3.711   6.637   3.293
  188    HB3  SER  29           2HB      SER  29  -3.622   8.052   4.342
  189    HG   SER  29           HG       SER  29  -2.766   8.552   2.321
  190    H    MET  30           H        MET  30  -3.515   7.325   6.815
  191    HA   MET  30           HA       MET  30  -1.888   9.495   7.614
  192    HB2  MET  30           1HB      MET  30  -3.325   9.680   9.515
  193    HB3  MET  30           2HB      MET  30  -4.324   9.217   8.145
  194    HG2  MET  30           1HG      MET  30  -4.670   7.081   8.945
  195    HG3  MET  30           2HG      MET  30  -3.236   7.123   9.969
  196    HE1  MET  30           3HE      MET  30  -4.631   7.714  13.294
  197    HE2  MET  30           1HE      MET  30  -4.409   6.292  12.274
  198    HE3  MET  30           2HE      MET  30  -3.188   7.565  12.289
  199    H    HIS  31           H        HIS  31  -1.587   6.140   8.065
  200    HA   HIS  31           HA       HIS  31   0.038   6.390  10.473
  201    HB2  HIS  31           1HB      HIS  31  -1.170   4.458  10.714
  202    HB3  HIS  31           2HB      HIS  31  -1.215   4.142   8.982
  203    HD1  HIS  31           HD1      HIS  31   0.877   3.580  12.031
  204    HD2  HIS  31           HD2      HIS  31   0.906   2.614   7.990
  205    HE1  HIS  31           HE1      HIS  31   2.659   1.825  11.772
  206    H    GLN  32           H        GLN  32   0.446   4.873   7.266
  207    HA   GLN  32           HA       GLN  32   3.063   4.273   7.236
  208    HB2  GLN  32           1HB      GLN  32   1.299   5.432   5.118
  209    HB3  GLN  32           2HB      GLN  32   3.009   5.206   4.776
  210    HG2  GLN  32           1HG      GLN  32   2.588   2.793   5.645
  211    HG3  GLN  32           2HG      GLN  32   0.899   3.167   5.305
  212   HE21  GLN  32          1HE2      GLN  32   0.685   4.325   3.067
  213   HE22  GLN  32          2HE2      GLN  32   1.483   3.517   1.766
  214    H    ARG  33           H        ARG  33   1.737   7.475   7.358
  215    HA   ARG  33           HA       ARG  33   3.778   9.064   6.443
  216    HB2  ARG  33           1HB      ARG  33   2.951  10.800   7.888
  217    HB3  ARG  33           2HB      ARG  33   1.580   9.863   7.309
  218    HG2  ARG  33           1HG      ARG  33   1.566   8.629   9.448
  219    HG3  ARG  33           2HG      ARG  33   2.869   9.671  10.022
  220    HD2  ARG  33           1HD      ARG  33   0.516  10.307  10.720
  221    HD3  ARG  33           2HD      ARG  33   1.493  11.581   9.991
  222    HE   ARG  33           HE       ARG  33  -0.123  10.192   8.081
  223   HH11  ARG  33          1HH1      ARG  33  -0.108  12.723  10.471
  224   HH12  ARG  33          2HH1      ARG  33  -1.420  13.593   9.747
  225   HH21  ARG  33          1HH2      ARG  33  -1.850  11.329   7.118
  226   HH22  ARG  33          2HH2      ARG  33  -2.410  12.799   7.840
  227    H    ILE  34           H        ILE  34   3.473   7.607   9.666
  228    HA   ILE  34           HA       ILE  34   5.649   8.709  10.931
  229    HB   ILE  34           HB       ILE  34   5.712   6.793  12.372
  230   HG12  ILE  34          1HG1      ILE  34   3.933   5.329  10.419
  231   HG13  ILE  34          2HG1      ILE  34   5.681   5.130  10.456
  232   HG21  ILE  34          1HG2      ILE  34   3.020   6.425  12.415
  233   HG22  ILE  34          2HG2      ILE  34   3.856   7.807  13.121
  234   HG23  ILE  34          3HG2      ILE  34   3.152   7.932  11.509
  235   HD11  ILE  34          3HD1      ILE  34   4.260   3.417  11.689
  236   HD12  ILE  34          1HD1      ILE  34   5.633   4.110  12.552
  237   HD13  ILE  34          2HD1      ILE  34   3.998   4.680  12.891
  238    H    HIS  35           H        HIS  35   5.592   6.268   8.439
  239    HA   HIS  35           HA       HIS  35   8.321   5.459   8.778
  240    HB2  HIS  35           1HB      HIS  35   6.350   5.042   6.526
  241    HB3  HIS  35           2HB      HIS  35   7.971   4.353   6.545
  242    HD1  HIS  35           HD1      HIS  35   8.263   3.152   9.227
  243    HD2  HIS  35           HD2      HIS  35   4.650   3.057   7.178
  244    HE1  HIS  35           HE1      HIS  35   6.977   1.233  10.221
  245    H    ARG  36           H        ARG  36   6.622   7.858   6.884
  246    HA   ARG  36           HA       ARG  36   8.976   8.501   5.313
  247    HB2  ARG  36           1HB      ARG  36   6.148   9.511   5.378
  248    HB3  ARG  36           2HB      ARG  36   7.397  10.397   4.515
  249    HG2  ARG  36           1HG      ARG  36   7.796   8.557   3.052
  250    HG3  ARG  36           2HG      ARG  36   6.754   7.503   4.010
  251    HD2  ARG  36           1HD      ARG  36   4.820   8.856   3.431
  252    HD3  ARG  36           2HD      ARG  36   5.847   9.968   2.528
  253    HE   ARG  36           HE       ARG  36   4.914   7.375   1.675
  254   HH11  ARG  36          1HH1      ARG  36   7.264   9.901   1.213
  255   HH12  ARG  36          2HH1      ARG  36   7.624   9.446  -0.420
  256   HH21  ARG  36          1HH2      ARG  36   5.379   6.766  -0.473
  257   HH22  ARG  36          2HH2      ARG  36   6.551   7.663  -1.378
  258    H    GLY  37           H        GLY  37   9.426   8.789   8.048
  259    HA2  GLY  37           1HA      GLY  37   9.905  10.343   9.716
  260    HA3  GLY  37           2HA      GLY  37  10.802  11.050   8.380
  261    H    GLU  38           H        GLU  38   7.316  10.852   9.082
  262    HA   GLU  38           HA       GLU  38   6.740  13.419   8.118
  263    HB2  GLU  38           1HB      GLU  38   5.138  11.467   8.592
  264    HB3  GLU  38           2HB      GLU  38   5.128  12.040  10.254
  265    HG2  GLU  38           1HG      GLU  38   3.240  12.995   9.266
  266    HG3  GLU  38           2HG      GLU  38   4.432  14.292   9.320
  267    H    LYS  39           H        LYS  39   6.670  12.374  11.530
  268    HA   LYS  39           HA       LYS  39   7.220  15.147  12.316
  269    HB2  LYS  39           1HB      LYS  39   5.925  12.818  13.686
  270    HB3  LYS  39           2HB      LYS  39   6.618  14.117  14.648
  271    HG2  LYS  39           1HG      LYS  39   4.447  14.814  14.458
  272    HG3  LYS  39           2HG      LYS  39   5.186  15.645  13.087
  273    HD2  LYS  39           1HD      LYS  39   3.197  14.699  12.251
  274    HD3  LYS  39           2HD      LYS  39   4.492  13.638  11.690
  275    HE2  LYS  39           1HE      LYS  39   3.993  12.017  13.357
  276    HE3  LYS  39           2HE      LYS  39   2.906  13.121  14.197
  277    HZ1  LYS  39           3HZ      LYS  39   2.319  11.321  12.112
  278    HZ2  LYS  39           1HZ      LYS  39   1.983  12.894  11.587
  279    HZ3  LYS  39           2HZ      LYS  39   1.258  12.300  12.994
  280    HA   PRO  40           HA       PRO  40  11.289  14.268  13.709
  281    HB2  PRO  40           1HB      PRO  40  11.477  15.890  15.878
  282    HB3  PRO  40           2HB      PRO  40  11.474  16.500  14.219
  283    HG2  PRO  40           1HG      PRO  40   9.228  16.370  16.194
  284    HG3  PRO  40           2HG      PRO  40   9.672  17.685  15.090
  285    HD2  PRO  40           1HD      PRO  40   7.654  15.959  14.561
  286    HD3  PRO  40           2HD      PRO  40   8.651  16.683  13.283
  287    H    SER  41           H        SER  41  12.567  13.599  15.661
  288    HA   SER  41           HA       SER  41  10.946  11.785  17.314
  289    HB2  SER  41           1HB      SER  41  12.924  11.025  15.727
  290    HB3  SER  41           2HB      SER  41  13.915  11.510  17.102
  291    HG   SER  41           HG       SER  41  13.279   9.291  17.174
  292    H    GLY  42           H        GLY  42  11.051  14.461  18.070
  293    HA2  GLY  42           1HA      GLY  42  11.681  15.885  19.777
  294    HA3  GLY  42           2HA      GLY  42  11.540  14.421  20.739
  295    HA   PRO  43           HA       PRO  43  15.853  15.908  21.290
  296    HB2  PRO  43           1HB      PRO  43  15.986  15.203  23.908
  297    HB3  PRO  43           2HB      PRO  43  15.310  16.742  23.360
  298    HG2  PRO  43           1HG      PRO  43  13.895  14.224  24.149
  299    HG3  PRO  43           2HG      PRO  43  13.498  15.905  24.554
  300    HD2  PRO  43           1HD      PRO  43  12.219  14.536  22.598
  301    HD3  PRO  43           2HD      PRO  43  12.488  16.289  22.518
  302    H    SER  44           H        SER  44  14.333  12.998  21.044
  303    HA   SER  44           HA       SER  44  16.788  11.481  21.639
  304    HB2  SER  44           1HB      SER  44  15.283   9.484  21.799
  305    HB3  SER  44           2HB      SER  44  14.969  10.709  23.028
  306    HG   SER  44           HG       SER  44  12.993  10.354  22.283
  307    H    SER  45           H        SER  45  17.643  12.026  19.561
  308    HA   SER  45           HA       SER  45  16.296  10.695  17.307
  309    HB2  SER  45           1HB      SER  45  16.812  13.206  17.197
  310    HB3  SER  45           2HB      SER  45  18.505  12.733  17.054
  311    HG   SER  45           HG       SER  45  17.324  13.040  15.028
  312    H    GLY  46           H        GLY  46  17.077   8.625  17.527
  313    HA2  GLY  46           1HA      GLY  46  19.079   7.551  16.289
  314    HA3  GLY  46           2HA      GLY  46  19.997   8.278  17.599