*HEADER    TRANSCRIPTION                           29-MAR-07   2EOL              
*TITLE     SOLUTION STRUCTURE OF THE C2H2 TYPE ZINC FINGER (REGION 581-          
*TITLE    2 609) OF HUMAN ZINC FINGER PROTEIN 268                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER PROTEIN 268;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZF-C2H2 DOMAIN;                                            
*COMPND   5 SYNONYM: ZINC FINGER PROTEIN HZF3;                                   
*COMPND   6 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: ZNF268;                                                        
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P061218-12;                               
*SOURCE   8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
*KEYWDS    ZF-C2H2, NMR, STRUCTURAL GENOMICS, NPPSFA, NATIONAL PROJECT           
*KEYWDS   2 ON PROTEIN STRUCTURAL AND FUNCTIONAL ANALYSES, RIKEN                 
*KEYWDS   3 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI,                     
*KEYWDS   4 TRANSCRIPTION                                                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    N.TOCHIO, T.TOMIZAWA, H.ABE, K.SAITO, H.LI, M.SATO,                   
*AUTHOR   2 S.KOSHIBA, N.KOBAYASHI, T.KIGAWA, S.YOKOYAMA, RIKEN                  
*AUTHOR   3 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI)                     
*REVDAT   1   12-MAY-09 2EOL    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.
**************************************************************

13 CYSS SG   201 ZN   ZN   2.19  5.00E+00
13 CYSS CB   201 ZN   ZN   3.25  5.00E+00
16 CYSS SG   201 ZN   ZN   2.19  5.00E+00
16 CYSS CB   201 ZN   ZN   3.25  5.00E+00
29 HIS NE2   201 ZN   ZN   1.90  5.00E+00
33 HIS NE2   201 ZN   ZN   1.90  5.00E+00
13 CYSS SG  16 CYSS SG   3.56  5.00E+00
13 CYSS SG  29 HIS NE2   3.32  5.00E+00
13 CYSS SG  33 HIS NE2   3.32  5.00E+00
16 CYSS SG  29 HIS NE2   3.32  5.00E+00
16 CYSS SG  33 HIS NE2   3.32  5.00E+00
29 HIS NE2  33 HIS NE2   3.00  5.00E+00

13 CYSS SG   201 ZN   ZN   2.39  5.00E+00
13 CYSS CB   201 ZN   ZN   3.51  5.00E+00
16 CYSS SG   201 ZN   ZN   2.39  5.00E+00
16 CYSS CB   201 ZN   ZN   3.51  5.00E+00
29 HIS NE2   201 ZN   ZN   2.10  5.00E+00
33 HIS NE2   201 ZN   ZN   2.10  5.00E+00
13 CYSS SG  16 CYSS SG   3.96  5.00E+00
13 CYSS SG  29 HIS NE2   3.72  5.00E+00
13 CYSS SG  33 HIS NE2   3.72  5.00E+00
16 CYSS SG  29 HIS NE2   3.72  5.00E+00
16 CYSS SG  33 HIS NE2   3.72  5.00E+00
29 HIS NE2  33 HIS NE2   3.60  5.00E+00

 13 CYSS HN     17 GLY  HN      4.79 #SUP  0.96  #QF  0.96
 15 ASP  HN     17 GLY  HN      4.13 #SUP  0.99  #QF  0.99
 17 GLY  HN     17 GLY  HA1     2.88 #SUP  0.99  #QF  0.99
 13 CYSS HB3    17 GLY  HN      3.53 #SUP  0.84  #QF  0.84
 12 GLU  QB     17 GLY  HN      5.50 #SUP  0.98  #QF  0.42
 15 ASP  HB2    17 GLY  HN      5.50 #SUP  0.98  #QF  0.42
 24 SER  HN     26 LEU  HN      4.90 #SUP  0.90  #QF  0.90
 26 LEU  HN     27 ILE  HN      3.19 #SUP  1.00
 25 GLN  HN     26 LEU  HN      3.10 #SUP  0.98  #QF  0.98
 24 SER  HA     26 LEU  HN      4.45 #SUP  0.98  #QF  0.84
 23 LYS  HA     26 LEU  HN      3.86 #SUP  0.94  #QF  0.94
 25 GLN  HB2    26 LEU  HN      3.47 #SUP  0.98  #QF  0.98
 26 LEU  HN     26 LEU  HB3     3.05 #SUP  0.97  #QF  0.97
 26 LEU  HN     27 ILE  HB      4.73 #SUP  0.97  #QF  0.97
 26 LEU  HN     26 LEU  HG      4.63 #SUP  0.99  #QF  0.80
 26 LEU  HN     27 ILE  HG13    4.90 #SUP  0.99  #QF  0.80
 26 LEU  HN     26 LEU  HB2     3.24 #SUP  0.96  #QF  0.96
 26 LEU  HN     26 LEU  QD2     4.28 #SUP  1.00
  8 GLU  HA      9 LYS  HN      3.21 #SUP  0.94  #QF  0.94
  9 LYS  HN     10 PRO  HD3     4.71 #SUP  0.99  #QF  0.99
  8 GLU  HG2     9 LYS  HN      5.50 #SUP  0.92  #QF  0.58
  8 GLU  HB2     9 LYS  HN      4.97 #SUP  0.95  #QF  0.95
  8 GLU  HB3     9 LYS  HN      4.97 #SUP  0.92  #QF  0.92
  9 LYS  HN      9 LYS  HB2     3.76 #SUP  0.98  #QF  0.98
  9 LYS  HN      9 LYS  HG3     4.58 #SUP  0.95  #QF  0.95
  9 LYS  HN      9 LYS  HG2     4.58 #SUP  0.97  #QF  0.97
 26 LEU  QD2    30 GLN  HE21    4.20 #SUP  0.88  #QF  0.88
 13 CYSS HA     30 GLN  HE21    4.74 #SUP  0.91  #QF  0.91
 26 LEU  QD2    30 GLN  HE22    4.18 #SUP  0.84  #QF  0.84
 24 SER  HN     24 SER  QB      3.31 #SUP  0.81  #QF  0.81
 36 GLU  HN     36 GLU  QG      4.54 #SUP  0.95  #QF  0.95
 22 LEU  HB3    24 SER  HN      3.80 #SUP  0.82  #QF  0.82
 23 LYS  HB3    24 SER  HN      3.77 #SUP  0.97  #QF  0.97
 23 LYS  HB2    24 SER  HN      4.28 #SUP  0.99  #QF  0.99
 22 LEU  QD1    25 GLN  HE21    4.43 #SUP  0.89  #QF  0.89
 22 LEU  QD1    25 GLN  HE22    4.43 #SUP  0.89  #QF  0.89
 34 THR  HN     35 GLY  HN      4.44 #SUP  0.85  #QF  0.85
 31 ARG  HA     34 THR  HN      4.72 #SUP  0.77  #QF  0.77
 33 HIS  HB2    34 THR  HN      4.07 #SUP  0.93  #QF  0.93
 34 THR  HN     34 THR  QG2     3.94 #SUP  0.95  #QF  0.95
 29 HIS  HB3    30 GLN  HN      3.49 #SUP  0.95  #QF  0.95
 30 GLN  HN     30 GLN  HG3     3.22 #SUP  0.77  #QF  0.77
 30 GLN  HN     30 GLN  HB2     3.21 #SUP  0.97  #QF  0.97
 30 GLN  HN     30 GLN  HB3     3.70 #SUP  0.95  #QF  0.95
 30 GLN  HN     31 ARG  HG3     4.81 #SUP  0.74  #QF  0.74
 28 ILE  HB     30 GLN  HN      5.50 #SUP  0.99  #QF  0.99
 30 GLN  HN     31 ARG  HG2     5.50 #SUP  0.99  #QF  0.99
 27 ILE  QG2    30 GLN  HN      4.90 #SUP  0.93  #QF  0.93
  8 GLU  HN      8 GLU  HG2     5.14 #SUP  0.93  #QF  0.62
  8 GLU  HN      8 GLU  HG3     5.14 #SUP  0.93  #QF  0.62
 27 ILE  HN     29 HIS  HN      4.83 #SUP  0.78  #QF  0.78
 29 HIS  HN     30 GLN  HN      3.36 #SUP  1.00
 25 GLN  HA     29 HIS  HN      4.83 #SUP  0.94  #QF  0.94
 27 ILE  HA     29 HIS  HN      4.68 #SUP  0.96  #QF  0.96
 26 LEU  HA     29 HIS  HN      3.79 #SUP  0.97  #QF  0.97
 29 HIS  HN     29 HIS  HB3     2.96 #SUP  0.96  #QF  0.96
 29 HIS  HN     29 HIS  HB2     3.10 #SUP  0.97  #QF  0.97
 28 ILE  HB     29 HIS  HN      3.24 #SUP  0.89  #QF  0.89
 28 ILE  HG13   29 HIS  HN      4.54 #SUP  0.97  #QF  0.97
 26 LEU  QD1    29 HIS  HN      4.51 #SUP  0.89  #QF  0.89
 28 ILE  QG2    29 HIS  HN      3.76 #SUP  0.94  #QF  0.94
 24 SER  HN     25 GLN  HN      3.85 #SUP  0.99  #QF  0.99
 25 GLN  HN     27 ILE  HN      4.45 #SUP  0.91  #QF  0.91
 23 LYS  HA     25 GLN  HN      4.64 #SUP  0.87  #QF  0.87
 27 ILE  HN     30 GLN  HG3     5.28 #SUP  0.97  #QF  0.97
 25 GLN  HN     25 GLN  HB2     3.02 #SUP  0.82  #QF  0.82
 26 LEU  HB3    27 ILE  HN      3.33 #SUP  0.98  #QF  0.98
 25 GLN  HN     25 GLN  HB3     3.76 #SUP  0.98  #QF  0.98
 27 ILE  HN     27 ILE  HB      2.94 #SUP  0.97  #QF  0.97
 22 LEU  HB3    25 GLN  HN      3.45 #SUP  0.94  #QF  0.94
 27 ILE  HN     27 ILE  HG13    3.08 #SUP  0.99  #QF  0.42
 22 LEU  HB2    25 GLN  HN      3.36 #SUP  0.93  #QF  0.93
 27 ILE  HN     27 ILE  HG12    3.47 #SUP  0.97  #QF  0.97
 26 LEU  QD2    27 ILE  HN      4.04 #SUP  1.00
 20 PHE  QD     25 GLN  HN      5.50 #SUP  0.95  #QF  0.53
 25 GLN  HN     28 ILE  HN      5.50 #SUP  0.95  #QF  0.53
 24 SER  HA     27 ILE  HN      3.83 #SUP  1.00
 23 LYS  HA     27 ILE  HN      4.59 #SUP  0.99  #QF  0.99
 26 LEU  HB2    27 ILE  HN      3.95 #SUP  0.99  #QF  0.99
 22 LEU  QD2    25 GLN  HN      4.74 #SUP  0.87  #QF  0.87
 28 ILE  HN     29 HIS  HB2     5.50 #SUP  0.98  #QF  0.98
 27 ILE  HN     28 ILE  HN      3.42 #SUP  1.00
 24 SER  HA     28 ILE  HN      4.47 #SUP  1.00  #QF  0.99
 28 ILE  HN     28 ILE  HB      2.75 #SUP  0.66  #QF  0.66
 27 ILE  HG13   28 ILE  HN      4.53 #SUP  0.88  #QF  0.88
 28 ILE  HN     28 ILE  HG13    3.55 #SUP  1.00
 27 ILE  QG2    28 ILE  HN      3.57 #SUP  0.96  #QF  0.96
 32 THR  HN     33 HIS  HN      3.15 #SUP  0.52  #QF  0.52
 32 THR  HN     32 THR  HB      3.75 #SUP  0.99  #QF  0.99
 31 ARG  HG3    32 THR  HN      4.33 #SUP  0.92  #QF  0.92
 31 ARG  HB2    32 THR  HN      4.05 #SUP  0.95  #QF  0.95
 11 TYR  HN     19 ALA  HA      5.22 #SUP  0.90  #QF  0.90
 11 TYR  HN     20 PHE  HN      3.77 #SUP  1.00
 11 TYR  HN     12 GLU  HN      4.63 #SUP  1.00
  9 LYS  HA     11 TYR  HN      4.60 #SUP  0.84  #QF  0.84
 10 PRO  HD2    11 TYR  HN      3.62 #SUP  0.80  #QF  0.80
 11 TYR  HN     11 TYR  HB3     3.83 #SUP  0.99  #QF  0.99
 11 TYR  HN     11 TYR  HB2     3.18 #SUP  0.93  #QF  0.93
 10 PRO  HG3    11 TYR  HN      4.86 #SUP  1.00
 10 PRO  HG2    11 TYR  HN      4.06 #SUP  1.00
 10 PRO  HB2    11 TYR  HN      4.14 #SUP  0.80  #QF  0.80
 11 TYR  HN     26 LEU  QD2     5.17 #SUP  1.00
 33 HIS  HN     34 THR  HN      3.51 #SUP  0.73  #QF  0.62
 11 TYR  HN     11 TYR  QE      4.79 #SUP  0.91  #QF  0.91
 33 HIS  HN     33 HIS  HD2     4.09 #SUP  0.94  #QF  0.94
 32 THR  HB     33 HIS  HN      4.48 #SUP  0.97  #QF  0.97
 30 GLN  HA     33 HIS  HN      4.03 #SUP  0.90  #QF  0.90
 33 HIS  HN     33 HIS  HB2     3.10 #SUP  0.91  #QF  0.91
 31 ARG  HA     33 HIS  HN      4.25 #SUP  0.81  #QF  0.81
 22 LEU  HB3    23 LYS  HN      3.76 #SUP  0.92  #QF  0.92
 23 LYS  HN     23 LYS  HB3     3.25 #SUP  0.97  #QF  0.97
 23 LYS  HN     23 LYS  HG3     4.69 #SUP  0.93  #QF  0.93
 23 LYS  HN     23 LYS  HB2     3.16 #SUP  0.99  #QF  0.99
 11 TYR  QD     23 LYS  HN      4.77 #SUP  1.00
 13 CYSS HN     20 PHE  HN      5.25 #SUP  0.99  #QF  0.99
 13 CYSS HN     20 PHE  QE      4.44 #SUP  0.98  #QF  0.98
 13 CYSS HN     17 GLY  HA1     5.02 #SUP  0.66  #QF  0.66
 13 CYSS HN     18 LYS  HB2     4.84 #SUP  1.00
 12 GLU  HN     13 CYSS HN      4.72 #SUP  0.97  #QF  0.97
 13 CYSS HN     20 PHE  QD      4.61 #SUP  0.99  #QF  0.99
 13 CYSS HN     19 ALA  HA      3.65 #SUP  0.95  #QF  0.95
 13 CYSS HN     13 CYSS HB3     3.05 #SUP  0.99  #QF  0.99
 12 GLU  HG3    13 CYSS HN      4.25 #SUP  0.70  #QF  0.70
 12 GLU  QB     13 CYSS HN      3.71 #SUP  0.99  #QF  0.99
 13 CYSS HN     18 LYS  HB3     4.15 #SUP  0.97  #QF  0.97
 31 ARG  HN     32 THR  HN      3.32 #SUP  0.91  #QF  0.91
 29 HIS  HN     31 ARG  HN      4.79 #SUP  0.91  #QF  0.91
 28 ILE  HA     31 ARG  HN      4.31 #SUP  0.95  #QF  0.95
 27 ILE  QG2    31 ARG  HN      5.04 #SUP  0.93  #QF  0.93
 30 GLN  HN     31 ARG  HN      3.33 #SUP  1.00
 29 HIS  HB2    31 ARG  HN      5.39 #SUP  0.56  #QF  0.56
 30 GLN  HB2    31 ARG  HN      3.95 #SUP  0.96  #QF  0.96
 30 GLN  HB3    31 ARG  HN      4.16 #SUP  0.95  #QF  0.95
 31 ARG  HN     31 ARG  HB2     3.00 #SUP  0.99  #QF  0.99
 31 ARG  HN     31 ARG  HG2     3.56 #SUP  0.98  #QF  0.98
 31 ARG  HN     32 THR  QG2     4.48 #SUP  0.93  #QF  0.93
 20 PHE  HB3    21 GLY  HN      4.38 #SUP  0.99  #QF  0.99
 20 PHE  HB2    21 GLY  HN      4.85 #SUP  0.92  #QF  0.92
 21 GLY  HN     22 LEU  HN      3.84 #SUP  0.98  #QF  0.98
 22 LEU  HN     23 LYS  HN      4.86 #SUP  0.99  #QF  0.99
 20 PHE  QD     22 LEU  HN      4.76 #SUP  0.99  #QF  0.99
 11 TYR  QD     22 LEU  HN      4.39 #SUP  0.98  #QF  0.98
 22 LEU  HN     25 GLN  HN      4.45 #SUP  0.95  #QF  0.95
 20 PHE  HA     22 LEU  HN      4.32 #SUP  0.96  #QF  0.96
 21 GLY  HA2    22 LEU  HN      3.52 #SUP  0.98  #QF  0.98
 20 PHE  HB3    22 LEU  HN      3.38 #SUP  0.99  #QF  0.99
 20 PHE  HB2    22 LEU  HN      3.85 #SUP  0.99  #QF  0.99
 22 LEU  HN     25 GLN  HB2     3.54 #SUP  0.95  #QF  0.95
 22 LEU  HN     25 GLN  HB3     4.27 #SUP  0.99  #QF  0.99
 22 LEU  HN     22 LEU  HB2     3.28 #SUP  0.96  #QF  0.96
 22 LEU  HN     22 LEU  QD2     4.22 #SUP  0.97  #QF  0.97
 19 ALA  HN     20 PHE  HN      4.75 #SUP  1.00
 11 TYR  QD     20 PHE  HN      4.94 #SUP  0.98  #QF  0.98
 20 PHE  HN     20 PHE  QE      5.10 #SUP  0.96  #QF  0.96
 19 ALA  HA     20 PHE  HN      2.81 #SUP  0.94  #QF  0.94
 20 PHE  HN     20 PHE  HB3     4.10 #SUP  1.00
 11 TYR  HB2    20 PHE  HN      4.00 #SUP  0.97  #QF  0.97
 20 PHE  HN     20 PHE  HB2     3.35 #SUP  0.97  #QF  0.97
  9 LYS  HB3    20 PHE  HN      4.08 #SUP  0.35  #QF  0.35
 19 ALA  QB     20 PHE  HN      3.32 #SUP  0.97  #QF  0.97
 12 GLU  HG3    20 PHE  HN      4.78 #SUP  0.93  #QF  0.93
 13 CYSS HA     14 THR  HN      3.51 #SUP  0.98  #QF  0.98
 14 THR  HN     14 THR  QG2     4.21 #SUP  0.96  #QF  0.96
 14 THR  HN     26 LEU  QD1     4.91 #SUP  0.86  #QF  0.86
 11 TYR  HB2    12 GLU  HN      4.43 #SUP  0.99  #QF  0.99
 11 TYR  HA     12 GLU  HN      2.79 #SUP  0.82  #QF  0.82
 12 GLU  HN     12 GLU  QB      3.15 #SUP  0.93  #QF  0.93
 12 GLU  HN     26 LEU  QD2     3.92 #SUP  0.99  #QF  0.99
 15 ASP  HN     16 CYSS HN      3.12 #SUP  0.99  #QF  0.99
 13 CYSS HB3    16 CYSS HN      3.56 #SUP  0.44  #QF  0.44
 15 ASP  HB3    16 CYSS HN      3.43 #SUP  0.85  #QF  0.51
 15 ASP  HB2    16 CYSS HN      3.82 #SUP  0.85  #QF  0.51
 13 CYSS HN     16 CYSS HN      5.50 #SUP  0.96  #QF  0.96
 16 CYSS HN     17 GLY  HA2     5.50 #SUP  0.89  #QF  0.56
 16 CYSS HN     16 CYSS HB3     3.60 #SUP  0.99  #QF  0.99
 18 LYS  HB3    19 ALA  HN      3.18 #SUP  0.94  #QF  0.47
 18 LYS  HG3    19 ALA  HN      4.52 #SUP  0.80  #QF  0.80
 16 CYSS HA     18 LYS  HN      5.08 #SUP  0.85  #QF  0.85
 13 CYSS HN     18 LYS  HN      4.30 #SUP  1.00
 14 THR  HN     15 ASP  HN      3.95 #SUP  0.99  #QF  0.99
 17 GLY  HN     18 LYS  HN      3.58 #SUP  0.99  #QF  0.99
 13 CYSS HB3    18 LYS  HN      3.36 #SUP  0.92  #QF  0.92
 13 CYSS HB2    18 LYS  HN      3.81 #SUP  0.95  #QF  0.95
 18 LYS  HN     18 LYS  HB2     3.02 #SUP  0.99  #QF  0.99
 18 LYS  HN     18 LYS  HB3     3.53 #SUP  0.98  #QF  0.98
 13 CYSS HB2    15 ASP  HN      4.85 #SUP  0.59  #QF  0.59
 15 ASP  HN     15 ASP  HB2     3.05 #SUP  0.97  #QF  0.97
 28 ILE  HN     29 HIS  HN      3.27 #SUP  1.00
 16 CYSS HN     17 GLY  HN      2.79 #SUP  0.99  #QF  0.99
 27 ILE  HB     28 ILE  HN      3.34 #SUP  0.99  #QF  0.99
 31 ARG  HN     31 ARG  HG3     2.97 #SUP  0.99  #QF  0.99
 18 LYS  HN     20 PHE  QE      5.00 #SUP  0.99  #QF  0.99
 20 PHE  QE     29 HIS  HE1     5.50 #SUP  0.99  #QF  0.99
 19 ALA  HA     20 PHE  QE      4.50 #SUP  0.90  #QF  0.90
 13 CYSS HA     20 PHE  QE      4.56 #SUP  0.99  #QF  0.99
 20 PHE  QE     29 HIS  HA      5.02 #SUP  0.98  #QF  0.98
 13 CYSS HB3    20 PHE  QE      3.96 #SUP  0.96  #QF  0.96
 20 PHE  QE     29 HIS  HB3     4.15 #SUP  1.00
 13 CYSS HB2    20 PHE  QE      3.45 #SUP  0.99  #QF  0.97
 20 PHE  QE     25 GLN  HB3     4.48 #SUP  0.99  #QF  0.99
 18 LYS  HB2    20 PHE  QE      4.03 #SUP  0.97  #QF  0.93
 18 LYS  HB3    20 PHE  QE      3.69 #SUP  1.00
 19 ALA  HN     20 PHE  QE      4.79 #SUP  0.87  #QF  0.82
 20 PHE  QE     29 HIS  HN      5.49 #SUP  0.87  #QF  0.82
 20 PHE  HB3    21 GLY  HA2     5.39 #SUP  0.97  #QF  0.97
  9 LYS  HB2    21 GLY  HA1     5.11 #SUP  0.99  #QF  0.93
 10 PRO  HG2    21 GLY  HA1     5.50 #SUP  0.99  #QF  0.93
 20 PHE  HA     21 GLY  HA2     4.70 #SUP  0.97  #QF  0.97
  9 LYS  HA     21 GLY  HA1     3.50 #SUP  0.99  #QF  0.99
  9 LYS  HA     21 GLY  HA2     3.94 #SUP  0.99  #QF  0.99
 12 GLU  HG2    17 GLY  HA1     4.98 #SUP  0.95  #QF  0.95
 21 GLY  HA2    22 LEU  HG      4.70 #SUP  0.97  #QF  0.97
 21 GLY  HA2    22 LEU  HB2     5.50 #SUP  0.98  #QF  0.20
  9 LYS  HB3    21 GLY  HA1     5.08 #SUP  0.88  #QF  0.88
 16 CYSS HN     17 GLY  HA1     4.46 #SUP  0.90  #QF  0.90
 16 CYSS HA     17 GLY  HA2     4.84 #SUP  0.95  #QF  0.95
 12 GLU  QB     17 GLY  HA2     5.50 #SUP  0.84  #QF  0.84
 22 LEU  HB2    23 LYS  HN      4.76 #SUP  0.95  #QF  0.89
 22 LEU  HB2    24 SER  HN      5.19 #SUP  0.95  #QF  0.89
 22 LEU  HN     22 LEU  HB3     3.90 #SUP  1.00
 22 LEU  HB2    26 LEU  HN      4.84 #SUP  0.93  #QF  0.93
 22 LEU  HB2    25 GLN  HG3     3.51 #SUP  0.99  #QF  0.99
 22 LEU  HB3    26 LEU  HN      4.82 #SUP  0.98  #QF  0.98
 22 LEU  HB3    25 GLN  HG3     3.91 #SUP  1.00
 27 ILE  HN     27 ILE  QG2     3.87 #SUP  1.00
 28 ILE  HN     28 ILE  QG2     4.30 #SUP  0.98  #QF  0.58
 24 SER  HA     27 ILE  QG2     4.25 #SUP  0.99  #QF  0.99
 28 ILE  QG2    29 HIS  HB2     4.78 #SUP  0.97  #QF  0.97
 27 ILE  QG2    30 GLN  HB2     4.83 #SUP  0.95  #QF  0.95
 27 ILE  QG2    31 ARG  HG3     4.67 #SUP  0.78  #QF  0.78
 28 ILE  QG2    28 ILE  HG12    3.11 #SUP  0.97  #QF  0.94
 27 ILE  QG2    27 ILE  HG13    3.26 #SUP  1.00
 27 ILE  QG2    27 ILE  HG12    3.10 #SUP  0.99  #QF  0.99
 28 ILE  QG2    28 ILE  HG13    3.19 #SUP  0.95  #QF  0.95
 19 ALA  HN     20 PHE  HZ      5.50 #SUP  1.00  #QF  0.64
 20 PHE  HZ     29 HIS  HN      5.50 #SUP  1.00  #QF  0.64
 20 PHE  HZ     29 HIS  HD2     4.51 #SUP  0.98  #QF  0.98
 20 PHE  HZ     26 LEU  HA      4.86 #SUP  0.99  #QF  0.99
 20 PHE  HZ     29 HIS  HB3     4.11 #SUP  1.00
 20 PHE  HZ     29 HIS  HB2     3.63 #SUP  1.00
 18 LYS  HG2    20 PHE  HZ      4.85 #SUP  0.95  #QF  0.63
 18 LYS  HB3    20 PHE  HZ      3.93 #SUP  1.00
 30 GLN  HN     33 HIS  HD2     5.16 #SUP  0.92  #QF  0.92
 11 TYR  HN     20 PHE  HB2     4.89 #SUP  0.95  #QF  0.95
 31 ARG  HN     31 ARG  QD      4.11 #SUP  1.00
 20 PHE  HB3    26 LEU  HN      4.11 #SUP  1.00
 20 PHE  HB2    26 LEU  HN      4.01 #SUP  0.99  #QF  0.99
 20 PHE  HB3    25 GLN  HN      5.00 #SUP  0.99  #QF  0.99
 19 ALA  HA     20 PHE  HB2     4.59 #SUP  1.00
 20 PHE  HB3    23 LYS  HA      5.50 #SUP  1.00
 11 TYR  HB3    20 PHE  HB2     3.99 #SUP  1.00
 11 TYR  HB2    20 PHE  HB2     3.66 #SUP  1.00
 20 PHE  HB3    25 GLN  HB2     3.37 #SUP  1.00
 20 PHE  HB2    25 GLN  HB2     3.85 #SUP  0.99  #QF  0.99
 20 PHE  HB2    25 GLN  HB3     4.27 #SUP  0.93  #QF  0.93
 20 PHE  HB3    25 GLN  HB3     3.74 #SUP  1.00
 31 ARG  HB3    31 ARG  QD      2.94 #SUP  0.99  #QF  0.99
 20 PHE  HB3    22 LEU  HB3     5.09 #SUP  0.98  #QF  0.98
 20 PHE  HB2    22 LEU  HB2     5.50 #SUP  0.99  #QF  0.39
 20 PHE  HB2    26 LEU  HG      5.50 #SUP  0.99  #QF  0.39
 20 PHE  HB3    22 LEU  HB2     4.76 #SUP  1.00
 20 PHE  HB3    26 LEU  HB2     4.26 #SUP  0.99  #QF  0.99
 20 PHE  HB2    26 LEU  HB2     3.84 #SUP  0.99  #QF  0.99
 28 ILE  HG13   31 ARG  QD      4.66 #SUP  0.79  #QF  0.79
 20 PHE  HB2    26 LEU  QD1     4.22 #SUP  0.91  #QF  0.91
 20 PHE  HB3    26 LEU  QD1     4.91 #SUP  0.69  #QF  0.69
 28 ILE  QG2    31 ARG  QD      3.83 #SUP  0.75  #QF  0.75
 15 ASP  HN     33 HIS  HD2     5.06 #SUP  0.92  #QF  0.92
 29 HIS  HD2    33 HIS  HD2     4.23 #SUP  0.68  #QF  0.68
 33 HIS  HB2    33 HIS  HD2     3.27 #SUP  0.85  #QF  0.85
 30 GLN  HG2    33 HIS  HD2     4.10 #SUP  0.75  #QF  0.75
 30 GLN  HB3    33 HIS  HD2     4.71 #SUP  0.99  #QF  0.99
 15 ASP  HB3    33 HIS  HD2     4.04 #SUP  0.90  #QF  0.53
 13 CYSS HN     29 HIS  HD2     5.12 #SUP  0.99  #QF  0.99
 29 HIS  HD2    30 GLN  HN      4.13 #SUP  0.98  #QF  0.98
 29 HIS  HN     29 HIS  HD2     5.15 #SUP  0.95  #QF  0.89
 29 HIS  HD2    30 GLN  HE21    5.50 #SUP  0.95  #QF  0.89
 13 CYSS HA     29 HIS  HD2     4.64 #SUP  1.00
 29 HIS  HA     29 HIS  HD2     4.97 #SUP  0.88  #QF  0.88
 13 CYSS HB3    29 HIS  HD2     4.00 #SUP  1.00
 26 LEU  HA     29 HIS  HD2     4.43 #SUP  1.00
 29 HIS  HB3    29 HIS  HD2     3.62 #SUP  1.00
 13 CYSS HB2    29 HIS  HD2     3.02 #SUP  0.91  #QF  0.91
 29 HIS  HD2    30 GLN  HB2     5.03 #SUP  1.00
 29 HIS  HD2    30 GLN  HB3     5.50 #SUP  1.00
 26 LEU  HG     29 HIS  HD2     5.07 #SUP  0.93  #QF  0.93
 18 LYS  HE3    29 HIS  HE1     5.50 #SUP  0.84  #QF  0.84
 18 LYS  HE2    29 HIS  HE1     5.50 #SUP  0.83  #QF  0.31
  9 LYS  HG2     9 LYS  QE      3.65 #SUP  0.97  #QF  0.97
  9 LYS  HG3     9 LYS  QE      3.65 #SUP  0.99  #QF  0.99
 23 LYS  HG2    23 LYS  HE3     3.96 #SUP  0.98  #QF  0.98
 23 LYS  HG2    23 LYS  HE2     3.96 #SUP  0.94  #QF  0.94
 23 LYS  HE3    27 ILE  QD1     4.19 #SUP  0.96  #QF  0.96
 34 THR  HB     35 GLY  HN      5.04 #SUP  0.90  #QF  0.90
 15 ASP  HN     15 ASP  HB3     3.57 #SUP  0.98  #QF  0.98
 15 ASP  HB2    33 HIS  HD2     4.28 #SUP  0.94  #QF  0.94
 32 THR  HA     32 THR  HB      2.86 #SUP  0.97  #QF  0.97
 15 ASP  HB3    33 HIS  HB3     5.13 #SUP  0.93  #QF  0.84
 28 ILE  QD1    29 HIS  HN      4.74 #SUP  0.99  #QF  0.99
 28 ILE  HN     28 ILE  QD1     3.88 #SUP  0.97  #QF  0.97
 27 ILE  QD1    28 ILE  HN      4.90 #SUP  0.99  #QF  0.99
 26 LEU  HN     27 ILE  QD1     4.94 #SUP  1.00
 25 GLN  HA     28 ILE  QD1     3.48 #SUP  0.98  #QF  0.98
 24 SER  HA     27 ILE  QD1     3.43 #SUP  0.99  #QF  0.99
 28 ILE  HA     28 ILE  QD1     3.93 #SUP  0.99  #QF  0.99
 28 ILE  QD1    31 ARG  QD      4.96 #SUP  0.82  #QF  0.82
 23 LYS  HE2    27 ILE  QD1     4.19 #SUP  0.91  #QF  0.91
 25 GLN  HG2    28 ILE  QD1     4.73 #SUP  0.56  #QF  0.56
 26 LEU  HB3    27 ILE  QD1     4.94 #SUP  1.00
 27 ILE  HB     27 ILE  QD1     3.23 #SUP  1.00
 28 ILE  HB     28 ILE  QD1     3.02 #SUP  0.97  #QF  0.63
 23 LYS  HG3    27 ILE  QD1     3.25 #SUP  1.00  #QF  0.66
 14 THR  HB     15 ASP  HN      4.46 #SUP  0.98  #QF  0.98
 20 PHE  QE     26 LEU  HB2     5.14 #SUP  0.94  #QF  0.94
 25 GLN  HN     26 LEU  HB3     4.93 #SUP  0.92  #QF  0.92
 20 PHE  QD     26 LEU  HB3     4.21 #SUP  0.98  #QF  0.98
 11 TYR  HA     26 LEU  HB2     5.50 #SUP  0.99  #QF  0.79
 13 CYSS HA     26 LEU  HB2     5.50 #SUP  0.99  #QF  0.79
 20 PHE  HA     26 LEU  HB2     5.50 #SUP  0.99  #QF  0.79
 11 TYR  HB3    26 LEU  HB3     3.78 #SUP  1.00  #QF  0.96
 11 TYR  HB3    26 LEU  HB2     3.50 #SUP  0.98  #QF  0.98
 20 PHE  HB2    26 LEU  HB3     4.45 #SUP  0.99  #QF  0.99
 26 LEU  HB3    27 ILE  HB      5.32 #SUP  1.00
 26 LEU  HB3    27 ILE  HG12    4.90 #SUP  0.84  #QF  0.84
 26 LEU  HB3    26 LEU  QD2     3.09 #SUP  0.98  #QF  0.98
 28 ILE  HB     29 HIS  HB3     4.86 #SUP  0.85  #QF  0.85
 25 GLN  HB3    28 ILE  HB      5.45 #SUP  0.88  #QF  0.88
 11 TYR  HB3    20 PHE  HN      4.47 #SUP  0.99  #QF  0.99
 11 TYR  HB3    12 GLU  HN      4.13 #SUP  1.00
 11 TYR  HB3    20 PHE  QD      4.59 #SUP  0.99  #QF  0.99
 25 GLN  HA     28 ILE  HB      3.39 #SUP  0.98  #QF  0.98
 11 TYR  HB3    20 PHE  HB3     5.42 #SUP  0.99  #QF  0.99
 11 TYR  HB2    20 PHE  HB3     4.34 #SUP  1.00
 25 GLN  HG2    28 ILE  HB      5.47 #SUP  0.91  #QF  0.91
 11 TYR  HB2    26 LEU  HB3     4.35 #SUP  1.00
 10 PRO  HG2    11 TYR  HB2     4.58 #SUP  0.65  #QF  0.65
 11 TYR  HB2    26 LEU  HB2     3.84 #SUP  1.00
 11 TYR  HB2    26 LEU  QD2     3.44 #SUP  0.99  #QF  0.99
 27 ILE  HB     28 ILE  HA      5.00 #SUP  0.96  #QF  0.96
 27 ILE  HA     30 GLN  HN      3.87 #SUP  0.96  #QF  0.96
 28 ILE  HA     30 GLN  HN      4.81 #SUP  0.96  #QF  0.96
 27 ILE  HN     28 ILE  HA      5.50 #SUP  0.98  #QF  0.98
 27 ILE  HA     30 GLN  HE21    5.50 #SUP  0.99  #QF  0.95
 26 LEU  HN     27 ILE  HA      5.30 #SUP  0.95  #QF  0.95
 28 ILE  HA     29 HIS  HA      4.89 #SUP  0.98  #QF  0.98
 28 ILE  HA     31 ARG  QD      3.56 #SUP  1.00
 27 ILE  HA     30 GLN  HB2     3.45 #SUP  0.97  #QF  0.97
 27 ILE  HA     30 GLN  HB3     4.76 #SUP  1.00
 26 LEU  HB3    27 ILE  HA      4.66 #SUP  0.99  #QF  0.99
 28 ILE  HA     31 ARG  HG3     3.62 #SUP  0.98  #QF  0.98
 28 ILE  HA     28 ILE  HG12    3.49 #SUP  0.98  #QF  0.87
 26 LEU  HG     27 ILE  HA      3.51 #SUP  1.00  #QF  0.67
 27 ILE  HA     27 ILE  HG12    3.18 #SUP  1.00
 28 ILE  HA     28 ILE  HG13    3.15 #SUP  0.99  #QF  0.99
 26 LEU  QD1    27 ILE  HA      4.68 #SUP  0.93  #QF  0.82
 26 LEU  QD2    27 ILE  HA      5.10 #SUP  0.93  #QF  0.82
 28 ILE  HA     28 ILE  QG2     2.97 #SUP  0.97  #QF  0.97
 27 ILE  HA     27 ILE  QG2     3.02 #SUP  1.00
 12 GLU  HG2    13 CYSS HN      4.59 #SUP  0.96  #QF  0.96
 12 GLU  HN     12 GLU  HG3     4.63 #SUP  0.98  #QF  0.98
 12 GLU  HN     12 GLU  HG2     4.99 #SUP  0.96  #QF  0.96
 14 THR  HA     17 GLY  HN      4.56 #SUP  0.72  #QF  0.72
 12 GLU  HG2    19 ALA  HA      4.94 #SUP  1.00
 14 THR  HA     14 THR  HB      2.64 #SUP  0.98  #QF  0.98
 12 GLU  HG3    17 GLY  HA1     5.44 #SUP  0.97  #QF  0.97
 14 THR  HA     14 THR  QG2     3.01 #SUP  0.99  #QF  0.99
 12 GLU  HG2    19 ALA  QB      4.10 #SUP  1.00
  8 GLU  HG3     9 LYS  HN      5.50 #SUP  0.99  #QF  0.99
 14 THR  HA     16 CYSS HN      4.79 #SUP  0.95  #QF  0.95
 12 GLU  QB     14 THR  HA      4.75 #SUP  0.49  #QF  0.49
 31 ARG  HB3    32 THR  HA      4.84 #SUP  0.90  #QF  0.90
 32 THR  HA     32 THR  QG2     3.27 #SUP  0.99  #QF  0.99
 30 GLN  HN     30 GLN  HG2     3.71 #SUP  0.99  #QF  0.99
 29 HIS  HD2    30 GLN  HG2     4.08 #SUP  0.99  #QF  0.99
 29 HIS  HD2    30 GLN  HG3     4.11 #SUP  0.98  #QF  0.98
 13 CYSS HA     30 GLN  HG3     5.12 #SUP  0.96  #QF  0.96
 27 ILE  HA     30 GLN  HG3     3.94 #SUP  1.00  #QF  0.83
 30 GLN  HA     30 GLN  HG3     4.12 #SUP  1.00  #QF  0.83
 26 LEU  HG     30 GLN  HG2     4.55 #SUP  1.00
 26 LEU  QD1    30 GLN  HG2     3.67 #SUP  0.99  #QF  0.99
 10 PRO  HA     11 TYR  HN      3.38 #SUP  0.99  #QF  0.99
 10 PRO  HA     11 TYR  QD      5.19 #SUP  1.00
 11 TYR  QE     23 LYS  HN      4.15 #SUP  0.97  #QF  0.97
 22 LEU  HN     25 GLN  HG3     4.86 #SUP  0.99  #QF  0.99
 22 LEU  HN     25 GLN  HG2     5.41 #SUP  0.99  #QF  0.99
 20 PHE  QD     25 GLN  HG2     4.67 #SUP  0.99  #QF  0.99
 20 PHE  QD     25 GLN  HG3     4.89 #SUP  0.99  #QF  0.99
 25 GLN  HG3    26 LEU  HN      4.90 #SUP  0.87  #QF  0.87
 25 GLN  HN     25 GLN  HG2     3.75 #SUP  1.00
 25 GLN  HN     25 GLN  HG3     3.62 #SUP  1.00
 11 TYR  QE     22 LEU  HA      3.97 #SUP  0.95  #QF  0.95
 11 TYR  HA     11 TYR  QE      4.98 #SUP  0.99  #QF  0.99
 25 GLN  HA     25 GLN  HG3     3.52 #SUP  1.00
 10 PRO  HD2    11 TYR  QE      4.13 #SUP  0.85  #QF  0.85
 20 PHE  HB3    25 GLN  HG2     5.23 #SUP  0.99  #QF  0.99
 20 PHE  HB3    25 GLN  HG3     4.68 #SUP  1.00
 11 TYR  QE     23 LYS  HA      3.90 #SUP  0.98  #QF  0.98
 10 PRO  HB3    11 TYR  QE      5.12 #SUP  0.97  #QF  0.97
 10 PRO  HG3    11 TYR  QE      4.52 #SUP  1.00
 22 LEU  HB3    25 GLN  HG2     4.53 #SUP  1.00
 10 PRO  HG2    11 TYR  QE      3.58 #SUP  0.99  #QF  0.98
 11 TYR  QE     23 LYS  HD2     4.66 #SUP  0.99  #QF  0.98
 22 LEU  HB2    25 GLN  HG2     4.05 #SUP  1.00
 10 PRO  HB2    11 TYR  QE      4.41 #SUP  0.95  #QF  0.90
 11 TYR  QE     23 LYS  HG3     4.76 #SUP  0.95  #QF  0.90
 11 TYR  QE     23 LYS  HB2     3.54 #SUP  0.72  #QF  0.62
 11 TYR  QE     23 LYS  HG2     4.00 #SUP  0.72  #QF  0.62
 22 LEU  QD1    25 GLN  HG2     3.85 #SUP  0.99  #QF  0.99
 33 HIS  HB3    34 THR  HA      5.04 #SUP  0.90  #QF  0.85
 33 HIS  HB2    34 THR  HA      5.50 #SUP  0.90  #QF  0.85
 18 LYS  HB2    19 ALA  HN      4.30 #SUP  1.00
 18 LYS  HB2    20 PHE  HZ      4.47 #SUP  0.99  #QF  0.99
 24 SER  QB     25 GLN  HN      4.46 #SUP  0.98  #QF  0.98
 22 LEU  HB3    24 SER  QB      4.51 #SUP  0.97  #QF  0.97
 22 LEU  HB2    24 SER  QB      5.17 #SUP  0.98  #QF  0.47
 23 LYS  HB3    24 SER  QB      5.36 #SUP  0.98  #QF  0.47
  9 LYS  HB3    20 PHE  HA      5.07 #SUP  0.95  #QF  0.95
  9 LYS  HB2    10 PRO  HD2     4.69 #SUP  0.92  #QF  0.92
  9 LYS  HB2     9 LYS  QE      4.94 #SUP  0.94  #QF  0.94
 24 SER  QB     25 GLN  HB2     5.50 #SUP  0.92  #QF  0.76
 24 SER  QB     25 GLN  HG2     5.50 #SUP  0.92  #QF  0.76
 24 SER  QB     27 ILE  HB      4.98 #SUP  0.87  #QF  0.87
 23 LYS  HG3    24 SER  QB      5.50 #SUP  0.68  #QF  0.68
 23 LYS  HG2    24 SER  QB      5.50 #SUP  0.57  #QF  0.43
 11 TYR  HA     12 GLU  QB      4.49 #SUP  0.84  #QF  0.80
 12 GLU  QB     13 CYSS HA      5.02 #SUP  0.84  #QF  0.80
  8 GLU  HA      9 LYS  HB2     4.94 #SUP  0.78  #QF  0.78
 12 GLU  QB     17 GLY  HA1     4.73 #SUP  0.93  #QF  0.93
 12 GLU  QB     12 GLU  HG3     2.60 #SUP  0.77  #QF  0.77
 12 GLU  QB     14 THR  QG2     4.88 #SUP  0.57  #QF  0.57
 12 GLU  QB     19 ALA  HA      4.42 #SUP  0.99  #QF  0.99
 24 SER  HA     27 ILE  HB      3.27 #SUP  0.99  #QF  0.99
 22 LEU  HB3    24 SER  HA      5.21 #SUP  0.76  #QF  0.76
 24 SER  HA     27 ILE  HG13    4.10 #SUP  0.93  #QF  0.93
 23 LYS  HG3    24 SER  HA      4.38 #SUP  0.84  #QF  0.84
 12 GLU  QB     19 ALA  QB      4.24 #SUP  1.00
 12 GLU  QB     26 LEU  QD1     5.30 #SUP  0.71  #QF  0.23
 12 GLU  QB     26 LEU  QD2     5.50 #SUP  0.71  #QF  0.23
 23 LYS  HG2    24 SER  HA      5.50 #SUP  0.62  #QF  0.62
 16 CYSS HB2    17 GLY  HN      4.54 #SUP  0.85  #QF  0.85
 16 CYSS HB3    17 GLY  HN      4.70 #SUP  0.97  #QF  0.97
 16 CYSS HA     16 CYSS HB2     2.96 #SUP  0.99  #QF  0.99
 16 CYSS HA     16 CYSS HB3     3.02 #SUP  1.00
 10 PRO  HB2    11 TYR  HA      4.91 #SUP  0.94  #QF  0.94
 15 ASP  HB3    16 CYSS HB2     5.50 #SUP  0.78  #QF  0.78
 15 ASP  HB3    16 CYSS HB3     4.59 #SUP  0.93  #QF  0.91
 30 GLN  HA     32 THR  HN      4.53 #SUP  0.99  #QF  0.99
 29 HIS  HN     30 GLN  HA      5.50 #SUP  1.00  #QF  0.76
 30 GLN  HA     30 GLN  HE21    5.50 #SUP  1.00  #QF  0.76
 29 HIS  HD2    30 GLN  HA      3.66 #SUP  1.00
 30 GLN  HA     33 HIS  HD2     3.10 #SUP  1.00
 29 HIS  HA     30 GLN  HA      5.48 #SUP  1.00  #QF  0.97
 30 GLN  HA     31 ARG  HA      5.50 #SUP  1.00  #QF  0.97
 30 GLN  HA     33 HIS  HB2     4.20 #SUP  0.91  #QF  0.91
 29 HIS  HB3    30 GLN  HA      4.77 #SUP  0.99  #QF  0.99
 30 GLN  HA     30 GLN  HG2     3.23 #SUP  0.95  #QF  0.95
 30 GLN  HA     32 THR  QG2     4.94 #SUP  0.90  #QF  0.90
 26 LEU  QD1    30 GLN  HA      4.61 #SUP  1.00
 11 TYR  QD     23 LYS  HB3     5.26 #SUP  0.99  #QF  0.99
 11 TYR  QD     23 LYS  HB2     4.69 #SUP  1.00
 22 LEU  HA     23 LYS  HB2     4.98 #SUP  0.90  #QF  0.90
 23 LYS  HB3    24 SER  HA      4.93 #SUP  0.71  #QF  0.71
 23 LYS  HB3    27 ILE  QD1     4.70 #SUP  0.96  #QF  0.96
 11 TYR  QD     23 LYS  HA      3.40 #SUP  0.90  #QF  0.90
 11 TYR  QE     23 LYS  HB3     5.05 #SUP  0.94  #QF  0.94
 20 PHE  HZ     29 HIS  HA      4.82 #SUP  0.99  #QF  0.99
 22 LEU  HA     23 LYS  HA      4.53 #SUP  0.99  #QF  0.99
 23 LYS  HA     24 SER  HA      5.08 #SUP  0.98  #QF  0.98
 26 LEU  HA     29 HIS  HA      5.38 #SUP  0.99  #QF  0.99
 29 HIS  HA     29 HIS  HB2     2.90 #SUP  1.00
 23 LYS  HA     26 LEU  HB3     3.47 #SUP  0.92  #QF  0.92
 23 LYS  HA     23 LYS  HG3     3.67 #SUP  0.97  #QF  0.97
 29 HIS  HA     32 THR  QG2     3.57 #SUP  0.51  #QF  0.51
 23 LYS  HA     23 LYS  HB2     2.91 #SUP  0.78  #QF  0.70
 28 ILE  QG2    29 HIS  HA      3.99 #SUP  1.00
 23 LYS  HA     27 ILE  QD1     4.94 #SUP  0.97  #QF  0.97
 30 GLN  HB2    31 ARG  HA      4.98 #SUP  1.00
 30 GLN  HB3    31 ARG  HA      4.71 #SUP  0.97  #QF  0.97
 15 ASP  HB3    16 CYSS HA      4.74 #SUP  0.96  #QF  0.96
 31 ARG  HA     31 ARG  HB3     2.96 #SUP  0.86  #QF  0.86
 31 ARG  HA     31 ARG  HG2     3.26 #SUP  1.00
 31 ARG  HA     34 THR  QG2     4.18 #SUP  0.88  #QF  0.88
 26 LEU  HA     30 GLN  HN      4.31 #SUP  0.98  #QF  0.98
 31 ARG  HB3    32 THR  HN      4.75 #SUP  0.96  #QF  0.96
 18 LYS  HA     19 ALA  HN      2.62 #SUP  0.98  #QF  0.98
 31 ARG  HN     31 ARG  HB3     3.78 #SUP  0.97  #QF  0.97
 20 PHE  QD     26 LEU  HA      3.59 #SUP  0.99  #QF  0.99
 20 PHE  QE     26 LEU  HA      4.11 #SUP  1.00
 18 LYS  HA     19 ALA  HA      4.59 #SUP  1.00
 25 GLN  HA     26 LEU  HA      4.98 #SUP  1.00
 28 ILE  HA     31 ARG  HB3     4.89 #SUP  0.98  #QF  0.98
 28 ILE  HA     31 ARG  HB2     4.71 #SUP  0.97  #QF  0.97
 26 LEU  HA     29 HIS  HB3     3.16 #SUP  0.99  #QF  0.99
 13 CYSS HB2    18 LYS  HA      5.50 #SUP  0.95  #QF  0.51
 26 LEU  HA     29 HIS  HB2     3.73 #SUP  1.00
 20 PHE  HB2    26 LEU  HA      4.50 #SUP  0.99  #QF  0.99
 25 GLN  HB2    26 LEU  HA      4.83 #SUP  0.99  #QF  0.99
 26 LEU  HA     26 LEU  HG      3.72 #SUP  1.00
 18 LYS  HA     18 LYS  HG2     3.59 #SUP  0.96  #QF  0.93
 18 LYS  HA     18 LYS  HG3     3.59 #SUP  1.00
 26 LEU  HA     26 LEU  QD1     2.96 #SUP  0.99  #QF  0.99
 28 ILE  QG2    31 ARG  HB2     4.99 #SUP  0.69  #QF  0.69
 13 CYSS HN     13 CYSS HB2     3.11 #SUP  0.99  #QF  0.99
 13 CYSS HB3    15 ASP  HN      4.72 #SUP  0.95  #QF  0.95
 13 CYSS HB2    17 GLY  HN      4.48 #SUP  0.97  #QF  0.97
 13 CYSS HB2    16 CYSS HN      4.57 #SUP  0.99  #QF  0.99
 13 CYSS HB2    20 PHE  QD      4.52 #SUP  0.93  #QF  0.93
 12 GLU  QB     13 CYSS HB3     5.50 #SUP  0.99  #QF  0.82
 13 CYSS HB3    15 ASP  HB2     5.50 #SUP  0.99  #QF  0.82
 12 GLU  QB     13 CYSS HB2     5.50 #SUP  0.91  #QF  0.41
 13 CYSS HB2    15 ASP  HB2     5.50 #SUP  0.91  #QF  0.41
 13 CYSS HB3    18 LYS  HB2     4.09 #SUP  0.99  #QF  0.99
 13 CYSS HB3    18 LYS  HB3     4.33 #SUP  1.00
 31 ARG  HB3    32 THR  QG2     5.50 #SUP  0.86  #QF  0.86
 13 CYSS HB3    26 LEU  QD1     3.68 #SUP  1.00
 25 GLN  HA     28 ILE  HN      4.21 #SUP  0.99  #QF  0.99
 25 GLN  HA     25 GLN  HG2     3.00 #SUP  1.00  #QF  0.99
 22 LEU  HB2    25 GLN  HA      4.70 #SUP  1.00
 13 CYSS HB2    18 LYS  HB2     4.41 #SUP  0.97  #QF  0.97
 13 CYSS HB2    18 LYS  HB3     4.46 #SUP  0.99  #QF  0.99
 18 LYS  HD3    29 HIS  HE1     3.97 #SUP  0.88  #QF  0.88
 28 ILE  HG12   29 HIS  HN      5.34 #SUP  0.98  #QF  0.98
 28 ILE  HN     28 ILE  HG12    3.70 #SUP  0.98  #QF  0.98
 18 LYS  HD3    20 PHE  HZ      4.42 #SUP  0.97  #QF  0.97
  9 LYS  HA      9 LYS  HD2     4.89 #SUP  1.00
  9 LYS  HA      9 LYS  HD3     4.89 #SUP  1.00
 18 LYS  HA     18 LYS  HD2     4.74 #SUP  1.00
 25 GLN  HA     28 ILE  HG12    5.44 #SUP  0.97  #QF  0.97
 24 SER  HA     28 ILE  HG13    4.95 #SUP  0.99  #QF  0.60
 25 GLN  HA     28 ILE  HG13    5.32 #SUP  0.99  #QF  0.60
 11 TYR  QE     23 LYS  HD3     4.66 #SUP  1.00
 18 LYS  HA     18 LYS  HD3     4.74 #SUP  0.97  #QF  0.97
 23 LYS  HA     23 LYS  HD2     4.99 #SUP  0.99  #QF  0.68
 23 LYS  HA     27 ILE  HG13    5.50 #SUP  0.99  #QF  0.68
 23 LYS  HA     23 LYS  HD3     4.99 #SUP  0.97  #QF  0.97
  8 GLU  HA      9 LYS  HA      4.88 #SUP  0.96  #QF  0.96
 24 SER  HA     27 ILE  HG12    4.74 #SUP  0.95  #QF  0.95
 27 ILE  HA     27 ILE  HG13    3.55 #SUP  1.00
  8 GLU  HA     10 PRO  HD3     5.34 #SUP  0.89  #QF  0.89
 23 LYS  HE2    27 ILE  HG12    5.50 #SUP  0.68  #QF  0.51
 23 LYS  HE3    27 ILE  HG12    5.50 #SUP  0.68  #QF  0.51
 26 LEU  HB3    27 ILE  HG13    4.57 #SUP  0.99  #QF  0.99
 33 HIS  HB3    34 THR  QG2     4.62 #SUP  0.88  #QF  0.88
 23 LYS  HG2    27 ILE  HG12    5.50 #SUP  0.63  #QF  0.21
 26 LEU  QD2    27 ILE  HG12    5.50 #SUP  0.63  #QF  0.21
 33 HIS  HB3    34 THR  HN      4.76 #SUP  0.90  #QF  0.90
 33 HIS  HN     33 HIS  HB3     3.75 #SUP  0.97  #QF  0.97
 33 HIS  HB3    33 HIS  HD2     3.76 #SUP  0.99  #QF  0.99
 30 GLN  HA     33 HIS  HB3     4.85 #SUP  0.99  #QF  0.99
 29 HIS  HB3    30 GLN  HB2     5.16 #SUP  0.87  #QF  0.87
 36 GLU  HA     36 GLU  QG      3.84 #SUP  1.00
 15 ASP  HB2    33 HIS  HB3     5.50 #SUP  0.92  #QF  0.80
 15 ASP  HB3    33 HIS  HB2     5.05 #SUP  0.88  #QF  0.79
 15 ASP  HB2    33 HIS  HB2     5.38 #SUP  0.88  #QF  0.79
 22 LEU  HB2    25 GLN  HB3     4.42 #SUP  0.99  #QF  0.99
 33 HIS  HB2    34 THR  QG2     4.85 #SUP  0.95  #QF  0.95
 29 HIS  HB2    30 GLN  HN      4.00 #SUP  0.98  #QF  0.98
 20 PHE  QD     29 HIS  HB3     4.85 #SUP  0.90  #QF  0.56
 28 ILE  HN     29 HIS  HB3     5.30 #SUP  0.90  #QF  0.56
 20 PHE  QD     29 HIS  HB2     4.58 #SUP  0.73  #QF  0.73
 25 GLN  HB3    26 LEU  HN      4.20 #SUP  1.00
 20 PHE  QE     29 HIS  HB2     3.98 #SUP  1.00
 20 PHE  HA     25 GLN  HB2     5.05 #SUP  0.99  #QF  0.99
 28 ILE  HB     29 HIS  HB2     4.91 #SUP  1.00
 22 LEU  HB3    25 GLN  HB3     4.89 #SUP  0.98  #QF  0.98
 26 LEU  HB2    29 HIS  HB3     5.07 #SUP  0.98  #QF  0.98
 26 LEU  QD1    29 HIS  HB2     4.35 #SUP  1.00
 22 LEU  QD2    25 GLN  HB2     5.02 #SUP  0.99  #QF  0.99
 22 LEU  QD1    25 GLN  HB3     5.07 #SUP  0.90  #QF  0.90
 28 ILE  QG2    29 HIS  HB3     5.17 #SUP  0.95  #QF  0.95
 29 HIS  HN     30 GLN  HB2     5.50 #SUP  1.00  #QF  0.90
 30 GLN  HB2    30 GLN  HE21    5.50 #SUP  1.00  #QF  0.90
 30 GLN  HB3    30 GLN  HE21    4.79 #SUP  0.87  #QF  0.87
 26 LEU  HG     30 GLN  HB2     4.85 #SUP  0.98  #QF  0.98
 30 GLN  HB3    34 THR  QG2     5.09 #SUP  0.49  #QF  0.49
 26 LEU  QD1    30 GLN  HB3     4.99 #SUP  0.94  #QF  0.94
 31 ARG  HA     31 ARG  HG3     3.83 #SUP  1.00
 28 ILE  HA     31 ARG  HG2     4.75 #SUP  1.00
 28 ILE  QG2    31 ARG  HG3     5.50 #SUP  0.98  #QF  0.95
 26 LEU  HG     27 ILE  HN      4.82 #SUP  0.98  #QF  0.98
 13 CYSS HA     26 LEU  HG      5.01 #SUP  0.95  #QF  0.95
 11 TYR  HB3    26 LEU  HG      4.87 #SUP  0.94  #QF  0.94
 26 LEU  HG     30 GLN  HG3     3.83 #SUP  0.98  #QF  0.98
 22 LEU  HG     23 LYS  HN      4.81 #SUP  0.99  #QF  0.99
 22 LEU  HN     22 LEU  HG      3.85 #SUP  1.00
 22 LEU  HG     25 GLN  HN      5.14 #SUP  1.00
 22 LEU  HA     22 LEU  HG      3.69 #SUP  1.00
 22 LEU  HG     25 GLN  HB2     4.79 #SUP  0.59  #QF  0.59
 22 LEU  HB2    22 LEU  HG      2.85 #SUP  1.00
 20 PHE  QD     26 LEU  QD2     4.43 #SUP  0.99  #QF  0.99
 11 TYR  HA     26 LEU  QD2     4.13 #SUP  0.99  #QF  0.98
 13 CYSS HA     26 LEU  QD2     4.30 #SUP  0.99  #QF  0.98
  9 LYS  HA     10 PRO  HG3     4.61 #SUP  1.00
  9 LYS  HA     10 PRO  HG2     4.88 #SUP  1.00
 13 CYSS HB3    26 LEU  QD2     5.50 #SUP  0.95  #QF  0.48
 20 PHE  HB3    26 LEU  QD2     5.50 #SUP  0.95  #QF  0.48
 26 LEU  HA     26 LEU  QD2     4.38 #SUP  1.00
 11 TYR  HB3    26 LEU  QD2     3.06 #SUP  1.00
 20 PHE  HB2    26 LEU  QD2     4.85 #SUP  0.90  #QF  0.90
 26 LEU  HB2    26 LEU  QD2     3.37 #SUP  0.99  #QF  0.99
 18 LYS  HN     18 LYS  HG2     4.83 #SUP  0.99  #QF  0.98
 18 LYS  HN     18 LYS  HG3     4.83 #SUP  0.99  #QF  0.99
 18 LYS  HG2    19 ALA  HN      4.52 #SUP  1.00
 18 LYS  HG3    20 PHE  HZ      4.85 #SUP  1.00
 22 LEU  HN     22 LEU  QD1     4.47 #SUP  1.00
 22 LEU  QD1    25 GLN  HN      4.46 #SUP  0.98  #QF  0.98
 22 LEU  HA     22 LEU  QD1     4.36 #SUP  1.00
 22 LEU  QD1    24 SER  HA      5.50 #SUP  0.78  #QF  0.78
 22 LEU  QD1    25 GLN  HG3     3.55 #SUP  0.72  #QF  0.72
 22 LEU  HB3    22 LEU  QD1     3.05 #SUP  1.00  #QF  0.99
 22 LEU  HB2    22 LEU  QD1     3.17 #SUP  1.00
 23 LYS  HN     23 LYS  HG2     4.63 #SUP  0.92  #QF  0.92
 11 TYR  QD     23 LYS  HG2     5.50 #SUP  1.00
 23 LYS  HA     23 LYS  HG2     4.09 #SUP  1.00
 23 LYS  HG2    27 ILE  QD1     4.28 #SUP  0.99  #QF  0.99
  9 LYS  HA      9 LYS  HG2     4.12 #SUP  1.00
  9 LYS  HA      9 LYS  HG3     4.12 #SUP  1.00
 23 LYS  HG3    26 LEU  HB3     4.96 #SUP  0.90  #QF  0.90
  9 LYS  HG2    10 PRO  HD2     5.33 #SUP  0.63  #QF  0.52
  9 LYS  HG2    10 PRO  HD3     5.50 #SUP  0.63  #QF  0.52
  9 LYS  HG3    10 PRO  HD2     5.33 #SUP  0.82  #QF  0.74
  9 LYS  HG3    10 PRO  HD3     5.50 #SUP  0.82  #QF  0.74
 22 LEU  QD2    23 LYS  HN      3.98 #SUP  0.93  #QF  0.93
 11 TYR  QD     22 LEU  QD2     5.21 #SUP  0.99  #QF  0.99
 11 TYR  QE     22 LEU  QD2     4.70 #SUP  0.96  #QF  0.96
 22 LEU  HA     22 LEU  QD2     2.96 #SUP  0.97  #QF  0.97
 22 LEU  QD2    24 SER  QB      4.76 #SUP  0.81  #QF  0.81
 22 LEU  HB3    22 LEU  QD2     3.07 #SUP  1.00  #QF  0.98
 22 LEU  HB2    22 LEU  QD2     3.50 #SUP  1.00
 13 CYSS HN     26 LEU  QD1     3.71 #SUP  0.98  #QF  0.98
 26 LEU  QD1    30 GLN  HN      4.14 #SUP  1.00
 26 LEU  QD1    27 ILE  HN      4.52 #SUP  0.88  #QF  0.88
 26 LEU  QD1    30 GLN  HE21    3.95 #SUP  0.96  #QF  0.96
 26 LEU  QD1    29 HIS  HD2     3.30 #SUP  1.00
 20 PHE  QE     26 LEU  QD1     3.40 #SUP  1.00
 20 PHE  HZ     26 LEU  QD1     4.94 #SUP  0.99  #QF  0.99
 19 ALA  HA     26 LEU  QD1     4.84 #SUP  0.96  #QF  0.96
 13 CYSS HA     26 LEU  QD1     3.11 #SUP  0.97  #QF  0.97
 26 LEU  QD1    29 HIS  HB3     3.78 #SUP  0.88  #QF  0.88
 13 CYSS HB2    26 LEU  QD1     3.14 #SUP  0.99  #QF  0.85
 26 LEU  QD1    30 GLN  HG3     3.39 #SUP  0.99  #QF  0.85
 26 LEU  QD1    30 GLN  HB2     4.48 #SUP  1.00
 26 LEU  HB3    26 LEU  QD1     3.61 #SUP  1.00
 15 ASP  HB2    26 LEU  QD1     5.50 #SUP  0.93  #QF  0.86
 26 LEU  HB2    26 LEU  QD1     3.30 #SUP  0.99  #QF  0.99
 11 TYR  HN     19 ALA  QB      4.70 #SUP  0.89  #QF  0.89
 19 ALA  HN     19 ALA  QB      3.04 #SUP  0.90  #QF  0.90
 19 ALA  QB     20 PHE  QD      4.54 #SUP  0.97  #QF  0.97
 10 PRO  HD3    11 TYR  QE      4.94 #SUP  0.82  #QF  0.82
 19 ALA  QB     20 PHE  HA      4.63 #SUP  0.95  #QF  0.95
  9 LYS  HA     19 ALA  QB      4.90 #SUP  0.95  #QF  0.95
 18 LYS  HA     19 ALA  QB      3.96 #SUP  0.91  #QF  0.91
 12 GLU  HG3    19 ALA  HA      4.80 #SUP  0.99  #QF  0.99
 12 GLU  HG3    19 ALA  QB      3.78 #SUP  0.90  #QF  0.90
  9 LYS  HB2    19 ALA  QB      3.36 #SUP  0.54  #QF  0.54
  9 LYS  HB3    19 ALA  HA      4.75 #SUP  0.97  #QF  0.97
 14 THR  QG2    15 ASP  HN      4.59 #SUP  0.96  #QF  0.96
 10 PRO  HD3    11 TYR  HN      4.11 #SUP  1.00
 10 PRO  HD3    11 TYR  QD      4.40 #SUP  1.00
 13 CYSS HA     14 THR  QG2     4.64 #SUP  0.83  #QF  0.83
  9 LYS  HA     10 PRO  HD2     3.01 #SUP  0.99  #QF  0.99
  9 LYS  HA     10 PRO  HD3     2.98 #SUP  0.98  #QF  0.98
 10 PRO  HD2    21 GLY  HA1     3.52 #SUP  0.99  #QF  0.99
 10 PRO  HD3    21 GLY  HA1     3.88 #SUP  0.99  #QF  0.99
  9 LYS  HB3    10 PRO  HD2     4.22 #SUP  0.98  #QF  0.98
  9 LYS  HB3    10 PRO  HD3     4.70 #SUP  0.99  #QF  0.99
 38 GLY  HA2    39 PRO  QD      3.33 #SUP  0.95  #QF  0.95
 38 GLY  HA1    39 PRO  QD      3.33 #SUP  0.97  #QF  0.97
 34 THR  HA     34 THR  QG2     2.91 #SUP  0.87  #QF  0.87
 29 HIS  HB2    32 THR  QG2     4.76 #SUP  0.90  #QF  0.90
 31 ARG  HB2    32 THR  QG2     4.53 #SUP  0.86  #QF  0.86
 32 THR  HN     32 THR  QG2     3.16 #SUP  0.98  #QF  0.98
 32 THR  QG2    33 HIS  HN      4.20 #SUP  0.64  #QF  0.64
 10 PRO  HD2    21 GLY  HA2     4.12 #SUP  0.98  #QF  0.98
 11 TYR  HA     11 TYR  QD      4.25 #SUP  0.98  #QF  0.98
 13 CYSS HB3    17 GLY  HA1     4.43 #SUP  0.84  #QF  0.84
 13 CYSS HB2    17 GLY  HA1     5.50 #SUP  0.77  #QF  0.77
 18 LYS  HD2    20 PHE  HZ      4.42 #SUP  0.97  #QF  0.97
 23 LYS  HG3    26 LEU  HN      5.08 #SUP  0.43  #QF  0.43
 23 LYS  HG3    27 ILE  HN      5.08 #SUP  0.95  #QF  0.95
  9 LYS  QE     19 ALA  QB      4.12 #SUP  0.99  #QF  0.29
 25 GLN  HA     28 ILE  QG2     4.65 #SUP  0.98  #QF  0.98
 22 LEU  QD1    25 GLN  HB2     4.75 #SUP  0.98  #QF  0.98
 27 ILE  HA     27 ILE  QD1     4.07 #SUP  0.99  #QF  0.99
 27 ILE  HN     27 ILE  QD1     3.85 #SUP  1.00
 22 LEU  HB2    25 GLN  HB2     3.60 #SUP  0.97  #QF  0.97
 22 LEU  HB3    25 GLN  HB2     3.89 #SUP  0.95  #QF  0.95
 16 CYSS HB3    33 HIS  HE1     3.13 #SUP  0.96  #QF  0.96
 16 CYSS HB2    33 HIS  HE1     3.82 #SUP  0.97  #QF  0.97
 15 ASP  HB3    33 HIS  HE1     4.34 #SUP  0.75  #QF  0.75
 16 CYSS HA     33 HIS  HE1     4.59 #SUP  0.95  #QF  0.95
 18 LYS  HD2    29 HIS  HE1     3.97 #SUP  0.83  #QF  0.73
 29 HIS  HE1    32 THR  QG2     4.24 #SUP  0.85  #QF  0.85
 20 PHE  HZ     29 HIS  HE1     4.56 #SUP  0.99  #QF  0.99
 31 ARG  HA     31 ARG  QD      4.25 #SUP  0.89  #QF  0.89
 31 ARG  HB2    31 ARG  QD      3.10 #SUP  1.00
 20 PHE  QD     26 LEU  QD1     3.13 #SUP  0.99  #QF  0.99
 20 PHE  QD     26 LEU  HB2     3.59 #SUP  1.00
 20 PHE  QD     26 LEU  HG      4.66 #SUP  0.95  #QF  0.95
 20 PHE  QD     25 GLN  HB3     3.34 #SUP  0.99  #QF  0.99
 20 PHE  QD     25 GLN  HB2     3.54 #SUP  1.00
 11 TYR  HB2    20 PHE  QD      4.41 #SUP  0.95  #QF  0.70
 20 PHE  QD     25 GLN  HA      4.84 #SUP  0.98  #QF  0.98
 20 PHE  HA     20 PHE  QD      3.42 #SUP  0.98  #QF  0.98
 19 ALA  HA     20 PHE  QD      3.57 #SUP  0.99  #QF  0.99
 20 PHE  QD     20 PHE  HZ      4.07 #SUP  1.00
 20 PHE  HN     20 PHE  QD      3.19 #SUP  0.98  #QF  0.98
 11 TYR  QD     26 LEU  QD2     3.31 #SUP  0.98  #QF  0.31
 10 PRO  HB2    11 TYR  QD      4.10 #SUP  0.97  #QF  0.97
 10 PRO  HG2    11 TYR  QD      3.62 #SUP  0.99  #QF  0.99
 10 PRO  HG3    11 TYR  QD      4.67 #SUP  1.00
 11 TYR  QD     26 LEU  HB3     4.45 #SUP  0.78  #QF  0.78
 11 TYR  QD     20 PHE  HB2     4.52 #SUP  0.99  #QF  0.99
 10 PRO  HD2    11 TYR  QD      3.60 #SUP  0.95  #QF  0.95
 11 TYR  QD     21 GLY  HA1     4.34 #SUP  0.97  #QF  0.97
 11 TYR  QD     22 LEU  HA      3.97 #SUP  0.98  #QF  0.98
 11 TYR  HN     11 TYR  QD      3.40 #SUP  0.99  #QF  0.99
 11 TYR  QD     12 GLU  HN      4.69 #SUP  0.97  #QF  0.97
  8 GLU  HN      8 GLU  QB      3.55 
  8 GLU  HN      8 GLU  QG      4.34 
  8 GLU  HA      8 GLU  QG      3.67 
  8 GLU  HA      9 LYS  QG      4.54 
  8 GLU  QB      9 LYS  HN      4.15 
  8 GLU  QB     10 PRO  HD3     4.65 
  9 LYS  HN      9 LYS  QG      3.94 
  9 LYS  HA      9 LYS  QG      3.44 
  9 LYS  QG      9 LYS  QE      3.18 
  9 LYS  QG     20 PHE  HA      4.92 
  9 LYS  QG     21 GLY  HA1     4.46 
  9 LYS  QG     21 GLY  HA2     4.56 
  9 LYS  QD     20 PHE  HN      4.53 
  9 LYS  QD     20 PHE  HB2     5.34 
  9 LYS  QD     21 GLY  HA2     5.09 
 11 TYR  HB3    23 LYS  QD      5.34 
 11 TYR  QD     23 LYS  QD      4.55 
 11 TYR  QE     23 LYS  QD      3.86 
 11 TYR  QE     23 LYS  QE      5.18 
 18 LYS  HN     18 LYS  QG      4.07 
 18 LYS  HN     18 LYS  QE      5.34 
 18 LYS  HA     18 LYS  QD      4.10 
 18 LYS  HA     18 LYS  QE      5.34 
 18 LYS  HB2    18 LYS  QE      4.91 
 18 LYS  QG     18 LYS  QE      3.32 
 18 LYS  QG     19 ALA  HN      3.87 
 18 LYS  QG     20 PHE  QE      4.09 
 18 LYS  QG     20 PHE  HZ      4.20 
 18 LYS  QG     29 HIS  HE1     5.32 
 18 LYS  QD     19 ALA  HN      4.72 
 18 LYS  QD     20 PHE  QE      4.94 
 18 LYS  QD     29 HIS  HE1     3.42 
 18 LYS  QE     29 HIS  HE1     4.82 
 23 LYS  HA     23 LYS  QD      4.38 
 23 LYS  HB2    23 LYS  QE      4.83 
 23 LYS  HB3    23 LYS  QE      4.65 
 23 LYS  HG3    23 LYS  QE      3.71 
 23 LYS  QE     27 ILE  QD1     3.56 
 25 GLN  HB2    25 GLN  QE2     3.74 
 36 GLU  HN     36 GLU  QB      3.67 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1 -12.332   1.740 -22.862
    2    HA2  GLY   1           1HA      GLY   1 -14.732   0.503 -23.087
    3    HA3  GLY   1           2HA      GLY   1 -13.653  -0.590 -23.941
    4    H    SER   2           H        SER   2 -14.620   0.665 -20.861
    5    HA   SER   2           HA       SER   2 -13.037  -1.442 -19.561
    6    HB2  SER   2           1HB      SER   2 -13.393   1.342 -18.429
    7    HB3  SER   2           2HB      SER   2 -12.439   0.031 -17.735
    8    HG   SER   2           HG       SER   2 -11.064   1.404 -18.839
    9    H    SER   3           H        SER   3 -14.588  -2.824 -18.956
   10    HA   SER   3           HA       SER   3 -16.436  -2.066 -16.914
   11    HB2  SER   3           1HB      SER   3 -17.620  -1.279 -18.980
   12    HB3  SER   3           2HB      SER   3 -17.637  -2.948 -19.549
   13    HG   SER   3           HG       SER   3 -19.225  -1.721 -17.704
   14    H    GLY   4           H        GLY   4 -17.576  -3.891 -16.015
   15    HA2  GLY   4           1HA      GLY   4 -17.936  -6.149 -15.597
   16    HA3  GLY   4           2HA      GLY   4 -17.002  -6.535 -17.035
   17    H    SER   5           H        SER   5 -16.984  -6.269 -13.631
   18    HA   SER   5           HA       SER   5 -14.299  -7.378 -13.546
   19    HB2  SER   5           1HB      SER   5 -13.441  -5.764 -11.960
   20    HB3  SER   5           2HB      SER   5 -14.006  -4.899 -13.390
   21    HG   SER   5           HG       SER   5 -14.775  -3.849 -11.574
   22    H    SER   6           H        SER   6 -13.828  -8.487 -11.610
   23    HA   SER   6           HA       SER   6 -16.129  -8.871  -9.811
   24    HB2  SER   6           1HB      SER   6 -14.396 -10.913 -11.168
   25    HB3  SER   6           2HB      SER   6 -15.149 -11.288  -9.618
   26    HG   SER   6           HG       SER   6 -16.365 -11.825 -11.607
   27    H    GLY   7           H        GLY   7 -15.708  -8.670  -7.701
   28    HA2  GLY   7           1HA      GLY   7 -14.362  -9.066  -5.760
   29    HA3  GLY   7           2HA      GLY   7 -12.932  -8.974  -6.777
   30    H    GLU   8           H        GLU   8 -13.039  -7.571  -4.425
   31    HA   GLU   8           HA       GLU   8 -13.252  -4.796  -5.387
   32    HB2  GLU   8           1HB      GLU   8 -13.878  -4.112  -3.109
   33    HB3  GLU   8           2HB      GLU   8 -15.050  -5.224  -3.803
   34    HG2  GLU   8           1HG      GLU   8 -12.854  -6.118  -1.962
   35    HG3  GLU   8           2HG      GLU   8 -14.438  -5.601  -1.389
   36    H    LYS   9           H        LYS   9 -11.901  -3.271  -4.036
   37    HA   LYS   9           HA       LYS   9  -9.301  -4.541  -3.507
   38    HB2  LYS   9           1HB      LYS   9  -9.805  -1.614  -4.042
   39    HB3  LYS   9           2HB      LYS   9  -8.263  -2.461  -4.067
   40    HG2  LYS   9           1HG      LYS   9  -8.908  -3.669  -6.051
   41    HG3  LYS   9           2HG      LYS   9 -10.522  -2.955  -5.997
   42    HD2  LYS   9           1HD      LYS   9  -9.623  -0.763  -6.411
   43    HD3  LYS   9           2HD      LYS   9  -7.970  -1.371  -6.285
   44    HE2  LYS   9           1HE      LYS   9  -8.069  -2.440  -8.329
   45    HE3  LYS   9           2HE      LYS   9  -9.828  -2.554  -8.302
   46    HZ1  LYS   9           3HZ      LYS   9  -9.246   0.141  -8.294
   47    HZ2  LYS   9           1HZ      LYS   9  -9.855  -0.765  -9.587
   48    HZ3  LYS   9           2HZ      LYS   9  -8.187  -0.534  -9.427
   49    HA   PRO  10           HA       PRO  10 -10.514  -3.458   0.733
   50    HB2  PRO  10           1HB      PRO  10  -8.789  -5.205   1.891
   51    HB3  PRO  10           2HB      PRO  10 -10.369  -5.689   1.263
   52    HG2  PRO  10           1HG      PRO  10  -7.668  -5.948  -0.001
   53    HG3  PRO  10           2HG      PRO  10  -8.996  -7.123   0.053
   54    HD2  PRO  10           1HD      PRO  10  -8.493  -5.592  -2.123
   55    HD3  PRO  10           2HD      PRO  10 -10.132  -6.107  -1.677
   56    H    TYR  11           H        TYR  11  -7.698  -3.041  -1.073
   57    HA   TYR  11           HA       TYR  11  -6.387  -1.592   1.132
   58    HB2  TYR  11           1HB      TYR  11  -5.085  -2.648  -1.383
   59    HB3  TYR  11           2HB      TYR  11  -4.275  -1.937   0.008
   60    HD1  TYR  11           HD1      TYR  11  -5.972  -4.917  -1.288
   61    HD2  TYR  11           HD2      TYR  11  -3.956  -3.209   2.047
   62    HE1  TYR  11           HE1      TYR  11  -5.749  -7.152  -0.286
   63    HE2  TYR  11           HE2      TYR  11  -3.726  -5.439   3.058
   64    HH   TYR  11           HH       TYR  11  -5.411  -7.907   2.468
   65    H    GLU  12           H        GLU  12  -5.874   0.525   0.882
   66    HA   GLU  12           HA       GLU  12  -6.220   1.770  -1.742
   67    HB2  GLU  12           1HB      GLU  12  -7.865   2.284   0.682
   68    HB3  GLU  12           2HB      GLU  12  -7.395   3.676  -0.284
   69    HG2  GLU  12           1HG      GLU  12  -9.369   3.169  -1.281
   70    HG3  GLU  12           2HG      GLU  12  -8.286   2.180  -2.258
   71    H    CYS  13           H        CYS  13  -4.981   3.590  -2.078
   72    HA   CYS  13           HA       CYS  13  -2.746   3.924  -0.289
   73    HB2  CYS  13           1HB      CYS  13  -2.332   3.950  -2.676
   74    HB3  CYS  13           2HB      CYS  13  -3.464   5.282  -2.894
   75    H    THR  14           H        THR  14  -2.881   5.167   1.450
   76    HA   THR  14           HA       THR  14  -4.889   7.129   1.841
   77    HB   THR  14           HB       THR  14  -3.488   7.775   3.856
   78    HG1  THR  14           HG1      THR  14  -1.978   5.470   3.144
   79   HG21  THR  14          3HG2      THR  14  -4.734   6.261   4.914
   80   HG22  THR  14          1HG2      THR  14  -3.708   4.953   4.329
   81   HG23  THR  14          2HG2      THR  14  -5.075   5.502   3.359
   82    H    ASP  15           H        ASP  15  -1.751   7.216   0.423
   83    HA   ASP  15           HA       ASP  15  -1.100   9.924   0.817
   84    HB2  ASP  15           1HB      ASP  15   0.270   7.897  -0.198
   85    HB3  ASP  15           2HB      ASP  15  -0.329   8.549  -1.720
   86    H    CYS  16           H        CYS  16  -2.607   8.330  -1.995
   87    HA   CYS  16           HA       CYS  16  -3.670  10.959  -2.795
   88    HB2  CYS  16           1HB      CYS  16  -3.750  10.108  -5.084
   89    HB3  CYS  16           2HB      CYS  16  -2.119   9.971  -4.435
   90    H    GLY  17           H        GLY  17  -4.420   7.502  -2.558
   91    HA2  GLY  17           1HA      GLY  17  -6.637   7.071  -1.475
   92    HA3  GLY  17           2HA      GLY  17  -7.286   8.220  -2.635
   93    H    LYS  18           H        LYS  18  -4.808   6.236  -3.862
   94    HA   LYS  18           HA       LYS  18  -6.497   5.055  -5.795
   95    HB2  LYS  18           1HB      LYS  18  -3.891   5.496  -5.758
   96    HB3  LYS  18           2HB      LYS  18  -3.843   3.854  -5.132
   97    HG2  LYS  18           1HG      LYS  18  -4.582   2.933  -7.095
   98    HG3  LYS  18           2HG      LYS  18  -5.415   4.405  -7.598
   99    HD2  LYS  18           1HD      LYS  18  -2.440   4.420  -7.346
  100    HD3  LYS  18           2HD      LYS  18  -3.184   3.674  -8.762
  101    HE2  LYS  18           1HE      LYS  18  -4.503   5.853  -8.989
  102    HE3  LYS  18           2HE      LYS  18  -3.350   6.528  -7.838
  103    HZ1  LYS  18           3HZ      LYS  18  -2.616   6.993 -10.053
  104    HZ2  LYS  18           1HZ      LYS  18  -2.725   5.364 -10.496
  105    HZ3  LYS  18           2HZ      LYS  18  -1.560   5.859  -9.374
  106    H    ALA  19           H        ALA  19  -6.216   2.530  -6.142
  107    HA   ALA  19           HA       ALA  19  -6.700   1.141  -3.599
  108    HB1  ALA  19           3HB      ALA  19  -8.566  -0.109  -4.766
  109    HB2  ALA  19           1HB      ALA  19  -8.897   1.571  -4.345
  110    HB3  ALA  19           2HB      ALA  19  -8.499   1.141  -6.009
  111    H    PHE  20           H        PHE  20  -6.447  -1.178  -3.716
  112    HA   PHE  20           HA       PHE  20  -5.286  -2.336  -6.090
  113    HB2  PHE  20           1HB      PHE  20  -3.612  -2.107  -3.580
  114    HB3  PHE  20           2HB      PHE  20  -3.158  -2.951  -5.057
  115    HD1  PHE  20           HD1      PHE  20  -3.643   0.321  -3.490
  116    HD2  PHE  20           HD2      PHE  20  -2.425  -1.749  -7.003
  117    HE1  PHE  20           HE1      PHE  20  -2.641   2.394  -4.359
  118    HE2  PHE  20           HE2      PHE  20  -1.421   0.320  -7.878
  119    HZ   PHE  20           HZ       PHE  20  -1.527   2.395  -6.556
  120    H    GLY  21           H        GLY  21  -6.241  -4.251  -6.218
  121    HA2  GLY  21           1HA      GLY  21  -7.660  -5.506  -4.181
  122    HA3  GLY  21           2HA      GLY  21  -7.086  -6.304  -5.638
  123    H    LEU  22           H        LEU  22  -4.267  -5.498  -4.772
  124    HA   LEU  22           HA       LEU  22  -3.906  -7.725  -2.882
  125    HB2  LEU  22           1HB      LEU  22  -2.358  -6.753  -5.217
  126    HB3  LEU  22           2HB      LEU  22  -1.446  -7.411  -3.860
  127    HG   LEU  22           HG       LEU  22  -3.422  -8.815  -5.638
  128   HD11  LEU  22          1HD1      LEU  22  -1.312 -10.428  -5.468
  129   HD12  LEU  22          2HD1      LEU  22  -0.503  -8.893  -5.152
  130   HD13  LEU  22          3HD1      LEU  22  -1.414  -9.119  -6.645
  131   HD21  LEU  22          3HD2      LEU  22  -4.123  -9.857  -3.767
  132   HD22  LEU  22          1HD2      LEU  22  -2.704  -9.374  -2.837
  133   HD23  LEU  22          2HD2      LEU  22  -2.609 -10.747  -3.940
  134    H    LYS  23           H        LYS  23  -1.951  -7.526  -1.468
  135    HA   LYS  23           HA       LYS  23  -1.967  -4.900  -0.219
  136    HB2  LYS  23           1HB      LYS  23  -2.239  -6.788   1.254
  137    HB3  LYS  23           2HB      LYS  23  -0.784  -7.549   0.625
  138    HG2  LYS  23           1HG      LYS  23   0.022  -6.682   2.570
  139    HG3  LYS  23           2HG      LYS  23   0.349  -5.335   1.477
  140    HD2  LYS  23           1HD      LYS  23  -2.013  -4.521   2.185
  141    HD3  LYS  23           2HD      LYS  23  -1.792  -5.616   3.552
  142    HE2  LYS  23           1HE      LYS  23   0.369  -3.677   2.866
  143    HE3  LYS  23           2HE      LYS  23  -1.065  -3.102   3.716
  144    HZ1  LYS  23           3HZ      LYS  23  -0.519  -5.183   5.209
  145    HZ2  LYS  23           1HZ      LYS  23   0.220  -3.685   5.475
  146    HZ3  LYS  23           2HZ      LYS  23   1.048  -4.899   4.638
  147    H    SER  24           H        SER  24   0.145  -6.939  -2.085
  148    HA   SER  24           HA       SER  24   2.523  -5.416  -1.499
  149    HB2  SER  24           1HB      SER  24   2.830  -7.745  -1.990
  150    HB3  SER  24           2HB      SER  24   1.935  -7.603  -3.503
  151    HG   SER  24           HG       SER  24   3.776  -7.168  -4.391
  152    H    GLN  25           H        GLN  25   0.040  -5.467  -3.951
  153    HA   GLN  25           HA       GLN  25   1.364  -3.971  -5.933
  154    HB2  GLN  25           1HB      GLN  25  -1.512  -4.506  -5.286
  155    HB3  GLN  25           2HB      GLN  25  -1.102  -3.327  -6.524
  156    HG2  GLN  25           1HG      GLN  25   0.406  -5.308  -7.405
  157    HG3  GLN  25           2HG      GLN  25  -0.776  -6.274  -6.523
  158   HE21  GLN  25          1HE2      GLN  25  -2.831  -6.463  -7.296
  159   HE22  GLN  25          2HE2      GLN  25  -3.333  -5.849  -8.831
  160    H    LEU  26           H        LEU  26  -0.308  -3.048  -3.012
  161    HA   LEU  26           HA       LEU  26  -0.443  -0.255  -3.683
  162    HB2  LEU  26           1HB      LEU  26  -2.127  -0.982  -2.232
  163    HB3  LEU  26           2HB      LEU  26  -0.989  -1.858  -1.210
  164    HG   LEU  26           HG       LEU  26  -0.094   0.335  -0.438
  165   HD11  LEU  26          1HD1      LEU  26  -0.770   1.683  -2.356
  166   HD12  LEU  26          2HD1      LEU  26  -1.409   2.345  -0.852
  167   HD13  LEU  26          3HD1      LEU  26  -2.466   1.440  -1.936
  168   HD21  LEU  26          3HD2      LEU  26  -3.014  -0.267  -0.008
  169   HD22  LEU  26          1HD2      LEU  26  -2.096   0.896   0.949
  170   HD23  LEU  26          2HD2      LEU  26  -1.647  -0.809   0.966
  171    H    ILE  27           H        ILE  27   1.474  -2.202  -1.401
  172    HA   ILE  27           HA       ILE  27   3.040  -0.249  -0.280
  173    HB   ILE  27           HB       ILE  27   3.965  -3.003  -1.105
  174   HG12  ILE  27          1HG1      ILE  27   2.972  -2.149   1.609
  175   HG13  ILE  27          2HG1      ILE  27   1.883  -2.779   0.378
  176   HG21  ILE  27          1HG2      ILE  27   5.092  -1.714   1.285
  177   HG22  ILE  27          2HG2      ILE  27   5.874  -2.692   0.044
  178   HG23  ILE  27          3HG2      ILE  27   5.551  -0.985  -0.254
  179   HD11  ILE  27          3HD1      ILE  27   4.309  -4.300   1.254
  180   HD12  ILE  27          1HD1      ILE  27   2.778  -4.402   2.123
  181   HD13  ILE  27          2HD1      ILE  27   2.867  -4.893   0.431
  182    H    ILE  28           H        ILE  28   3.636  -1.975  -3.328
  183    HA   ILE  28           HA       ILE  28   6.066  -0.684  -3.944
  184    HB   ILE  28           HB       ILE  28   4.051  -1.925  -5.822
  185   HG12  ILE  28          1HG1      ILE  28   6.617  -3.134  -4.798
  186   HG13  ILE  28          2HG1      ILE  28   5.078  -3.365  -3.976
  187   HG21  ILE  28          1HG2      ILE  28   5.825  -2.032  -7.445
  188   HG22  ILE  28          2HG2      ILE  28   5.627  -0.362  -6.917
  189   HG23  ILE  28          3HG2      ILE  28   6.966  -1.328  -6.299
  190   HD11  ILE  28          3HD1      ILE  28   6.152  -4.785  -6.182
  191   HD12  ILE  28          1HD1      ILE  28   4.639  -5.059  -5.318
  192   HD13  ILE  28          2HD1      ILE  28   4.679  -3.969  -6.704
  193    H    HIS  29           H        HIS  29   2.727   0.210  -4.416
  194    HA   HIS  29           HA       HIS  29   3.227   2.291  -6.308
  195    HB2  HIS  29           1HB      HIS  29   1.033   1.479  -6.363
  196    HB3  HIS  29           2HB      HIS  29   0.877   1.506  -4.609
  197    HD1  HIS  29           HD1      HIS  29   0.842   3.806  -7.594
  198    HD2  HIS  29           HD2      HIS  29  -0.106   3.854  -3.549
  199    HE1  HIS  29           HE1      HIS  29  -0.370   5.977  -7.213
  200    H    GLN  30           H        GLN  30   2.582   2.245  -2.811
  201    HA   GLN  30           HA       GLN  30   2.576   4.939  -2.277
  202    HB2  GLN  30           1HB      GLN  30   3.680   2.656  -0.642
  203    HB3  GLN  30           2HB      GLN  30   3.534   4.295  -0.023
  204    HG2  GLN  30           1HG      GLN  30   1.049   4.053  -0.770
  205    HG3  GLN  30           2HG      GLN  30   1.402   2.327  -0.698
  206   HE21  GLN  30          1HE2      GLN  30  -0.392   2.676   0.953
  207   HE22  GLN  30          2HE2      GLN  30   0.118   2.948   2.581
  208    H    ARG  31           H        ARG  31   5.197   3.008  -3.351
  209    HA   ARG  31           HA       ARG  31   7.371   4.474  -2.335
  210    HB2  ARG  31           1HB      ARG  31   7.192   2.927  -4.927
  211    HB3  ARG  31           2HB      ARG  31   8.676   3.427  -4.128
  212    HG2  ARG  31           1HG      ARG  31   7.931   2.048  -2.150
  213    HG3  ARG  31           2HG      ARG  31   6.671   1.396  -3.199
  214    HD2  ARG  31           1HD      ARG  31   8.389  -0.159  -3.393
  215    HD3  ARG  31           2HD      ARG  31   8.598   0.859  -4.818
  216    HE   ARG  31           HE       ARG  31  10.153   1.817  -2.648
  217   HH11  ARG  31          1HH1      ARG  31  10.032  -0.682  -5.068
  218   HH12  ARG  31          2HH1      ARG  31  11.750  -0.900  -5.117
  219   HH21  ARG  31          1HH2      ARG  31  12.417   1.540  -2.703
  220   HH22  ARG  31          2HH2      ARG  31  13.105   0.364  -3.770
  221    H    THR  32           H        THR  32   5.716   4.687  -5.481
  222    HA   THR  32           HA       THR  32   7.161   6.678  -6.681
  223    HB   THR  32           HB       THR  32   5.191   5.454  -7.670
  224    HG1  THR  32           HG1      THR  32   5.037   8.278  -7.989
  225   HG21  THR  32          3HG2      THR  32   3.052   5.894  -7.091
  226   HG22  THR  32          1HG2      THR  32   3.364   7.611  -6.841
  227   HG23  THR  32          2HG2      THR  32   3.779   6.447  -5.582
  228    H    HIS  33           H        HIS  33   4.838   6.978  -4.080
  229    HA   HIS  33           HA       HIS  33   4.641   9.831  -4.213
  230    HB2  HIS  33           1HB      HIS  33   3.849   7.800  -2.129
  231    HB3  HIS  33           2HB      HIS  33   3.627   9.531  -1.889
  232    HD1  HIS  33           HD1      HIS  33   2.250  10.642  -4.106
  233    HD2  HIS  33           HD2      HIS  33   1.619   6.658  -3.114
  234    HE1  HIS  33           HE1      HIS  33   0.052  10.027  -5.160
  235    H    THR  34           H        THR  34   6.321   7.571  -2.038
  236    HA   THR  34           HA       THR  34   7.604   9.583  -0.513
  237    HB   THR  34           HB       THR  34   9.055   7.777   0.326
  238    HG1  THR  34           HG1      THR  34   7.905   6.405  -1.856
  239   HG21  THR  34          3HG2      THR  34   7.336   6.443   1.365
  240   HG22  THR  34          1HG2      THR  34   6.183   6.871   0.102
  241   HG23  THR  34          2HG2      THR  34   6.758   8.103   1.226
  242    H    GLY  35           H        GLY  35   8.671  11.057  -1.798
  243    HA2  GLY  35           1HA      GLY  35  10.664  11.859  -2.689
  244    HA3  GLY  35           2HA      GLY  35  11.260  10.208  -2.771
  245    H    GLU  36           H        GLU  36  10.150  12.820  -4.546
  246    HA   GLU  36           HA       GLU  36  10.338  11.339  -7.005
  247    HB2  GLU  36           1HB      GLU  36   8.145  11.724  -7.840
  248    HB3  GLU  36           2HB      GLU  36   7.957  11.000  -6.249
  249    HG2  GLU  36           1HG      GLU  36   7.923  13.969  -6.558
  250    HG3  GLU  36           2HG      GLU  36   6.486  13.018  -6.929
  251    H    SER  37           H        SER  37  10.043  12.809  -8.919
  252    HA   SER  37           HA       SER  37  11.219  15.412  -8.276
  253    HB2  SER  37           1HB      SER  37  11.884  15.477 -10.645
  254    HB3  SER  37           2HB      SER  37  12.444  13.996  -9.868
  255    HG   SER  37           HG       SER  37  10.200  13.265 -10.759
  256    H    GLY  38           H        GLY  38  10.478  17.340  -9.309
  257    HA2  GLY  38           1HA      GLY  38   8.683  18.116 -10.968
  258    HA3  GLY  38           2HA      GLY  38   7.594  17.237  -9.904
  259    HA   PRO  39           HA       PRO  39   8.654  21.703  -8.431
  260    HB2  PRO  39           1HB      PRO  39   6.784  23.163  -9.751
  261    HB3  PRO  39           2HB      PRO  39   8.415  22.899 -10.379
  262    HG2  PRO  39           1HG      PRO  39   5.865  21.497 -11.081
  263    HG3  PRO  39           2HG      PRO  39   7.159  22.068 -12.150
  264    HD2  PRO  39           1HD      PRO  39   6.924  19.476 -11.405
  265    HD3  PRO  39           2HD      PRO  39   8.495  20.240 -11.718
  266    H    SER  40           H        SER  40   6.061  19.562  -8.669
  267    HA   SER  40           HA       SER  40   4.059  20.992  -7.263
  268    HB2  SER  40           1HB      SER  40   4.528  18.137  -7.991
  269    HB3  SER  40           2HB      SER  40   3.350  18.483  -6.726
  270    HG   SER  40           HG       SER  40   3.040  18.680  -9.353
  271    H    SER  41           H        SER  41   5.188  21.960  -5.514
  272    HA   SER  41           HA       SER  41   5.742  20.091  -3.304
  273    HB2  SER  41           1HB      SER  41   7.755  21.334  -4.344
  274    HB3  SER  41           2HB      SER  41   7.098  22.768  -3.557
  275    HG   SER  41           HG       SER  41   7.071  21.138  -1.647
  276    H    GLY  42           H        GLY  42   5.173  20.778  -1.203
  277    HA2  GLY  42           1HA      GLY  42   3.863  23.301  -0.776
  278    HA3  GLY  42           2HA      GLY  42   2.735  21.956  -0.856
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1 -10.219  -8.567 -19.367
    2    HA2  GLY   1           1HA      GLY   1 -10.222 -10.828 -18.075
    3    HA3  GLY   1           2HA      GLY   1 -10.955  -9.836 -16.823
    4    H    SER   2           H        SER   2 -13.071 -10.120 -16.726
    5    HA   SER   2           HA       SER   2 -14.532 -10.680 -19.219
    6    HB2  SER   2           1HB      SER   2 -14.629 -12.432 -17.441
    7    HB3  SER   2           2HB      SER   2 -15.409 -11.259 -16.380
    8    HG   SER   2           HG       SER   2 -17.002 -12.456 -17.378
    9    H    SER   3           H        SER   3 -14.935  -9.018 -16.092
   10    HA   SER   3           HA       SER   3 -16.140  -6.750 -17.431
   11    HB2  SER   3           1HB      SER   3 -18.016  -8.395 -16.985
   12    HB3  SER   3           2HB      SER   3 -17.714  -8.152 -15.265
   13    HG   SER   3           HG       SER   3 -18.196  -5.987 -17.015
   14    H    GLY   4           H        GLY   4 -16.776  -5.044 -15.730
   15    HA2  GLY   4           1HA      GLY   4 -14.492  -4.754 -13.962
   16    HA3  GLY   4           2HA      GLY   4 -15.707  -3.532 -14.311
   17    H    SER   5           H        SER   5 -15.211  -3.411 -11.845
   18    HA   SER   5           HA       SER   5 -15.819  -3.818  -9.673
   19    HB2  SER   5           1HB      SER   5 -18.368  -3.851 -11.257
   20    HB3  SER   5           2HB      SER   5 -18.412  -4.130  -9.517
   21    HG   SER   5           HG       SER   5 -18.584  -1.976  -9.687
   22    H    SER   6           H        SER   6 -14.725  -6.101 -10.815
   23    HA   SER   6           HA       SER   6 -16.459  -8.322 -10.052
   24    HB2  SER   6           1HB      SER   6 -13.783  -8.184 -11.444
   25    HB3  SER   6           2HB      SER   6 -14.504  -9.707 -10.924
   26    HG   SER   6           HG       SER   6 -14.988  -9.121 -13.123
   27    H    GLY   7           H        GLY   7 -13.100  -7.297  -9.394
   28    HA2  GLY   7           1HA      GLY   7 -13.269  -8.734  -6.826
   29    HA3  GLY   7           2HA      GLY   7 -11.777  -8.354  -7.673
   30    H    GLU   8           H        GLU   8 -13.562  -7.566  -5.058
   31    HA   GLU   8           HA       GLU   8 -13.323  -4.716  -5.073
   32    HB2  GLU   8           1HB      GLU   8 -13.842  -6.667  -2.824
   33    HB3  GLU   8           2HB      GLU   8 -13.904  -4.918  -2.651
   34    HG2  GLU   8           1HG      GLU   8 -15.643  -6.541  -4.495
   35    HG3  GLU   8           2HG      GLU   8 -16.124  -5.928  -2.914
   36    H    LYS   9           H        LYS   9 -11.759  -3.430  -4.239
   37    HA   LYS   9           HA       LYS   9  -9.279  -4.762  -3.407
   38    HB2  LYS   9           1HB      LYS   9  -9.612  -1.871  -4.206
   39    HB3  LYS   9           2HB      LYS   9  -8.115  -2.785  -4.081
   40    HG2  LYS   9           1HG      LYS   9  -8.718  -4.123  -5.991
   41    HG3  LYS   9           2HG      LYS   9 -10.299  -3.343  -6.078
   42    HD2  LYS   9           1HD      LYS   9  -9.384  -1.309  -6.785
   43    HD3  LYS   9           2HD      LYS   9  -7.761  -1.750  -6.249
   44    HE2  LYS   9           1HE      LYS   9  -7.504  -3.297  -8.034
   45    HE3  LYS   9           2HE      LYS   9  -9.211  -3.187  -8.461
   46    HZ1  LYS   9           3HZ      LYS   9  -8.148  -1.865 -10.025
   47    HZ2  LYS   9           1HZ      LYS   9  -7.072  -1.201  -8.900
   48    HZ3  LYS   9           2HZ      LYS   9  -8.699  -0.737  -8.891
   49    HA   PRO  10           HA       PRO  10 -10.639  -3.273   0.661
   50    HB2  PRO  10           1HB      PRO  10  -9.058  -4.992   2.046
   51    HB3  PRO  10           2HB      PRO  10 -10.628  -5.456   1.379
   52    HG2  PRO  10           1HG      PRO  10  -7.886  -5.941   0.281
   53    HG3  PRO  10           2HG      PRO  10  -9.271  -7.046   0.362
   54    HD2  PRO  10           1HD      PRO  10  -8.590  -5.728  -1.903
   55    HD3  PRO  10           2HD      PRO  10 -10.272  -6.130  -1.501
   56    H    TYR  11           H        TYR  11  -7.678  -3.210  -0.993
   57    HA   TYR  11           HA       TYR  11  -6.385  -1.671   1.155
   58    HB2  TYR  11           1HB      TYR  11  -5.094  -2.858  -1.307
   59    HB3  TYR  11           2HB      TYR  11  -4.274  -2.134   0.071
   60    HD1  TYR  11           HD1      TYR  11  -6.180  -5.063  -1.090
   61    HD2  TYR  11           HD2      TYR  11  -3.923  -3.371   2.096
   62    HE1  TYR  11           HE1      TYR  11  -6.058  -7.270  -0.012
   63    HE2  TYR  11           HE2      TYR  11  -3.794  -5.574   3.182
   64    HH   TYR  11           HH       TYR  11  -5.617  -8.310   2.009
   65    H    GLU  12           H        GLU  12  -6.008   0.444   0.909
   66    HA   GLU  12           HA       GLU  12  -6.153   1.616  -1.776
   67    HB2  GLU  12           1HB      GLU  12  -7.897   2.222   0.558
   68    HB3  GLU  12           2HB      GLU  12  -7.373   3.574  -0.436
   69    HG2  GLU  12           1HG      GLU  12  -9.335   3.031  -1.461
   70    HG3  GLU  12           2HG      GLU  12  -8.201   2.063  -2.401
   71    H    CYS  13           H        CYS  13  -4.925   3.467  -2.082
   72    HA   CYS  13           HA       CYS  13  -2.745   3.799  -0.221
   73    HB2  CYS  13           1HB      CYS  13  -2.295   3.789  -2.623
   74    HB3  CYS  13           2HB      CYS  13  -3.347   5.183  -2.844
   75    H    THR  14           H        THR  14  -2.956   5.051   1.505
   76    HA   THR  14           HA       THR  14  -4.964   7.006   1.832
   77    HB   THR  14           HB       THR  14  -3.648   7.701   3.855
   78    HG1  THR  14           HG1      THR  14  -1.870   6.156   4.326
   79   HG21  THR  14          3HG2      THR  14  -4.879   6.119   4.823
   80   HG22  THR  14          1HG2      THR  14  -3.627   4.936   4.449
   81   HG23  THR  14          2HG2      THR  14  -4.946   5.214   3.311
   82    H    ASP  15           H        ASP  15  -1.765   7.130   0.510
   83    HA   ASP  15           HA       ASP  15  -1.199   9.858   0.821
   84    HB2  ASP  15           1HB      ASP  15   0.243   7.847  -0.105
   85    HB3  ASP  15           2HB      ASP  15  -0.352   8.422  -1.660
   86    H    CYS  16           H        CYS  16  -2.522   8.185  -2.041
   87    HA   CYS  16           HA       CYS  16  -3.619  10.763  -2.936
   88    HB2  CYS  16           1HB      CYS  16  -3.691   9.802  -5.176
   89    HB3  CYS  16           2HB      CYS  16  -2.069   9.661  -4.507
   90    H    GLY  17           H        GLY  17  -4.418   7.320  -2.594
   91    HA2  GLY  17           1HA      GLY  17  -6.613   6.893  -1.507
   92    HA3  GLY  17           2HA      GLY  17  -7.271   8.094  -2.609
   93    H    LYS  18           H        LYS  18  -4.859   5.967  -3.836
   94    HA   LYS  18           HA       LYS  18  -6.636   4.924  -5.803
   95    HB2  LYS  18           1HB      LYS  18  -3.757   4.603  -5.124
   96    HB3  LYS  18           2HB      LYS  18  -4.501   3.340  -6.097
   97    HG2  LYS  18           1HG      LYS  18  -5.087   4.900  -7.804
   98    HG3  LYS  18           2HG      LYS  18  -4.600   6.265  -6.796
   99    HD2  LYS  18           1HD      LYS  18  -2.296   5.586  -6.898
  100    HD3  LYS  18           2HD      LYS  18  -2.728   4.094  -7.736
  101    HE2  LYS  18           1HE      LYS  18  -2.097   5.358  -9.525
  102    HE3  LYS  18           2HE      LYS  18  -3.802   5.799  -9.450
  103    HZ1  LYS  18           3HZ      LYS  18  -3.012   7.702  -7.978
  104    HZ2  LYS  18           1HZ      LYS  18  -2.685   7.814  -9.635
  105    HZ3  LYS  18           2HZ      LYS  18  -1.460   7.362  -8.560
  106    H    ALA  19           H        ALA  19  -6.435   2.407  -6.220
  107    HA   ALA  19           HA       ALA  19  -6.917   0.986  -3.690
  108    HB1  ALA  19           3HB      ALA  19  -8.592   0.395  -6.096
  109    HB2  ALA  19           1HB      ALA  19  -8.922   0.070  -4.394
  110    HB3  ALA  19           2HB      ALA  19  -9.022   1.719  -5.013
  111    H    PHE  20           H        PHE  20  -6.421  -1.220  -3.684
  112    HA   PHE  20           HA       PHE  20  -5.315  -2.419  -6.090
  113    HB2  PHE  20           1HB      PHE  20  -3.657  -2.162  -3.573
  114    HB3  PHE  20           2HB      PHE  20  -3.180  -2.979  -5.057
  115    HD1  PHE  20           HD1      PHE  20  -3.989   0.319  -3.599
  116    HD2  PHE  20           HD2      PHE  20  -2.218  -1.793  -6.843
  117    HE1  PHE  20           HE1      PHE  20  -3.030   2.423  -4.441
  118    HE2  PHE  20           HE2      PHE  20  -1.257   0.307  -7.690
  119    HZ   PHE  20           HZ       PHE  20  -1.661   2.418  -6.489
  120    H    GLY  21           H        GLY  21  -6.217  -4.359  -6.210
  121    HA2  GLY  21           1HA      GLY  21  -7.639  -5.621  -4.179
  122    HA3  GLY  21           2HA      GLY  21  -7.026  -6.424  -5.618
  123    H    LEU  22           H        LEU  22  -4.238  -5.557  -4.730
  124    HA   LEU  22           HA       LEU  22  -3.867  -7.719  -2.765
  125    HB2  LEU  22           1HB      LEU  22  -2.339  -6.870  -5.158
  126    HB3  LEU  22           2HB      LEU  22  -1.414  -7.459  -3.779
  127    HG   LEU  22           HG       LEU  22  -3.406  -8.948  -5.466
  128   HD11  LEU  22          1HD1      LEU  22  -1.318 -10.562  -5.255
  129   HD12  LEU  22          2HD1      LEU  22  -0.483  -9.035  -4.969
  130   HD13  LEU  22          3HD1      LEU  22  -1.388  -9.278  -6.463
  131   HD21  LEU  22          3HD2      LEU  22  -2.564 -10.781  -3.658
  132   HD22  LEU  22          1HD2      LEU  22  -4.097  -9.915  -3.558
  133   HD23  LEU  22          2HD2      LEU  22  -2.702  -9.346  -2.641
  134    H    LYS  23           H        LYS  23  -2.016  -7.467  -1.294
  135    HA   LYS  23           HA       LYS  23  -1.983  -4.793  -0.189
  136    HB2  LYS  23           1HB      LYS  23  -2.216  -6.567   1.391
  137    HB3  LYS  23           2HB      LYS  23  -0.828  -7.423   0.732
  138    HG2  LYS  23           1HG      LYS  23   0.084  -6.511   2.617
  139    HG3  LYS  23           2HG      LYS  23   0.460  -5.255   1.434
  140    HD2  LYS  23           1HD      LYS  23  -1.607  -4.061   2.136
  141    HD3  LYS  23           2HD      LYS  23  -1.831  -5.273   3.399
  142    HE2  LYS  23           1HE      LYS  23   0.508  -4.654   4.186
  143    HE3  LYS  23           2HE      LYS  23   0.386  -3.261   3.112
  144    HZ1  LYS  23           3HZ      LYS  23  -1.228  -3.876   5.510
  145    HZ2  LYS  23           1HZ      LYS  23  -1.767  -2.774   4.345
  146    HZ3  LYS  23           2HZ      LYS  23  -0.322  -2.487   5.176
  147    H    SER  24           H        SER  24   0.131  -6.886  -1.993
  148    HA   SER  24           HA       SER  24   2.500  -5.323  -1.494
  149    HB2  SER  24           1HB      SER  24   2.697  -7.723  -1.925
  150    HB3  SER  24           2HB      SER  24   1.966  -7.513  -3.516
  151    HG   SER  24           HG       SER  24   4.295  -6.101  -2.785
  152    H    GLN  25           H        GLN  25  -0.027  -5.449  -3.887
  153    HA   GLN  25           HA       GLN  25   1.294  -3.980  -5.918
  154    HB2  GLN  25           1HB      GLN  25  -1.574  -4.620  -5.316
  155    HB3  GLN  25           2HB      GLN  25  -1.174  -3.480  -6.594
  156    HG2  GLN  25           1HG      GLN  25   0.437  -5.448  -7.332
  157    HG3  GLN  25           2HG      GLN  25  -0.757  -6.409  -6.460
  158   HE21  GLN  25          1HE2      GLN  25  -2.407  -7.102  -7.605
  159   HE22  GLN  25          2HE2      GLN  25  -3.001  -6.402  -9.068
  160    H    LEU  26           H        LEU  26  -0.354  -3.075  -3.003
  161    HA   LEU  26           HA       LEU  26  -0.663  -0.306  -3.760
  162    HB2  LEU  26           1HB      LEU  26  -2.324  -1.092  -2.309
  163    HB3  LEU  26           2HB      LEU  26  -1.151  -1.869  -1.249
  164    HG   LEU  26           HG       LEU  26  -0.396   0.374  -0.513
  165   HD11  LEU  26          1HD1      LEU  26  -1.670   1.281  -2.763
  166   HD12  LEU  26          2HD1      LEU  26  -1.107   2.282  -1.425
  167   HD13  LEU  26          3HD1      LEU  26  -2.785   1.739  -1.475
  168   HD21  LEU  26          3HD2      LEU  26  -3.340  -0.187  -0.169
  169   HD22  LEU  26          1HD2      LEU  26  -2.364   0.860   0.861
  170   HD23  LEU  26          2HD2      LEU  26  -2.030  -0.871   0.795
  171    H    ILE  27           H        ILE  27   1.331  -2.115  -1.433
  172    HA   ILE  27           HA       ILE  27   2.790  -0.050  -0.349
  173    HB   ILE  27           HB       ILE  27   3.813  -2.803  -1.054
  174   HG12  ILE  27          1HG1      ILE  27   2.775  -1.820   1.604
  175   HG13  ILE  27          2HG1      ILE  27   1.746  -2.617   0.420
  176   HG21  ILE  27          1HG2      ILE  27   5.473  -0.894  -0.483
  177   HG22  ILE  27          2HG2      ILE  27   4.876  -1.103   1.163
  178   HG23  ILE  27          3HG2      ILE  27   5.639  -2.453   0.323
  179   HD11  ILE  27          3HD1      ILE  27   3.614  -3.746   2.310
  180   HD12  ILE  27          1HD1      ILE  27   2.319  -4.520   1.399
  181   HD13  ILE  27          2HD1      ILE  27   3.911  -4.314   0.667
  182    H    ILE  28           H        ILE  28   3.521  -1.877  -3.311
  183    HA   ILE  28           HA       ILE  28   5.914  -0.611  -3.972
  184    HB   ILE  28           HB       ILE  28   3.822  -1.722  -5.847
  185   HG12  ILE  28          1HG1      ILE  28   6.357  -3.054  -4.897
  186   HG13  ILE  28          2HG1      ILE  28   4.821  -3.250  -4.059
  187   HG21  ILE  28          1HG2      ILE  28   6.705  -0.977  -6.294
  188   HG22  ILE  28          2HG2      ILE  28   5.768  -1.980  -7.400
  189   HG23  ILE  28          3HG2      ILE  28   5.283  -0.312  -7.097
  190   HD11  ILE  28          3HD1      ILE  28   5.587  -4.998  -5.815
  191   HD12  ILE  28          1HD1      ILE  28   3.900  -4.485  -5.760
  192   HD13  ILE  28          2HD1      ILE  28   4.987  -3.817  -6.979
  193    H    HIS  29           H        HIS  29   2.583   0.355  -4.541
  194    HA   HIS  29           HA       HIS  29   3.155   2.485  -6.325
  195    HB2  HIS  29           1HB      HIS  29   0.933   1.734  -6.372
  196    HB3  HIS  29           2HB      HIS  29   0.787   1.768  -4.617
  197    HD1  HIS  29           HD1      HIS  29   1.105   4.199  -7.516
  198    HD2  HIS  29           HD2      HIS  29  -0.386   4.016  -3.643
  199    HE1  HIS  29           HE1      HIS  29  -0.094   6.380  -7.154
  200    H    GLN  30           H        GLN  30   2.404   2.448  -2.842
  201    HA   GLN  30           HA       GLN  30   2.540   5.109  -2.256
  202    HB2  GLN  30           1HB      GLN  30   3.449   2.707  -0.692
  203    HB3  GLN  30           2HB      GLN  30   3.574   4.329  -0.024
  204    HG2  GLN  30           1HG      GLN  30   1.138   4.608  -0.373
  205    HG3  GLN  30           2HG      GLN  30   1.060   2.928  -0.900
  206   HE21  GLN  30          1HE2      GLN  30  -0.528   3.423   1.080
  207   HE22  GLN  30          2HE2      GLN  30   0.092   2.875   2.597
  208    H    ARG  31           H        ARG  31   5.099   3.094  -3.338
  209    HA   ARG  31           HA       ARG  31   7.316   4.476  -2.298
  210    HB2  ARG  31           1HB      ARG  31   7.084   2.942  -4.893
  211    HB3  ARG  31           2HB      ARG  31   8.590   3.409  -4.114
  212    HG2  ARG  31           1HG      ARG  31   7.635   2.077  -2.091
  213    HG3  ARG  31           2HG      ARG  31   6.612   1.326  -3.318
  214    HD2  ARG  31           1HD      ARG  31   8.389  -0.101  -3.388
  215    HD3  ARG  31           2HD      ARG  31   8.923   1.085  -4.579
  216    HE   ARG  31           HE       ARG  31  10.597   1.729  -3.147
  217   HH11  ARG  31          1HH1      ARG  31   8.301  -0.251  -1.436
  218   HH12  ARG  31          2HH1      ARG  31   9.286  -0.396  -0.018
  219   HH21  ARG  31          1HH2      ARG  31  11.903   1.545  -1.285
  220   HH22  ARG  31          2HH2      ARG  31  11.334   0.626   0.067
  221    H    THR  32           H        THR  32   5.453   4.913  -5.273
  222    HA   THR  32           HA       THR  32   7.077   6.883  -6.445
  223    HB   THR  32           HB       THR  32   5.294   5.673  -7.666
  224    HG1  THR  32           HG1      THR  32   4.698   8.435  -7.793
  225   HG21  THR  32          3HG2      THR  32   3.104   7.407  -6.994
  226   HG22  THR  32          1HG2      THR  32   3.676   6.573  -5.550
  227   HG23  THR  32          2HG2      THR  32   3.178   5.646  -6.966
  228    H    HIS  33           H        HIS  33   5.041   7.015  -3.722
  229    HA   HIS  33           HA       HIS  33   4.581   9.880  -3.897
  230    HB2  HIS  33           1HB      HIS  33   3.783   7.765  -1.904
  231    HB3  HIS  33           2HB      HIS  33   3.528   9.480  -1.595
  232    HD1  HIS  33           HD1      HIS  33   2.320  10.583  -4.017
  233    HD2  HIS  33           HD2      HIS  33   1.459   6.716  -2.764
  234    HE1  HIS  33           HE1      HIS  33   0.122  10.002  -5.091
  235    H    THR  34           H        THR  34   7.120   7.983  -3.039
  236    HA   THR  34           HA       THR  34   8.100   9.964  -1.088
  237    HB   THR  34           HB       THR  34   9.507   8.194  -0.104
  238    HG1  THR  34           HG1      THR  34   9.500   6.844  -2.035
  239   HG21  THR  34          3HG2      THR  34   6.671   8.430   0.096
  240   HG22  THR  34          1HG2      THR  34   7.828   7.959   1.341
  241   HG23  THR  34          2HG2      THR  34   7.112   6.734   0.294
  242    H    GLY  35           H        GLY  35  10.131  10.790  -1.378
  243    HA2  GLY  35           1HA      GLY  35  12.254  11.018  -2.320
  244    HA3  GLY  35           2HA      GLY  35  11.914   9.644  -3.361
  245    H    GLU  36           H        GLU  36  12.303  12.955  -3.251
  246    HA   GLU  36           HA       GLU  36  10.548  13.601  -5.455
  247    HB2  GLU  36           1HB      GLU  36  10.898  15.308  -3.799
  248    HB3  GLU  36           2HB      GLU  36  12.643  15.196  -3.978
  249    HG2  GLU  36           1HG      GLU  36  11.821  17.178  -5.071
  250    HG3  GLU  36           2HG      GLU  36  12.456  16.049  -6.267
  251    H    SER  37           H        SER  37  11.149  12.554  -7.286
  252    HA   SER  37           HA       SER  37  13.821  13.192  -8.340
  253    HB2  SER  37           1HB      SER  37  12.424  10.530  -8.266
  254    HB3  SER  37           2HB      SER  37  13.621  10.884  -9.511
  255    HG   SER  37           HG       SER  37  14.578   9.898  -7.694
  256    H    GLY  38           H        GLY  38  13.552  14.482 -10.035
  257    HA2  GLY  38           1HA      GLY  38  12.757  15.341 -12.008
  258    HA3  GLY  38           2HA      GLY  38  12.161  13.723 -12.349
  259    HA   PRO  39           HA       PRO  39   8.644  16.806 -11.635
  260    HB2  PRO  39           1HB      PRO  39   7.681  16.817 -14.173
  261    HB3  PRO  39           2HB      PRO  39   8.913  17.951 -13.608
  262    HG2  PRO  39           1HG      PRO  39   9.242  15.425 -15.182
  263    HG3  PRO  39           2HG      PRO  39  10.035  16.995 -15.407
  264    HD2  PRO  39           1HD      PRO  39  11.248  14.913 -14.171
  265    HD3  PRO  39           2HD      PRO  39  11.567  16.603 -13.729
  266    H    SER  40           H        SER  40   7.132  15.645 -10.620
  267    HA   SER  40           HA       SER  40   5.781  13.506 -12.113
  268    HB2  SER  40           1HB      SER  40   5.630  12.194  -9.984
  269    HB3  SER  40           2HB      SER  40   7.274  12.357 -10.600
  270    HG   SER  40           HG       SER  40   7.109  14.371  -9.085
  271    H    SER  41           H        SER  41   3.647  13.745 -12.153
  272    HA   SER  41           HA       SER  41   2.400  15.894 -10.729
  273    HB2  SER  41           1HB      SER  41   0.359  15.211 -11.902
  274    HB3  SER  41           2HB      SER  41   1.720  15.280 -13.021
  275    HG   SER  41           HG       SER  41   1.053  13.331 -13.491
  276    H    GLY  42           H        GLY  42   0.293  15.520  -9.548
  277    HA2  GLY  42           1HA      GLY  42   0.793  13.659  -7.400
  278    HA3  GLY  42           2HA      GLY  42  -0.535  14.805  -7.503
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1 -23.290  -3.025   2.316
    2    HA2  GLY   1           1HA      GLY   1 -21.535  -4.559   0.507
    3    HA3  GLY   1           2HA      GLY   1 -21.767  -4.908   2.214
    4    H    SER   2           H        SER   2 -22.808  -6.760   2.462
    5    HA   SER   2           HA       SER   2 -24.148  -8.563   2.005
    6    HB2  SER   2           1HB      SER   2 -26.001  -6.199   1.719
    7    HB3  SER   2           2HB      SER   2 -26.583  -7.862   1.658
    8    HG   SER   2           HG       SER   2 -26.688  -6.987   3.772
    9    H    SER   3           H        SER   3 -22.586  -7.942  -0.200
   10    HA   SER   3           HA       SER   3 -24.316  -8.893  -2.350
   11    HB2  SER   3           1HB      SER   3 -22.492  -6.492  -2.625
   12    HB3  SER   3           2HB      SER   3 -23.320  -7.290  -3.962
   13    HG   SER   3           HG       SER   3 -25.130  -6.360  -3.398
   14    H    GLY   4           H        GLY   4 -22.801  -9.309  -4.376
   15    HA2  GLY   4           1HA      GLY   4 -20.916 -11.274  -3.519
   16    HA3  GLY   4           2HA      GLY   4 -21.240 -10.800  -5.180
   17    H    SER   5           H        SER   5 -18.703 -11.321  -3.675
   18    HA   SER   5           HA       SER   5 -17.175  -9.222  -2.986
   19    HB2  SER   5           1HB      SER   5 -16.325 -11.396  -4.915
   20    HB3  SER   5           2HB      SER   5 -15.233 -10.370  -3.985
   21    HG   SER   5           HG       SER   5 -15.668 -11.478  -2.225
   22    H    SER   6           H        SER   6 -17.571 -10.233  -6.385
   23    HA   SER   6           HA       SER   6 -17.407  -9.087  -8.343
   24    HB2  SER   6           1HB      SER   6 -18.205  -6.806  -6.526
   25    HB3  SER   6           2HB      SER   6 -18.091  -6.661  -8.280
   26    HG   SER   6           HG       SER   6 -20.223  -7.151  -7.550
   27    H    GLY   7           H        GLY   7 -15.000  -9.636  -7.212
   28    HA2  GLY   7           1HA      GLY   7 -12.814  -8.892  -6.920
   29    HA3  GLY   7           2HA      GLY   7 -13.130  -8.255  -8.527
   30    H    GLU   8           H        GLU   8 -13.298  -7.477  -5.081
   31    HA   GLU   8           HA       GLU   8 -13.205  -4.621  -5.783
   32    HB2  GLU   8           1HB      GLU   8 -15.111  -5.295  -4.379
   33    HB3  GLU   8           2HB      GLU   8 -13.998  -5.927  -3.174
   34    HG2  GLU   8           1HG      GLU   8 -14.975  -3.667  -2.691
   35    HG3  GLU   8           2HG      GLU   8 -13.218  -3.776  -2.618
   36    H    LYS   9           H        LYS   9 -11.762  -3.238  -4.654
   37    HA   LYS   9           HA       LYS   9  -9.326  -4.618  -3.777
   38    HB2  LYS   9           1HB      LYS   9  -9.717  -1.739  -4.616
   39    HB3  LYS   9           2HB      LYS   9  -8.179  -2.496  -4.222
   40    HG2  LYS   9           1HG      LYS   9  -8.079  -3.644  -6.190
   41    HG3  LYS   9           2HG      LYS   9  -9.833  -3.715  -6.366
   42    HD2  LYS   9           1HD      LYS   9  -8.519  -1.050  -6.490
   43    HD3  LYS   9           2HD      LYS   9  -8.342  -2.130  -7.875
   44    HE2  LYS   9           1HE      LYS   9 -10.247  -0.803  -8.315
   45    HE3  LYS   9           2HE      LYS   9 -10.855  -2.387  -7.834
   46    HZ1  LYS   9           3HZ      LYS   9 -11.774  -0.138  -6.812
   47    HZ2  LYS   9           1HZ      LYS   9 -10.512  -0.412  -5.719
   48    HZ3  LYS   9           2HZ      LYS   9 -11.720  -1.578  -5.926
   49    HA   PRO  10           HA       PRO  10 -10.805  -3.284   0.299
   50    HB2  PRO  10           1HB      PRO  10  -9.249  -5.039   1.666
   51    HB3  PRO  10           2HB      PRO  10 -10.794  -5.491   0.936
   52    HG2  PRO  10           1HG      PRO  10  -8.015  -5.911  -0.097
   53    HG3  PRO  10           2HG      PRO  10  -9.390  -7.031  -0.098
   54    HD2  PRO  10           1HD      PRO  10  -8.656  -5.623  -2.291
   55    HD3  PRO  10           2HD      PRO  10 -10.345  -6.055  -1.955
   56    H    TYR  11           H        TYR  11  -7.801  -3.127  -1.264
   57    HA   TYR  11           HA       TYR  11  -6.553  -1.709   0.986
   58    HB2  TYR  11           1HB      TYR  11  -5.255  -2.667  -1.571
   59    HB3  TYR  11           2HB      TYR  11  -4.437  -2.028  -0.150
   60    HD1  TYR  11           HD1      TYR  11  -6.392  -4.889  -1.441
   61    HD2  TYR  11           HD2      TYR  11  -3.929  -3.423   1.704
   62    HE1  TYR  11           HE1      TYR  11  -6.208  -7.167  -0.531
   63    HE2  TYR  11           HE2      TYR  11  -3.737  -5.697   2.621
   64    HH   TYR  11           HH       TYR  11  -5.618  -8.359   1.341
   65    H    GLU  12           H        GLU  12  -6.078   0.416   0.880
   66    HA   GLU  12           HA       GLU  12  -6.344   1.806  -1.684
   67    HB2  GLU  12           1HB      GLU  12  -8.011   2.210   0.745
   68    HB3  GLU  12           2HB      GLU  12  -7.510   3.646  -0.137
   69    HG2  GLU  12           1HG      GLU  12  -9.525   3.181  -1.119
   70    HG3  GLU  12           2HG      GLU  12  -8.407   2.362  -2.209
   71    H    CYS  13           H        CYS  13  -5.024   3.563  -1.932
   72    HA   CYS  13           HA       CYS  13  -2.852   3.802  -0.050
   73    HB2  CYS  13           1HB      CYS  13  -2.321   3.846  -2.406
   74    HB3  CYS  13           2HB      CYS  13  -3.423   5.194  -2.672
   75    H    THR  14           H        THR  14  -2.867   5.120   1.634
   76    HA   THR  14           HA       THR  14  -4.885   7.106   1.999
   77    HB   THR  14           HB       THR  14  -3.606   7.680   4.077
   78    HG1  THR  14           HG1      THR  14  -1.645   6.920   4.326
   79   HG21  THR  14          3HG2      THR  14  -3.968   5.457   5.169
   80   HG22  THR  14          1HG2      THR  14  -4.289   4.784   3.571
   81   HG23  THR  14          2HG2      THR  14  -5.345   6.034   4.230
   82    H    ASP  15           H        ASP  15  -1.798   7.100   0.544
   83    HA   ASP  15           HA       ASP  15  -1.019   9.776   1.017
   84    HB2  ASP  15           1HB      ASP  15   0.320   7.755   0.024
   85    HB3  ASP  15           2HB      ASP  15  -0.306   8.339  -1.515
   86    H    CYS  16           H        CYS  16  -2.577   8.279  -1.820
   87    HA   CYS  16           HA       CYS  16  -3.557  10.956  -2.570
   88    HB2  CYS  16           1HB      CYS  16  -3.674  10.091  -4.893
   89    HB3  CYS  16           2HB      CYS  16  -2.037  10.085  -4.247
   90    H    GLY  17           H        GLY  17  -4.373   7.508  -2.452
   91    HA2  GLY  17           1HA      GLY  17  -6.623   7.103  -1.414
   92    HA3  GLY  17           2HA      GLY  17  -7.224   8.276  -2.576
   93    H    LYS  18           H        LYS  18  -4.744   6.238  -3.733
   94    HA   LYS  18           HA       LYS  18  -6.385   5.125  -5.745
   95    HB2  LYS  18           1HB      LYS  18  -3.568   4.781  -4.853
   96    HB3  LYS  18           2HB      LYS  18  -4.256   3.513  -5.859
   97    HG2  LYS  18           1HG      LYS  18  -4.874   5.273  -7.518
   98    HG3  LYS  18           2HG      LYS  18  -3.969   6.429  -6.539
   99    HD2  LYS  18           1HD      LYS  18  -1.930   5.427  -7.013
  100    HD3  LYS  18           2HD      LYS  18  -2.676   3.888  -7.451
  101    HE2  LYS  18           1HE      LYS  18  -3.732   5.203  -9.396
  102    HE3  LYS  18           2HE      LYS  18  -2.516   6.428  -9.039
  103    HZ1  LYS  18           3HZ      LYS  18  -1.152   4.042  -9.123
  104    HZ2  LYS  18           1HZ      LYS  18  -1.140   5.257 -10.300
  105    HZ3  LYS  18           2HZ      LYS  18  -2.226   3.967 -10.427
  106    H    ALA  19           H        ALA  19  -6.251   2.621  -6.117
  107    HA   ALA  19           HA       ALA  19  -6.793   1.189  -3.613
  108    HB1  ALA  19           3HB      ALA  19  -8.964   1.863  -4.392
  109    HB2  ALA  19           1HB      ALA  19  -8.620   1.252  -6.010
  110    HB3  ALA  19           2HB      ALA  19  -8.779   0.130  -4.658
  111    H    PHE  20           H        PHE  20  -6.405  -1.032  -3.672
  112    HA   PHE  20           HA       PHE  20  -5.437  -2.211  -6.155
  113    HB2  PHE  20           1HB      PHE  20  -3.750  -2.174  -3.644
  114    HB3  PHE  20           2HB      PHE  20  -3.341  -2.966  -5.161
  115    HD1  PHE  20           HD1      PHE  20  -3.974   0.343  -3.623
  116    HD2  PHE  20           HD2      PHE  20  -2.239  -1.804  -6.862
  117    HE1  PHE  20           HE1      PHE  20  -2.874   2.404  -4.395
  118    HE2  PHE  20           HE2      PHE  20  -1.135   0.253  -7.639
  119    HZ   PHE  20           HZ       PHE  20  -1.451   2.360  -6.404
  120    H    GLY  21           H        GLY  21  -5.895  -4.339  -6.320
  121    HA2  GLY  21           1HA      GLY  21  -7.625  -5.524  -4.393
  122    HA3  GLY  21           2HA      GLY  21  -6.974  -6.310  -5.823
  123    H    LEU  22           H        LEU  22  -4.208  -5.507  -4.778
  124    HA   LEU  22           HA       LEU  22  -3.965  -7.740  -2.872
  125    HB2  LEU  22           1HB      LEU  22  -2.310  -6.836  -5.158
  126    HB3  LEU  22           2HB      LEU  22  -1.461  -7.482  -3.755
  127    HG   LEU  22           HG       LEU  22  -3.388  -8.889  -5.584
  128   HD11  LEU  22          1HD1      LEU  22  -1.339  -9.235  -6.498
  129   HD12  LEU  22          2HD1      LEU  22  -1.322 -10.535  -5.307
  130   HD13  LEU  22          3HD1      LEU  22  -0.492  -9.017  -4.966
  131   HD21  LEU  22          3HD2      LEU  22  -2.876 -10.842  -3.935
  132   HD22  LEU  22          1HD2      LEU  22  -4.174  -9.702  -3.576
  133   HD23  LEU  22          2HD2      LEU  22  -2.611  -9.540  -2.774
  134    H    LYS  23           H        LYS  23  -1.961  -7.547  -1.456
  135    HA   LYS  23           HA       LYS  23  -2.024  -4.922  -0.195
  136    HB2  LYS  23           1HB      LYS  23  -2.317  -6.777   1.295
  137    HB3  LYS  23           2HB      LYS  23  -0.886  -7.583   0.665
  138    HG2  LYS  23           1HG      LYS  23  -0.022  -6.734   2.583
  139    HG3  LYS  23           2HG      LYS  23   0.292  -5.372   1.505
  140    HD2  LYS  23           1HD      LYS  23  -1.934  -4.434   2.253
  141    HD3  LYS  23           2HD      LYS  23  -1.942  -5.682   3.501
  142    HE2  LYS  23           1HE      LYS  23  -1.029  -3.840   4.588
  143    HE3  LYS  23           2HE      LYS  23   0.388  -4.776   4.116
  144    HZ1  LYS  23           3HZ      LYS  23   0.168  -3.232   1.997
  145    HZ2  LYS  23           1HZ      LYS  23   1.029  -2.753   3.373
  146    HZ3  LYS  23           2HZ      LYS  23  -0.549  -2.197   3.127
  147    H    SER  24           H        SER  24   0.144  -6.984  -1.984
  148    HA   SER  24           HA       SER  24   2.493  -5.427  -1.376
  149    HB2  SER  24           1HB      SER  24   2.765  -7.795  -1.817
  150    HB3  SER  24           2HB      SER  24   2.005  -7.625  -3.399
  151    HG   SER  24           HG       SER  24   4.538  -7.463  -2.897
  152    H    GLN  25           H        GLN  25   0.067  -5.549  -3.880
  153    HA   GLN  25           HA       GLN  25   1.434  -4.079  -5.859
  154    HB2  GLN  25           1HB      GLN  25  -1.457  -4.639  -5.293
  155    HB3  GLN  25           2HB      GLN  25  -1.012  -3.500  -6.557
  156    HG2  GLN  25           1HG      GLN  25   0.551  -5.505  -7.296
  157    HG3  GLN  25           2HG      GLN  25  -0.677  -6.440  -6.444
  158   HE21  GLN  25          1HE2      GLN  25  -2.077  -7.254  -7.815
  159   HE22  GLN  25          2HE2      GLN  25  -2.737  -6.457  -9.199
  160    H    LEU  26           H        LEU  26  -0.345  -3.130  -3.011
  161    HA   LEU  26           HA       LEU  26  -0.488  -0.348  -3.749
  162    HB2  LEU  26           1HB      LEU  26  -2.239  -1.134  -2.378
  163    HB3  LEU  26           2HB      LEU  26  -1.116  -1.876  -1.241
  164    HG   LEU  26           HG       LEU  26  -0.408   0.368  -0.510
  165   HD11  LEU  26          1HD1      LEU  26  -2.675   1.765  -1.681
  166   HD12  LEU  26          2HD1      LEU  26  -1.501   1.226  -2.881
  167   HD13  LEU  26          3HD1      LEU  26  -0.987   2.255  -1.545
  168   HD21  LEU  26          3HD2      LEU  26  -2.425   0.913   0.726
  169   HD22  LEU  26          1HD2      LEU  26  -2.200  -0.835   0.663
  170   HD23  LEU  26          2HD2      LEU  26  -3.392  -0.062  -0.382
  171    H    ILE  27           H        ILE  27   1.361  -2.271  -1.400
  172    HA   ILE  27           HA       ILE  27   2.839  -0.255  -0.222
  173    HB   ILE  27           HB       ILE  27   3.763  -3.055  -0.881
  174   HG12  ILE  27          1HG1      ILE  27   2.727  -2.042   1.761
  175   HG13  ILE  27          2HG1      ILE  27   1.647  -2.699   0.536
  176   HG21  ILE  27          1HG2      ILE  27   5.276  -0.919   0.050
  177   HG22  ILE  27          2HG2      ILE  27   4.895  -1.856   1.493
  178   HG23  ILE  27          3HG2      ILE  27   5.701  -2.628   0.128
  179   HD11  ILE  27          3HD1      ILE  27   2.936  -4.802   0.589
  180   HD12  ILE  27          1HD1      ILE  27   3.911  -4.135   1.898
  181   HD13  ILE  27          2HD1      ILE  27   2.184  -4.404   2.133
  182    H    ILE  28           H        ILE  28   3.566  -2.072  -3.184
  183    HA   ILE  28           HA       ILE  28   6.050  -0.853  -3.712
  184    HB   ILE  28           HB       ILE  28   4.078  -2.103  -5.627
  185   HG12  ILE  28          1HG1      ILE  28   6.648  -3.363  -4.771
  186   HG13  ILE  28          2HG1      ILE  28   5.284  -3.400  -3.659
  187   HG21  ILE  28          1HG2      ILE  28   5.466  -0.740  -6.952
  188   HG22  ILE  28          2HG2      ILE  28   6.902  -1.155  -6.016
  189   HG23  ILE  28          3HG2      ILE  28   6.155  -2.360  -7.066
  190   HD11  ILE  28          3HD1      ILE  28   5.530  -4.645  -6.368
  191   HD12  ILE  28          1HD1      ILE  28   5.147  -5.407  -4.825
  192   HD13  ILE  28          2HD1      ILE  28   3.959  -4.370  -5.615
  193    H    HIS  29           H        HIS  29   2.767   0.142  -4.317
  194    HA   HIS  29           HA       HIS  29   3.361   2.144  -6.252
  195    HB2  HIS  29           1HB      HIS  29   1.133   1.531  -6.318
  196    HB3  HIS  29           2HB      HIS  29   0.994   1.449  -4.564
  197    HD1  HIS  29           HD1      HIS  29   1.359   4.088  -7.276
  198    HD2  HIS  29           HD2      HIS  29  -0.211   3.613  -3.459
  199    HE1  HIS  29           HE1      HIS  29   0.160   6.239  -6.769
  200    H    GLN  30           H        GLN  30   2.572   2.336  -2.780
  201    HA   GLN  30           HA       GLN  30   2.810   5.038  -2.387
  202    HB2  GLN  30           1HB      GLN  30   3.612   2.764  -0.575
  203    HB3  GLN  30           2HB      GLN  30   3.586   4.443  -0.053
  204    HG2  GLN  30           1HG      GLN  30   1.229   4.587  -0.405
  205    HG3  GLN  30           2HG      GLN  30   1.195   2.996  -1.163
  206   HE21  GLN  30          1HE2      GLN  30  -0.533   3.268   0.765
  207   HE22  GLN  30          2HE2      GLN  30  -0.027   2.495   2.225
  208    H    ARG  31           H        ARG  31   5.276   2.835  -3.254
  209    HA   ARG  31           HA       ARG  31   7.540   4.096  -2.180
  210    HB2  ARG  31           1HB      ARG  31   7.326   2.564  -4.778
  211    HB3  ARG  31           2HB      ARG  31   8.807   2.895  -3.890
  212    HG2  ARG  31           1HG      ARG  31   7.962   1.557  -2.012
  213    HG3  ARG  31           2HG      ARG  31   6.510   1.194  -2.947
  214    HD2  ARG  31           1HD      ARG  31   7.716  -0.058  -4.531
  215    HD3  ARG  31           2HD      ARG  31   9.262   0.583  -3.979
  216    HE   ARG  31           HE       ARG  31   7.754  -1.589  -2.807
  217   HH11  ARG  31          1HH1      ARG  31  10.307   0.742  -2.398
  218   HH12  ARG  31          2HH1      ARG  31  11.102  -0.153  -1.146
  219   HH21  ARG  31          1HH2      ARG  31   8.791  -2.777  -1.158
  220   HH22  ARG  31          2HH2      ARG  31  10.239  -2.155  -0.442
  221    H    THR  32           H        THR  32   6.107   4.403  -5.430
  222    HA   THR  32           HA       THR  32   7.821   6.344  -6.431
  223    HB   THR  32           HB       THR  32   5.945   5.042  -7.640
  224    HG1  THR  32           HG1      THR  32   6.877   7.637  -8.091
  225   HG21  THR  32          3HG2      THR  32   4.398   7.516  -6.864
  226   HG22  THR  32          1HG2      THR  32   4.118   5.908  -6.199
  227   HG23  THR  32          2HG2      THR  32   3.847   6.212  -7.915
  228    H    HIS  33           H        HIS  33   4.989   6.679  -4.375
  229    HA   HIS  33           HA       HIS  33   4.561   9.418  -4.568
  230    HB2  HIS  33           1HB      HIS  33   4.017   7.348  -2.500
  231    HB3  HIS  33           2HB      HIS  33   3.888   9.035  -2.011
  232    HD1  HIS  33           HD1      HIS  33   2.466  10.379  -4.215
  233    HD2  HIS  33           HD2      HIS  33   1.526   6.497  -3.071
  234    HE1  HIS  33           HE1      HIS  33   0.116   9.990  -5.023
  235    H    THR  34           H        THR  34   6.548   7.691  -2.163
  236    HA   THR  34           HA       THR  34   7.575   9.995  -0.923
  237    HB   THR  34           HB       THR  34   9.359   8.501  -0.042
  238    HG1  THR  34           HG1      THR  34   8.053   6.468  -1.553
  239   HG21  THR  34          3HG2      THR  34   6.670   7.151   0.106
  240   HG22  THR  34          1HG2      THR  34   7.029   8.663   0.939
  241   HG23  THR  34          2HG2      THR  34   7.932   7.201   1.337
  242    H    GLY  35           H        GLY  35   8.233  11.442  -2.551
  243    HA2  GLY  35           1HA      GLY  35  10.968  11.275  -3.265
  244    HA3  GLY  35           2HA      GLY  35   9.969  10.894  -4.659
  245    H    GLU  36           H        GLU  36   7.825  12.652  -4.131
  246    HA   GLU  36           HA       GLU  36   9.066  15.306  -4.102
  247    HB2  GLU  36           1HB      GLU  36   8.976  14.761  -6.444
  248    HB3  GLU  36           2HB      GLU  36   7.309  14.219  -6.304
  249    HG2  GLU  36           1HG      GLU  36   7.338  16.367  -7.346
  250    HG3  GLU  36           2HG      GLU  36   6.648  16.530  -5.732
  251    H    SER  37           H        SER  37   7.788  16.922  -3.296
  252    HA   SER  37           HA       SER  37   5.003  16.273  -2.637
  253    HB2  SER  37           1HB      SER  37   7.148  17.184  -0.726
  254    HB3  SER  37           2HB      SER  37   5.438  17.454  -0.391
  255    HG   SER  37           HG       SER  37   6.541  15.415   0.383
  256    H    GLY  38           H        GLY  38   3.600  17.919  -2.914
  257    HA2  GLY  38           1HA      GLY  38   4.722  20.455  -3.877
  258    HA3  GLY  38           2HA      GLY  38   3.088  19.877  -4.167
  259    HA   PRO  39           HA       PRO  39   3.229  23.014  -0.646
  260    HB2  PRO  39           1HB      PRO  39   1.747  24.933  -1.867
  261    HB3  PRO  39           2HB      PRO  39   3.508  24.851  -1.997
  262    HG2  PRO  39           1HG      PRO  39   1.421  23.913  -3.926
  263    HG3  PRO  39           2HG      PRO  39   2.932  24.783  -4.249
  264    HD2  PRO  39           1HD      PRO  39   2.685  22.110  -4.607
  265    HD3  PRO  39           2HD      PRO  39   4.210  22.870  -4.108
  266    H    SER  40           H        SER  40   1.885  21.670   0.554
  267    HA   SER  40           HA       SER  40  -0.828  22.418   0.742
  268    HB2  SER  40           1HB      SER  40  -0.719  20.858  -1.349
  269    HB3  SER  40           2HB      SER  40  -0.577  19.564  -0.160
  270    HG   SER  40           HG       SER  40  -2.748  21.118  -0.829
  271    H    SER  41           H        SER  41  -1.875  21.494   2.549
  272    HA   SER  41           HA       SER  41  -0.022  20.430   4.513
  273    HB2  SER  41           1HB      SER  41  -2.940  21.168   4.840
  274    HB3  SER  41           2HB      SER  41  -1.784  20.862   6.135
  275    HG   SER  41           HG       SER  41  -1.966  23.054   4.387
  276    H    GLY  42           H        GLY  42  -0.038  18.411   5.353
  277    HA2  GLY  42           1HA      GLY  42  -1.042  16.330   5.911
  278    HA3  GLY  42           2HA      GLY  42  -2.251  16.612   4.667
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1 -24.512   0.269 -16.434
    2    HA2  GLY   1           1HA      GLY   1 -21.941   0.741 -16.276
    3    HA3  GLY   1           2HA      GLY   1 -23.059   2.016 -15.811
    4    H    SER   2           H        SER   2 -23.638   2.178 -13.531
    5    HA   SER   2           HA       SER   2 -21.304   1.743 -11.872
    6    HB2  SER   2           1HB      SER   2 -23.818   3.340 -11.644
    7    HB3  SER   2           2HB      SER   2 -22.959   2.917 -10.162
    8    HG   SER   2           HG       SER   2 -21.144   3.965 -10.949
    9    H    SER   3           H        SER   3 -22.232  -0.690 -12.486
   10    HA   SER   3           HA       SER   3 -22.834  -1.807  -9.935
   11    HB2  SER   3           1HB      SER   3 -25.105  -1.175 -10.432
   12    HB3  SER   3           2HB      SER   3 -24.992  -1.856 -12.055
   13    HG   SER   3           HG       SER   3 -24.515  -3.512  -9.844
   14    H    GLY   4           H        GLY   4 -21.600  -3.558  -9.899
   15    HA2  GLY   4           1HA      GLY   4 -21.330  -5.848 -10.716
   16    HA3  GLY   4           2HA      GLY   4 -21.442  -5.204 -12.347
   17    H    SER   5           H        SER   5 -19.551  -4.060  -9.569
   18    HA   SER   5           HA       SER   5 -17.175  -4.052 -11.263
   19    HB2  SER   5           1HB      SER   5 -17.539  -2.956  -8.464
   20    HB3  SER   5           2HB      SER   5 -16.159  -2.675  -9.526
   21    HG   SER   5           HG       SER   5 -17.247  -1.149 -10.460
   22    H    SER   6           H        SER   6 -16.807  -6.312 -11.316
   23    HA   SER   6           HA       SER   6 -16.410  -7.805  -8.901
   24    HB2  SER   6           1HB      SER   6 -17.154  -9.054 -10.784
   25    HB3  SER   6           2HB      SER   6 -15.878  -8.402 -11.813
   26    HG   SER   6           HG       SER   6 -15.444 -10.545 -11.072
   27    H    GLY   7           H        GLY   7 -14.820  -6.749  -7.715
   28    HA2  GLY   7           1HA      GLY   7 -12.247  -7.562  -7.811
   29    HA3  GLY   7           2HA      GLY   7 -12.243  -6.182  -8.900
   30    H    GLU   8           H        GLU   8 -13.804  -6.840  -5.762
   31    HA   GLU   8           HA       GLU   8 -13.582  -4.221  -4.810
   32    HB2  GLU   8           1HB      GLU   8 -15.050  -6.071  -3.899
   33    HB3  GLU   8           2HB      GLU   8 -13.623  -6.698  -3.087
   34    HG2  GLU   8           1HG      GLU   8 -14.914  -5.390  -1.545
   35    HG3  GLU   8           2HG      GLU   8 -13.396  -4.562  -1.887
   36    H    LYS   9           H        LYS   9 -11.886  -3.079  -4.179
   37    HA   LYS   9           HA       LYS   9  -9.385  -4.482  -3.559
   38    HB2  LYS   9           1HB      LYS   9  -9.891  -1.582  -4.251
   39    HB3  LYS   9           2HB      LYS   9  -8.310  -2.281  -3.924
   40    HG2  LYS   9           1HG      LYS   9  -8.259  -3.437  -5.913
   41    HG3  LYS   9           2HG      LYS   9 -10.017  -3.447  -6.075
   42    HD2  LYS   9           1HD      LYS   9  -9.848  -0.925  -6.364
   43    HD3  LYS   9           2HD      LYS   9  -8.110  -1.169  -6.554
   44    HE2  LYS   9           1HE      LYS   9  -8.627  -2.782  -8.396
   45    HE3  LYS   9           2HE      LYS   9 -10.317  -2.299  -8.267
   46    HZ1  LYS   9           3HZ      LYS   9  -9.904  -0.270  -9.172
   47    HZ2  LYS   9           1HZ      LYS   9  -8.684  -1.148  -9.949
   48    HZ3  LYS   9           2HZ      LYS   9  -8.313  -0.195  -8.602
   49    HA   PRO  10           HA       PRO  10 -10.558  -3.401   0.686
   50    HB2  PRO  10           1HB      PRO  10  -8.877  -5.201   1.828
   51    HB3  PRO  10           2HB      PRO  10 -10.466  -5.640   1.192
   52    HG2  PRO  10           1HG      PRO  10  -7.770  -5.950  -0.071
   53    HG3  PRO  10           2HG      PRO  10  -9.125  -7.093  -0.031
   54    HD2  PRO  10           1HD      PRO  10  -8.582  -5.552  -2.190
   55    HD3  PRO  10           2HD      PRO  10 -10.234  -6.033  -1.752
   56    H    TYR  11           H        TYR  11  -7.708  -3.065  -1.101
   57    HA   TYR  11           HA       TYR  11  -6.376  -1.658   1.118
   58    HB2  TYR  11           1HB      TYR  11  -5.087  -2.718  -1.403
   59    HB3  TYR  11           2HB      TYR  11  -4.269  -2.053   0.007
   60    HD1  TYR  11           HD1      TYR  11  -6.033  -4.962  -1.355
   61    HD2  TYR  11           HD2      TYR  11  -4.010  -3.365   2.030
   62    HE1  TYR  11           HE1      TYR  11  -5.882  -7.219  -0.388
   63    HE2  TYR  11           HE2      TYR  11  -3.852  -5.617   3.006
   64    HH   TYR  11           HH       TYR  11  -4.480  -7.750   2.824
   65    H    GLU  12           H        GLU  12  -5.982   0.466   0.940
   66    HA   GLU  12           HA       GLU  12  -6.235   1.739  -1.693
   67    HB2  GLU  12           1HB      GLU  12  -7.857   2.261   0.744
   68    HB3  GLU  12           2HB      GLU  12  -7.363   3.653  -0.209
   69    HG2  GLU  12           1HG      GLU  12  -9.420   3.136  -1.103
   70    HG3  GLU  12           2HG      GLU  12  -8.310   2.332  -2.211
   71    H    CYS  13           H        CYS  13  -5.006   3.591  -1.992
   72    HA   CYS  13           HA       CYS  13  -2.713   3.823  -0.268
   73    HB2  CYS  13           1HB      CYS  13  -2.653   3.992  -2.791
   74    HB3  CYS  13           2HB      CYS  13  -3.417   5.570  -2.630
   75    H    THR  14           H        THR  14  -2.504   5.153   1.397
   76    HA   THR  14           HA       THR  14  -4.542   7.164   1.895
   77    HB   THR  14           HB       THR  14  -3.474   7.425   4.097
   78    HG1  THR  14           HG1      THR  14  -1.642   6.303   4.608
   79   HG21  THR  14          3HG2      THR  14  -3.664   4.872   4.732
   80   HG22  THR  14          1HG2      THR  14  -4.298   4.741   3.092
   81   HG23  THR  14          2HG2      THR  14  -5.089   5.799   4.261
   82    H    ASP  15           H        ASP  15  -2.479   7.493  -0.235
   83    HA   ASP  15           HA       ASP  15  -1.285  10.006   0.739
   84    HB2  ASP  15           1HB      ASP  15  -0.173   7.822  -0.947
   85    HB3  ASP  15           2HB      ASP  15   0.282   9.472  -1.364
   86    H    CYS  16           H        CYS  16  -2.858   8.349  -1.938
   87    HA   CYS  16           HA       CYS  16  -3.528  10.981  -3.077
   88    HB2  CYS  16           1HB      CYS  16  -3.434   9.981  -5.323
   89    HB3  CYS  16           2HB      CYS  16  -1.876   9.888  -4.510
   90    H    GLY  17           H        GLY  17  -4.487   7.637  -2.540
   91    HA2  GLY  17           1HA      GLY  17  -6.801   7.316  -1.769
   92    HA3  GLY  17           2HA      GLY  17  -7.286   8.462  -3.010
   93    H    LYS  18           H        LYS  18  -4.821   6.192  -3.806
   94    HA   LYS  18           HA       LYS  18  -6.462   5.039  -5.859
   95    HB2  LYS  18           1HB      LYS  18  -3.876   5.518  -5.818
   96    HB3  LYS  18           2HB      LYS  18  -3.795   3.916  -5.096
   97    HG2  LYS  18           1HG      LYS  18  -4.623   2.879  -7.012
   98    HG3  LYS  18           2HG      LYS  18  -5.267   4.388  -7.662
   99    HD2  LYS  18           1HD      LYS  18  -2.336   4.207  -7.196
  100    HD3  LYS  18           2HD      LYS  18  -3.013   3.321  -8.564
  101    HE2  LYS  18           1HE      LYS  18  -2.606   5.313  -9.589
  102    HE3  LYS  18           2HE      LYS  18  -4.228   5.639  -8.982
  103    HZ1  LYS  18           3HZ      LYS  18  -1.757   6.893  -8.302
  104    HZ2  LYS  18           1HZ      LYS  18  -2.572   6.341  -6.925
  105    HZ3  LYS  18           2HZ      LYS  18  -3.341   7.402  -7.995
  106    H    ALA  19           H        ALA  19  -6.279   2.545  -6.142
  107    HA   ALA  19           HA       ALA  19  -6.666   1.183  -3.570
  108    HB1  ALA  19           3HB      ALA  19  -8.892   1.588  -4.119
  109    HB2  ALA  19           1HB      ALA  19  -8.616   1.322  -5.841
  110    HB3  ALA  19           2HB      ALA  19  -8.610  -0.044  -4.724
  111    H    PHE  20           H        PHE  20  -6.477  -1.141  -3.688
  112    HA   PHE  20           HA       PHE  20  -5.465  -2.324  -6.124
  113    HB2  PHE  20           1HB      PHE  20  -3.690  -2.188  -3.678
  114    HB3  PHE  20           2HB      PHE  20  -3.321  -3.012  -5.189
  115    HD1  PHE  20           HD1      PHE  20  -3.745   0.268  -3.584
  116    HD2  PHE  20           HD2      PHE  20  -2.522  -1.819  -7.086
  117    HE1  PHE  20           HE1      PHE  20  -2.714   2.328  -4.447
  118    HE2  PHE  20           HE2      PHE  20  -1.488   0.238  -7.955
  119    HZ   PHE  20           HZ       PHE  20  -1.583   2.315  -6.635
  120    H    GLY  21           H        GLY  21  -6.139  -4.367  -6.246
  121    HA2  GLY  21           1HA      GLY  21  -7.667  -5.552  -4.187
  122    HA3  GLY  21           2HA      GLY  21  -7.112  -6.359  -5.646
  123    H    LEU  22           H        LEU  22  -4.278  -5.593  -4.836
  124    HA   LEU  22           HA       LEU  22  -3.913  -7.818  -2.946
  125    HB2  LEU  22           1HB      LEU  22  -2.373  -6.825  -5.276
  126    HB3  LEU  22           2HB      LEU  22  -1.456  -7.493  -3.927
  127    HG   LEU  22           HG       LEU  22  -3.437  -8.885  -5.710
  128   HD11  LEU  22          1HD1      LEU  22  -1.354 -10.500  -5.618
  129   HD12  LEU  22          2HD1      LEU  22  -0.512  -9.009  -5.200
  130   HD13  LEU  22          3HD1      LEU  22  -1.404  -9.121  -6.717
  131   HD21  LEU  22          3HD2      LEU  22  -2.733  -9.449  -2.914
  132   HD22  LEU  22          1HD2      LEU  22  -2.584 -10.819  -4.015
  133   HD23  LEU  22          2HD2      LEU  22  -4.123  -9.972  -3.866
  134    H    LYS  23           H        LYS  23  -1.991  -7.635  -1.508
  135    HA   LYS  23           HA       LYS  23  -1.990  -5.016  -0.250
  136    HB2  LYS  23           1HB      LYS  23  -2.275  -6.928   1.199
  137    HB3  LYS  23           2HB      LYS  23  -0.803  -7.667   0.583
  138    HG2  LYS  23           1HG      LYS  23  -0.039  -6.806   2.550
  139    HG3  LYS  23           2HG      LYS  23   0.297  -5.453   1.468
  140    HD2  LYS  23           1HD      LYS  23  -2.051  -4.623   2.135
  141    HD3  LYS  23           2HD      LYS  23  -1.910  -5.761   3.477
  142    HE2  LYS  23           1HE      LYS  23   0.359  -4.620   3.914
  143    HE3  LYS  23           2HE      LYS  23  -0.255  -3.333   2.877
  144    HZ1  LYS  23           3HZ      LYS  23  -2.119  -4.151   4.904
  145    HZ2  LYS  23           1HZ      LYS  23  -1.597  -2.599   4.479
  146    HZ3  LYS  23           2HZ      LYS  23  -0.677  -3.538   5.543
  147    H    SER  24           H        SER  24   0.111  -7.039  -2.138
  148    HA   SER  24           HA       SER  24   2.497  -5.535  -1.530
  149    HB2  SER  24           1HB      SER  24   2.546  -7.966  -2.102
  150    HB3  SER  24           2HB      SER  24   2.043  -7.553  -3.741
  151    HG   SER  24           HG       SER  24   4.500  -7.254  -2.509
  152    H    GLN  25           H        GLN  25  -0.004  -5.521  -3.952
  153    HA   GLN  25           HA       GLN  25   1.341  -4.018  -5.928
  154    HB2  GLN  25           1HB      GLN  25  -1.531  -4.588  -5.307
  155    HB3  GLN  25           2HB      GLN  25  -1.133  -3.369  -6.511
  156    HG2  GLN  25           1HG      GLN  25   0.405  -5.314  -7.434
  157    HG3  GLN  25           2HG      GLN  25  -0.785  -6.310  -6.595
  158   HE21  GLN  25          1HE2      GLN  25  -2.304  -7.009  -7.896
  159   HE22  GLN  25          2HE2      GLN  25  -2.993  -6.147  -9.225
  160    H    LEU  26           H        LEU  26  -0.351  -3.134  -3.006
  161    HA   LEU  26           HA       LEU  26  -0.482  -0.331  -3.647
  162    HB2  LEU  26           1HB      LEU  26  -2.182  -1.142  -2.227
  163    HB3  LEU  26           2HB      LEU  26  -1.020  -1.931  -1.163
  164    HG   LEU  26           HG       LEU  26  -0.243   0.316  -0.437
  165   HD11  LEU  26          1HD1      LEU  26  -0.990   2.231  -1.317
  166   HD12  LEU  26          2HD1      LEU  26  -2.655   1.657  -1.404
  167   HD13  LEU  26          3HD1      LEU  26  -1.508   1.231  -2.674
  168   HD21  LEU  26          3HD2      LEU  26  -2.121  -1.101   0.639
  169   HD22  LEU  26          1HD2      LEU  26  -3.198   0.142   0.001
  170   HD23  LEU  26          2HD2      LEU  26  -1.923   0.580   1.138
  171    H    ILE  27           H        ILE  27   1.414  -2.316  -1.382
  172    HA   ILE  27           HA       ILE  27   2.965  -0.368  -0.216
  173    HB   ILE  27           HB       ILE  27   3.893  -3.121  -1.044
  174   HG12  ILE  27          1HG1      ILE  27   2.896  -2.311   1.677
  175   HG13  ILE  27          2HG1      ILE  27   1.783  -2.854   0.427
  176   HG21  ILE  27          1HG2      ILE  27   5.872  -2.526  -0.235
  177   HG22  ILE  27          2HG2      ILE  27   5.251  -0.946   0.240
  178   HG23  ILE  27          3HG2      ILE  27   5.118  -2.315   1.345
  179   HD11  ILE  27          3HD1      ILE  27   2.995  -4.465   2.231
  180   HD12  ILE  27          1HD1      ILE  27   2.369  -4.995   0.670
  181   HD13  ILE  27          2HD1      ILE  27   4.082  -4.613   0.850
  182    H    ILE  28           H        ILE  28   3.538  -2.035  -3.295
  183    HA   ILE  28           HA       ILE  28   6.001  -0.760  -3.863
  184    HB   ILE  28           HB       ILE  28   4.009  -2.005  -5.762
  185   HG12  ILE  28          1HG1      ILE  28   6.586  -3.206  -4.765
  186   HG13  ILE  28          2HG1      ILE  28   5.069  -3.425  -3.899
  187   HG21  ILE  28          1HG2      ILE  28   6.915  -1.336  -6.209
  188   HG22  ILE  28          2HG2      ILE  28   5.829  -2.113  -7.359
  189   HG23  ILE  28          3HG2      ILE  28   5.549  -0.441  -6.874
  190   HD11  ILE  28          3HD1      ILE  28   4.294  -4.157  -6.356
  191   HD12  ILE  28          1HD1      ILE  28   5.998  -4.605  -6.430
  192   HD13  ILE  28          2HD1      ILE  28   4.964  -5.276  -5.168
  193    H    HIS  29           H        HIS  29   2.661   0.111  -4.415
  194    HA   HIS  29           HA       HIS  29   3.157   2.189  -6.292
  195    HB2  HIS  29           1HB      HIS  29   0.956   1.386  -6.300
  196    HB3  HIS  29           2HB      HIS  29   0.825   1.453  -4.545
  197    HD1  HIS  29           HD1      HIS  29   0.811   3.708  -7.571
  198    HD2  HIS  29           HD2      HIS  29  -0.159   3.813  -3.532
  199    HE1  HIS  29           HE1      HIS  29  -0.383   5.893  -7.223
  200    H    GLN  30           H        GLN  30   2.698   2.131  -2.778
  201    HA   GLN  30           HA       GLN  30   2.684   4.852  -2.269
  202    HB2  GLN  30           1HB      GLN  30   3.671   2.506  -0.670
  203    HB3  GLN  30           2HB      GLN  30   3.788   4.145  -0.043
  204    HG2  GLN  30           1HG      GLN  30   1.328   4.370  -0.380
  205    HG3  GLN  30           2HG      GLN  30   1.287   2.657  -0.794
  206   HE21  GLN  30          1HE2      GLN  30   0.833   1.331   0.802
  207   HE22  GLN  30          2HE2      GLN  30   1.072   1.640   2.485
  208    H    ARG  31           H        ARG  31   5.244   2.892  -3.409
  209    HA   ARG  31           HA       ARG  31   7.483   4.257  -2.432
  210    HB2  ARG  31           1HB      ARG  31   7.148   2.860  -5.094
  211    HB3  ARG  31           2HB      ARG  31   8.683   3.296  -4.354
  212    HG2  ARG  31           1HG      ARG  31   7.912   1.844  -2.381
  213    HG3  ARG  31           2HG      ARG  31   6.719   1.201  -3.512
  214    HD2  ARG  31           1HD      ARG  31   8.527  -0.273  -3.679
  215    HD3  ARG  31           2HD      ARG  31   8.699   0.787  -5.078
  216    HE   ARG  31           HE       ARG  31  10.196   1.929  -3.061
  217   HH11  ARG  31          1HH1      ARG  31  10.153  -1.080  -4.811
  218   HH12  ARG  31          2HH1      ARG  31  11.860  -1.338  -4.669
  219   HH21  ARG  31          1HH2      ARG  31  12.445   1.600  -2.866
  220   HH22  ARG  31          2HH2      ARG  31  13.163   0.187  -3.561
  221    H    THR  32           H        THR  32   5.304   4.974  -5.076
  222    HA   THR  32           HA       THR  32   6.954   7.062  -6.173
  223    HB   THR  32           HB       THR  32   5.334   5.736  -7.548
  224    HG1  THR  32           HG1      THR  32   4.515   7.694  -8.631
  225   HG21  THR  32          3HG2      THR  32   2.974   7.150  -7.250
  226   HG22  THR  32          1HG2      THR  32   3.485   6.837  -5.591
  227   HG23  THR  32          2HG2      THR  32   3.270   5.496  -6.716
  228    H    HIS  33           H        HIS  33   5.488   6.943  -3.333
  229    HA   HIS  33           HA       HIS  33   4.611   9.756  -3.421
  230    HB2  HIS  33           1HB      HIS  33   3.632   7.452  -1.740
  231    HB3  HIS  33           2HB      HIS  33   3.297   9.129  -1.320
  232    HD1  HIS  33           HD1      HIS  33   2.281  10.453  -3.668
  233    HD2  HIS  33           HD2      HIS  33   1.534   6.412  -3.063
  234    HE1  HIS  33           HE1      HIS  33   0.262   9.925  -5.072
  235    H    THR  34           H        THR  34   7.318   8.616  -2.993
  236    HA   THR  34           HA       THR  34   7.813   9.756  -0.320
  237    HB   THR  34           HB       THR  34   9.825   8.257  -0.201
  238    HG1  THR  34           HG1      THR  34   9.829   6.458  -1.628
  239   HG21  THR  34          3HG2      THR  34   7.290   7.781   0.588
  240   HG22  THR  34          1HG2      THR  34   8.632   6.684   0.909
  241   HG23  THR  34          2HG2      THR  34   7.556   6.384  -0.456
  242    H    GLY  35           H        GLY  35   9.204   9.149  -3.534
  243    HA2  GLY  35           1HA      GLY  35  11.185  11.256  -3.073
  244    HA3  GLY  35           2HA      GLY  35  11.173  10.123  -4.416
  245    H    GLU  36           H        GLU  36  11.181  13.197  -4.051
  246    HA   GLU  36           HA       GLU  36   8.783  14.099  -5.306
  247    HB2  GLU  36           1HB      GLU  36  11.443  15.353  -4.703
  248    HB3  GLU  36           2HB      GLU  36  10.273  16.190  -5.713
  249    HG2  GLU  36           1HG      GLU  36   9.452  15.136  -3.046
  250    HG3  GLU  36           2HG      GLU  36  10.351  16.647  -3.163
  251    H    SER  37           H        SER  37   8.281  13.505  -7.311
  252    HA   SER  37           HA       SER  37  10.183  14.030  -9.449
  253    HB2  SER  37           1HB      SER  37   9.932  11.829 -10.465
  254    HB3  SER  37           2HB      SER  37  10.567  11.658  -8.829
  255    HG   SER  37           HG       SER  37   8.218  11.389  -8.268
  256    H    GLY  38           H        GLY  38   9.124  15.237 -10.867
  257    HA2  GLY  38           1HA      GLY  38   7.071  14.693 -12.464
  258    HA3  GLY  38           2HA      GLY  38   6.213  15.114 -10.989
  259    HA   PRO  39           HA       PRO  39   7.754  18.895 -13.555
  260    HB2  PRO  39           1HB      PRO  39   5.708  19.231 -15.307
  261    HB3  PRO  39           2HB      PRO  39   7.153  18.286 -15.687
  262    HG2  PRO  39           1HG      PRO  39   4.454  17.345 -14.798
  263    HG3  PRO  39           2HG      PRO  39   5.510  16.682 -16.058
  264    HD2  PRO  39           1HD      PRO  39   5.329  15.591 -13.586
  265    HD3  PRO  39           2HD      PRO  39   6.827  15.556 -14.538
  266    H    SER  40           H        SER  40   4.313  18.094 -13.039
  267    HA   SER  40           HA       SER  40   4.022  20.667 -11.630
  268    HB2  SER  40           1HB      SER  40   2.083  19.128 -13.350
  269    HB3  SER  40           2HB      SER  40   1.540  20.369 -12.221
  270    HG   SER  40           HG       SER  40   3.262  20.665 -14.449
  271    H    SER  41           H        SER  41   2.787  20.726  -9.731
  272    HA   SER  41           HA       SER  41   1.465  18.507  -8.609
  273    HB2  SER  41           1HB      SER  41   2.995  17.686  -7.007
  274    HB3  SER  41           2HB      SER  41   3.930  17.790  -8.499
  275    HG   SER  41           HG       SER  41   4.785  19.760  -7.749
  276    H    GLY  42           H        GLY  42   0.128  19.225  -7.062
  277    HA2  GLY  42           1HA      GLY  42   0.481  20.823  -4.942
  278    HA3  GLY  42           2HA      GLY  42   0.361  22.001  -6.240
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1  -4.157  -5.577 -20.719
    2    HA2  GLY   1           1HA      GLY   1  -3.972  -2.918 -20.892
    3    HA3  GLY   1           2HA      GLY   1  -3.517  -3.387 -22.523
    4    H    SER   2           H        SER   2  -5.992  -4.578 -20.254
    5    HA   SER   2           HA       SER   2  -8.052  -3.817 -22.201
    6    HB2  SER   2           1HB      SER   2  -7.855  -6.536 -20.882
    7    HB3  SER   2           2HB      SER   2  -9.171  -5.992 -21.922
    8    HG   SER   2           HG       SER   2  -6.762  -7.007 -22.602
    9    H    SER   3           H        SER   3 -10.048  -3.301 -21.333
   10    HA   SER   3           HA       SER   3 -10.019  -2.500 -18.575
   11    HB2  SER   3           1HB      SER   3 -12.126  -2.317 -20.734
   12    HB3  SER   3           2HB      SER   3 -12.362  -1.703 -19.098
   13    HG   SER   3           HG       SER   3 -10.133  -0.930 -20.646
   14    H    GLY   4           H        GLY   4 -10.205  -4.072 -17.092
   15    HA2  GLY   4           1HA      GLY   4 -12.669  -5.411 -16.728
   16    HA3  GLY   4           2HA      GLY   4 -11.490  -6.527 -17.401
   17    H    SER   5           H        SER   5 -11.166  -3.909 -15.015
   18    HA   SER   5           HA       SER   5 -10.107  -5.910 -13.127
   19    HB2  SER   5           1HB      SER   5  -9.219  -3.112 -13.749
   20    HB3  SER   5           2HB      SER   5  -8.914  -3.795 -12.152
   21    HG   SER   5           HG       SER   5  -7.696  -4.324 -14.537
   22    H    SER   6           H        SER   6 -12.830  -5.417 -13.247
   23    HA   SER   6           HA       SER   6 -13.492  -3.506 -11.163
   24    HB2  SER   6           1HB      SER   6 -15.845  -4.275 -11.606
   25    HB3  SER   6           2HB      SER   6 -15.022  -3.614 -13.019
   26    HG   SER   6           HG       SER   6 -15.032  -6.384 -12.465
   27    H    GLY   7           H        GLY   7 -12.442  -4.443  -9.367
   28    HA2  GLY   7           1HA      GLY   7 -13.930  -6.715  -8.232
   29    HA3  GLY   7           2HA      GLY   7 -12.173  -6.759  -8.253
   30    H    GLU   8           H        GLU   8 -13.199  -7.048  -5.858
   31    HA   GLU   8           HA       GLU   8 -13.546  -4.485  -4.545
   32    HB2  GLU   8           1HB      GLU   8 -13.516  -7.318  -3.499
   33    HB3  GLU   8           2HB      GLU   8 -13.741  -5.905  -2.478
   34    HG2  GLU   8           1HG      GLU   8 -15.904  -6.567  -2.846
   35    HG3  GLU   8           2HG      GLU   8 -15.683  -5.357  -4.109
   36    H    LYS   9           H        LYS   9 -11.832  -3.297  -4.058
   37    HA   LYS   9           HA       LYS   9  -9.289  -4.632  -3.448
   38    HB2  LYS   9           1HB      LYS   9  -9.827  -1.735  -4.127
   39    HB3  LYS   9           2HB      LYS   9  -8.242  -2.459  -3.886
   40    HG2  LYS   9           1HG      LYS   9  -8.288  -3.566  -5.895
   41    HG3  LYS   9           2HG      LYS   9 -10.051  -3.594  -5.962
   42    HD2  LYS   9           1HD      LYS   9 -10.123  -1.250  -6.493
   43    HD3  LYS   9           2HD      LYS   9  -8.382  -1.098  -6.245
   44    HE2  LYS   9           1HE      LYS   9  -9.375  -3.068  -8.245
   45    HE3  LYS   9           2HE      LYS   9  -9.412  -1.354  -8.660
   46    HZ1  LYS   9           3HZ      LYS   9  -6.981  -2.750  -7.689
   47    HZ2  LYS   9           1HZ      LYS   9  -7.079  -1.195  -8.347
   48    HZ3  LYS   9           2HZ      LYS   9  -7.349  -2.546  -9.327
   49    HA   PRO  10           HA       PRO  10 -10.492  -3.517   0.781
   50    HB2  PRO  10           1HB      PRO  10  -8.783  -5.274   1.950
   51    HB3  PRO  10           2HB      PRO  10 -10.364  -5.747   1.319
   52    HG2  PRO  10           1HG      PRO  10  -7.662  -6.031   0.063
   53    HG3  PRO  10           2HG      PRO  10  -8.998  -7.195   0.117
   54    HD2  PRO  10           1HD      PRO  10  -8.477  -5.674  -2.062
   55    HD3  PRO  10           2HD      PRO  10 -10.121  -6.177  -1.619
   56    H    TYR  11           H        TYR  11  -7.697  -3.083  -1.030
   57    HA   TYR  11           HA       TYR  11  -6.360  -1.668   1.182
   58    HB2  TYR  11           1HB      TYR  11  -5.087  -2.698  -1.359
   59    HB3  TYR  11           2HB      TYR  11  -4.259  -1.998   0.027
   60    HD1  TYR  11           HD1      TYR  11  -5.983  -4.967  -1.263
   61    HD2  TYR  11           HD2      TYR  11  -3.902  -3.286   2.045
   62    HE1  TYR  11           HE1      TYR  11  -5.746  -7.209  -0.281
   63    HE2  TYR  11           HE2      TYR  11  -3.658  -5.524   3.036
   64    HH   TYR  11           HH       TYR  11  -4.227  -7.675   2.889
   65    H    GLU  12           H        GLU  12  -5.824   0.449   0.947
   66    HA   GLU  12           HA       GLU  12  -6.247   1.727  -1.654
   67    HB2  GLU  12           1HB      GLU  12  -7.760   2.245   0.852
   68    HB3  GLU  12           2HB      GLU  12  -7.304   3.641  -0.113
   69    HG2  GLU  12           1HG      GLU  12  -9.393   3.139  -0.931
   70    HG3  GLU  12           2HG      GLU  12  -8.337   2.319  -2.080
   71    H    CYS  13           H        CYS  13  -5.017   3.560  -2.018
   72    HA   CYS  13           HA       CYS  13  -2.647   3.791  -0.413
   73    HB2  CYS  13           1HB      CYS  13  -2.800   4.011  -2.958
   74    HB3  CYS  13           2HB      CYS  13  -3.445   5.623  -2.671
   75    H    THR  14           H        THR  14  -2.429   5.033   1.314
   76    HA   THR  14           HA       THR  14  -4.410   7.055   1.929
   77    HB   THR  14           HB       THR  14  -3.015   7.325   4.043
   78    HG1  THR  14           HG1      THR  14  -1.852   4.848   3.391
   79   HG21  THR  14          3HG2      THR  14  -4.043   5.496   5.084
   80   HG22  THR  14          1HG2      THR  14  -3.916   4.487   3.644
   81   HG23  THR  14          2HG2      THR  14  -5.070   5.820   3.688
   82    H    ASP  15           H        ASP  15  -2.473   7.437  -0.299
   83    HA   ASP  15           HA       ASP  15  -1.235   9.935   0.660
   84    HB2  ASP  15           1HB      ASP  15  -0.194   7.783  -1.110
   85    HB3  ASP  15           2HB      ASP  15   0.233   9.442  -1.523
   86    H    CYS  16           H        CYS  16  -2.847   8.306  -2.026
   87    HA   CYS  16           HA       CYS  16  -3.624  10.954  -3.059
   88    HB2  CYS  16           1HB      CYS  16  -3.633   9.946  -5.336
   89    HB3  CYS  16           2HB      CYS  16  -2.031   9.999  -4.606
   90    H    GLY  17           H        GLY  17  -4.509   7.613  -2.472
   91    HA2  GLY  17           1HA      GLY  17  -6.788   7.230  -1.664
   92    HA3  GLY  17           2HA      GLY  17  -7.334   8.380  -2.876
   93    H    LYS  18           H        LYS  18  -4.853   6.198  -3.813
   94    HA   LYS  18           HA       LYS  18  -6.507   5.044  -5.835
   95    HB2  LYS  18           1HB      LYS  18  -3.659   4.823  -5.004
   96    HB3  LYS  18           2HB      LYS  18  -4.326   3.501  -5.954
   97    HG2  LYS  18           1HG      LYS  18  -5.117   5.328  -7.572
   98    HG3  LYS  18           2HG      LYS  18  -3.983   6.376  -6.717
   99    HD2  LYS  18           1HD      LYS  18  -2.717   5.556  -8.489
  100    HD3  LYS  18           2HD      LYS  18  -2.268   4.495  -7.151
  101    HE2  LYS  18           1HE      LYS  18  -2.643   3.128  -9.071
  102    HE3  LYS  18           2HE      LYS  18  -3.991   2.877  -7.962
  103    HZ1  LYS  18           3HZ      LYS  18  -5.135   3.181  -9.879
  104    HZ2  LYS  18           1HZ      LYS  18  -3.953   4.168 -10.581
  105    HZ3  LYS  18           2HZ      LYS  18  -5.008   4.805  -9.423
  106    H    ALA  19           H        ALA  19  -6.247   2.522  -6.130
  107    HA   ALA  19           HA       ALA  19  -6.710   1.160  -3.574
  108    HB1  ALA  19           3HB      ALA  19  -8.701   0.073  -4.388
  109    HB2  ALA  19           1HB      ALA  19  -8.901   1.821  -4.509
  110    HB3  ALA  19           2HB      ALA  19  -8.541   0.872  -5.952
  111    H    PHE  20           H        PHE  20  -6.440  -1.138  -3.656
  112    HA   PHE  20           HA       PHE  20  -5.396  -2.332  -6.076
  113    HB2  PHE  20           1HB      PHE  20  -3.652  -2.138  -3.612
  114    HB3  PHE  20           2HB      PHE  20  -3.253  -2.983  -5.104
  115    HD1  PHE  20           HD1      PHE  20  -3.920   0.360  -3.667
  116    HD2  PHE  20           HD2      PHE  20  -2.269  -1.854  -6.906
  117    HE1  PHE  20           HE1      PHE  20  -2.907   2.419  -4.554
  118    HE2  PHE  20           HE2      PHE  20  -1.253   0.201  -7.798
  119    HZ   PHE  20           HZ       PHE  20  -1.570   2.341  -6.621
  120    H    GLY  21           H        GLY  21  -6.152  -4.339  -6.191
  121    HA2  GLY  21           1HA      GLY  21  -7.646  -5.540  -4.141
  122    HA3  GLY  21           2HA      GLY  21  -7.062  -6.356  -5.584
  123    H    LEU  22           H        LEU  22  -4.248  -5.547  -4.739
  124    HA   LEU  22           HA       LEU  22  -3.889  -7.734  -2.802
  125    HB2  LEU  22           1HB      LEU  22  -2.347  -6.815  -5.160
  126    HB3  LEU  22           2HB      LEU  22  -1.429  -7.438  -3.790
  127    HG   LEU  22           HG       LEU  22  -3.405  -8.888  -5.531
  128   HD11  LEU  22          1HD1      LEU  22  -1.294 -10.495  -5.321
  129   HD12  LEU  22          2HD1      LEU  22  -0.485  -8.954  -5.039
  130   HD13  LEU  22          3HD1      LEU  22  -1.394  -9.213  -6.528
  131   HD21  LEU  22          3HD2      LEU  22  -2.575 -10.769  -3.773
  132   HD22  LEU  22          1HD2      LEU  22  -4.105  -9.901  -3.648
  133   HD23  LEU  22          2HD2      LEU  22  -2.709  -9.365  -2.713
  134    H    LYS  23           H        LYS  23  -1.883  -7.504  -1.431
  135    HA   LYS  23           HA       LYS  23  -1.916  -4.862  -0.211
  136    HB2  LYS  23           1HB      LYS  23  -2.153  -6.686   1.318
  137    HB3  LYS  23           2HB      LYS  23  -0.750  -7.509   0.649
  138    HG2  LYS  23           1HG      LYS  23   0.187  -6.638   2.522
  139    HG3  LYS  23           2HG      LYS  23   0.469  -5.293   1.414
  140    HD2  LYS  23           1HD      LYS  23  -1.710  -4.319   2.227
  141    HD3  LYS  23           2HD      LYS  23  -1.708  -5.562   3.480
  142    HE2  LYS  23           1HE      LYS  23   0.701  -4.662   3.951
  143    HE3  LYS  23           2HE      LYS  23   0.116  -3.224   3.115
  144    HZ1  LYS  23           3HZ      LYS  23  -1.030  -2.617   4.898
  145    HZ2  LYS  23           1HZ      LYS  23  -0.254  -3.848   5.762
  146    HZ3  LYS  23           2HZ      LYS  23  -1.761  -4.135   5.049
  147    H    SER  24           H        SER  24   0.215  -6.939  -2.028
  148    HA   SER  24           HA       SER  24   2.573  -5.368  -1.509
  149    HB2  SER  24           1HB      SER  24   2.562  -7.851  -2.036
  150    HB3  SER  24           2HB      SER  24   2.200  -7.411  -3.705
  151    HG   SER  24           HG       SER  24   4.191  -5.937  -3.232
  152    H    GLN  25           H        GLN  25   0.067  -5.501  -3.930
  153    HA   GLN  25           HA       GLN  25   1.370  -4.042  -5.961
  154    HB2  GLN  25           1HB      GLN  25  -1.496  -4.617  -5.300
  155    HB3  GLN  25           2HB      GLN  25  -1.107  -3.463  -6.568
  156    HG2  GLN  25           1HG      GLN  25   0.442  -5.443  -7.388
  157    HG3  GLN  25           2HG      GLN  25  -0.736  -6.401  -6.493
  158   HE21  GLN  25          1HE2      GLN  25  -2.908  -6.379  -7.157
  159   HE22  GLN  25          2HE2      GLN  25  -3.355  -5.908  -8.758
  160    H    LEU  26           H        LEU  26  -0.363  -3.076  -3.081
  161    HA   LEU  26           HA       LEU  26  -0.521  -0.301  -3.822
  162    HB2  LEU  26           1HB      LEU  26  -2.220  -1.064  -2.384
  163    HB3  LEU  26           2HB      LEU  26  -1.064  -1.828  -1.295
  164    HG   LEU  26           HG       LEU  26  -0.279   0.470  -0.665
  165   HD11  LEU  26          1HD1      LEU  26  -1.506   1.355  -2.854
  166   HD12  LEU  26          2HD1      LEU  26  -1.247   2.369  -1.435
  167   HD13  LEU  26          3HD1      LEU  26  -2.813   1.601  -1.696
  168   HD21  LEU  26          3HD2      LEU  26  -3.087   0.605   0.068
  169   HD22  LEU  26          1HD2      LEU  26  -1.664   0.348   1.077
  170   HD23  LEU  26          2HD2      LEU  26  -2.416  -1.016   0.251
  171    H    ILE  27           H        ILE  27   1.328  -2.120  -1.375
  172    HA   ILE  27           HA       ILE  27   2.860  -0.121  -0.315
  173    HB   ILE  27           HB       ILE  27   3.787  -2.915  -0.989
  174   HG12  ILE  27          1HG1      ILE  27   2.818  -1.883   1.673
  175   HG13  ILE  27          2HG1      ILE  27   1.719  -2.584   0.489
  176   HG21  ILE  27          1HG2      ILE  27   5.055  -0.672   0.469
  177   HG22  ILE  27          2HG2      ILE  27   5.217  -2.282   1.170
  178   HG23  ILE  27          3HG2      ILE  27   5.786  -1.973  -0.471
  179   HD11  ILE  27          3HD1      ILE  27   4.137  -4.046   1.493
  180   HD12  ILE  27          1HD1      ILE  27   2.577  -4.111   2.313
  181   HD13  ILE  27          2HD1      ILE  27   2.727  -4.695   0.656
  182    H    ILE  28           H        ILE  28   3.480  -1.910  -3.313
  183    HA   ILE  28           HA       ILE  28   5.950  -0.681  -3.911
  184    HB   ILE  28           HB       ILE  28   3.929  -1.957  -5.756
  185   HG12  ILE  28          1HG1      ILE  28   6.543  -3.078  -4.746
  186   HG13  ILE  28          2HG1      ILE  28   5.009  -3.358  -3.930
  187   HG21  ILE  28          1HG2      ILE  28   5.496  -0.343  -6.865
  188   HG22  ILE  28          2HG2      ILE  28   6.824  -1.378  -6.341
  189   HG23  ILE  28          3HG2      ILE  28   5.602  -2.004  -7.448
  190   HD11  ILE  28          3HD1      ILE  28   5.306  -5.246  -5.242
  191   HD12  ILE  28          1HD1      ILE  28   4.201  -4.252  -6.190
  192   HD13  ILE  28          2HD1      ILE  28   5.912  -4.318  -6.613
  193    H    HIS  29           H        HIS  29   2.622   0.216  -4.553
  194    HA   HIS  29           HA       HIS  29   3.245   2.304  -6.403
  195    HB2  HIS  29           1HB      HIS  29   1.070   1.506  -6.645
  196    HB3  HIS  29           2HB      HIS  29   0.785   1.463  -4.907
  197    HD1  HIS  29           HD1      HIS  29   1.088   3.957  -7.740
  198    HD2  HIS  29           HD2      HIS  29  -0.455   3.677  -3.893
  199    HE1  HIS  29           HE1      HIS  29  -0.216   6.077  -7.383
  200    H    GLN  30           H        GLN  30   2.437   2.202  -2.950
  201    HA   GLN  30           HA       GLN  30   2.337   4.909  -2.411
  202    HB2  GLN  30           1HB      GLN  30   3.299   2.602  -0.726
  203    HB3  GLN  30           2HB      GLN  30   3.169   4.240  -0.098
  204    HG2  GLN  30           1HG      GLN  30   0.756   4.207  -0.751
  205    HG3  GLN  30           2HG      GLN  30   0.950   2.497  -1.131
  206   HE21  GLN  30          1HE2      GLN  30  -0.880   3.314   0.725
  207   HE22  GLN  30          2HE2      GLN  30  -0.376   2.818   2.301
  208    H    ARG  31           H        ARG  31   5.012   3.048  -3.399
  209    HA   ARG  31           HA       ARG  31   7.115   4.492  -2.189
  210    HB2  ARG  31           1HB      ARG  31   7.135   3.003  -4.821
  211    HB3  ARG  31           2HB      ARG  31   8.547   3.467  -3.881
  212    HG2  ARG  31           1HG      ARG  31   7.863   1.987  -2.081
  213    HG3  ARG  31           2HG      ARG  31   6.406   1.552  -2.977
  214    HD2  ARG  31           1HD      ARG  31   9.256   0.836  -3.522
  215    HD3  ARG  31           2HD      ARG  31   7.834  -0.205  -3.458
  216    HE   ARG  31           HE       ARG  31   7.376   0.314  -5.661
  217   HH11  ARG  31          1HH1      ARG  31   9.949   2.325  -4.456
  218   HH12  ARG  31          2HH1      ARG  31  10.389   2.925  -6.021
  219   HH21  ARG  31          1HH2      ARG  31   7.945   1.097  -7.727
  220   HH22  ARG  31          2HH2      ARG  31   9.248   2.226  -7.880
  221    H    THR  32           H        THR  32   5.633   4.758  -5.414
  222    HA   THR  32           HA       THR  32   7.147   6.763  -6.505
  223    HB   THR  32           HB       THR  32   5.226   5.553  -7.612
  224    HG1  THR  32           HG1      THR  32   5.869   8.251  -7.854
  225   HG21  THR  32          3HG2      THR  32   3.044   6.082  -7.222
  226   HG22  THR  32          1HG2      THR  32   3.413   7.747  -6.772
  227   HG23  THR  32          2HG2      THR  32   3.687   6.441  -5.619
  228    H    HIS  33           H        HIS  33   4.854   6.994  -3.914
  229    HA   HIS  33           HA       HIS  33   4.501   9.830  -4.043
  230    HB2  HIS  33           1HB      HIS  33   3.875   7.740  -1.969
  231    HB3  HIS  33           2HB      HIS  33   3.638   9.455  -1.644
  232    HD1  HIS  33           HD1      HIS  33   2.326  10.474  -4.121
  233    HD2  HIS  33           HD2      HIS  33   1.418   6.758  -2.498
  234    HE1  HIS  33           HE1      HIS  33   0.035   9.903  -4.988
  235    H    THR  34           H        THR  34   6.404   7.671  -1.953
  236    HA   THR  34           HA       THR  34   7.724   9.905  -0.678
  237    HB   THR  34           HB       THR  34   8.984   8.213   0.569
  238    HG1  THR  34           HG1      THR  34   7.562   6.320  -1.023
  239   HG21  THR  34          3HG2      THR  34   7.259   7.791   1.957
  240   HG22  THR  34          1HG2      THR  34   6.312   6.998   0.699
  241   HG23  THR  34          2HG2      THR  34   6.327   8.758   0.814
  242    H    GLY  35           H        GLY  35   9.025  10.998  -2.070
  243    HA2  GLY  35           1HA      GLY  35  11.592  10.223  -2.594
  244    HA3  GLY  35           2HA      GLY  35  10.689   9.658  -3.992
  245    H    GLU  36           H        GLU  36  10.138  11.075  -5.564
  246    HA   GLU  36           HA       GLU  36  11.118  13.817  -5.236
  247    HB2  GLU  36           1HB      GLU  36  10.711  12.005  -7.571
  248    HB3  GLU  36           2HB      GLU  36  10.606  13.740  -7.837
  249    HG2  GLU  36           1HG      GLU  36  12.955  12.275  -6.654
  250    HG3  GLU  36           2HG      GLU  36  12.839  12.897  -8.300
  251    H    SER  37           H        SER  37   9.844  15.501  -6.509
  252    HA   SER  37           HA       SER  37   7.495  16.124  -5.386
  253    HB2  SER  37           1HB      SER  37   8.754  17.507  -7.075
  254    HB3  SER  37           2HB      SER  37   7.972  16.562  -8.341
  255    HG   SER  37           HG       SER  37   5.963  17.252  -7.060
  256    H    GLY  38           H        GLY  38   5.399  15.530  -5.433
  257    HA2  GLY  38           1HA      GLY  38   4.603  13.519  -7.446
  258    HA3  GLY  38           2HA      GLY  38   4.190  13.339  -5.747
  259    HA   PRO  39           HA       PRO  39   0.565  15.314  -7.782
  260    HB2  PRO  39           1HB      PRO  39  -1.271  13.913  -6.356
  261    HB3  PRO  39           2HB      PRO  39  -0.530  13.295  -7.837
  262    HG2  PRO  39           1HG      PRO  39   0.155  12.697  -4.985
  263    HG3  PRO  39           2HG      PRO  39   0.029  11.587  -6.362
  264    HD2  PRO  39           1HD      PRO  39   2.405  12.500  -5.439
  265    HD3  PRO  39           2HD      PRO  39   2.124  12.130  -7.152
  266    H    SER  40           H        SER  40   0.632  17.335  -6.915
  267    HA   SER  40           HA       SER  40  -0.026  17.625  -4.061
  268    HB2  SER  40           1HB      SER  40   1.549  19.335  -5.967
  269    HB3  SER  40           2HB      SER  40   0.846  20.034  -4.508
  270    HG   SER  40           HG       SER  40   2.644  19.334  -3.652
  271    H    SER  41           H        SER  41  -2.127  17.051  -5.720
  272    HA   SER  41           HA       SER  41  -3.413  19.512  -6.540
  273    HB2  SER  41           1HB      SER  41  -4.491  16.682  -6.478
  274    HB3  SER  41           2HB      SER  41  -5.254  18.063  -7.266
  275    HG   SER  41           HG       SER  41  -2.834  16.767  -7.946
  276    H    GLY  42           H        GLY  42  -5.771  19.812  -5.848
  277    HA2  GLY  42           1HA      GLY  42  -7.030  20.622  -4.078
  278    HA3  GLY  42           2HA      GLY  42  -7.018  18.921  -3.635
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1 -15.059  -3.470 -18.818
    2    HA2  GLY   1           1HA      GLY   1 -15.437  -5.503 -17.810
    3    HA3  GLY   1           2HA      GLY   1 -17.107  -4.961 -17.740
    4    H    SER   2           H        SER   2 -14.760  -6.479 -19.934
    5    HA   SER   2           HA       SER   2 -16.799  -7.553 -21.636
    6    HB2  SER   2           1HB      SER   2 -13.846  -8.190 -21.432
    7    HB3  SER   2           2HB      SER   2 -14.918  -8.785 -22.700
    8    HG   SER   2           HG       SER   2 -13.949  -6.197 -22.247
    9    H    SER   3           H        SER   3 -14.536  -8.989 -19.292
   10    HA   SER   3           HA       SER   3 -16.251 -11.379 -19.212
   11    HB2  SER   3           1HB      SER   3 -13.318 -10.963 -18.700
   12    HB3  SER   3           2HB      SER   3 -14.155 -12.365 -18.034
   13    HG   SER   3           HG       SER   3 -14.174 -11.655 -20.781
   14    H    GLY   4           H        GLY   4 -14.282  -9.302 -17.085
   15    HA2  GLY   4           1HA      GLY   4 -15.904  -8.506 -15.182
   16    HA3  GLY   4           2HA      GLY   4 -15.850 -10.218 -14.786
   17    H    SER   5           H        SER   5 -14.390 -10.806 -13.334
   18    HA   SER   5           HA       SER   5 -12.638 -10.716 -11.882
   19    HB2  SER   5           1HB      SER   5 -11.417  -9.701 -14.437
   20    HB3  SER   5           2HB      SER   5 -10.457  -9.812 -12.961
   21    HG   SER   5           HG       SER   5 -10.821 -12.008 -12.910
   22    H    SER   6           H        SER   6 -14.468  -8.611 -11.648
   23    HA   SER   6           HA       SER   6 -13.002  -6.137 -11.370
   24    HB2  SER   6           1HB      SER   6 -15.102  -5.168 -10.686
   25    HB3  SER   6           2HB      SER   6 -15.414  -6.230 -12.059
   26    HG   SER   6           HG       SER   6 -16.073  -7.832 -10.540
   27    H    GLY   7           H        GLY   7 -14.781  -8.260  -9.115
   28    HA2  GLY   7           1HA      GLY   7 -14.569  -8.560  -6.846
   29    HA3  GLY   7           2HA      GLY   7 -12.843  -8.442  -7.158
   30    H    GLU   8           H        GLU   8 -12.753  -7.493  -5.006
   31    HA   GLU   8           HA       GLU   8 -13.254  -4.601  -5.125
   32    HB2  GLU   8           1HB      GLU   8 -14.926  -6.004  -3.692
   33    HB3  GLU   8           2HB      GLU   8 -13.598  -6.086  -2.543
   34    HG2  GLU   8           1HG      GLU   8 -14.405  -3.434  -3.622
   35    HG3  GLU   8           2HG      GLU   8 -15.404  -4.201  -2.389
   36    H    LYS   9           H        LYS   9 -11.674  -3.327  -4.272
   37    HA   LYS   9           HA       LYS   9  -9.226  -4.706  -3.430
   38    HB2  LYS   9           1HB      LYS   9  -9.579  -1.835  -4.308
   39    HB3  LYS   9           2HB      LYS   9  -8.053  -2.661  -4.024
   40    HG2  LYS   9           1HG      LYS   9  -8.258  -3.961  -5.945
   41    HG3  LYS   9           2HG      LYS   9  -9.992  -3.659  -6.076
   42    HD2  LYS   9           1HD      LYS   9  -8.059  -1.385  -6.271
   43    HD3  LYS   9           2HD      LYS   9  -8.336  -2.428  -7.667
   44    HE2  LYS   9           1HE      LYS   9 -10.797  -1.983  -7.367
   45    HE3  LYS   9           2HE      LYS   9 -10.354  -0.760  -6.177
   46    HZ1  LYS   9           3HZ      LYS   9 -10.683   0.275  -8.296
   47    HZ2  LYS   9           1HZ      LYS   9  -9.601  -0.787  -9.048
   48    HZ3  LYS   9           2HZ      LYS   9  -9.034   0.340  -7.922
   49    HA   PRO  10           HA       PRO  10 -10.534  -3.217   0.649
   50    HB2  PRO  10           1HB      PRO  10  -8.936  -4.934   2.017
   51    HB3  PRO  10           2HB      PRO  10 -10.511  -5.401   1.362
   52    HG2  PRO  10           1HG      PRO  10  -7.776  -5.875   0.240
   53    HG3  PRO  10           2HG      PRO  10  -9.156  -6.985   0.331
   54    HD2  PRO  10           1HD      PRO  10  -8.500  -5.660  -1.937
   55    HD3  PRO  10           2HD      PRO  10 -10.177  -6.068  -1.522
   56    H    TYR  11           H        TYR  11  -7.591  -3.137  -1.032
   57    HA   TYR  11           HA       TYR  11  -6.264  -1.628   1.114
   58    HB2  TYR  11           1HB      TYR  11  -5.037  -2.738  -1.416
   59    HB3  TYR  11           2HB      TYR  11  -4.180  -2.035  -0.048
   60    HD1  TYR  11           HD1      TYR  11  -6.154  -4.945  -1.175
   61    HD2  TYR  11           HD2      TYR  11  -3.689  -3.328   1.894
   62    HE1  TYR  11           HE1      TYR  11  -5.975  -7.174  -0.152
   63    HE2  TYR  11           HE2      TYR  11  -3.503  -5.554   2.924
   64    HH   TYR  11           HH       TYR  11  -4.381  -8.387   1.353
   65    H    GLU  12           H        GLU  12  -6.103   0.507   0.959
   66    HA   GLU  12           HA       GLU  12  -6.236   1.757  -1.696
   67    HB2  GLU  12           1HB      GLU  12  -8.001   2.226   0.653
   68    HB3  GLU  12           2HB      GLU  12  -7.518   3.629  -0.290
   69    HG2  GLU  12           1HG      GLU  12  -9.445   3.075  -1.360
   70    HG3  GLU  12           2HG      GLU  12  -8.291   2.137  -2.307
   71    H    CYS  13           H        CYS  13  -4.928   3.501  -1.996
   72    HA   CYS  13           HA       CYS  13  -2.779   3.871  -0.161
   73    HB2  CYS  13           1HB      CYS  13  -2.618   4.072  -2.669
   74    HB3  CYS  13           2HB      CYS  13  -3.470   5.607  -2.536
   75    H    THR  14           H        THR  14  -2.665   5.196   1.519
   76    HA   THR  14           HA       THR  14  -4.791   7.129   1.966
   77    HB   THR  14           HB       THR  14  -3.650   7.439   4.200
   78    HG1  THR  14           HG1      THR  14  -2.160   5.639   4.681
   79   HG21  THR  14          3HG2      THR  14  -5.216   5.974   4.802
   80   HG22  THR  14          1HG2      THR  14  -4.080   4.666   4.472
   81   HG23  THR  14          2HG2      THR  14  -5.175   5.224   3.207
   82    H    ASP  15           H        ASP  15  -2.678   7.562  -0.083
   83    HA   ASP  15           HA       ASP  15  -1.606  10.099   0.968
   84    HB2  ASP  15           1HB      ASP  15  -0.337   7.969  -0.675
   85    HB3  ASP  15           2HB      ASP  15   0.076   9.637  -1.063
   86    H    CYS  16           H        CYS  16  -2.984   8.408  -1.796
   87    HA   CYS  16           HA       CYS  16  -3.663  11.026  -2.966
   88    HB2  CYS  16           1HB      CYS  16  -3.499   9.986  -5.198
   89    HB3  CYS  16           2HB      CYS  16  -1.962   9.948  -4.340
   90    H    GLY  17           H        GLY  17  -4.604   7.652  -2.515
   91    HA2  GLY  17           1HA      GLY  17  -6.940   7.313  -1.793
   92    HA3  GLY  17           2HA      GLY  17  -7.397   8.465  -3.039
   93    H    LYS  18           H        LYS  18  -4.899   6.174  -3.722
   94    HA   LYS  18           HA       LYS  18  -6.466   5.037  -5.851
   95    HB2  LYS  18           1HB      LYS  18  -3.871   5.531  -5.696
   96    HB3  LYS  18           2HB      LYS  18  -3.827   3.902  -5.035
   97    HG2  LYS  18           1HG      LYS  18  -4.394   2.930  -7.013
   98    HG3  LYS  18           2HG      LYS  18  -5.317   4.330  -7.565
   99    HD2  LYS  18           1HD      LYS  18  -2.364   4.583  -7.231
  100    HD3  LYS  18           2HD      LYS  18  -2.994   3.732  -8.643
  101    HE2  LYS  18           1HE      LYS  18  -3.685   6.548  -7.807
  102    HE3  LYS  18           2HE      LYS  18  -2.612   6.093  -9.131
  103    HZ1  LYS  18           3HZ      LYS  18  -4.459   6.265 -10.357
  104    HZ2  LYS  18           1HZ      LYS  18  -5.498   6.133  -9.028
  105    HZ3  LYS  18           2HZ      LYS  18  -4.850   4.741  -9.736
  106    H    ALA  19           H        ALA  19  -6.107   2.506  -6.112
  107    HA   ALA  19           HA       ALA  19  -6.602   1.144  -3.568
  108    HB1  ALA  19           3HB      ALA  19  -8.405   0.548  -5.877
  109    HB2  ALA  19           1HB      ALA  19  -8.650   0.246  -4.156
  110    HB3  ALA  19           2HB      ALA  19  -8.765   1.889  -4.789
  111    H    PHE  20           H        PHE  20  -6.406  -1.188  -3.708
  112    HA   PHE  20           HA       PHE  20  -5.319  -2.345  -6.118
  113    HB2  PHE  20           1HB      PHE  20  -3.586  -2.212  -3.642
  114    HB3  PHE  20           2HB      PHE  20  -3.177  -2.991  -5.167
  115    HD1  PHE  20           HD1      PHE  20  -3.761   0.259  -3.529
  116    HD2  PHE  20           HD2      PHE  20  -2.303  -1.756  -6.983
  117    HE1  PHE  20           HE1      PHE  20  -2.757   2.359  -4.326
  118    HE2  PHE  20           HE2      PHE  20  -1.296   0.341  -7.785
  119    HZ   PHE  20           HZ       PHE  20  -1.521   2.402  -6.456
  120    H    GLY  21           H        GLY  21  -6.106  -4.336  -6.259
  121    HA2  GLY  21           1HA      GLY  21  -7.589  -5.561  -4.213
  122    HA3  GLY  21           2HA      GLY  21  -7.032  -6.354  -5.678
  123    H    LEU  22           H        LEU  22  -4.222  -5.425  -4.667
  124    HA   LEU  22           HA       LEU  22  -3.850  -7.709  -2.843
  125    HB2  LEU  22           1HB      LEU  22  -2.313  -6.752  -5.190
  126    HB3  LEU  22           2HB      LEU  22  -1.392  -7.398  -3.833
  127    HG   LEU  22           HG       LEU  22  -3.374  -8.819  -5.591
  128   HD11  LEU  22          1HD1      LEU  22  -0.452  -8.902  -5.104
  129   HD12  LEU  22          2HD1      LEU  22  -1.362  -9.119  -6.599
  130   HD13  LEU  22          3HD1      LEU  22  -1.270 -10.432  -5.424
  131   HD21  LEU  22          3HD2      LEU  22  -2.670  -9.341  -2.785
  132   HD22  LEU  22          1HD2      LEU  22  -2.536 -10.728  -3.866
  133   HD23  LEU  22          2HD2      LEU  22  -4.068  -9.865  -3.725
  134    H    LYS  23           H        LYS  23  -1.809  -7.498  -1.498
  135    HA   LYS  23           HA       LYS  23  -1.851  -4.883  -0.220
  136    HB2  LYS  23           1HB      LYS  23  -2.065  -6.737   1.275
  137    HB3  LYS  23           2HB      LYS  23  -0.665  -7.541   0.577
  138    HG2  LYS  23           1HG      LYS  23   0.291  -6.703   2.454
  139    HG3  LYS  23           2HG      LYS  23   0.548  -5.331   1.375
  140    HD2  LYS  23           1HD      LYS  23  -1.646  -4.410   2.237
  141    HD3  LYS  23           2HD      LYS  23  -1.584  -5.667   3.475
  142    HE2  LYS  23           1HE      LYS  23   0.771  -3.877   3.066
  143    HE3  LYS  23           2HE      LYS  23  -0.627  -3.282   3.959
  144    HZ1  LYS  23           3HZ      LYS  23  -0.410  -5.247   5.418
  145    HZ2  LYS  23           1HZ      LYS  23   0.928  -4.215   5.490
  146    HZ3  LYS  23           2HZ      LYS  23   1.021  -5.661   4.616
  147    H    SER  24           H        SER  24   0.275  -6.915  -2.094
  148    HA   SER  24           HA       SER  24   2.630  -5.343  -1.565
  149    HB2  SER  24           1HB      SER  24   2.985  -7.661  -2.043
  150    HB3  SER  24           2HB      SER  24   2.041  -7.564  -3.530
  151    HG   SER  24           HG       SER  24   4.568  -6.394  -2.998
  152    H    GLN  25           H        GLN  25   0.125  -5.470  -3.997
  153    HA   GLN  25           HA       GLN  25   1.387  -3.968  -6.007
  154    HB2  GLN  25           1HB      GLN  25  -1.473  -4.518  -5.300
  155    HB3  GLN  25           2HB      GLN  25  -1.090  -3.359  -6.565
  156    HG2  GLN  25           1HG      GLN  25   0.419  -5.354  -7.426
  157    HG3  GLN  25           2HG      GLN  25  -0.759  -6.302  -6.521
  158   HE21  GLN  25          1HE2      GLN  25  -3.066  -5.789  -7.004
  159   HE22  GLN  25          2HE2      GLN  25  -3.482  -5.474  -8.651
  160    H    LEU  26           H        LEU  26  -0.283  -3.031  -3.080
  161    HA   LEU  26           HA       LEU  26  -0.419  -0.242  -3.777
  162    HB2  LEU  26           1HB      LEU  26  -2.112  -1.015  -2.334
  163    HB3  LEU  26           2HB      LEU  26  -0.950  -1.798  -1.264
  164    HG   LEU  26           HG       LEU  26  -0.143   0.488  -0.619
  165   HD11  LEU  26          1HD1      LEU  26  -2.127   2.198  -1.067
  166   HD12  LEU  26          2HD1      LEU  26  -2.285   1.224  -2.529
  167   HD13  LEU  26          3HD1      LEU  26  -0.758   2.030  -2.166
  168   HD21  LEU  26          3HD2      LEU  26  -1.427   0.026   1.132
  169   HD22  LEU  26          1HD2      LEU  26  -2.553  -0.884   0.125
  170   HD23  LEU  26          2HD2      LEU  26  -2.757   0.857   0.324
  171    H    ILE  27           H        ILE  27   1.464  -2.155  -1.435
  172    HA   ILE  27           HA       ILE  27   3.022  -0.202  -0.321
  173    HB   ILE  27           HB       ILE  27   3.915  -2.973  -1.121
  174   HG12  ILE  27          1HG1      ILE  27   2.995  -2.008   1.586
  175   HG13  ILE  27          2HG1      ILE  27   1.895  -2.719   0.410
  176   HG21  ILE  27          1HG2      ILE  27   5.295  -2.181   1.158
  177   HG22  ILE  27          2HG2      ILE  27   5.945  -2.336  -0.474
  178   HG23  ILE  27          3HG2      ILE  27   5.345  -0.777   0.092
  179   HD11  ILE  27          3HD1      ILE  27   2.826  -4.241   2.212
  180   HD12  ILE  27          1HD1      ILE  27   2.932  -4.811   0.546
  181   HD13  ILE  27          2HD1      ILE  27   4.358  -4.147   1.344
  182    H    ILE  28           H        ILE  28   3.628  -1.914  -3.373
  183    HA   ILE  28           HA       ILE  28   6.069  -0.641  -3.972
  184    HB   ILE  28           HB       ILE  28   4.038  -1.863  -5.844
  185   HG12  ILE  28          1HG1      ILE  28   6.649  -3.093  -5.017
  186   HG13  ILE  28          2HG1      ILE  28   5.233  -3.247  -3.982
  187   HG21  ILE  28          1HG2      ILE  28   5.304  -0.593  -7.285
  188   HG22  ILE  28          2HG2      ILE  28   6.755  -0.719  -6.292
  189   HG23  ILE  28          3HG2      ILE  28   6.224  -2.097  -7.257
  190   HD11  ILE  28          3HD1      ILE  28   5.605  -5.167  -5.502
  191   HD12  ILE  28          1HD1      ILE  28   4.031  -4.397  -5.694
  192   HD13  ILE  28          2HD1      ILE  28   5.312  -4.089  -6.867
  193    H    HIS  29           H        HIS  29   2.748   0.314  -4.402
  194    HA   HIS  29           HA       HIS  29   3.280   2.412  -6.276
  195    HB2  HIS  29           1HB      HIS  29   1.080   1.598  -6.355
  196    HB3  HIS  29           2HB      HIS  29   0.904   1.638  -4.603
  197    HD1  HIS  29           HD1      HIS  29   0.952   3.931  -7.597
  198    HD2  HIS  29           HD2      HIS  29  -0.091   3.991  -3.576
  199    HE1  HIS  29           HE1      HIS  29  -0.247   6.113  -7.246
  200    H    GLN  30           H        GLN  30   2.662   2.285  -2.782
  201    HA   GLN  30           HA       GLN  30   2.677   4.996  -2.225
  202    HB2  GLN  30           1HB      GLN  30   3.554   2.612  -0.613
  203    HB3  GLN  30           2HB      GLN  30   3.629   4.242   0.045
  204    HG2  GLN  30           1HG      GLN  30   1.174   4.441  -0.513
  205    HG3  GLN  30           2HG      GLN  30   1.200   2.706  -0.822
  206   HE21  GLN  30          1HE2      GLN  30   0.164   1.803   0.817
  207   HE22  GLN  30          2HE2      GLN  30   0.481   2.089   2.491
  208    H    ARG  31           H        ARG  31   5.228   3.053  -3.351
  209    HA   ARG  31           HA       ARG  31   7.440   4.384  -2.209
  210    HB2  ARG  31           1HB      ARG  31   7.234   2.910  -4.842
  211    HB3  ARG  31           2HB      ARG  31   8.735   3.372  -4.051
  212    HG2  ARG  31           1HG      ARG  31   7.943   1.981  -2.077
  213    HG3  ARG  31           2HG      ARG  31   6.716   1.338  -3.171
  214    HD2  ARG  31           1HD      ARG  31   8.572  -0.165  -3.186
  215    HD3  ARG  31           2HD      ARG  31   8.554   0.688  -4.729
  216    HE   ARG  31           HE       ARG  31  10.602   1.542  -4.213
  217   HH11  ARG  31          1HH1      ARG  31   9.059   0.507  -1.269
  218   HH12  ARG  31          2HH1      ARG  31  10.444   0.825  -0.277
  219   HH21  ARG  31          1HH2      ARG  31  12.432   1.965  -2.918
  220   HH22  ARG  31          2HH2      ARG  31  12.361   1.655  -1.216
  221    H    THR  32           H        THR  32   5.892   4.754  -5.397
  222    HA   THR  32           HA       THR  32   7.449   6.787  -6.419
  223    HB   THR  32           HB       THR  32   5.538   5.542  -7.569
  224    HG1  THR  32           HG1      THR  32   5.683   8.372  -7.902
  225   HG21  THR  32          3HG2      THR  32   3.354   6.241  -7.355
  226   HG22  THR  32          1HG2      THR  32   3.809   7.841  -6.773
  227   HG23  THR  32          2HG2      THR  32   3.926   6.447  -5.700
  228    H    HIS  33           H        HIS  33   4.954   6.949  -3.985
  229    HA   HIS  33           HA       HIS  33   4.588   9.769  -4.051
  230    HB2  HIS  33           1HB      HIS  33   3.892   7.594  -2.108
  231    HB3  HIS  33           2HB      HIS  33   3.713   9.280  -1.635
  232    HD1  HIS  33           HD1      HIS  33   2.489  10.547  -4.058
  233    HD2  HIS  33           HD2      HIS  33   1.392   6.771  -2.715
  234    HE1  HIS  33           HE1      HIS  33   0.187  10.145  -4.987
  235    H    THR  34           H        THR  34   6.293   7.680  -1.713
  236    HA   THR  34           HA       THR  34   7.463   9.755  -0.241
  237    HB   THR  34           HB       THR  34   9.103   8.038   0.529
  238    HG1  THR  34           HG1      THR  34   9.006   6.894  -1.590
  239   HG21  THR  34          3HG2      THR  34   6.573   8.302   1.259
  240   HG22  THR  34          1HG2      THR  34   7.579   6.999   1.889
  241   HG23  THR  34          2HG2      THR  34   6.452   6.684   0.569
  242    H    GLY  35           H        GLY  35   8.184   8.583  -3.365
  243    HA2  GLY  35           1HA      GLY  35  10.917   9.643  -3.300
  244    HA3  GLY  35           2HA      GLY  35  10.212   8.683  -4.593
  245    H    GLU  36           H        GLU  36  11.511  10.696  -5.545
  246    HA   GLU  36           HA       GLU  36  10.113  13.175  -5.621
  247    HB2  GLU  36           1HB      GLU  36  12.539  12.979  -6.051
  248    HB3  GLU  36           2HB      GLU  36  12.193  12.093  -7.529
  249    HG2  GLU  36           1HG      GLU  36  12.749  14.506  -7.839
  250    HG3  GLU  36           2HG      GLU  36  11.221  13.992  -8.551
  251    H    SER  37           H        SER  37   8.089  13.193  -6.395
  252    HA   SER  37           HA       SER  37   7.375  11.599  -8.716
  253    HB2  SER  37           1HB      SER  37   5.941  12.105  -6.552
  254    HB3  SER  37           2HB      SER  37   5.484  13.546  -7.459
  255    HG   SER  37           HG       SER  37   5.216  11.704  -9.196
  256    H    GLY  38           H        GLY  38   6.295  12.540 -10.574
  257    HA2  GLY  38           1HA      GLY  38   7.723  14.502 -11.866
  258    HA3  GLY  38           2HA      GLY  38   6.067  14.076 -12.271
  259    HA   PRO  39           HA       PRO  39   4.911  18.173 -11.178
  260    HB2  PRO  39           1HB      PRO  39   2.256  17.775 -10.772
  261    HB3  PRO  39           2HB      PRO  39   2.990  17.791 -12.380
  262    HG2  PRO  39           1HG      PRO  39   2.227  15.456 -10.669
  263    HG3  PRO  39           2HG      PRO  39   1.991  15.691 -12.411
  264    HD2  PRO  39           1HD      PRO  39   4.001  14.182 -11.402
  265    HD3  PRO  39           2HD      PRO  39   4.164  15.105 -12.911
  266    H    SER  40           H        SER  40   5.047  15.639  -9.032
  267    HA   SER  40           HA       SER  40   4.827  15.405  -6.772
  268    HB2  SER  40           1HB      SER  40   5.663  17.305  -5.453
  269    HB3  SER  40           2HB      SER  40   6.670  17.031  -6.875
  270    HG   SER  40           HG       SER  40   4.793  19.081  -6.397
  271    H    SER  41           H        SER  41   2.374  15.733  -8.034
  272    HA   SER  41           HA       SER  41   0.752  17.734  -6.869
  273    HB2  SER  41           1HB      SER  41   0.169  15.125  -8.249
  274    HB3  SER  41           2HB      SER  41  -1.130  16.082  -7.537
  275    HG   SER  41           HG       SER  41  -0.137  16.399  -9.896
  276    H    GLY  42           H        GLY  42   1.104  17.773  -4.646
  277    HA2  GLY  42           1HA      GLY  42   0.097  17.282  -2.566
  278    HA3  GLY  42           2HA      GLY  42  -0.348  15.698  -3.182
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1 -12.444   4.093 -22.983
    2    HA2  GLY   1           1HA      GLY   1 -14.412   3.019 -22.423
    3    HA3  GLY   1           2HA      GLY   1 -13.426   1.583 -22.658
    4    H    SER   2           H        SER   2 -12.161   0.851 -20.746
    5    HA   SER   2           HA       SER   2 -12.310  -0.087 -18.662
    6    HB2  SER   2           1HB      SER   2 -12.694   2.845 -18.017
    7    HB3  SER   2           2HB      SER   2 -12.309   1.605 -16.824
    8    HG   SER   2           HG       SER   2 -10.686   1.850 -19.094
    9    H    SER   3           H        SER   3 -14.715  -0.336 -20.015
   10    HA   SER   3           HA       SER   3 -16.738   0.195 -17.944
   11    HB2  SER   3           1HB      SER   3 -18.402  -0.166 -19.772
   12    HB3  SER   3           2HB      SER   3 -17.326   1.200 -20.067
   13    HG   SER   3           HG       SER   3 -16.828   0.242 -21.858
   14    H    GLY   4           H        GLY   4 -16.966  -1.507 -16.643
   15    HA2  GLY   4           1HA      GLY   4 -18.024  -3.943 -17.489
   16    HA3  GLY   4           2HA      GLY   4 -16.287  -4.164 -17.343
   17    H    SER   5           H        SER   5 -18.103  -5.598 -15.801
   18    HA   SER   5           HA       SER   5 -18.807  -4.617 -13.332
   19    HB2  SER   5           1HB      SER   5 -17.850  -7.358 -14.153
   20    HB3  SER   5           2HB      SER   5 -18.407  -7.010 -12.516
   21    HG   SER   5           HG       SER   5 -20.300  -6.059 -13.870
   22    H    SER   6           H        SER   6 -17.545  -3.388 -12.087
   23    HA   SER   6           HA       SER   6 -14.746  -3.499 -11.964
   24    HB2  SER   6           1HB      SER   6 -16.807  -2.333 -10.093
   25    HB3  SER   6           2HB      SER   6 -15.075  -2.178  -9.802
   26    HG   SER   6           HG       SER   6 -16.656  -0.803 -11.512
   27    H    GLY   7           H        GLY   7 -13.517  -3.893  -9.872
   28    HA2  GLY   7           1HA      GLY   7 -14.391  -6.491  -8.781
   29    HA3  GLY   7           2HA      GLY   7 -12.716  -5.981  -8.937
   30    H    GLU   8           H        GLU   8 -12.416  -6.506  -6.711
   31    HA   GLU   8           HA       GLU   8 -13.410  -4.394  -4.921
   32    HB2  GLU   8           1HB      GLU   8 -13.756  -5.941  -3.145
   33    HB3  GLU   8           2HB      GLU   8 -14.571  -6.598  -4.557
   34    HG2  GLU   8           1HG      GLU   8 -11.898  -7.459  -3.477
   35    HG3  GLU   8           2HG      GLU   8 -13.416  -8.346  -3.356
   36    H    LYS   9           H        LYS   9 -11.891  -3.395  -3.747
   37    HA   LYS   9           HA       LYS   9  -9.268  -4.680  -3.437
   38    HB2  LYS   9           1HB      LYS   9  -9.631  -1.777  -4.191
   39    HB3  LYS   9           2HB      LYS   9  -8.111  -2.646  -4.026
   40    HG2  LYS   9           1HG      LYS   9  -8.461  -3.865  -5.992
   41    HG3  LYS   9           2HG      LYS   9 -10.180  -3.466  -6.035
   42    HD2  LYS   9           1HD      LYS   9  -9.652  -1.143  -6.519
   43    HD3  LYS   9           2HD      LYS   9  -7.925  -1.492  -6.401
   44    HE2  LYS   9           1HE      LYS   9  -8.437  -3.256  -8.247
   45    HE3  LYS   9           2HE      LYS   9  -9.884  -2.286  -8.517
   46    HZ1  LYS   9           3HZ      LYS   9  -8.018  -1.629  -9.944
   47    HZ2  LYS   9           1HZ      LYS   9  -7.108  -1.233  -8.573
   48    HZ3  LYS   9           2HZ      LYS   9  -8.516  -0.368  -8.932
   49    HA   PRO  10           HA       PRO  10 -10.555  -3.306   0.693
   50    HB2  PRO  10           1HB      PRO  10  -8.958  -5.069   2.002
   51    HB3  PRO  10           2HB      PRO  10 -10.540  -5.509   1.346
   52    HG2  PRO  10           1HG      PRO  10  -7.816  -5.968   0.191
   53    HG3  PRO  10           2HG      PRO  10  -9.203  -7.072   0.261
   54    HD2  PRO  10           1HD      PRO  10  -8.553  -5.689  -1.974
   55    HD3  PRO  10           2HD      PRO  10 -10.230  -6.099  -1.558
   56    H    TYR  11           H        TYR  11  -7.677  -3.107  -1.041
   57    HA   TYR  11           HA       TYR  11  -6.338  -1.649   1.140
   58    HB2  TYR  11           1HB      TYR  11  -5.077  -2.832  -1.341
   59    HB3  TYR  11           2HB      TYR  11  -4.233  -2.088   0.012
   60    HD1  TYR  11           HD1      TYR  11  -6.153  -5.038  -1.073
   61    HD2  TYR  11           HD2      TYR  11  -3.826  -3.302   2.038
   62    HE1  TYR  11           HE1      TYR  11  -5.998  -7.232   0.026
   63    HE2  TYR  11           HE2      TYR  11  -3.663  -5.492   3.145
   64    HH   TYR  11           HH       TYR  11  -5.595  -8.141   2.272
   65    H    GLU  12           H        GLU  12  -5.872   0.459   0.895
   66    HA   GLU  12           HA       GLU  12  -6.085   1.664  -1.768
   67    HB2  GLU  12           1HB      GLU  12  -7.734   2.309   0.634
   68    HB3  GLU  12           2HB      GLU  12  -7.251   3.627  -0.424
   69    HG2  GLU  12           1HG      GLU  12  -9.226   3.092  -1.390
   70    HG3  GLU  12           2HG      GLU  12  -8.174   1.997  -2.285
   71    H    CYS  13           H        CYS  13  -4.909   3.585  -2.047
   72    HA   CYS  13           HA       CYS  13  -2.650   3.837  -0.255
   73    HB2  CYS  13           1HB      CYS  13  -2.193   3.866  -2.626
   74    HB3  CYS  13           2HB      CYS  13  -3.325   5.192  -2.872
   75    H    THR  14           H        THR  14  -2.784   5.077   1.486
   76    HA   THR  14           HA       THR  14  -4.768   7.066   1.864
   77    HB   THR  14           HB       THR  14  -3.500   7.652   3.922
   78    HG1  THR  14           HG1      THR  14  -1.717   5.592   3.078
   79   HG21  THR  14          3HG2      THR  14  -3.502   4.703   3.999
   80   HG22  THR  14          1HG2      THR  14  -5.000   5.453   3.450
   81   HG23  THR  14          2HG2      THR  14  -4.335   5.865   5.031
   82    H    ASP  15           H        ASP  15  -1.699   7.109   0.360
   83    HA   ASP  15           HA       ASP  15  -0.987   9.813   0.801
   84    HB2  ASP  15           1HB      ASP  15   0.378   7.780  -0.190
   85    HB3  ASP  15           2HB      ASP  15  -0.219   8.408  -1.724
   86    H    CYS  16           H        CYS  16  -2.479   8.231  -2.027
   87    HA   CYS  16           HA       CYS  16  -3.503  10.869  -2.845
   88    HB2  CYS  16           1HB      CYS  16  -3.623   9.964  -5.126
   89    HB3  CYS  16           2HB      CYS  16  -1.986   9.863  -4.485
   90    H    GLY  17           H        GLY  17  -4.327   7.429  -2.589
   91    HA2  GLY  17           1HA      GLY  17  -6.540   7.027  -1.506
   92    HA3  GLY  17           2HA      GLY  17  -7.176   8.214  -2.635
   93    H    LYS  18           H        LYS  18  -4.751   6.086  -3.816
   94    HA   LYS  18           HA       LYS  18  -6.496   5.015  -5.792
   95    HB2  LYS  18           1HB      LYS  18  -3.631   4.692  -5.056
   96    HB3  LYS  18           2HB      LYS  18  -4.362   3.421  -6.028
   97    HG2  LYS  18           1HG      LYS  18  -5.128   5.264  -7.595
   98    HG3  LYS  18           2HG      LYS  18  -4.034   6.326  -6.707
   99    HD2  LYS  18           1HD      LYS  18  -2.150   5.237  -7.463
  100    HD3  LYS  18           2HD      LYS  18  -3.010   3.721  -7.743
  101    HE2  LYS  18           1HE      LYS  18  -4.280   5.194  -9.534
  102    HE3  LYS  18           2HE      LYS  18  -2.793   6.139  -9.463
  103    HZ1  LYS  18           3HZ      LYS  18  -1.634   3.910  -9.803
  104    HZ2  LYS  18           1HZ      LYS  18  -2.416   4.594 -11.138
  105    HZ3  LYS  18           2HZ      LYS  18  -3.146   3.326 -10.289
  106    H    ALA  19           H        ALA  19  -6.313   2.498  -6.176
  107    HA   ALA  19           HA       ALA  19  -6.792   1.088  -3.642
  108    HB1  ALA  19           3HB      ALA  19  -8.802   0.111  -4.401
  109    HB2  ALA  19           1HB      ALA  19  -8.939   1.834  -4.754
  110    HB3  ALA  19           2HB      ALA  19  -8.555   0.696  -6.046
  111    H    PHE  20           H        PHE  20  -6.387  -1.147  -3.677
  112    HA   PHE  20           HA       PHE  20  -5.353  -2.347  -6.112
  113    HB2  PHE  20           1HB      PHE  20  -3.640  -2.143  -3.627
  114    HB3  PHE  20           2HB      PHE  20  -3.216  -2.985  -5.115
  115    HD1  PHE  20           HD1      PHE  20  -3.922   0.352  -3.683
  116    HD2  PHE  20           HD2      PHE  20  -2.224  -1.847  -6.908
  117    HE1  PHE  20           HE1      PHE  20  -2.914   2.419  -4.558
  118    HE2  PHE  20           HE2      PHE  20  -1.213   0.216  -7.787
  119    HZ   PHE  20           HZ       PHE  20  -1.557   2.353  -6.612
  120    H    GLY  21           H        GLY  21  -6.158  -4.331  -6.241
  121    HA2  GLY  21           1HA      GLY  21  -7.641  -5.558  -4.210
  122    HA3  GLY  21           2HA      GLY  21  -7.038  -6.365  -5.649
  123    H    LEU  22           H        LEU  22  -4.247  -5.473  -4.695
  124    HA   LEU  22           HA       LEU  22  -3.890  -7.699  -2.801
  125    HB2  LEU  22           1HB      LEU  22  -2.326  -6.736  -5.122
  126    HB3  LEU  22           2HB      LEU  22  -1.413  -7.335  -3.739
  127    HG   LEU  22           HG       LEU  22  -3.314  -8.834  -5.517
  128   HD11  LEU  22          1HD1      LEU  22  -1.213 -10.401  -5.325
  129   HD12  LEU  22          2HD1      LEU  22  -0.405  -8.894  -4.898
  130   HD13  LEU  22          3HD1      LEU  22  -1.236  -9.040  -6.447
  131   HD21  LEU  22          3HD2      LEU  22  -2.767 -10.761  -3.896
  132   HD22  LEU  22          1HD2      LEU  22  -4.022  -9.608  -3.442
  133   HD23  LEU  22          2HD2      LEU  22  -2.412  -9.481  -2.734
  134    H    LYS  23           H        LYS  23  -1.897  -7.451  -1.400
  135    HA   LYS  23           HA       LYS  23  -2.007  -4.830  -0.140
  136    HB2  LYS  23           1HB      LYS  23  -2.233  -6.667   1.368
  137    HB3  LYS  23           2HB      LYS  23  -0.819  -7.473   0.700
  138    HG2  LYS  23           1HG      LYS  23   0.116  -6.620   2.577
  139    HG3  LYS  23           2HG      LYS  23   0.364  -5.240   1.505
  140    HD2  LYS  23           1HD      LYS  23  -1.906  -4.412   2.355
  141    HD3  LYS  23           2HD      LYS  23  -1.722  -5.614   3.634
  142    HE2  LYS  23           1HE      LYS  23   0.451  -3.634   3.050
  143    HE3  LYS  23           2HE      LYS  23  -0.921  -3.198   4.068
  144    HZ1  LYS  23           3HZ      LYS  23   1.371  -4.721   4.728
  145    HZ2  LYS  23           1HZ      LYS  23  -0.023  -5.643   4.989
  146    HZ3  LYS  23           2HZ      LYS  23   0.150  -4.140   5.745
  147    H    SER  24           H        SER  24   0.244  -6.893  -1.857
  148    HA   SER  24           HA       SER  24   2.522  -5.214  -1.320
  149    HB2  SER  24           1HB      SER  24   2.013  -7.717  -2.846
  150    HB3  SER  24           2HB      SER  24   3.394  -6.740  -3.342
  151    HG   SER  24           HG       SER  24   4.087  -6.819  -1.128
  152    H    GLN  25           H        GLN  25   0.067  -5.465  -3.760
  153    HA   GLN  25           HA       GLN  25   1.376  -4.088  -5.844
  154    HB2  GLN  25           1HB      GLN  25  -1.488  -4.648  -5.171
  155    HB3  GLN  25           2HB      GLN  25  -1.104  -3.534  -6.476
  156    HG2  GLN  25           1HG      GLN  25   0.459  -5.536  -7.223
  157    HG3  GLN  25           2HG      GLN  25  -0.725  -6.466  -6.306
  158   HE21  GLN  25          1HE2      GLN  25  -2.410  -7.156  -7.399
  159   HE22  GLN  25          2HE2      GLN  25  -3.032  -6.470  -8.857
  160    H    LEU  26           H        LEU  26  -0.354  -3.009  -3.005
  161    HA   LEU  26           HA       LEU  26  -0.489  -0.261  -3.867
  162    HB2  LEU  26           1HB      LEU  26  -2.237  -0.921  -2.454
  163    HB3  LEU  26           2HB      LEU  26  -1.139  -1.703  -1.319
  164    HG   LEU  26           HG       LEU  26  -0.296   0.586  -0.713
  165   HD11  LEU  26          1HD1      LEU  26  -1.355   1.517  -2.915
  166   HD12  LEU  26          2HD1      LEU  26  -1.296   2.511  -1.460
  167   HD13  LEU  26          3HD1      LEU  26  -2.793   1.693  -1.907
  168   HD21  LEU  26          3HD2      LEU  26  -1.632   0.008   0.985
  169   HD22  LEU  26          1HD2      LEU  26  -2.883  -0.619  -0.089
  170   HD23  LEU  26          2HD2      LEU  26  -2.801   1.109   0.256
  171    H    ILE  27           H        ILE  27   1.318  -2.049  -1.373
  172    HA   ILE  27           HA       ILE  27   2.826  -0.021  -0.306
  173    HB   ILE  27           HB       ILE  27   3.805  -2.814  -0.910
  174   HG12  ILE  27          1HG1      ILE  27   2.675  -1.829   1.701
  175   HG13  ILE  27          2HG1      ILE  27   1.635  -2.494   0.446
  176   HG21  ILE  27          1HG2      ILE  27   5.658  -2.397   0.281
  177   HG22  ILE  27          2HG2      ILE  27   5.301  -0.705  -0.061
  178   HG23  ILE  27          3HG2      ILE  27   4.794  -1.422   1.469
  179   HD11  ILE  27          3HD1      ILE  27   2.400  -4.066   2.280
  180   HD12  ILE  27          1HD1      ILE  27   2.607  -4.616   0.617
  181   HD13  ILE  27          2HD1      ILE  27   3.991  -4.001   1.521
  182    H    ILE  28           H        ILE  28   3.503  -1.883  -3.247
  183    HA   ILE  28           HA       ILE  28   5.986  -0.663  -3.821
  184    HB   ILE  28           HB       ILE  28   4.026  -1.977  -5.706
  185   HG12  ILE  28          1HG1      ILE  28   6.565  -3.189  -4.652
  186   HG13  ILE  28          2HG1      ILE  28   5.078  -3.277  -3.714
  187   HG21  ILE  28          1HG2      ILE  28   5.812  -0.394  -6.665
  188   HG22  ILE  28          2HG2      ILE  28   6.963  -1.645  -6.197
  189   HG23  ILE  28          3HG2      ILE  28   5.678  -2.014  -7.348
  190   HD11  ILE  28          3HD1      ILE  28   4.448  -5.036  -4.885
  191   HD12  ILE  28          1HD1      ILE  28   4.486  -4.077  -6.365
  192   HD13  ILE  28          2HD1      ILE  28   5.931  -4.938  -5.835
  193    H    HIS  29           H        HIS  29   2.670   0.192  -4.568
  194    HA   HIS  29           HA       HIS  29   3.261   2.179  -6.508
  195    HB2  HIS  29           1HB      HIS  29   1.057   1.516  -6.642
  196    HB3  HIS  29           2HB      HIS  29   0.867   1.419  -4.894
  197    HD1  HIS  29           HD1      HIS  29   1.157   4.053  -7.613
  198    HD2  HIS  29           HD2      HIS  29  -0.386   3.563  -3.786
  199    HE1  HIS  29           HE1      HIS  29  -0.119   6.165  -7.127
  200    H    GLN  30           H        GLN  30   2.422   2.396  -3.053
  201    HA   GLN  30           HA       GLN  30   2.483   5.098  -2.674
  202    HB2  GLN  30           1HB      GLN  30   3.305   2.807  -0.933
  203    HB3  GLN  30           2HB      GLN  30   3.564   4.453  -0.373
  204    HG2  GLN  30           1HG      GLN  30   1.068   4.787  -0.963
  205    HG3  GLN  30           2HG      GLN  30   0.999   3.026  -0.919
  206   HE21  GLN  30          1HE2      GLN  30   0.143   2.402   0.923
  207   HE22  GLN  30          2HE2      GLN  30   0.504   3.043   2.486
  208    H    ARG  31           H        ARG  31   5.132   3.036  -3.461
  209    HA   ARG  31           HA       ARG  31   7.305   4.468  -2.493
  210    HB2  ARG  31           1HB      ARG  31   7.070   2.916  -5.077
  211    HB3  ARG  31           2HB      ARG  31   8.584   3.439  -4.353
  212    HG2  ARG  31           1HG      ARG  31   7.779   2.114  -2.285
  213    HG3  ARG  31           2HG      ARG  31   6.674   1.340  -3.423
  214    HD2  ARG  31           1HD      ARG  31   8.527  -0.064  -3.438
  215    HD3  ARG  31           2HD      ARG  31   8.773   0.948  -4.860
  216    HE   ARG  31           HE       ARG  31  10.061   2.147  -2.685
  217   HH11  ARG  31          1HH1      ARG  31  10.311  -0.691  -4.685
  218   HH12  ARG  31          2HH1      ARG  31  12.027  -0.834  -4.495
  219   HH21  ARG  31          1HH2      ARG  31  12.320   1.970  -2.426
  220   HH22  ARG  31          2HH2      ARG  31  13.169   0.680  -3.209
  221    H    THR  32           H        THR  32   5.387   4.966  -5.409
  222    HA   THR  32           HA       THR  32   6.991   6.869  -6.674
  223    HB   THR  32           HB       THR  32   5.032   7.544  -7.914
  224    HG1  THR  32           HG1      THR  32   3.656   7.533  -5.937
  225   HG21  THR  32          3HG2      THR  32   5.309   5.615  -8.999
  226   HG22  THR  32          1HG2      THR  32   4.065   4.917  -7.963
  227   HG23  THR  32          2HG2      THR  32   5.765   4.784  -7.513
  228    H    HIS  33           H        HIS  33   4.567   7.222  -4.137
  229    HA   HIS  33           HA       HIS  33   4.549  10.068  -4.152
  230    HB2  HIS  33           1HB      HIS  33   3.674   8.045  -2.086
  231    HB3  HIS  33           2HB      HIS  33   3.462   9.782  -1.887
  232    HD1  HIS  33           HD1      HIS  33   2.110  10.876  -4.104
  233    HD2  HIS  33           HD2      HIS  33   1.486   6.883  -3.143
  234    HE1  HIS  33           HE1      HIS  33  -0.064  10.252  -5.204
  235    H    THR  34           H        THR  34   6.069   7.685  -1.986
  236    HA   THR  34           HA       THR  34   7.537   9.715  -0.573
  237    HB   THR  34           HB       THR  34   8.676   7.762   0.524
  238    HG1  THR  34           HG1      THR  34   8.217   6.366  -1.400
  239   HG21  THR  34          3HG2      THR  34   5.873   7.026   0.848
  240   HG22  THR  34          1HG2      THR  34   6.137   8.769   0.902
  241   HG23  THR  34          2HG2      THR  34   7.004   7.710   2.015
  242    H    GLY  35           H        GLY  35   8.786  10.745  -2.164
  243    HA2  GLY  35           1HA      GLY  35  11.360   9.636  -2.579
  244    HA3  GLY  35           2HA      GLY  35  10.417   9.523  -4.057
  245    H    GLU  36           H        GLU  36  10.195  11.286  -5.327
  246    HA   GLU  36           HA       GLU  36  10.617  13.947  -4.328
  247    HB2  GLU  36           1HB      GLU  36  12.944  12.978  -4.656
  248    HB3  GLU  36           2HB      GLU  36  12.587  12.940  -6.377
  249    HG2  GLU  36           1HG      GLU  36  12.042  15.445  -6.085
  250    HG3  GLU  36           2HG      GLU  36  12.947  15.298  -4.580
  251    H    SER  37           H        SER  37   9.946  15.544  -5.770
  252    HA   SER  37           HA       SER  37   8.568  16.393  -7.376
  253    HB2  SER  37           1HB      SER  37   9.188  15.927  -9.643
  254    HB3  SER  37           2HB      SER  37  10.665  15.852  -8.682
  255    HG   SER  37           HG       SER  37  10.863  13.961  -9.582
  256    H    GLY  38           H        GLY  38   7.239  14.611  -5.817
  257    HA2  GLY  38           1HA      GLY  38   5.870  12.679  -7.498
  258    HA3  GLY  38           2HA      GLY  38   5.598  12.950  -5.784
  259    HA   PRO  39           HA       PRO  39   2.108  14.782  -8.333
  260    HB2  PRO  39           1HB      PRO  39   0.123  13.319  -7.198
  261    HB3  PRO  39           2HB      PRO  39   1.026  12.776  -8.617
  262    HG2  PRO  39           1HG      PRO  39   1.385  12.026  -5.741
  263    HG3  PRO  39           2HG      PRO  39   1.414  10.989  -7.180
  264    HD2  PRO  39           1HD      PRO  39   3.672  11.838  -5.949
  265    HD3  PRO  39           2HD      PRO  39   3.586  11.560  -7.700
  266    H    SER  40           H        SER  40   3.270  14.771  -5.253
  267    HA   SER  40           HA       SER  40   1.477  15.527  -3.433
  268    HB2  SER  40           1HB      SER  40   4.016  17.053  -4.059
  269    HB3  SER  40           2HB      SER  40   3.108  17.182  -2.553
  270    HG   SER  40           HG       SER  40   4.053  15.433  -1.901
  271    H    SER  41           H        SER  41   2.747  17.810  -5.859
  272    HA   SER  41           HA       SER  41   1.363  20.066  -5.266
  273    HB2  SER  41           1HB      SER  41   2.974  19.664  -7.207
  274    HB3  SER  41           2HB      SER  41   1.576  19.084  -8.113
  275    HG   SER  41           HG       SER  41   2.299  21.495  -8.064
  276    H    GLY  42           H        GLY  42   0.137  17.539  -7.474
  277    HA2  GLY  42           1HA      GLY  42  -2.346  18.494  -8.040
  278    HA3  GLY  42           2HA      GLY  42  -2.020  16.784  -7.797
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1 -16.705   1.062 -18.785
    2    HA2  GLY   1           1HA      GLY   1 -17.111  -1.018 -19.897
    3    HA3  GLY   1           2HA      GLY   1 -15.442  -1.008 -20.449
    4    H    SER   2           H        SER   2 -17.490  -2.547 -18.452
    5    HA   SER   2           HA       SER   2 -15.490  -3.037 -16.358
    6    HB2  SER   2           1HB      SER   2 -18.433  -3.748 -16.444
    7    HB3  SER   2           2HB      SER   2 -17.345  -4.068 -15.093
    8    HG   SER   2           HG       SER   2 -17.935  -2.152 -14.465
    9    H    SER   3           H        SER   3 -15.304  -5.306 -15.583
   10    HA   SER   3           HA       SER   3 -15.421  -7.174 -17.860
   11    HB2  SER   3           1HB      SER   3 -13.134  -6.418 -16.882
   12    HB3  SER   3           2HB      SER   3 -13.528  -7.500 -15.546
   13    HG   SER   3           HG       SER   3 -13.445  -8.238 -18.287
   14    H    GLY   4           H        GLY   4 -15.330  -9.545 -17.042
   15    HA2  GLY   4           1HA      GLY   4 -17.695 -10.266 -15.907
   16    HA3  GLY   4           2HA      GLY   4 -16.250 -11.260 -15.802
   17    H    SER   5           H        SER   5 -14.627 -10.117 -14.091
   18    HA   SER   5           HA       SER   5 -16.206  -9.973 -11.615
   19    HB2  SER   5           1HB      SER   5 -14.152 -10.692 -10.463
   20    HB3  SER   5           2HB      SER   5 -14.608 -11.836 -11.725
   21    HG   SER   5           HG       SER   5 -12.294 -10.958 -11.510
   22    H    SER   6           H        SER   6 -16.211  -8.177 -10.421
   23    HA   SER   6           HA       SER   6 -15.090  -5.776 -11.382
   24    HB2  SER   6           1HB      SER   6 -16.403  -6.557  -8.789
   25    HB3  SER   6           2HB      SER   6 -15.733  -4.942  -9.019
   26    HG   SER   6           HG       SER   6 -17.327  -4.463 -10.318
   27    H    GLY   7           H        GLY   7 -14.164  -7.906  -8.693
   28    HA2  GLY   7           1HA      GLY   7 -12.073  -8.263  -7.774
   29    HA3  GLY   7           2HA      GLY   7 -11.403  -7.169  -8.974
   30    H    GLU   8           H        GLU   8 -13.387  -7.140  -6.019
   31    HA   GLU   8           HA       GLU   8 -13.099  -4.446  -5.395
   32    HB2  GLU   8           1HB      GLU   8 -13.576  -5.129  -3.052
   33    HB3  GLU   8           2HB      GLU   8 -14.695  -5.815  -4.221
   34    HG2  GLU   8           1HG      GLU   8 -13.555  -7.939  -4.128
   35    HG3  GLU   8           2HG      GLU   8 -12.333  -7.266  -3.050
   36    H    LYS   9           H        LYS   9 -11.713  -3.322  -3.986
   37    HA   LYS   9           HA       LYS   9  -9.140  -4.647  -3.439
   38    HB2  LYS   9           1HB      LYS   9  -9.442  -1.757  -4.260
   39    HB3  LYS   9           2HB      LYS   9  -7.946  -2.660  -4.062
   40    HG2  LYS   9           1HG      LYS   9  -8.181  -3.759  -6.055
   41    HG3  LYS   9           2HG      LYS   9  -9.941  -3.620  -6.050
   42    HD2  LYS   9           1HD      LYS   9  -9.727  -1.207  -6.498
   43    HD3  LYS   9           2HD      LYS   9  -7.972  -1.387  -6.555
   44    HE2  LYS   9           1HE      LYS   9  -9.947  -2.753  -8.382
   45    HE3  LYS   9           2HE      LYS   9  -8.960  -1.353  -8.798
   46    HZ1  LYS   9           3HZ      LYS   9  -7.533  -2.880  -9.551
   47    HZ2  LYS   9           1HZ      LYS   9  -8.235  -4.141  -8.667
   48    HZ3  LYS   9           2HZ      LYS   9  -7.119  -3.108  -7.926
   49    HA   PRO  10           HA       PRO  10 -10.580  -3.152   0.600
   50    HB2  PRO  10           1HB      PRO  10  -9.050  -4.890   2.018
   51    HB3  PRO  10           2HB      PRO  10 -10.608  -5.336   1.313
   52    HG2  PRO  10           1HG      PRO  10  -7.846  -5.848   0.279
   53    HG3  PRO  10           2HG      PRO  10  -9.243  -6.939   0.325
   54    HD2  PRO  10           1HD      PRO  10  -8.496  -5.623  -1.921
   55    HD3  PRO  10           2HD      PRO  10 -10.191  -6.008  -1.559
   56    H    TYR  11           H        TYR  11  -7.600  -3.082  -0.999
   57    HA   TYR  11           HA       TYR  11  -6.309  -1.612   1.196
   58    HB2  TYR  11           1HB      TYR  11  -5.036  -2.716  -1.315
   59    HB3  TYR  11           2HB      TYR  11  -4.202  -2.024   0.071
   60    HD1  TYR  11           HD1      TYR  11  -6.202  -4.908  -1.084
   61    HD2  TYR  11           HD2      TYR  11  -3.730  -3.333   2.000
   62    HE1  TYR  11           HE1      TYR  11  -6.060  -7.142  -0.065
   63    HE2  TYR  11           HE2      TYR  11  -3.580  -5.563   3.026
   64    HH   TYR  11           HH       TYR  11  -3.882  -7.831   2.556
   65    H    GLU  12           H        GLU  12  -6.077   0.520   1.060
   66    HA   GLU  12           HA       GLU  12  -6.296   1.793  -1.586
   67    HB2  GLU  12           1HB      GLU  12  -7.765   2.368   0.937
   68    HB3  GLU  12           2HB      GLU  12  -7.285   3.740  -0.052
   69    HG2  GLU  12           1HG      GLU  12  -9.400   3.285  -0.832
   70    HG3  GLU  12           2HG      GLU  12  -8.382   2.428  -1.987
   71    H    CYS  13           H        CYS  13  -5.095   3.692  -1.903
   72    HA   CYS  13           HA       CYS  13  -2.688   3.827  -0.307
   73    HB2  CYS  13           1HB      CYS  13  -2.748   3.978  -2.837
   74    HB3  CYS  13           2HB      CYS  13  -3.439   5.586  -2.644
   75    H    THR  14           H        THR  14  -2.367   5.165   1.335
   76    HA   THR  14           HA       THR  14  -4.333   7.206   1.942
   77    HB   THR  14           HB       THR  14  -3.023   7.523   4.032
   78    HG1  THR  14           HG1      THR  14  -1.114   6.358   2.667
   79   HG21  THR  14          3HG2      THR  14  -4.409   5.962   4.806
   80   HG22  THR  14          1HG2      THR  14  -3.234   4.727   4.356
   81   HG23  THR  14          2HG2      THR  14  -4.491   5.206   3.216
   82    H    ASP  15           H        ASP  15  -2.424   7.481  -0.348
   83    HA   ASP  15           HA       ASP  15  -1.189  10.029   0.475
   84    HB2  ASP  15           1HB      ASP  15  -0.162   7.802  -1.208
   85    HB3  ASP  15           2HB      ASP  15   0.250   9.441  -1.704
   86    H    CYS  16           H        CYS  16  -2.870   8.273  -2.078
   87    HA   CYS  16           HA       CYS  16  -3.661  10.865  -3.233
   88    HB2  CYS  16           1HB      CYS  16  -3.683   9.788  -5.460
   89    HB3  CYS  16           2HB      CYS  16  -2.075   9.804  -4.743
   90    H    GLY  17           H        GLY  17  -4.521   7.540  -2.508
   91    HA2  GLY  17           1HA      GLY  17  -6.769   7.153  -1.640
   92    HA3  GLY  17           2HA      GLY  17  -7.356   8.294  -2.840
   93    H    LYS  18           H        LYS  18  -4.907   6.098  -3.836
   94    HA   LYS  18           HA       LYS  18  -6.631   4.932  -5.795
   95    HB2  LYS  18           1HB      LYS  18  -3.754   4.726  -5.069
   96    HB3  LYS  18           2HB      LYS  18  -4.451   3.395  -5.983
   97    HG2  LYS  18           1HG      LYS  18  -5.167   4.963  -7.718
   98    HG3  LYS  18           2HG      LYS  18  -4.457   6.294  -6.801
   99    HD2  LYS  18           1HD      LYS  18  -2.256   5.110  -6.951
  100    HD3  LYS  18           2HD      LYS  18  -3.019   3.953  -8.044
  101    HE2  LYS  18           1HE      LYS  18  -1.991   5.511  -9.458
  102    HE3  LYS  18           2HE      LYS  18  -3.689   5.982  -9.442
  103    HZ1  LYS  18           3HZ      LYS  18  -2.568   7.969  -9.151
  104    HZ2  LYS  18           1HZ      LYS  18  -1.398   7.297  -8.130
  105    HZ3  LYS  18           2HZ      LYS  18  -2.972   7.548  -7.564
  106    H    ALA  19           H        ALA  19  -6.461   2.434  -6.092
  107    HA   ALA  19           HA       ALA  19  -6.775   1.069  -3.512
  108    HB1  ALA  19           3HB      ALA  19  -8.980   0.979  -3.772
  109    HB2  ALA  19           1HB      ALA  19  -8.879   1.654  -5.399
  110    HB3  ALA  19           2HB      ALA  19  -8.704  -0.084  -5.153
  111    H    PHE  20           H        PHE  20  -6.225  -1.096  -3.499
  112    HA   PHE  20           HA       PHE  20  -5.404  -2.336  -6.014
  113    HB2  PHE  20           1HB      PHE  20  -3.582  -2.182  -3.604
  114    HB3  PHE  20           2HB      PHE  20  -3.230  -2.989  -5.129
  115    HD1  PHE  20           HD1      PHE  20  -3.941   0.334  -3.644
  116    HD2  PHE  20           HD2      PHE  20  -2.222  -1.831  -6.879
  117    HE1  PHE  20           HE1      PHE  20  -2.961   2.417  -4.512
  118    HE2  PHE  20           HE2      PHE  20  -1.238   0.248  -7.753
  119    HZ   PHE  20           HZ       PHE  20  -1.606   2.376  -6.569
  120    H    GLY  21           H        GLY  21  -5.969  -4.421  -6.117
  121    HA2  GLY  21           1HA      GLY  21  -7.487  -5.620  -4.057
  122    HA3  GLY  21           2HA      GLY  21  -6.897  -6.429  -5.501
  123    H    LEU  22           H        LEU  22  -4.105  -5.482  -4.582
  124    HA   LEU  22           HA       LEU  22  -3.703  -7.640  -2.616
  125    HB2  LEU  22           1HB      LEU  22  -2.227  -6.878  -5.071
  126    HB3  LEU  22           2HB      LEU  22  -1.274  -7.438  -3.699
  127    HG   LEU  22           HG       LEU  22  -3.324  -8.951  -5.293
  128   HD11  LEU  22          1HD1      LEU  22  -1.241 -10.581  -5.073
  129   HD12  LEU  22          2HD1      LEU  22  -0.391  -9.049  -4.875
  130   HD13  LEU  22          3HD1      LEU  22  -1.342  -9.348  -6.330
  131   HD21  LEU  22          3HD2      LEU  22  -3.978  -9.761  -3.277
  132   HD22  LEU  22          1HD2      LEU  22  -2.459  -9.338  -2.487
  133   HD23  LEU  22          2HD2      LEU  22  -2.552 -10.774  -3.507
  134    H    LYS  23           H        LYS  23  -1.856  -7.366  -1.169
  135    HA   LYS  23           HA       LYS  23  -1.748  -4.660  -0.159
  136    HB2  LYS  23           1HB      LYS  23  -1.975  -6.378   1.481
  137    HB3  LYS  23           2HB      LYS  23  -0.617  -7.280   0.821
  138    HG2  LYS  23           1HG      LYS  23   0.333  -6.322   2.672
  139    HG3  LYS  23           2HG      LYS  23   0.737  -5.135   1.429
  140    HD2  LYS  23           1HD      LYS  23  -1.054  -3.706   2.117
  141    HD3  LYS  23           2HD      LYS  23  -1.689  -4.940   3.208
  142    HE2  LYS  23           1HE      LYS  23  -0.513  -3.312   4.514
  143    HE3  LYS  23           2HE      LYS  23   0.434  -4.798   4.499
  144    HZ1  LYS  23           3HZ      LYS  23   2.085  -3.842   3.325
  145    HZ2  LYS  23           1HZ      LYS  23   1.472  -2.416   3.998
  146    HZ3  LYS  23           2HZ      LYS  23   1.048  -2.857   2.422
  147    H    SER  24           H        SER  24   0.292  -6.833  -1.950
  148    HA   SER  24           HA       SER  24   2.697  -5.296  -1.541
  149    HB2  SER  24           1HB      SER  24   3.003  -7.640  -1.892
  150    HB3  SER  24           2HB      SER  24   2.017  -7.616  -3.354
  151    HG   SER  24           HG       SER  24   4.533  -6.346  -3.001
  152    H    GLN  25           H        GLN  25   0.110  -5.435  -3.864
  153    HA   GLN  25           HA       GLN  25   1.421  -4.039  -5.960
  154    HB2  GLN  25           1HB      GLN  25  -1.442  -4.651  -5.311
  155    HB3  GLN  25           2HB      GLN  25  -1.051  -3.548  -6.623
  156    HG2  GLN  25           1HG      GLN  25   0.543  -5.543  -7.324
  157    HG3  GLN  25           2HG      GLN  25  -0.645  -6.474  -6.413
  158   HE21  GLN  25          1HE2      GLN  25  -1.812  -7.471  -7.914
  159   HE22  GLN  25          2HE2      GLN  25  -2.612  -6.700  -9.237
  160    H    LEU  26           H        LEU  26  -0.251  -3.053  -3.073
  161    HA   LEU  26           HA       LEU  26  -0.553  -0.308  -3.887
  162    HB2  LEU  26           1HB      LEU  26  -2.177  -1.077  -2.376
  163    HB3  LEU  26           2HB      LEU  26  -0.967  -1.794  -1.313
  164    HG   LEU  26           HG       LEU  26  -0.230   0.504  -0.703
  165   HD11  LEU  26          1HD1      LEU  26  -1.760   1.237  -2.917
  166   HD12  LEU  26          2HD1      LEU  26  -0.963   2.308  -1.765
  167   HD13  LEU  26          3HD1      LEU  26  -2.645   1.840  -1.515
  168   HD21  LEU  26          3HD2      LEU  26  -1.727   0.600   0.990
  169   HD22  LEU  26          1HD2      LEU  26  -2.209  -0.969   0.343
  170   HD23  LEU  26          2HD2      LEU  26  -3.120   0.479  -0.087
  171    H    ILE  27           H        ILE  27   1.492  -2.035  -1.540
  172    HA   ILE  27           HA       ILE  27   2.965   0.053  -0.541
  173    HB   ILE  27           HB       ILE  27   3.994  -2.703  -1.228
  174   HG12  ILE  27          1HG1      ILE  27   3.051  -1.694   1.453
  175   HG13  ILE  27          2HG1      ILE  27   1.963  -2.475   0.311
  176   HG21  ILE  27          1HG2      ILE  27   5.161  -1.234   1.030
  177   HG22  ILE  27          2HG2      ILE  27   5.934  -2.242  -0.192
  178   HG23  ILE  27          3HG2      ILE  27   5.524  -0.568  -0.562
  179   HD11  ILE  27          3HD1      ILE  27   4.108  -3.620   1.982
  180   HD12  ILE  27          1HD1      ILE  27   2.546  -4.291   1.515
  181   HD13  ILE  27          2HD1      ILE  27   3.891  -4.312   0.375
  182    H    ILE  28           H        ILE  28   3.750  -1.879  -3.432
  183    HA   ILE  28           HA       ILE  28   6.071  -0.560  -4.183
  184    HB   ILE  28           HB       ILE  28   3.974  -1.810  -5.960
  185   HG12  ILE  28          1HG1      ILE  28   6.625  -2.995  -5.177
  186   HG13  ILE  28          2HG1      ILE  28   5.211  -3.182  -4.146
  187   HG21  ILE  28          1HG2      ILE  28   5.377  -0.272  -7.226
  188   HG22  ILE  28          2HG2      ILE  28   6.824  -1.053  -6.590
  189   HG23  ILE  28          3HG2      ILE  28   5.736  -1.945  -7.654
  190   HD11  ILE  28          3HD1      ILE  28   5.935  -4.875  -6.142
  191   HD12  ILE  28          1HD1      ILE  28   4.309  -4.729  -5.475
  192   HD13  ILE  28          2HD1      ILE  28   4.740  -3.858  -6.947
  193    H    HIS  29           H        HIS  29   2.712   0.316  -4.723
  194    HA   HIS  29           HA       HIS  29   3.216   2.407  -6.577
  195    HB2  HIS  29           1HB      HIS  29   1.014   1.658  -6.628
  196    HB3  HIS  29           2HB      HIS  29   0.883   1.611  -4.872
  197    HD1  HIS  29           HD1      HIS  29   1.221   4.239  -7.605
  198    HD2  HIS  29           HD2      HIS  29  -0.476   3.713  -3.849
  199    HE1  HIS  29           HE1      HIS  29  -0.075   6.345  -7.152
  200    H    GLN  30           H        GLN  30   2.479   2.446  -3.091
  201    HA   GLN  30           HA       GLN  30   2.548   5.122  -2.575
  202    HB2  GLN  30           1HB      GLN  30   3.526   2.785  -0.958
  203    HB3  GLN  30           2HB      GLN  30   3.625   4.425  -0.332
  204    HG2  GLN  30           1HG      GLN  30   1.269   4.682  -0.387
  205    HG3  GLN  30           2HG      GLN  30   1.066   3.190  -1.304
  206   HE21  GLN  30          1HE2      GLN  30  -0.479   2.936   0.577
  207   HE22  GLN  30          2HE2      GLN  30   0.138   2.130   1.976
  208    H    ARG  31           H        ARG  31   5.180   3.117  -3.546
  209    HA   ARG  31           HA       ARG  31   7.381   4.493  -2.578
  210    HB2  ARG  31           1HB      ARG  31   7.055   3.121  -5.253
  211    HB3  ARG  31           2HB      ARG  31   8.594   3.595  -4.546
  212    HG2  ARG  31           1HG      ARG  31   7.869   2.128  -2.551
  213    HG3  ARG  31           2HG      ARG  31   6.711   1.438  -3.691
  214    HD2  ARG  31           1HD      ARG  31   8.650   0.065  -3.746
  215    HD3  ARG  31           2HD      ARG  31   8.637   1.006  -5.237
  216    HE   ARG  31           HE       ARG  31  10.572   2.031  -4.566
  217   HH11  ARG  31          1HH1      ARG  31   9.125   0.419  -1.840
  218   HH12  ARG  31          2HH1      ARG  31  10.483   0.683  -0.797
  219   HH21  ARG  31          1HH2      ARG  31  12.366   2.384  -3.202
  220   HH22  ARG  31          2HH2      ARG  31  12.326   1.802  -1.573
  221    H    THR  32           H        THR  32   5.350   5.187  -5.373
  222    HA   THR  32           HA       THR  32   6.929   7.203  -6.525
  223    HB   THR  32           HB       THR  32   4.953   7.901  -7.727
  224    HG1  THR  32           HG1      THR  32   3.572   7.703  -5.760
  225   HG21  THR  32          3HG2      THR  32   5.947   5.824  -8.482
  226   HG22  THR  32          1HG2      THR  32   4.194   5.729  -8.642
  227   HG23  THR  32          2HG2      THR  32   5.004   4.911  -7.305
  228    H    HIS  33           H        HIS  33   4.783   7.219  -3.791
  229    HA   HIS  33           HA       HIS  33   4.607  10.100  -3.663
  230    HB2  HIS  33           1HB      HIS  33   3.719   7.924  -1.763
  231    HB3  HIS  33           2HB      HIS  33   3.461   9.642  -1.472
  232    HD1  HIS  33           HD1      HIS  33   2.218  10.790  -3.784
  233    HD2  HIS  33           HD2      HIS  33   1.504   6.815  -2.811
  234    HE1  HIS  33           HE1      HIS  33   0.066  10.191  -4.940
  235    H    THR  34           H        THR  34   5.850   7.652  -1.382
  236    HA   THR  34           HA       THR  34   7.157   9.184   0.409
  237    HB   THR  34           HB       THR  34   8.900   7.371   0.579
  238    HG1  THR  34           HG1      THR  34   8.927   5.779  -0.878
  239   HG21  THR  34          3HG2      THR  34   7.071   7.022   1.969
  240   HG22  THR  34          1HG2      THR  34   7.108   5.540   1.015
  241   HG23  THR  34          2HG2      THR  34   5.956   6.815   0.618
  242    H    GLY  35           H        GLY  35   8.408   8.288  -2.789
  243    HA2  GLY  35           1HA      GLY  35   9.682  10.561  -3.477
  244    HA3  GLY  35           2HA      GLY  35  10.839   9.810  -2.388
  245    H    GLU  36           H        GLU  36  12.415   8.903  -3.520
  246    HA   GLU  36           HA       GLU  36  13.538   7.722  -5.108
  247    HB2  GLU  36           1HB      GLU  36  11.973   5.954  -4.168
  248    HB3  GLU  36           2HB      GLU  36  10.949   6.244  -5.567
  249    HG2  GLU  36           1HG      GLU  36  12.507   4.290  -5.743
  250    HG3  GLU  36           2HG      GLU  36  12.595   5.457  -7.061
  251    H    SER  37           H        SER  37  12.412  10.156  -5.949
  252    HA   SER  37           HA       SER  37  11.200   9.742  -8.543
  253    HB2  SER  37           1HB      SER  37  10.427  11.655  -7.333
  254    HB3  SER  37           2HB      SER  37  12.073  12.222  -7.053
  255    HG   SER  37           HG       SER  37  11.238  11.878  -9.695
  256    H    GLY  38           H        GLY  38  14.164  11.400  -7.430
  257    HA2  GLY  38           1HA      GLY  38  15.687  10.217  -9.585
  258    HA3  GLY  38           2HA      GLY  38  15.413  11.944  -9.762
  259    HA   PRO  39           HA       PRO  39  18.955  10.790  -6.707
  260    HB2  PRO  39           1HB      PRO  39  21.077  10.633  -8.394
  261    HB3  PRO  39           2HB      PRO  39  20.113   9.226  -7.928
  262    HG2  PRO  39           1HG      PRO  39  19.972  10.876 -10.422
  263    HG3  PRO  39           2HG      PRO  39  19.902   9.113 -10.241
  264    HD2  PRO  39           1HD      PRO  39  17.688  10.630 -10.602
  265    HD3  PRO  39           2HD      PRO  39  17.677   9.138  -9.641
  266    H    SER  40           H        SER  40  19.780  12.551  -5.772
  267    HA   SER  40           HA       SER  40  20.282  14.918  -7.452
  268    HB2  SER  40           1HB      SER  40  18.539  15.467  -5.947
  269    HB3  SER  40           2HB      SER  40  19.337  14.655  -4.600
  270    HG   SER  40           HG       SER  40  19.935  16.653  -4.199
  271    H    SER  41           H        SER  41  22.430  14.292  -7.921
  272    HA   SER  41           HA       SER  41  24.416  13.445  -6.272
  273    HB2  SER  41           1HB      SER  41  24.890  13.724  -8.596
  274    HB3  SER  41           2HB      SER  41  24.555  15.454  -8.525
  275    HG   SER  41           HG       SER  41  26.759  14.039  -7.465
  276    H    GLY  42           H        GLY  42  24.614  14.149  -4.218
  277    HA2  GLY  42           1HA      GLY  42  25.929  15.752  -2.914
  278    HA3  GLY  42           2HA      GLY  42  25.170  17.028  -3.854
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1 -11.116  -1.528 -21.214
    2    HA2  GLY   1           1HA      GLY   1 -10.012  -1.524 -18.846
    3    HA3  GLY   1           2HA      GLY   1 -10.538   0.153 -18.880
    4    H    SER   2           H        SER   2 -12.027  -2.945 -19.830
    5    HA   SER   2           HA       SER   2 -14.414  -2.141 -18.309
    6    HB2  SER   2           1HB      SER   2 -14.014  -3.679 -20.829
    7    HB3  SER   2           2HB      SER   2 -15.368  -4.142 -19.798
    8    HG   SER   2           HG       SER   2 -14.905  -1.458 -20.555
    9    H    SER   3           H        SER   3 -12.775  -5.158 -19.284
   10    HA   SER   3           HA       SER   3 -13.800  -6.536 -16.964
   11    HB2  SER   3           1HB      SER   3 -13.465  -7.579 -19.265
   12    HB3  SER   3           2HB      SER   3 -11.738  -7.575 -18.910
   13    HG   SER   3           HG       SER   3 -12.264  -9.469 -18.097
   14    H    GLY   4           H        GLY   4 -12.528  -7.493 -15.318
   15    HA2  GLY   4           1HA      GLY   4 -10.666  -7.748 -13.948
   16    HA3  GLY   4           2HA      GLY   4  -9.723  -6.821 -15.105
   17    H    SER   5           H        SER   5 -10.024  -4.471 -15.113
   18    HA   SER   5           HA       SER   5  -9.631  -3.313 -12.650
   19    HB2  SER   5           1HB      SER   5  -9.902  -1.178 -13.721
   20    HB3  SER   5           2HB      SER   5  -9.168  -2.270 -14.896
   21    HG   SER   5           HG       SER   5 -11.929  -1.623 -14.735
   22    H    SER   6           H        SER   6 -11.105  -1.381 -11.872
   23    HA   SER   6           HA       SER   6 -12.958  -0.807 -10.683
   24    HB2  SER   6           1HB      SER   6 -14.309  -2.192 -13.010
   25    HB3  SER   6           2HB      SER   6 -15.164  -1.246 -11.792
   26    HG   SER   6           HG       SER   6 -13.046  -0.229 -13.381
   27    H    GLY   7           H        GLY   7 -11.650  -3.114  -9.815
   28    HA2  GLY   7           1HA      GLY   7 -13.840  -4.941  -9.080
   29    HA3  GLY   7           2HA      GLY   7 -12.127  -5.327  -9.008
   30    H    GLU   8           H        GLU   8 -13.199  -6.047  -6.825
   31    HA   GLU   8           HA       GLU   8 -13.422  -3.888  -4.901
   32    HB2  GLU   8           1HB      GLU   8 -13.606  -6.887  -4.570
   33    HB3  GLU   8           2HB      GLU   8 -13.875  -5.722  -3.282
   34    HG2  GLU   8           1HG      GLU   8 -15.819  -4.874  -4.329
   35    HG3  GLU   8           2HG      GLU   8 -15.471  -5.737  -5.825
   36    H    LYS   9           H        LYS   9 -11.718  -3.056  -3.914
   37    HA   LYS   9           HA       LYS   9  -9.418  -4.805  -3.346
   38    HB2  LYS   9           1HB      LYS   9  -9.242  -1.893  -4.132
   39    HB3  LYS   9           2HB      LYS   9  -7.897  -2.984  -3.829
   40    HG2  LYS   9           1HG      LYS   9  -8.313  -4.208  -5.799
   41    HG3  LYS   9           2HG      LYS   9  -9.900  -3.465  -6.014
   42    HD2  LYS   9           1HD      LYS   9  -8.984  -1.426  -6.693
   43    HD3  LYS   9           2HD      LYS   9  -7.400  -1.806  -6.013
   44    HE2  LYS   9           1HE      LYS   9  -6.959  -2.174  -8.220
   45    HE3  LYS   9           2HE      LYS   9  -7.523  -3.781  -7.768
   46    HZ1  LYS   9           3HZ      LYS   9  -8.519  -2.906  -9.842
   47    HZ2  LYS   9           1HZ      LYS   9  -9.264  -1.684  -8.941
   48    HZ3  LYS   9           2HZ      LYS   9  -9.665  -3.303  -8.663
   49    HA   PRO  10           HA       PRO  10 -10.515  -3.342   0.754
   50    HB2  PRO  10           1HB      PRO  10  -8.835  -5.028   2.060
   51    HB3  PRO  10           2HB      PRO  10 -10.404  -5.537   1.425
   52    HG2  PRO  10           1HG      PRO  10  -7.676  -5.896   0.245
   53    HG3  PRO  10           2HG      PRO  10  -9.016  -7.054   0.339
   54    HD2  PRO  10           1HD      PRO  10  -8.446  -5.665  -1.914
   55    HD3  PRO  10           2HD      PRO  10 -10.100  -6.138  -1.477
   56    H    TYR  11           H        TYR  11  -7.564  -3.195  -0.946
   57    HA   TYR  11           HA       TYR  11  -6.291  -1.624   1.189
   58    HB2  TYR  11           1HB      TYR  11  -5.005  -2.728  -1.314
   59    HB3  TYR  11           2HB      TYR  11  -4.187  -2.011   0.071
   60    HD1  TYR  11           HD1      TYR  11  -6.019  -4.968  -1.137
   61    HD2  TYR  11           HD2      TYR  11  -3.778  -3.283   2.064
   62    HE1  TYR  11           HE1      TYR  11  -5.820  -7.195  -0.112
   63    HE2  TYR  11           HE2      TYR  11  -3.572  -5.505   3.097
   64    HH   TYR  11           HH       TYR  11  -5.350  -8.249   1.925
   65    H    GLU  12           H        GLU  12  -6.090   0.509   0.985
   66    HA   GLU  12           HA       GLU  12  -6.296   1.708  -1.689
   67    HB2  GLU  12           1HB      GLU  12  -7.998   2.225   0.697
   68    HB3  GLU  12           2HB      GLU  12  -7.547   3.606  -0.294
   69    HG2  GLU  12           1HG      GLU  12  -9.487   3.030  -1.315
   70    HG3  GLU  12           2HG      GLU  12  -8.367   2.034  -2.244
   71    H    CYS  13           H        CYS  13  -5.010   3.462  -2.051
   72    HA   CYS  13           HA       CYS  13  -2.847   3.890  -0.218
   73    HB2  CYS  13           1HB      CYS  13  -2.390   3.913  -2.592
   74    HB3  CYS  13           2HB      CYS  13  -3.553   5.210  -2.845
   75    H    THR  14           H        THR  14  -2.876   5.240   1.440
   76    HA   THR  14           HA       THR  14  -4.976   7.136   1.825
   77    HB   THR  14           HB       THR  14  -3.682   7.803   3.861
   78    HG1  THR  14           HG1      THR  14  -1.638   6.931   2.652
   79   HG21  THR  14          3HG2      THR  14  -5.303   5.792   3.648
   80   HG22  THR  14          1HG2      THR  14  -4.277   5.908   5.077
   81   HG23  THR  14          2HG2      THR  14  -3.843   4.811   3.766
   82    H    ASP  15           H        ASP  15  -1.922   7.245   0.300
   83    HA   ASP  15           HA       ASP  15  -1.267   9.966   0.701
   84    HB2  ASP  15           1HB      ASP  15   0.122   7.957  -0.304
   85    HB3  ASP  15           2HB      ASP  15  -0.520   8.560  -1.829
   86    H    CYS  16           H        CYS  16  -2.794   8.331  -2.077
   87    HA   CYS  16           HA       CYS  16  -3.909  10.940  -2.874
   88    HB2  CYS  16           1HB      CYS  16  -4.050   9.992  -5.166
   89    HB3  CYS  16           2HB      CYS  16  -2.398  10.082  -4.563
   90    H    GLY  17           H        GLY  17  -4.584   7.470  -2.619
   91    HA2  GLY  17           1HA      GLY  17  -6.788   7.006  -1.519
   92    HA3  GLY  17           2HA      GLY  17  -7.465   8.123  -2.694
   93    H    LYS  18           H        LYS  18  -4.941   6.159  -3.875
   94    HA   LYS  18           HA       LYS  18  -6.610   4.916  -5.793
   95    HB2  LYS  18           1HB      LYS  18  -4.016   5.425  -5.776
   96    HB3  LYS  18           2HB      LYS  18  -3.922   3.793  -5.127
   97    HG2  LYS  18           1HG      LYS  18  -4.592   2.827  -7.077
   98    HG3  LYS  18           2HG      LYS  18  -5.547   4.226  -7.573
   99    HD2  LYS  18           1HD      LYS  18  -2.596   4.541  -7.382
  100    HD3  LYS  18           2HD      LYS  18  -3.246   3.618  -8.739
  101    HE2  LYS  18           1HE      LYS  18  -4.340   6.319  -8.036
  102    HE3  LYS  18           2HE      LYS  18  -2.887   6.157  -9.021
  103    HZ1  LYS  18           3HZ      LYS  18  -4.061   5.096 -10.709
  104    HZ2  LYS  18           1HZ      LYS  18  -5.113   6.325 -10.213
  105    HZ3  LYS  18           2HZ      LYS  18  -5.380   4.732  -9.714
  106    H    ALA  19           H        ALA  19  -6.218   2.383  -6.095
  107    HA   ALA  19           HA       ALA  19  -6.659   1.023  -3.532
  108    HB1  ALA  19           3HB      ALA  19  -8.859   1.030  -4.014
  109    HB2  ALA  19           1HB      ALA  19  -8.590   1.323  -5.733
  110    HB3  ALA  19           2HB      ALA  19  -8.427  -0.308  -5.079
  111    H    PHE  20           H        PHE  20  -6.342  -1.287  -3.618
  112    HA   PHE  20           HA       PHE  20  -5.168  -2.434  -5.998
  113    HB2  PHE  20           1HB      PHE  20  -3.511  -2.174  -3.480
  114    HB3  PHE  20           2HB      PHE  20  -3.035  -3.011  -4.954
  115    HD1  PHE  20           HD1      PHE  20  -3.591   0.254  -3.393
  116    HD2  PHE  20           HD2      PHE  20  -2.307  -1.797  -6.895
  117    HE1  PHE  20           HE1      PHE  20  -2.622   2.344  -4.259
  118    HE2  PHE  20           HE2      PHE  20  -1.336   0.289  -7.765
  119    HZ   PHE  20           HZ       PHE  20  -1.492   2.363  -6.446
  120    H    GLY  21           H        GLY  21  -6.239  -4.294  -6.110
  121    HA2  GLY  21           1HA      GLY  21  -7.581  -5.592  -4.072
  122    HA3  GLY  21           2HA      GLY  21  -7.018  -6.378  -5.539
  123    H    LEU  22           H        LEU  22  -4.206  -5.477  -4.602
  124    HA   LEU  22           HA       LEU  22  -3.810  -7.738  -2.754
  125    HB2  LEU  22           1HB      LEU  22  -2.293  -6.765  -5.107
  126    HB3  LEU  22           2HB      LEU  22  -1.361  -7.408  -3.757
  127    HG   LEU  22           HG       LEU  22  -3.343  -8.838  -5.507
  128   HD11  LEU  22          1HD1      LEU  22  -1.317 -10.442  -5.519
  129   HD12  LEU  22          2HD1      LEU  22  -0.415  -9.048  -4.927
  130   HD13  LEU  22          3HD1      LEU  22  -1.245  -8.965  -6.481
  131   HD21  LEU  22          3HD2      LEU  22  -2.337  -9.571  -2.779
  132   HD22  LEU  22          1HD2      LEU  22  -2.792 -10.806  -3.953
  133   HD23  LEU  22          2HD2      LEU  22  -3.984  -9.626  -3.408
  134    H    LYS  23           H        LYS  23  -1.715  -7.503  -1.461
  135    HA   LYS  23           HA       LYS  23  -1.786  -4.893  -0.163
  136    HB2  LYS  23           1HB      LYS  23  -1.975  -6.806   1.296
  137    HB3  LYS  23           2HB      LYS  23  -0.511  -7.516   0.627
  138    HG2  LYS  23           1HG      LYS  23   0.265  -6.637   2.596
  139    HG3  LYS  23           2HG      LYS  23   0.607  -5.319   1.473
  140    HD2  LYS  23           1HD      LYS  23  -1.688  -4.402   2.144
  141    HD3  LYS  23           2HD      LYS  23  -1.610  -5.542   3.489
  142    HE2  LYS  23           1HE      LYS  23  -0.708  -3.665   4.457
  143    HE3  LYS  23           2HE      LYS  23   0.748  -4.464   3.864
  144    HZ1  LYS  23           3HZ      LYS  23   0.038  -1.906   3.338
  145    HZ2  LYS  23           1HZ      LYS  23  -0.457  -2.710   1.934
  146    HZ3  LYS  23           2HZ      LYS  23   1.152  -2.812   2.444
  147    H    SER  24           H        SER  24   0.289  -6.847  -2.142
  148    HA   SER  24           HA       SER  24   2.643  -5.243  -1.617
  149    HB2  SER  24           1HB      SER  24   2.487  -7.796  -2.258
  150    HB3  SER  24           2HB      SER  24   2.467  -7.167  -3.906
  151    HG   SER  24           HG       SER  24   4.594  -7.621  -3.119
  152    H    GLN  25           H        GLN  25   0.062  -5.393  -3.933
  153    HA   GLN  25           HA       GLN  25   1.312  -3.915  -6.006
  154    HB2  GLN  25           1HB      GLN  25  -1.534  -4.581  -5.327
  155    HB3  GLN  25           2HB      GLN  25  -1.172  -3.451  -6.625
  156    HG2  GLN  25           1HG      GLN  25   0.430  -5.407  -7.392
  157    HG3  GLN  25           2HG      GLN  25  -0.717  -6.376  -6.468
  158   HE21  GLN  25          1HE2      GLN  25  -2.263  -7.207  -7.655
  159   HE22  GLN  25          2HE2      GLN  25  -2.969  -6.497  -9.062
  160    H    LEU  26           H        LEU  26  -0.128  -3.034  -3.006
  161    HA   LEU  26           HA       LEU  26  -0.507  -0.257  -3.772
  162    HB2  LEU  26           1HB      LEU  26  -2.176  -1.012  -2.328
  163    HB3  LEU  26           2HB      LEU  26  -1.025  -1.850  -1.289
  164    HG   LEU  26           HG       LEU  26  -0.199   0.377  -0.526
  165   HD11  LEU  26          1HD1      LEU  26  -1.394   1.400  -2.695
  166   HD12  LEU  26          2HD1      LEU  26  -1.046   2.342  -1.246
  167   HD13  LEU  26          3HD1      LEU  26  -2.661   1.681  -1.501
  168   HD21  LEU  26          3HD2      LEU  26  -3.123  -0.228  -0.101
  169   HD22  LEU  26          1HD2      LEU  26  -2.148   0.843   0.905
  170   HD23  LEU  26          2HD2      LEU  26  -1.768  -0.877   0.824
  171    H    ILE  27           H        ILE  27   1.489  -2.105  -1.479
  172    HA   ILE  27           HA       ILE  27   2.957  -0.042  -0.381
  173    HB   ILE  27           HB       ILE  27   3.998  -2.790  -1.079
  174   HG12  ILE  27          1HG1      ILE  27   2.927  -1.934   1.596
  175   HG13  ILE  27          2HG1      ILE  27   1.845  -2.540   0.347
  176   HG21  ILE  27          1HG2      ILE  27   5.598  -0.858  -0.395
  177   HG22  ILE  27          2HG2      ILE  27   4.942  -1.131   1.218
  178   HG23  ILE  27          3HG2      ILE  27   5.763  -2.439   0.368
  179   HD11  ILE  27          3HD1      ILE  27   2.524  -4.271   1.944
  180   HD12  ILE  27          1HD1      ILE  27   3.029  -4.641   0.295
  181   HD13  ILE  27          2HD1      ILE  27   4.205  -4.035   1.463
  182    H    ILE  28           H        ILE  28   3.471  -1.736  -3.437
  183    HA   ILE  28           HA       ILE  28   5.944  -0.485  -4.057
  184    HB   ILE  28           HB       ILE  28   3.919  -1.779  -5.887
  185   HG12  ILE  28          1HG1      ILE  28   6.546  -2.932  -4.975
  186   HG13  ILE  28          2HG1      ILE  28   5.079  -3.137  -4.024
  187   HG21  ILE  28          1HG2      ILE  28   6.806  -1.114  -6.445
  188   HG22  ILE  28          2HG2      ILE  28   5.658  -1.864  -7.552
  189   HG23  ILE  28          3HG2      ILE  28   5.428  -0.191  -7.044
  190   HD11  ILE  28          3HD1      ILE  28   5.258  -5.074  -5.316
  191   HD12  ILE  28          1HD1      ILE  28   4.039  -4.096  -6.132
  192   HD13  ILE  28          2HD1      ILE  28   5.682  -4.171  -6.769
  193    H    HIS  29           H        HIS  29   2.604   0.404  -4.501
  194    HA   HIS  29           HA       HIS  29   3.105   2.472  -6.418
  195    HB2  HIS  29           1HB      HIS  29   0.921   1.673  -6.528
  196    HB3  HIS  29           2HB      HIS  29   0.743   1.627  -4.777
  197    HD1  HIS  29           HD1      HIS  29   0.580   3.976  -7.696
  198    HD2  HIS  29           HD2      HIS  29  -0.160   3.983  -3.607
  199    HE1  HIS  29           HE1      HIS  29  -0.637   6.128  -7.236
  200    H    GLN  30           H        GLN  30   2.487   2.396  -2.924
  201    HA   GLN  30           HA       GLN  30   2.427   5.111  -2.408
  202    HB2  GLN  30           1HB      GLN  30   3.475   2.826  -0.740
  203    HB3  GLN  30           2HB      GLN  30   3.341   4.470  -0.129
  204    HG2  GLN  30           1HG      GLN  30   0.869   4.268  -0.916
  205    HG3  GLN  30           2HG      GLN  30   1.190   2.536  -0.848
  206   HE21  GLN  30          1HE2      GLN  30   1.040   1.541   1.049
  207   HE22  GLN  30          2HE2      GLN  30   0.880   2.324   2.580
  208    H    ARG  31           H        ARG  31   5.062   3.180  -3.429
  209    HA   ARG  31           HA       ARG  31   7.221   4.631  -2.360
  210    HB2  ARG  31           1HB      ARG  31   7.080   3.090  -4.958
  211    HB3  ARG  31           2HB      ARG  31   8.555   3.596  -4.146
  212    HG2  ARG  31           1HG      ARG  31   7.575   2.235  -2.145
  213    HG3  ARG  31           2HG      ARG  31   6.626   1.451  -3.409
  214    HD2  ARG  31           1HD      ARG  31   8.474   0.092  -3.359
  215    HD3  ARG  31           2HD      ARG  31   8.952   1.251  -4.599
  216    HE   ARG  31           HE       ARG  31  10.554   2.094  -3.167
  217   HH11  ARG  31          1HH1      ARG  31   8.475  -0.125  -1.472
  218   HH12  ARG  31          2HH1      ARG  31   9.489  -0.207  -0.069
  219   HH21  ARG  31          1HH2      ARG  31  11.897   1.994  -1.327
  220   HH22  ARG  31          2HH2      ARG  31  11.435   1.000   0.012
  221    H    THR  32           H        THR  32   5.630   4.870  -5.537
  222    HA   THR  32           HA       THR  32   7.129   6.908  -6.638
  223    HB   THR  32           HB       THR  32   5.258   5.588  -7.748
  224    HG1  THR  32           HG1      THR  32   6.273   7.321  -8.819
  225   HG21  THR  32          3HG2      THR  32   3.402   7.796  -7.057
  226   HG22  THR  32          1HG2      THR  32   3.652   6.544  -5.841
  227   HG23  THR  32          2HG2      THR  32   3.061   6.110  -7.445
  228    H    HIS  33           H        HIS  33   4.729   7.066  -4.130
  229    HA   HIS  33           HA       HIS  33   4.249   9.873  -4.290
  230    HB2  HIS  33           1HB      HIS  33   3.660   7.734  -2.276
  231    HB3  HIS  33           2HB      HIS  33   3.455   9.426  -1.832
  232    HD1  HIS  33           HD1      HIS  33   1.981  10.740  -3.918
  233    HD2  HIS  33           HD2      HIS  33   1.322   6.714  -3.128
  234    HE1  HIS  33           HE1      HIS  33  -0.295  10.234  -4.860
  235    H    THR  34           H        THR  34   6.516   7.841  -2.539
  236    HA   THR  34           HA       THR  34   7.714  10.249  -1.341
  237    HB   THR  34           HB       THR  34   8.786   8.780   0.285
  238    HG1  THR  34           HG1      THR  34   7.852   6.493   0.193
  239   HG21  THR  34          3HG2      THR  34   6.930   8.422   1.613
  240   HG22  THR  34          1HG2      THR  34   5.942   7.860   0.266
  241   HG23  THR  34          2HG2      THR  34   6.298   9.578   0.442
  242    H    GLY  35           H        GLY  35  10.213   9.604  -0.826
  243    HA2  GLY  35           1HA      GLY  35  12.274   8.896  -1.698
  244    HA3  GLY  35           2HA      GLY  35  11.449   8.361  -3.154
  245    H    GLU  36           H        GLU  36  10.264  10.434  -4.215
  246    HA   GLU  36           HA       GLU  36  12.473  12.257  -4.798
  247    HB2  GLU  36           1HB      GLU  36   9.872  11.717  -6.235
  248    HB3  GLU  36           2HB      GLU  36  11.033  12.936  -6.739
  249    HG2  GLU  36           1HG      GLU  36  11.926  10.115  -6.386
  250    HG3  GLU  36           2HG      GLU  36  11.036  10.577  -7.836
  251    H    SER  37           H        SER  37  11.567  14.543  -5.517
  252    HA   SER  37           HA       SER  37   9.433  15.547  -3.859
  253    HB2  SER  37           1HB      SER  37  11.472  15.414  -2.344
  254    HB3  SER  37           2HB      SER  37  12.200  16.654  -3.365
  255    HG   SER  37           HG       SER  37  10.200  16.863  -1.485
  256    H    GLY  38           H        GLY  38   9.237  17.982  -4.115
  257    HA2  GLY  38           1HA      GLY  38  10.330  19.739  -5.723
  258    HA3  GLY  38           2HA      GLY  38   9.736  18.611  -6.933
  259    HA   PRO  39           HA       PRO  39   6.419  21.684  -5.293
  260    HB2  PRO  39           1HB      PRO  39   6.707  23.727  -7.057
  261    HB3  PRO  39           2HB      PRO  39   7.541  23.678  -5.500
  262    HG2  PRO  39           1HG      PRO  39   8.568  22.969  -8.221
  263    HG3  PRO  39           2HG      PRO  39   9.363  23.887  -6.928
  264    HD2  PRO  39           1HD      PRO  39   9.906  21.278  -7.409
  265    HD3  PRO  39           2HD      PRO  39   9.975  21.984  -5.781
  266    H    SER  40           H        SER  40   7.470  21.494  -8.702
  267    HA   SER  40           HA       SER  40   4.780  21.410  -9.679
  268    HB2  SER  40           1HB      SER  40   7.354  20.749 -11.131
  269    HB3  SER  40           2HB      SER  40   5.794  21.100 -11.876
  270    HG   SER  40           HG       SER  40   6.944  22.969 -10.125
  271    H    SER  41           H        SER  41   7.431  19.023  -9.685
  272    HA   SER  41           HA       SER  41   5.557  16.893 -10.298
  273    HB2  SER  41           1HB      SER  41   8.545  16.797  -9.817
  274    HB3  SER  41           2HB      SER  41   7.557  15.460 -10.404
  275    HG   SER  41           HG       SER  41   8.101  16.276 -12.277
  276    H    GLY  42           H        GLY  42   4.984  18.078  -7.859
  277    HA2  GLY  42           1HA      GLY  42   5.854  16.010  -5.935
  278    HA3  GLY  42           2HA      GLY  42   5.486  17.667  -5.479
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1 -17.062  -3.127   6.534
    2    HA2  GLY   1           1HA      GLY   1 -18.869  -3.450   5.150
    3    HA3  GLY   1           2HA      GLY   1 -17.659  -3.750   3.912
    4    H    SER   2           H        SER   2 -17.298  -5.806   3.205
    5    HA   SER   2           HA       SER   2 -17.643  -8.029   2.859
    6    HB2  SER   2           1HB      SER   2 -16.957  -8.217   5.258
    7    HB3  SER   2           2HB      SER   2 -18.658  -8.107   5.710
    8    HG   SER   2           HG       SER   2 -17.927 -10.021   3.814
    9    H    SER   3           H        SER   3 -19.594  -6.253   2.009
   10    HA   SER   3           HA       SER   3 -22.175  -7.403   2.717
   11    HB2  SER   3           1HB      SER   3 -21.266  -4.970   1.249
   12    HB3  SER   3           2HB      SER   3 -22.858  -5.623   0.861
   13    HG   SER   3           HG       SER   3 -23.473  -5.345   2.978
   14    H    GLY   4           H        GLY   4 -20.448  -6.696  -0.330
   15    HA2  GLY   4           1HA      GLY   4 -21.979  -8.847  -1.616
   16    HA3  GLY   4           2HA      GLY   4 -21.093  -7.578  -2.448
   17    H    SER   5           H        SER   5 -20.748 -10.078  -3.344
   18    HA   SER   5           HA       SER   5 -18.087 -10.823  -2.319
   19    HB2  SER   5           1HB      SER   5 -18.622 -13.149  -3.141
   20    HB3  SER   5           2HB      SER   5 -19.588 -12.612  -1.767
   21    HG   SER   5           HG       SER   5 -20.644 -13.631  -3.741
   22    H    SER   6           H        SER   6 -18.418  -8.872  -4.274
   23    HA   SER   6           HA       SER   6 -17.923 -10.157  -6.843
   24    HB2  SER   6           1HB      SER   6 -18.075  -7.218  -6.130
   25    HB3  SER   6           2HB      SER   6 -17.973  -7.879  -7.762
   26    HG   SER   6           HG       SER   6 -20.145  -7.409  -6.405
   27    H    GLY   7           H        GLY   7 -16.293  -7.833  -4.686
   28    HA2  GLY   7           1HA      GLY   7 -13.890  -8.498  -4.252
   29    HA3  GLY   7           2HA      GLY   7 -13.750  -8.556  -6.003
   30    H    GLU   8           H        GLU   8 -14.004  -6.501  -3.204
   31    HA   GLU   8           HA       GLU   8 -13.467  -4.158  -4.906
   32    HB2  GLU   8           1HB      GLU   8 -14.912  -4.461  -2.297
   33    HB3  GLU   8           2HB      GLU   8 -14.179  -2.920  -2.720
   34    HG2  GLU   8           1HG      GLU   8 -16.219  -4.385  -4.379
   35    HG3  GLU   8           2HG      GLU   8 -16.559  -3.032  -3.300
   36    H    LYS   9           H        LYS   9 -11.381  -3.668  -4.942
   37    HA   LYS   9           HA       LYS   9  -9.315  -4.578  -3.491
   38    HB2  LYS   9           1HB      LYS   9  -9.622  -1.694  -4.348
   39    HB3  LYS   9           2HB      LYS   9  -8.103  -2.503  -3.986
   40    HG2  LYS   9           1HG      LYS   9  -8.116  -3.704  -5.937
   41    HG3  LYS   9           2HG      LYS   9  -9.875  -3.650  -6.085
   42    HD2  LYS   9           1HD      LYS   9  -9.747  -1.266  -6.646
   43    HD3  LYS   9           2HD      LYS   9  -7.988  -1.332  -6.510
   44    HE2  LYS   9           1HE      LYS   9  -7.807  -2.769  -8.384
   45    HE3  LYS   9           2HE      LYS   9  -9.542  -3.082  -8.400
   46    HZ1  LYS   9           3HZ      LYS   9  -8.323  -0.426  -8.924
   47    HZ2  LYS   9           1HZ      LYS   9  -9.954  -0.846  -9.089
   48    HZ3  LYS   9           2HZ      LYS   9  -8.801  -1.509 -10.133
   49    HA   PRO  10           HA       PRO  10 -10.613  -3.165   0.615
   50    HB2  PRO  10           1HB      PRO  10  -9.041  -4.933   1.948
   51    HB3  PRO  10           2HB      PRO  10 -10.618  -5.365   1.275
   52    HG2  PRO  10           1HG      PRO  10  -7.884  -5.845   0.154
   53    HG3  PRO  10           2HG      PRO  10  -9.277  -6.940   0.212
   54    HD2  PRO  10           1HD      PRO  10  -8.594  -5.568  -2.021
   55    HD3  PRO  10           2HD      PRO  10 -10.278  -5.967  -1.622
   56    H    TYR  11           H        TYR  11  -7.670  -3.062  -1.058
   57    HA   TYR  11           HA       TYR  11  -6.366  -1.575   1.123
   58    HB2  TYR  11           1HB      TYR  11  -5.064  -2.766  -1.332
   59    HB3  TYR  11           2HB      TYR  11  -4.249  -2.058   0.058
   60    HD1  TYR  11           HD1      TYR  11  -6.138  -4.967  -1.159
   61    HD2  TYR  11           HD2      TYR  11  -3.972  -3.300   2.101
   62    HE1  TYR  11           HE1      TYR  11  -6.054  -7.181  -0.091
   63    HE2  TYR  11           HE2      TYR  11  -3.880  -5.509   3.177
   64    HH   TYR  11           HH       TYR  11  -5.338  -8.364   1.641
   65    H    GLU  12           H        GLU  12  -6.153   0.551   0.921
   66    HA   GLU  12           HA       GLU  12  -6.186   1.735  -1.769
   67    HB2  GLU  12           1HB      GLU  12  -8.374   1.880  -0.262
   68    HB3  GLU  12           2HB      GLU  12  -7.494   3.221   0.456
   69    HG2  GLU  12           1HG      GLU  12  -7.261   4.223  -1.788
   70    HG3  GLU  12           2HG      GLU  12  -8.245   2.914  -2.441
   71    H    CYS  13           H        CYS  13  -4.812   3.422  -2.095
   72    HA   CYS  13           HA       CYS  13  -2.634   3.744  -0.324
   73    HB2  CYS  13           1HB      CYS  13  -2.721   4.105  -2.876
   74    HB3  CYS  13           2HB      CYS  13  -3.340   5.708  -2.493
   75    H    THR  14           H        THR  14  -2.524   4.897   1.473
   76    HA   THR  14           HA       THR  14  -4.586   6.808   2.134
   77    HB   THR  14           HB       THR  14  -3.381   7.027   4.293
   78    HG1  THR  14           HG1      THR  14  -1.298   6.595   4.048
   79   HG21  THR  14          3HG2      THR  14  -4.137   4.320   3.247
   80   HG22  THR  14          1HG2      THR  14  -5.024   5.372   4.350
   81   HG23  THR  14          2HG2      THR  14  -3.582   4.524   4.908
   82    H    ASP  15           H        ASP  15  -2.549   7.328  -0.035
   83    HA   ASP  15           HA       ASP  15  -1.587   9.916   0.998
   84    HB2  ASP  15           1HB      ASP  15  -0.207   7.835  -0.613
   85    HB3  ASP  15           2HB      ASP  15   0.106   9.514  -1.045
   86    H    CYS  16           H        CYS  16  -2.960   8.134  -1.695
   87    HA   CYS  16           HA       CYS  16  -3.742  10.701  -2.908
   88    HB2  CYS  16           1HB      CYS  16  -3.611   9.543  -5.130
   89    HB3  CYS  16           2HB      CYS  16  -2.055   9.770  -4.338
   90    H    GLY  17           H        GLY  17  -4.534   7.315  -2.339
   91    HA2  GLY  17           1HA      GLY  17  -6.852   6.903  -1.600
   92    HA3  GLY  17           2HA      GLY  17  -7.360   7.980  -2.893
   93    H    LYS  18           H        LYS  18  -4.893   6.383  -4.231
   94    HA   LYS  18           HA       LYS  18  -6.344   4.938  -6.061
   95    HB2  LYS  18           1HB      LYS  18  -3.535   4.821  -5.088
   96    HB3  LYS  18           2HB      LYS  18  -4.107   3.472  -6.062
   97    HG2  LYS  18           1HG      LYS  18  -4.605   4.915  -7.897
   98    HG3  LYS  18           2HG      LYS  18  -4.294   6.351  -6.918
   99    HD2  LYS  18           1HD      LYS  18  -2.016   6.077  -6.996
  100    HD3  LYS  18           2HD      LYS  18  -2.126   4.329  -7.216
  101    HE2  LYS  18           1HE      LYS  18  -3.246   5.058  -9.500
  102    HE3  LYS  18           2HE      LYS  18  -2.303   6.520  -9.219
  103    HZ1  LYS  18           3HZ      LYS  18  -1.211   3.759  -9.309
  104    HZ2  LYS  18           1HZ      LYS  18  -0.312   5.170  -9.059
  105    HZ3  LYS  18           2HZ      LYS  18  -1.080   4.909 -10.543
  106    H    ALA  19           H        ALA  19  -6.585   2.618  -6.371
  107    HA   ALA  19           HA       ALA  19  -6.928   1.179  -3.821
  108    HB1  ALA  19           3HB      ALA  19  -8.950   0.305  -4.502
  109    HB2  ALA  19           1HB      ALA  19  -9.012   1.927  -5.192
  110    HB3  ALA  19           2HB      ALA  19  -8.601   0.548  -6.213
  111    H    PHE  20           H        PHE  20  -6.324  -0.963  -3.727
  112    HA   PHE  20           HA       PHE  20  -5.244  -2.218  -6.134
  113    HB2  PHE  20           1HB      PHE  20  -3.661  -1.937  -3.571
  114    HB3  PHE  20           2HB      PHE  20  -3.156  -2.831  -5.001
  115    HD1  PHE  20           HD1      PHE  20  -3.827   0.527  -3.648
  116    HD2  PHE  20           HD2      PHE  20  -2.203  -1.729  -6.870
  117    HE1  PHE  20           HE1      PHE  20  -2.786   2.567  -4.547
  118    HE2  PHE  20           HE2      PHE  20  -1.158   0.307  -7.774
  119    HZ   PHE  20           HZ       PHE  20  -1.448   2.459  -6.612
  120    H    GLY  21           H        GLY  21  -5.931  -4.248  -6.277
  121    HA2  GLY  21           1HA      GLY  21  -7.498  -5.462  -4.266
  122    HA3  GLY  21           2HA      GLY  21  -6.887  -6.257  -5.710
  123    H    LEU  22           H        LEU  22  -4.097  -5.404  -4.770
  124    HA   LEU  22           HA       LEU  22  -3.759  -7.603  -2.839
  125    HB2  LEU  22           1HB      LEU  22  -2.207  -6.738  -5.210
  126    HB3  LEU  22           2HB      LEU  22  -1.296  -7.349  -3.830
  127    HG   LEU  22           HG       LEU  22  -3.287  -8.806  -5.547
  128   HD11  LEU  22          1HD1      LEU  22  -0.367  -9.001  -4.966
  129   HD12  LEU  22          2HD1      LEU  22  -1.213  -9.048  -6.512
  130   HD13  LEU  22          3HD1      LEU  22  -1.265 -10.444  -5.437
  131   HD21  LEU  22          3HD2      LEU  22  -2.314  -9.463  -2.787
  132   HD22  LEU  22          1HD2      LEU  22  -2.787 -10.727  -3.922
  133   HD23  LEU  22          2HD2      LEU  22  -3.959  -9.506  -3.424
  134    H    LYS  23           H        LYS  23  -2.048  -7.381  -1.267
  135    HA   LYS  23           HA       LYS  23  -1.959  -4.724  -0.160
  136    HB2  LYS  23           1HB      LYS  23  -2.227  -6.486   1.410
  137    HB3  LYS  23           2HB      LYS  23  -0.873  -7.387   0.741
  138    HG2  LYS  23           1HG      LYS  23  -0.015  -6.508   2.702
  139    HG3  LYS  23           2HG      LYS  23   0.553  -5.375   1.473
  140    HD2  LYS  23           1HD      LYS  23  -1.149  -3.798   2.039
  141    HD3  LYS  23           2HD      LYS  23  -1.956  -4.962   3.092
  142    HE2  LYS  23           1HE      LYS  23   0.375  -4.976   4.310
  143    HE3  LYS  23           2HE      LYS  23   0.544  -3.400   3.539
  144    HZ1  LYS  23           3HZ      LYS  23  -1.730  -4.198   5.275
  145    HZ2  LYS  23           1HZ      LYS  23  -1.468  -2.668   4.602
  146    HZ3  LYS  23           2HZ      LYS  23  -0.411  -3.266   5.779
  147    H    SER  24           H        SER  24   0.120  -6.750  -2.042
  148    HA   SER  24           HA       SER  24   2.514  -5.240  -1.456
  149    HB2  SER  24           1HB      SER  24   3.662  -6.850  -2.640
  150    HB3  SER  24           2HB      SER  24   2.234  -7.778  -2.180
  151    HG   SER  24           HG       SER  24   2.007  -8.071  -4.243
  152    H    GLN  25           H        GLN  25   0.055  -5.362  -3.941
  153    HA   GLN  25           HA       GLN  25   1.409  -3.818  -5.886
  154    HB2  GLN  25           1HB      GLN  25  -1.468  -4.508  -5.391
  155    HB3  GLN  25           2HB      GLN  25  -1.039  -3.342  -6.636
  156    HG2  GLN  25           1HG      GLN  25   0.620  -5.280  -7.348
  157    HG3  GLN  25           2HG      GLN  25  -0.593  -6.268  -6.536
  158   HE21  GLN  25          1HE2      GLN  25  -2.807  -6.068  -7.270
  159   HE22  GLN  25          2HE2      GLN  25  -3.118  -5.695  -8.928
  160    H    LEU  26           H        LEU  26  -0.216  -3.003  -2.961
  161    HA   LEU  26           HA       LEU  26  -0.581  -0.218  -3.682
  162    HB2  LEU  26           1HB      LEU  26  -2.286  -1.041  -2.309
  163    HB3  LEU  26           2HB      LEU  26  -1.149  -1.851  -1.234
  164    HG   LEU  26           HG       LEU  26  -0.424   0.367  -0.401
  165   HD11  LEU  26          1HD1      LEU  26  -2.821   1.600  -1.665
  166   HD12  LEU  26          2HD1      LEU  26  -1.336   1.459  -2.605
  167   HD13  LEU  26          3HD1      LEU  26  -1.335   2.353  -1.085
  168   HD21  LEU  26          3HD2      LEU  26  -3.388   0.249  -0.083
  169   HD22  LEU  26          1HD2      LEU  26  -2.136   0.536   1.125
  170   HD23  LEU  26          2HD2      LEU  26  -2.398  -1.091   0.497
  171    H    ILE  27           H        ILE  27   1.403  -2.107  -1.422
  172    HA   ILE  27           HA       ILE  27   2.799  -0.014  -0.239
  173    HB   ILE  27           HB       ILE  27   3.837  -2.781  -0.864
  174   HG12  ILE  27          1HG1      ILE  27   2.723  -1.844   1.769
  175   HG13  ILE  27          2HG1      ILE  27   1.664  -2.478   0.514
  176   HG21  ILE  27          1HG2      ILE  27   4.907  -1.698   1.531
  177   HG22  ILE  27          2HG2      ILE  27   5.755  -2.156   0.055
  178   HG23  ILE  27          3HG2      ILE  27   5.136  -0.515   0.244
  179   HD11  ILE  27          3HD1      ILE  27   2.644  -4.022   2.395
  180   HD12  ILE  27          1HD1      ILE  27   2.442  -4.606   0.743
  181   HD13  ILE  27          2HD1      ILE  27   4.030  -4.085   1.306
  182    H    ILE  28           H        ILE  28   3.654  -1.913  -3.123
  183    HA   ILE  28           HA       ILE  28   6.074  -0.635  -3.695
  184    HB   ILE  28           HB       ILE  28   4.113  -1.888  -5.620
  185   HG12  ILE  28          1HG1      ILE  28   6.652  -3.130  -4.599
  186   HG13  ILE  28          2HG1      ILE  28   5.161  -3.250  -3.671
  187   HG21  ILE  28          1HG2      ILE  28   5.571  -0.504  -6.884
  188   HG22  ILE  28          2HG2      ILE  28   6.978  -1.038  -5.966
  189   HG23  ILE  28          3HG2      ILE  28   6.160  -2.158  -7.056
  190   HD11  ILE  28          3HD1      ILE  28   4.392  -4.003  -6.201
  191   HD12  ILE  28          1HD1      ILE  28   6.006  -4.695  -6.037
  192   HD13  ILE  28          2HD1      ILE  28   4.756  -5.082  -4.854
  193    H    HIS  29           H        HIS  29   2.762   0.233  -4.480
  194    HA   HIS  29           HA       HIS  29   3.363   2.275  -6.345
  195    HB2  HIS  29           1HB      HIS  29   1.151   1.505  -6.414
  196    HB3  HIS  29           2HB      HIS  29   0.957   1.620  -4.667
  197    HD1  HIS  29           HD1      HIS  29   1.318   3.910  -7.674
  198    HD2  HIS  29           HD2      HIS  29  -0.255   3.904  -3.828
  199    HE1  HIS  29           HE1      HIS  29   0.089   6.092  -7.446
  200    H    GLN  30           H        GLN  30   2.476   2.445  -2.895
  201    HA   GLN  30           HA       GLN  30   2.581   5.126  -2.453
  202    HB2  GLN  30           1HB      GLN  30   3.533   2.855  -0.718
  203    HB3  GLN  30           2HB      GLN  30   3.518   4.519  -0.151
  204    HG2  GLN  30           1HG      GLN  30   1.126   4.644  -0.472
  205    HG3  GLN  30           2HG      GLN  30   1.109   3.014  -1.142
  206   HE21  GLN  30          1HE2      GLN  30   1.156   1.279   0.206
  207   HE22  GLN  30          2HE2      GLN  30   1.076   1.400   1.927
  208    H    ARG  31           H        ARG  31   5.216   3.060  -3.277
  209    HA   ARG  31           HA       ARG  31   7.397   4.460  -2.278
  210    HB2  ARG  31           1HB      ARG  31   7.154   2.952  -4.888
  211    HB3  ARG  31           2HB      ARG  31   8.672   3.457  -4.158
  212    HG2  ARG  31           1HG      ARG  31   7.840   2.105  -2.106
  213    HG3  ARG  31           2HG      ARG  31   6.763   1.340  -3.277
  214    HD2  ARG  31           1HD      ARG  31   8.691  -0.020  -3.177
  215    HD3  ARG  31           2HD      ARG  31   8.815   0.893  -4.680
  216    HE   ARG  31           HE       ARG  31  10.158   2.126  -2.456
  217   HH11  ARG  31          1HH1      ARG  31  10.431  -0.176  -5.054
  218   HH12  ARG  31          2HH1      ARG  31  12.159  -0.073  -5.138
  219   HH21  ARG  31          1HH2      ARG  31  12.432   2.270  -2.557
  220   HH22  ARG  31          2HH2      ARG  31  13.296   1.318  -3.716
  221    H    THR  32           H        THR  32   5.538   4.987  -5.237
  222    HA   THR  32           HA       THR  32   7.141   6.908  -6.449
  223    HB   THR  32           HB       THR  32   5.183   7.629  -7.674
  224    HG1  THR  32           HG1      THR  32   3.146   6.393  -6.876
  225   HG21  THR  32          3HG2      THR  32   4.886   5.688  -8.812
  226   HG22  THR  32          1HG2      THR  32   4.503   4.768  -7.359
  227   HG23  THR  32          2HG2      THR  32   6.182   5.134  -7.753
  228    H    HIS  33           H        HIS  33   4.731   7.244  -3.900
  229    HA   HIS  33           HA       HIS  33   4.680  10.078  -3.872
  230    HB2  HIS  33           1HB      HIS  33   3.949   8.025  -1.781
  231    HB3  HIS  33           2HB      HIS  33   3.709   9.755  -1.559
  232    HD1  HIS  33           HD1      HIS  33   2.353  10.748  -3.923
  233    HD2  HIS  33           HD2      HIS  33   1.617   6.907  -2.521
  234    HE1  HIS  33           HE1      HIS  33   0.113  10.105  -4.868
  235    H    THR  34           H        THR  34   6.411   7.701  -1.872
  236    HA   THR  34           HA       THR  34   7.876   9.759  -0.481
  237    HB   THR  34           HB       THR  34   9.059   7.903   0.619
  238    HG1  THR  34           HG1      THR  34   8.986   6.470  -1.239
  239   HG21  THR  34          3HG2      THR  34   7.337   7.505   2.021
  240   HG22  THR  34          1HG2      THR  34   6.300   6.892   0.734
  241   HG23  THR  34          2HG2      THR  34   6.465   8.630   0.980
  242    H    GLY  35           H        GLY  35   8.299  10.069  -3.180
  243    HA2  GLY  35           1HA      GLY  35  11.045  10.295  -3.398
  244    HA3  GLY  35           2HA      GLY  35  10.643   8.737  -4.105
  245    H    GLU  36           H        GLU  36   9.448  12.098  -4.210
  246    HA   GLU  36           HA       GLU  36   8.964  11.744  -7.086
  247    HB2  GLU  36           1HB      GLU  36   7.772  13.520  -4.994
  248    HB3  GLU  36           2HB      GLU  36   7.737  14.031  -6.676
  249    HG2  GLU  36           1HG      GLU  36   6.664  11.805  -7.196
  250    HG3  GLU  36           2HG      GLU  36   6.476  11.597  -5.456
  251    H    SER  37           H        SER  37  10.163  14.217  -4.814
  252    HA   SER  37           HA       SER  37  12.450  14.788  -6.408
  253    HB2  SER  37           1HB      SER  37  11.910  16.966  -7.225
  254    HB3  SER  37           2HB      SER  37  10.583  15.911  -7.709
  255    HG   SER  37           HG       SER  37   9.384  16.713  -5.957
  256    H    GLY  38           H        GLY  38  13.490  16.945  -5.583
  257    HA2  GLY  38           1HA      GLY  38  14.052  16.650  -2.875
  258    HA3  GLY  38           2HA      GLY  38  14.391  18.096  -3.814
  259    HA   PRO  39           HA       PRO  39  11.532  20.238  -1.255
  260    HB2  PRO  39           1HB      PRO  39  11.007  22.353  -2.874
  261    HB3  PRO  39           2HB      PRO  39  12.535  22.165  -2.004
  262    HG2  PRO  39           1HG      PRO  39  11.893  21.543  -4.861
  263    HG3  PRO  39           2HG      PRO  39  13.328  22.335  -4.184
  264    HD2  PRO  39           1HD      PRO  39  13.310  19.727  -4.912
  265    HD3  PRO  39           2HD      PRO  39  14.294  20.336  -3.565
  266    H    SER  40           H        SER  40   9.892  18.554  -1.443
  267    HA   SER  40           HA       SER  40   8.017  18.469  -3.552
  268    HB2  SER  40           1HB      SER  40   8.280  16.571  -2.067
  269    HB3  SER  40           2HB      SER  40   7.792  17.542  -0.679
  270    HG   SER  40           HG       SER  40   6.028  17.422  -2.828
  271    H    SER  41           H        SER  41   5.936  19.292  -3.724
  272    HA   SER  41           HA       SER  41   4.715  20.909  -1.734
  273    HB2  SER  41           1HB      SER  41   6.394  22.234  -3.806
  274    HB3  SER  41           2HB      SER  41   4.844  22.982  -3.421
  275    HG   SER  41           HG       SER  41   6.330  22.206  -1.234
  276    H    GLY  42           H        GLY  42   2.760  22.076  -2.643
  277    HA2  GLY  42           1HA      GLY  42   1.697  20.565  -4.951
  278    HA3  GLY  42           2HA      GLY  42   0.732  20.922  -3.526
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1 -17.803  -4.534   6.229
    2    HA2  GLY   1           1HA      GLY   1 -18.681  -3.706   3.702
    3    HA3  GLY   1           2HA      GLY   1 -16.992  -3.248   3.857
    4    H    SER   2           H        SER   2 -19.235  -5.962   3.879
    5    HA   SER   2           HA       SER   2 -17.223  -7.975   3.995
    6    HB2  SER   2           1HB      SER   2 -19.455  -8.533   4.707
    7    HB3  SER   2           2HB      SER   2 -20.124  -8.069   3.142
    8    HG   SER   2           HG       SER   2 -19.770 -10.388   3.515
    9    H    SER   3           H        SER   3 -15.693  -7.709   2.421
   10    HA   SER   3           HA       SER   3 -15.789  -6.898  -0.123
   11    HB2  SER   3           1HB      SER   3 -13.794  -7.892   1.094
   12    HB3  SER   3           2HB      SER   3 -14.376  -9.475   0.580
   13    HG   SER   3           HG       SER   3 -14.191  -8.754  -1.581
   14    H    GLY   4           H        GLY   4 -16.615 -10.218   0.872
   15    HA2  GLY   4           1HA      GLY   4 -18.083 -11.725  -0.065
   16    HA3  GLY   4           2HA      GLY   4 -18.681 -10.422  -1.082
   17    H    SER   5           H        SER   5 -18.721 -11.340  -3.055
   18    HA   SER   5           HA       SER   5 -16.323 -12.752  -3.988
   19    HB2  SER   5           1HB      SER   5 -18.369 -14.022  -4.251
   20    HB3  SER   5           2HB      SER   5 -19.143 -12.676  -5.087
   21    HG   SER   5           HG       SER   5 -17.468 -14.592  -6.057
   22    H    SER   6           H        SER   6 -18.587 -10.191  -4.929
   23    HA   SER   6           HA       SER   6 -17.668  -9.413  -7.354
   24    HB2  SER   6           1HB      SER   6 -19.509  -8.286  -6.164
   25    HB3  SER   6           2HB      SER   6 -18.343  -7.534  -5.076
   26    HG   SER   6           HG       SER   6 -18.770  -7.064  -7.821
   27    H    GLY   7           H        GLY   7 -16.000  -8.206  -8.204
   28    HA2  GLY   7           1HA      GLY   7 -13.496  -8.367  -6.896
   29    HA3  GLY   7           2HA      GLY   7 -13.824  -7.494  -8.386
   30    H    GLU   8           H        GLU   8 -12.896  -7.187  -5.207
   31    HA   GLU   8           HA       GLU   8 -13.341  -4.289  -5.314
   32    HB2  GLU   8           1HB      GLU   8 -14.213  -6.179  -3.189
   33    HB3  GLU   8           2HB      GLU   8 -13.565  -4.628  -2.673
   34    HG2  GLU   8           1HG      GLU   8 -15.802  -4.165  -2.814
   35    HG3  GLU   8           2HG      GLU   8 -15.241  -3.655  -4.406
   36    H    LYS   9           H        LYS   9 -11.860  -3.054  -3.993
   37    HA   LYS   9           HA       LYS   9  -9.323  -4.483  -3.547
   38    HB2  LYS   9           1HB      LYS   9  -9.769  -1.572  -4.235
   39    HB3  LYS   9           2HB      LYS   9  -8.204  -2.327  -3.963
   40    HG2  LYS   9           1HG      LYS   9  -8.353  -3.598  -5.931
   41    HG3  LYS   9           2HG      LYS   9 -10.080  -3.280  -6.101
   42    HD2  LYS   9           1HD      LYS   9  -9.615  -0.929  -6.550
   43    HD3  LYS   9           2HD      LYS   9  -7.887  -1.218  -6.334
   44    HE2  LYS   9           1HE      LYS   9  -7.788  -2.585  -8.272
   45    HE3  LYS   9           2HE      LYS   9  -9.545  -2.658  -8.393
   46    HZ1  LYS   9           3HZ      LYS   9  -9.368  -0.126  -8.662
   47    HZ2  LYS   9           1HZ      LYS   9  -8.961  -1.104  -9.981
   48    HZ3  LYS   9           2HZ      LYS   9  -7.743  -0.414  -9.031
   49    HA   PRO  10           HA       PRO  10 -10.446  -3.341   0.697
   50    HB2  PRO  10           1HB      PRO  10  -8.795  -5.166   1.844
   51    HB3  PRO  10           2HB      PRO  10 -10.398  -5.577   1.224
   52    HG2  PRO  10           1HG      PRO  10  -7.719  -5.956  -0.055
   53    HG3  PRO  10           2HG      PRO  10  -9.097  -7.069   0.004
   54    HD2  PRO  10           1HD      PRO  10  -8.537  -5.560  -2.173
   55    HD3  PRO  10           2HD      PRO  10 -10.196  -6.001  -1.718
   56    H    TYR  11           H        TYR  11  -7.644  -3.017  -1.133
   57    HA   TYR  11           HA       TYR  11  -6.253  -1.637   1.069
   58    HB2  TYR  11           1HB      TYR  11  -5.002  -2.755  -1.446
   59    HB3  TYR  11           2HB      TYR  11  -4.161  -2.081  -0.054
   60    HD1  TYR  11           HD2      TYR  11  -3.938  -3.359   2.004
   61    HD2  TYR  11           HD1      TYR  11  -5.954  -4.987  -1.370
   62    HE1  TYR  11           HE2      TYR  11  -3.810  -5.598   3.015
   63    HE2  TYR  11           HE1      TYR  11  -5.833  -7.230  -0.368
   64    HH   TYR  11           HH       TYR  11  -4.413  -8.428   1.299
   65    H    GLU  12           H        GLU  12  -6.047   0.495   0.909
   66    HA   GLU  12           HA       GLU  12  -6.157   1.739  -1.751
   67    HB2  GLU  12           1HB      GLU  12  -7.895   2.258   0.609
   68    HB3  GLU  12           2HB      GLU  12  -7.389   3.645  -0.347
   69    HG2  GLU  12           1HG      GLU  12  -9.357   3.107  -1.370
   70    HG3  GLU  12           2HG      GLU  12  -8.214   2.196  -2.354
   71    H    CYS  13           H        CYS  13  -4.955   3.617  -2.007
   72    HA   CYS  13           HA       CYS  13  -2.776   3.922  -0.134
   73    HB2  CYS  13           1HB      CYS  13  -2.360   3.947  -2.562
   74    HB3  CYS  13           2HB      CYS  13  -3.356   5.390  -2.716
   75    H    THR  14           H        THR  14  -2.936   5.189   1.583
   76    HA   THR  14           HA       THR  14  -4.976   7.149   1.890
   77    HB   THR  14           HB       THR  14  -3.773   7.744   3.998
   78    HG1  THR  14           HG1      THR  14  -1.684   6.882   2.889
   79   HG21  THR  14          3HG2      THR  14  -5.394   5.721   3.609
   80   HG22  THR  14          1HG2      THR  14  -4.524   5.881   5.134
   81   HG23  THR  14          2HG2      THR  14  -3.943   4.763   3.900
   82    H    ASP  15           H        ASP  15  -1.954   7.212   0.379
   83    HA   ASP  15           HA       ASP  15  -1.212   9.909   0.906
   84    HB2  ASP  15           1HB      ASP  15   0.197   7.916  -0.048
   85    HB3  ASP  15           2HB      ASP  15  -0.408   8.480  -1.603
   86    H    CYS  16           H        CYS  16  -2.685   8.352  -1.944
   87    HA   CYS  16           HA       CYS  16  -3.708  10.999  -2.739
   88    HB2  CYS  16           1HB      CYS  16  -3.777  10.092  -5.055
   89    HB3  CYS  16           2HB      CYS  16  -2.149  10.157  -4.387
   90    H    GLY  17           H        GLY  17  -4.453   7.552  -2.494
   91    HA2  GLY  17           1HA      GLY  17  -6.711   7.114  -1.520
   92    HA3  GLY  17           2HA      GLY  17  -7.317   8.250  -2.716
   93    H    LYS  18           H        LYS  18  -4.782   6.291  -3.846
   94    HA   LYS  18           HA       LYS  18  -6.368   5.086  -5.838
   95    HB2  LYS  18           1HB      LYS  18  -3.757   5.506  -5.640
   96    HB3  LYS  18           2HB      LYS  18  -3.770   3.857  -5.032
   97    HG2  LYS  18           1HG      LYS  18  -4.356   2.967  -7.046
   98    HG3  LYS  18           2HG      LYS  18  -5.215   4.419  -7.563
   99    HD2  LYS  18           1HD      LYS  18  -2.766   5.439  -7.470
  100    HD3  LYS  18           2HD      LYS  18  -2.324   3.751  -7.733
  101    HE2  LYS  18           1HE      LYS  18  -4.411   5.045  -9.441
  102    HE3  LYS  18           2HE      LYS  18  -2.702   5.323  -9.772
  103    HZ1  LYS  18           3HZ      LYS  18  -4.050   3.311 -10.816
  104    HZ2  LYS  18           1HZ      LYS  18  -3.530   2.556  -9.394
  105    HZ3  LYS  18           2HZ      LYS  18  -2.398   3.210 -10.467
  106    H    ALA  19           H        ALA  19  -6.106   2.562  -6.153
  107    HA   ALA  19           HA       ALA  19  -6.661   1.166  -3.636
  108    HB1  ALA  19           3HB      ALA  19  -8.568  -0.014  -4.857
  109    HB2  ALA  19           1HB      ALA  19  -8.853   1.638  -4.308
  110    HB3  ALA  19           2HB      ALA  19  -8.495   1.321  -6.007
  111    H    PHE  20           H        PHE  20  -6.380  -1.117  -3.731
  112    HA   PHE  20           HA       PHE  20  -5.324  -2.295  -6.156
  113    HB2  PHE  20           1HB      PHE  20  -3.609  -2.153  -3.668
  114    HB3  PHE  20           2HB      PHE  20  -3.197  -2.970  -5.172
  115    HD1  PHE  20           HD1      PHE  20  -3.645   0.291  -3.547
  116    HD2  PHE  20           HD2      PHE  20  -2.401  -1.753  -7.067
  117    HE1  PHE  20           HE1      PHE  20  -2.609   2.361  -4.379
  118    HE2  PHE  20           HE2      PHE  20  -1.362   0.314  -7.904
  119    HZ   PHE  20           HZ       PHE  20  -1.465   2.374  -6.559
  120    H    GLY  21           H        GLY  21  -6.157  -4.266  -6.304
  121    HA2  GLY  21           1HA      GLY  21  -7.646  -5.484  -4.260
  122    HA3  GLY  21           2HA      GLY  21  -7.099  -6.278  -5.730
  123    H    LEU  22           H        LEU  22  -4.280  -5.376  -4.706
  124    HA   LEU  22           HA       LEU  22  -3.930  -7.681  -2.903
  125    HB2  LEU  22           1HB      LEU  22  -2.378  -6.711  -5.235
  126    HB3  LEU  22           2HB      LEU  22  -1.467  -7.378  -3.882
  127    HG   LEU  22           HG       LEU  22  -3.456  -8.766  -5.659
  128   HD11  LEU  22          1HD1      LEU  22  -1.355 -10.391  -5.499
  129   HD12  LEU  22          2HD1      LEU  22  -0.536  -8.863  -5.182
  130   HD13  LEU  22          3HD1      LEU  22  -1.452  -9.079  -6.673
  131   HD21  LEU  22          3HD2      LEU  22  -2.741  -9.333  -2.860
  132   HD22  LEU  22          1HD2      LEU  22  -2.644 -10.704  -3.965
  133   HD23  LEU  22          2HD2      LEU  22  -4.158  -9.815  -3.794
  134    H    LYS  23           H        LYS  23  -1.963  -7.508  -1.495
  135    HA   LYS  23           HA       LYS  23  -1.956  -4.890  -0.228
  136    HB2  LYS  23           1HB      LYS  23  -2.247  -6.792   1.228
  137    HB3  LYS  23           2HB      LYS  23  -0.790  -7.551   0.601
  138    HG2  LYS  23           1HG      LYS  23   0.040  -6.698   2.532
  139    HG3  LYS  23           2HG      LYS  23   0.318  -5.314   1.472
  140    HD2  LYS  23           1HD      LYS  23  -1.984  -4.500   2.221
  141    HD3  LYS  23           2HD      LYS  23  -1.871  -5.717   3.495
  142    HE2  LYS  23           1HE      LYS  23   0.115  -4.693   4.372
  143    HE3  LYS  23           2HE      LYS  23   0.195  -3.575   3.012
  144    HZ1  LYS  23           3HZ      LYS  23  -1.595  -2.365   3.794
  145    HZ2  LYS  23           1HZ      LYS  23  -0.784  -2.762   5.224
  146    HZ3  LYS  23           2HZ      LYS  23  -2.169  -3.620   4.772
  147    H    SER  24           H        SER  24   0.141  -6.948  -2.095
  148    HA   SER  24           HA       SER  24   2.526  -5.432  -1.511
  149    HB2  SER  24           1HB      SER  24   2.821  -7.770  -1.975
  150    HB3  SER  24           2HB      SER  24   1.939  -7.637  -3.497
  151    HG   SER  24           HG       SER  24   3.864  -7.355  -4.299
  152    H    GLN  25           H        GLN  25  -0.002  -5.410  -3.885
  153    HA   GLN  25           HA       GLN  25   1.356  -3.962  -5.907
  154    HB2  GLN  25           1HB      GLN  25  -1.518  -4.516  -5.276
  155    HB3  GLN  25           2HB      GLN  25  -1.115  -3.325  -6.505
  156    HG2  GLN  25           1HG      GLN  25   0.414  -5.283  -7.396
  157    HG3  GLN  25           2HG      GLN  25  -0.759  -6.268  -6.523
  158   HE21  GLN  25          1HE2      GLN  25  -2.085  -7.104  -7.968
  159   HE22  GLN  25          2HE2      GLN  25  -2.872  -6.242  -9.242
  160    H    LEU  26           H        LEU  26  -0.261  -3.039  -2.969
  161    HA   LEU  26           HA       LEU  26  -0.408  -0.241  -3.666
  162    HB2  LEU  26           1HB      LEU  26  -2.126  -0.973  -2.248
  163    HB3  LEU  26           2HB      LEU  26  -1.004  -1.828  -1.191
  164    HG   LEU  26           HG       LEU  26  -0.150   0.353  -0.396
  165   HD11  LEU  26          1HD1      LEU  26  -0.511   1.932  -2.019
  166   HD12  LEU  26          2HD1      LEU  26  -1.842   2.281  -0.918
  167   HD13  LEU  26          3HD1      LEU  26  -2.134   1.347  -2.385
  168   HD21  LEU  26          3HD2      LEU  26  -3.074  -0.280  -0.116
  169   HD22  LEU  26          1HD2      LEU  26  -2.295   1.010   0.800
  170   HD23  LEU  26          2HD2      LEU  26  -1.755  -0.658   0.993
  171    H    ILE  27           H        ILE  27   1.450  -2.199  -1.344
  172    HA   ILE  27           HA       ILE  27   3.010  -0.239  -0.210
  173    HB   ILE  27           HB       ILE  27   3.914  -3.024  -0.953
  174   HG12  ILE  27          1HG1      ILE  27   2.871  -2.114   1.722
  175   HG13  ILE  27          2HG1      ILE  27   1.791  -2.721   0.472
  176   HG21  ILE  27          1HG2      ILE  27   5.413  -0.914   0.046
  177   HG22  ILE  27          2HG2      ILE  27   5.030  -1.891   1.462
  178   HG23  ILE  27          3HG2      ILE  27   5.844  -2.624   0.080
  179   HD11  ILE  27          3HD1      ILE  27   3.103  -4.212   2.380
  180   HD12  ILE  27          1HD1      ILE  27   2.313  -4.827   0.928
  181   HD13  ILE  27          2HD1      ILE  27   4.043  -4.483   0.913
  182    H    ILE  28           H        ILE  28   3.492  -1.903  -3.290
  183    HA   ILE  28           HA       ILE  28   6.016  -0.718  -3.854
  184    HB   ILE  28           HB       ILE  28   4.005  -1.942  -5.746
  185   HG12  ILE  28          1HG1      ILE  28   6.542  -3.263  -4.863
  186   HG13  ILE  28          2HG1      ILE  28   5.147  -3.291  -3.790
  187   HG21  ILE  28          1HG2      ILE  28   5.799  -2.099  -7.343
  188   HG22  ILE  28          2HG2      ILE  28   5.627  -0.420  -6.835
  189   HG23  ILE  28          3HG2      ILE  28   6.938  -1.407  -6.188
  190   HD11  ILE  28          3HD1      ILE  28   5.035  -5.285  -4.996
  191   HD12  ILE  28          1HD1      ILE  28   3.853  -4.227  -5.768
  192   HD13  ILE  28          2HD1      ILE  28   5.427  -4.489  -6.520
  193    H    HIS  29           H        HIS  29   2.712   0.260  -4.327
  194    HA   HIS  29           HA       HIS  29   3.267   2.300  -6.256
  195    HB2  HIS  29           1HB      HIS  29   1.058   1.569  -6.339
  196    HB3  HIS  29           2HB      HIS  29   0.892   1.552  -4.586
  197    HD1  HIS  29           HD1      HIS  29   1.014   3.978  -7.481
  198    HD2  HIS  29           HD2      HIS  29  -0.151   3.841  -3.495
  199    HE1  HIS  29           HE1      HIS  29  -0.184   6.148  -7.056
  200    H    GLN  30           H        GLN  30   2.668   2.276  -2.757
  201    HA   GLN  30           HA       GLN  30   2.715   4.999  -2.270
  202    HB2  GLN  30           1HB      GLN  30   3.632   2.674  -0.587
  203    HB3  GLN  30           2HB      GLN  30   3.629   4.326   0.015
  204    HG2  GLN  30           1HG      GLN  30   1.141   4.306  -0.744
  205    HG3  GLN  30           2HG      GLN  30   1.332   2.555  -0.668
  206   HE21  GLN  30          1HE2      GLN  30   0.546   1.790   1.148
  207   HE22  GLN  30          2HE2      GLN  30   0.688   2.514   2.710
  208    H    ARG  31           H        ARG  31   5.228   3.022  -3.398
  209    HA   ARG  31           HA       ARG  31   7.470   4.342  -2.297
  210    HB2  ARG  31           1HB      ARG  31   7.294   2.910  -4.954
  211    HB3  ARG  31           2HB      ARG  31   8.756   3.242  -4.035
  212    HG2  ARG  31           1HG      ARG  31   8.005   1.759  -2.263
  213    HG3  ARG  31           2HG      ARG  31   6.503   1.456  -3.140
  214    HD2  ARG  31           1HD      ARG  31   7.569   0.225  -4.794
  215    HD3  ARG  31           2HD      ARG  31   9.144   0.936  -4.444
  216    HE   ARG  31           HE       ARG  31   8.088  -1.423  -3.319
  217   HH11  ARG  31          1HH1      ARG  31   9.893   1.424  -2.449
  218   HH12  ARG  31          2HH1      ARG  31  10.730   0.653  -1.143
  219   HH21  ARG  31          1HH2      ARG  31   9.183  -2.449  -1.602
  220   HH22  ARG  31          2HH2      ARG  31  10.326  -1.551  -0.662
  221    H    THR  32           H        THR  32   5.890   4.682  -5.473
  222    HA   THR  32           HA       THR  32   7.471   6.721  -6.493
  223    HB   THR  32           HB       THR  32   5.656   5.414  -7.708
  224    HG1  THR  32           HG1      THR  32   6.783   7.556  -8.327
  225   HG21  THR  32          3HG2      THR  32   3.765   7.611  -7.084
  226   HG22  THR  32          1HG2      THR  32   3.962   6.353  -5.865
  227   HG23  THR  32          2HG2      THR  32   3.447   5.927  -7.497
  228    H    HIS  33           H        HIS  33   5.070   6.829  -4.017
  229    HA   HIS  33           HA       HIS  33   4.506   9.624  -4.181
  230    HB2  HIS  33           1HB      HIS  33   3.914   7.430  -2.251
  231    HB3  HIS  33           2HB      HIS  33   3.781   9.089  -1.677
  232    HD1  HIS  33           HD1      HIS  33   2.290  10.617  -3.574
  233    HD2  HIS  33           HD2      HIS  33   1.542   6.551  -3.166
  234    HE1  HIS  33           HE1      HIS  33  -0.019  10.262  -4.505
  235    H    THR  34           H        THR  34   6.337   7.721  -1.780
  236    HA   THR  34           HA       THR  34   7.390   9.772  -0.292
  237    HB   THR  34           HB       THR  34   9.257   8.285   0.285
  238    HG1  THR  34           HG1      THR  34   8.303   6.289  -1.434
  239   HG21  THR  34          3HG2      THR  34   6.762   7.929   1.011
  240   HG22  THR  34          1HG2      THR  34   7.986   6.724   1.410
  241   HG23  THR  34          2HG2      THR  34   6.903   6.462   0.043
  242    H    GLY  35           H        GLY  35   8.556   8.511  -3.380
  243    HA2  GLY  35           1HA      GLY  35  11.017   9.676  -3.617
  244    HA3  GLY  35           2HA      GLY  35   9.900   9.507  -4.964
  245    H    GLU  36           H        GLU  36   7.887  11.267  -4.078
  246    HA   GLU  36           HA       GLU  36   9.240  13.807  -4.582
  247    HB2  GLU  36           1HB      GLU  36   6.447  12.803  -4.943
  248    HB3  GLU  36           2HB      GLU  36   6.716  14.533  -4.784
  249    HG2  GLU  36           1HG      GLU  36   8.516  14.102  -6.642
  250    HG3  GLU  36           2HG      GLU  36   7.529  12.677  -6.960
  251    H    SER  37           H        SER  37   6.857  12.399  -2.356
  252    HA   SER  37           HA       SER  37   6.571  14.683  -0.727
  253    HB2  SER  37           1HB      SER  37   5.163  12.460  -0.869
  254    HB3  SER  37           2HB      SER  37   6.258  11.928   0.407
  255    HG   SER  37           HG       SER  37   5.044  14.436   0.650
  256    H    GLY  38           H        GLY  38   7.129  14.532   1.714
  257    HA2  GLY  38           1HA      GLY  38   8.698  14.145   3.407
  258    HA3  GLY  38           2HA      GLY  38   9.708  13.295   2.247
  259    HA   PRO  39           HA       PRO  39  10.472  18.094   1.878
  260    HB2  PRO  39           1HB      PRO  39   9.977  19.450   4.177
  261    HB3  PRO  39           2HB      PRO  39   8.772  19.255   2.899
  262    HG2  PRO  39           1HG      PRO  39   9.088  17.728   5.455
  263    HG3  PRO  39           2HG      PRO  39   7.609  18.346   4.696
  264    HD2  PRO  39           1HD      PRO  39   8.371  15.754   4.507
  265    HD3  PRO  39           2HD      PRO  39   7.486  16.586   3.212
  266    H    SER  40           H        SER  40  11.097  15.989   4.528
  267    HA   SER  40           HA       SER  40  13.807  17.109   4.761
  268    HB2  SER  40           1HB      SER  40  12.281  17.683   6.731
  269    HB3  SER  40           2HB      SER  40  12.313  15.964   7.121
  270    HG   SER  40           HG       SER  40  13.993  17.604   8.005
  271    H    SER  41           H        SER  41  11.876  14.307   5.840
  272    HA   SER  41           HA       SER  41  13.636  12.485   4.456
  273    HB2  SER  41           1HB      SER  41  14.229  11.204   6.504
  274    HB3  SER  41           2HB      SER  41  14.927  12.823   6.491
  275    HG   SER  41           HG       SER  41  12.518  12.926   7.636
  276    H    GLY  42           H        GLY  42  12.963  10.133   5.039
  277    HA2  GLY  42           1HA      GLY  42  11.289   8.558   5.437
  278    HA3  GLY  42           2HA      GLY  42  10.199   9.863   5.879
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1 -19.938   8.305 -14.611
    2    HA2  GLY   1           1HA      GLY   1 -18.970  10.658 -13.860
    3    HA3  GLY   1           2HA      GLY   1 -20.086   9.793 -12.815
    4    H    SER   2           H        SER   2 -16.654   9.283 -13.617
    5    HA   SER   2           HA       SER   2 -14.834   8.943 -12.292
    6    HB2  SER   2           1HB      SER   2 -16.309  11.161 -10.930
    7    HB3  SER   2           2HB      SER   2 -14.903  10.458 -10.131
    8    HG   SER   2           HG       SER   2 -14.319  10.902 -12.700
    9    H    SER   3           H        SER   3 -16.805   7.010 -12.011
   10    HA   SER   3           HA       SER   3 -16.890   6.453  -9.129
   11    HB2  SER   3           1HB      SER   3 -19.069   6.287 -10.041
   12    HB3  SER   3           2HB      SER   3 -18.496   5.408 -11.459
   13    HG   SER   3           HG       SER   3 -18.483   3.598 -10.348
   14    H    GLY   4           H        GLY   4 -16.051   4.960 -12.240
   15    HA2  GLY   4           1HA      GLY   4 -14.924   2.965 -12.661
   16    HA3  GLY   4           2HA      GLY   4 -13.712   3.796 -11.697
   17    H    SER   5           H        SER   5 -16.508   1.632 -11.459
   18    HA   SER   5           HA       SER   5 -15.362   0.555  -8.968
   19    HB2  SER   5           1HB      SER   5 -18.212   0.633  -9.967
   20    HB3  SER   5           2HB      SER   5 -17.704  -0.358  -8.600
   21    HG   SER   5           HG       SER   5 -16.743   1.890  -7.966
   22    H    SER   6           H        SER   6 -14.026  -1.030  -9.695
   23    HA   SER   6           HA       SER   6 -15.304  -3.364 -10.870
   24    HB2  SER   6           1HB      SER   6 -13.685  -3.606 -12.659
   25    HB3  SER   6           2HB      SER   6 -14.454  -2.025 -12.797
   26    HG   SER   6           HG       SER   6 -12.347  -1.720 -11.247
   27    H    GLY   7           H        GLY   7 -14.731  -5.048  -9.676
   28    HA2  GLY   7           1HA      GLY   7 -13.419  -6.524  -8.489
   29    HA3  GLY   7           2HA      GLY   7 -12.011  -5.625  -9.035
   30    H    GLU   8           H        GLU   8 -13.488  -6.632  -6.352
   31    HA   GLU   8           HA       GLU   8 -13.555  -4.310  -4.723
   32    HB2  GLU   8           1HB      GLU   8 -13.595  -7.256  -4.224
   33    HB3  GLU   8           2HB      GLU   8 -13.296  -6.172  -2.872
   34    HG2  GLU   8           1HG      GLU   8 -15.680  -5.962  -4.692
   35    HG3  GLU   8           2HG      GLU   8 -15.674  -6.849  -3.169
   36    H    LYS   9           H        LYS   9 -11.992  -3.282  -3.638
   37    HA   LYS   9           HA       LYS   9  -9.350  -4.563  -3.435
   38    HB2  LYS   9           1HB      LYS   9  -9.843  -1.656  -4.106
   39    HB3  LYS   9           2HB      LYS   9  -8.274  -2.435  -3.942
   40    HG2  LYS   9           1HG      LYS   9  -8.764  -3.843  -5.873
   41    HG3  LYS   9           2HG      LYS   9 -10.346  -3.076  -6.033
   42    HD2  LYS   9           1HD      LYS   9  -9.196  -0.895  -6.341
   43    HD3  LYS   9           2HD      LYS   9  -7.651  -1.748  -6.317
   44    HE2  LYS   9           1HE      LYS   9  -8.430  -3.095  -8.253
   45    HE3  LYS   9           2HE      LYS   9  -9.889  -2.106  -8.308
   46    HZ1  LYS   9           3HZ      LYS   9  -8.355  -0.149  -8.554
   47    HZ2  LYS   9           1HZ      LYS   9  -8.407  -1.203  -9.876
   48    HZ3  LYS   9           2HZ      LYS   9  -7.097  -1.251  -8.807
   49    HA   PRO  10           HA       PRO  10 -10.461  -3.385   0.804
   50    HB2  PRO  10           1HB      PRO  10  -8.763  -5.159   1.961
   51    HB3  PRO  10           2HB      PRO  10 -10.364  -5.611   1.364
   52    HG2  PRO  10           1HG      PRO  10  -7.690  -5.956   0.063
   53    HG3  PRO  10           2HG      PRO  10  -9.045  -7.096   0.153
   54    HD2  PRO  10           1HD      PRO  10  -8.537  -5.608  -2.051
   55    HD3  PRO  10           2HD      PRO  10 -10.182  -6.076  -1.573
   56    H    TYR  11           H        TYR  11  -7.641  -3.099  -1.038
   57    HA   TYR  11           HA       TYR  11  -6.278  -1.627   1.120
   58    HB2  TYR  11           1HB      TYR  11  -5.009  -2.772  -1.372
   59    HB3  TYR  11           2HB      TYR  11  -4.183  -2.075   0.017
   60    HD1  TYR  11           HD2      TYR  11  -3.965  -3.328   2.093
   61    HD2  TYR  11           HD1      TYR  11  -5.931  -5.015  -1.282
   62    HE1  TYR  11           HE2      TYR  11  -3.819  -5.554   3.129
   63    HE2  TYR  11           HE1      TYR  11  -5.791  -7.246  -0.255
   64    HH   TYR  11           HH       TYR  11  -5.338  -8.373   1.645
   65    H    GLU  12           H        GLU  12  -5.943   0.494   0.878
   66    HA   GLU  12           HA       GLU  12  -6.111   1.675  -1.799
   67    HB2  GLU  12           1HB      GLU  12  -7.897   2.221   0.517
   68    HB3  GLU  12           2HB      GLU  12  -7.393   3.595  -0.457
   69    HG2  GLU  12           1HG      GLU  12  -9.326   3.016  -1.515
   70    HG3  GLU  12           2HG      GLU  12  -8.158   2.081  -2.447
   71    H    CYS  13           H        CYS  13  -4.811   3.430  -2.126
   72    HA   CYS  13           HA       CYS  13  -2.667   3.825  -0.284
   73    HB2  CYS  13           1HB      CYS  13  -2.572   3.980  -2.837
   74    HB3  CYS  13           2HB      CYS  13  -3.288   5.578  -2.657
   75    H    THR  14           H        THR  14  -2.505   5.236   1.326
   76    HA   THR  14           HA       THR  14  -4.669   7.086   1.829
   77    HB   THR  14           HB       THR  14  -3.416   7.601   3.929
   78    HG1  THR  14           HG1      THR  14  -1.693   5.484   3.118
   79   HG21  THR  14          3HG2      THR  14  -3.637   5.251   4.880
   80   HG22  THR  14          1HG2      THR  14  -4.086   4.745   3.252
   81   HG23  THR  14          2HG2      THR  14  -5.073   5.926   4.112
   82    H    ASP  15           H        ASP  15  -1.767   7.206   0.160
   83    HA   ASP  15           HA       ASP  15  -1.049   9.922   0.783
   84    HB2  ASP  15           1HB      ASP  15  -0.053   7.815  -1.077
   85    HB3  ASP  15           2HB      ASP  15   0.342   9.492  -1.444
   86    H    CYS  16           H        CYS  16  -2.511   8.266  -2.004
   87    HA   CYS  16           HA       CYS  16  -3.448  10.891  -2.962
   88    HB2  CYS  16           1HB      CYS  16  -3.593   9.823  -5.208
   89    HB3  CYS  16           2HB      CYS  16  -1.953   9.881  -4.569
   90    H    GLY  17           H        GLY  17  -4.336   7.459  -2.697
   91    HA2  GLY  17           1HA      GLY  17  -6.573   7.123  -1.612
   92    HA3  GLY  17           2HA      GLY  17  -7.169   8.294  -2.779
   93    H    LYS  18           H        LYS  18  -4.760   6.108  -3.876
   94    HA   LYS  18           HA       LYS  18  -6.514   5.002  -5.834
   95    HB2  LYS  18           1HB      LYS  18  -3.641   4.685  -5.107
   96    HB3  LYS  18           2HB      LYS  18  -4.384   3.426  -6.085
   97    HG2  LYS  18           1HG      LYS  18  -5.122   5.238  -7.665
   98    HG3  LYS  18           2HG      LYS  18  -4.097   6.344  -6.747
   99    HD2  LYS  18           1HD      LYS  18  -2.155   5.361  -7.473
  100    HD3  LYS  18           2HD      LYS  18  -2.917   3.788  -7.720
  101    HE2  LYS  18           1HE      LYS  18  -3.680   4.334  -9.804
  102    HE3  LYS  18           2HE      LYS  18  -3.809   6.051  -9.426
  103    HZ1  LYS  18           3HZ      LYS  18  -1.960   6.206 -10.651
  104    HZ2  LYS  18           1HZ      LYS  18  -1.580   4.564 -10.502
  105    HZ3  LYS  18           2HZ      LYS  18  -1.161   5.644  -9.270
  106    H    ALA  19           H        ALA  19  -6.370   2.496  -6.176
  107    HA   ALA  19           HA       ALA  19  -6.777   1.118  -3.612
  108    HB1  ALA  19           3HB      ALA  19  -8.983   1.693  -4.373
  109    HB2  ALA  19           1HB      ALA  19  -8.645   1.043  -5.977
  110    HB3  ALA  19           2HB      ALA  19  -8.743  -0.041  -4.588
  111    H    PHE  20           H        PHE  20  -6.431  -1.141  -3.652
  112    HA   PHE  20           HA       PHE  20  -5.446  -2.362  -6.093
  113    HB2  PHE  20           1HB      PHE  20  -3.674  -2.181  -3.648
  114    HB3  PHE  20           2HB      PHE  20  -3.290  -2.996  -5.161
  115    HD1  PHE  20           HD1      PHE  20  -3.987   0.323  -3.674
  116    HD2  PHE  20           HD2      PHE  20  -2.301  -1.835  -6.932
  117    HE1  PHE  20           HE1      PHE  20  -2.995   2.404  -4.534
  118    HE2  PHE  20           HE2      PHE  20  -1.306   0.242  -7.797
  119    HZ   PHE  20           HZ       PHE  20  -1.651   2.365  -6.597
  120    H    GLY  21           H        GLY  21  -6.184  -4.377  -6.191
  121    HA2  GLY  21           1HA      GLY  21  -7.676  -5.568  -4.137
  122    HA3  GLY  21           2HA      GLY  21  -7.073  -6.397  -5.565
  123    H    LEU  22           H        LEU  22  -4.268  -5.642  -4.790
  124    HA   LEU  22           HA       LEU  22  -3.909  -7.779  -2.804
  125    HB2  LEU  22           1HB      LEU  22  -2.351  -6.847  -5.147
  126    HB3  LEU  22           2HB      LEU  22  -1.443  -7.462  -3.767
  127    HG   LEU  22           HG       LEU  22  -3.388  -8.929  -5.527
  128   HD11  LEU  22          1HD1      LEU  22  -1.261 -10.515  -5.294
  129   HD12  LEU  22          2HD1      LEU  22  -0.473  -8.963  -5.015
  130   HD13  LEU  22          3HD1      LEU  22  -1.369  -9.241  -6.508
  131   HD21  LEU  22          3HD2      LEU  22  -2.710  -9.402  -2.705
  132   HD22  LEU  22          1HD2      LEU  22  -2.556 -10.804  -3.764
  133   HD23  LEU  22          2HD2      LEU  22  -4.095  -9.949  -3.651
  134    H    LYS  23           H        LYS  23  -1.943  -7.528  -1.395
  135    HA   LYS  23           HA       LYS  23  -2.003  -4.879  -0.195
  136    HB2  LYS  23           1HB      LYS  23  -2.258  -6.704   1.336
  137    HB3  LYS  23           2HB      LYS  23  -0.831  -7.513   0.701
  138    HG2  LYS  23           1HG      LYS  23   0.025  -6.619   2.613
  139    HG3  LYS  23           2HG      LYS  23   0.365  -5.306   1.483
  140    HD2  LYS  23           1HD      LYS  23  -1.869  -4.322   2.191
  141    HD3  LYS  23           2HD      LYS  23  -1.854  -5.498   3.506
  142    HE2  LYS  23           1HE      LYS  23   0.183  -4.578   4.381
  143    HE3  LYS  23           2HE      LYS  23   0.356  -3.516   2.985
  144    HZ1  LYS  23           3HZ      LYS  23  -1.895  -3.379   4.914
  145    HZ2  LYS  23           1HZ      LYS  23  -1.570  -2.296   3.656
  146    HZ3  LYS  23           2HZ      LYS  23  -0.523  -2.393   4.981
  147    H    SER  24           H        SER  24   0.153  -6.943  -1.988
  148    HA   SER  24           HA       SER  24   2.500  -5.363  -1.433
  149    HB2  SER  24           1HB      SER  24   2.924  -7.663  -1.836
  150    HB3  SER  24           2HB      SER  24   1.938  -7.667  -3.299
  151    HG   SER  24           HG       SER  24   3.606  -7.015  -4.389
  152    H    GLN  25           H        GLN  25   0.028  -5.517  -3.884
  153    HA   GLN  25           HA       GLN  25   1.360  -4.060  -5.902
  154    HB2  GLN  25           1HB      GLN  25  -1.512  -4.666  -5.298
  155    HB3  GLN  25           2HB      GLN  25  -1.110  -3.514  -6.565
  156    HG2  GLN  25           1HG      GLN  25   0.478  -5.477  -7.344
  157    HG3  GLN  25           2HG      GLN  25  -0.700  -6.448  -6.463
  158   HE21  GLN  25          1HE2      GLN  25  -2.341  -7.154  -7.610
  159   HE22  GLN  25          2HE2      GLN  25  -2.969  -6.433  -9.048
  160    H    LEU  26           H        LEU  26  -0.375  -3.106  -3.033
  161    HA   LEU  26           HA       LEU  26  -0.581  -0.336  -3.797
  162    HB2  LEU  26           1HB      LEU  26  -2.288  -1.122  -2.378
  163    HB3  LEU  26           2HB      LEU  26  -1.133  -1.853  -1.265
  164    HG   LEU  26           HG       LEU  26  -0.418   0.415  -0.580
  165   HD11  LEU  26          1HD1      LEU  26  -1.148   2.305  -1.535
  166   HD12  LEU  26          2HD1      LEU  26  -2.796   1.701  -1.708
  167   HD13  LEU  26          3HD1      LEU  26  -1.566   1.261  -2.894
  168   HD21  LEU  26          3HD2      LEU  26  -2.325   0.875   0.797
  169   HD22  LEU  26          1HD2      LEU  26  -2.172  -0.874   0.627
  170   HD23  LEU  26          2HD2      LEU  26  -3.390  -0.002  -0.303
  171    H    ILE  27           H        ILE  27   1.342  -2.194  -1.453
  172    HA   ILE  27           HA       ILE  27   2.815  -0.149  -0.333
  173    HB   ILE  27           HB       ILE  27   3.803  -2.923  -1.005
  174   HG12  ILE  27          1HG1      ILE  27   2.759  -1.969   1.653
  175   HG13  ILE  27          2HG1      ILE  27   1.680  -2.625   0.427
  176   HG21  ILE  27          1HG2      ILE  27   5.773  -2.120  -0.320
  177   HG22  ILE  27          2HG2      ILE  27   5.048  -0.647   0.322
  178   HG23  ILE  27          3HG2      ILE  27   5.064  -2.118   1.295
  179   HD11  ILE  27          3HD1      ILE  27   3.119  -4.682   0.421
  180   HD12  ILE  27          1HD1      ILE  27   3.930  -4.020   1.840
  181   HD13  ILE  27          2HD1      ILE  27   2.206  -4.389   1.901
  182    H    ILE  28           H        ILE  28   3.505  -1.964  -3.304
  183    HA   ILE  28           HA       ILE  28   5.952  -0.701  -3.898
  184    HB   ILE  28           HB       ILE  28   3.955  -2.018  -5.740
  185   HG12  ILE  28          1HG1      ILE  28   6.611  -3.147  -4.928
  186   HG13  ILE  28          2HG1      ILE  28   5.237  -3.287  -3.837
  187   HG21  ILE  28          1HG2      ILE  28   5.825  -2.152  -7.348
  188   HG22  ILE  28          2HG2      ILE  28   5.320  -0.495  -7.021
  189   HG23  ILE  28          3HG2      ILE  28   6.786  -1.133  -6.278
  190   HD11  ILE  28          3HD1      ILE  28   4.132  -4.745  -5.198
  191   HD12  ILE  28          1HD1      ILE  28   4.895  -4.130  -6.664
  192   HD13  ILE  28          2HD1      ILE  28   5.804  -5.170  -5.566
  193    H    HIS  29           H        HIS  29   2.631   0.206  -4.469
  194    HA   HIS  29           HA       HIS  29   3.159   2.227  -6.404
  195    HB2  HIS  29           1HB      HIS  29   0.947   1.489  -6.424
  196    HB3  HIS  29           2HB      HIS  29   0.815   1.526  -4.668
  197    HD1  HIS  29           HD1      HIS  29   1.152   3.996  -7.540
  198    HD2  HIS  29           HD2      HIS  29  -0.475   3.714  -3.728
  199    HE1  HIS  29           HE1      HIS  29  -0.104   6.145  -7.184
  200    H    GLN  30           H        GLN  30   2.412   2.379  -2.922
  201    HA   GLN  30           HA       GLN  30   2.537   5.077  -2.501
  202    HB2  GLN  30           1HB      GLN  30   3.473   2.799  -0.766
  203    HB3  GLN  30           2HB      GLN  30   3.489   4.466  -0.208
  204    HG2  GLN  30           1HG      GLN  30   1.111   4.631  -0.441
  205    HG3  GLN  30           2HG      GLN  30   1.033   3.041  -1.199
  206   HE21  GLN  30          1HE2      GLN  30  -0.598   3.181   0.758
  207   HE22  GLN  30          2HE2      GLN  30  -0.009   2.455   2.211
  208    H    ARG  31           H        ARG  31   5.108   2.984  -3.406
  209    HA   ARG  31           HA       ARG  31   7.334   4.344  -2.424
  210    HB2  ARG  31           1HB      ARG  31   7.063   2.859  -5.045
  211    HB3  ARG  31           2HB      ARG  31   8.580   3.285  -4.263
  212    HG2  ARG  31           1HG      ARG  31   7.568   1.936  -2.258
  213    HG3  ARG  31           2HG      ARG  31   6.585   1.205  -3.528
  214    HD2  ARG  31           1HD      ARG  31   8.374   0.186  -4.517
  215    HD3  ARG  31           2HD      ARG  31   9.510   1.426  -3.988
  216    HE   ARG  31           HE       ARG  31   8.460  -0.149  -1.832
  217   HH11  ARG  31          1HH1      ARG  31  10.897   0.027  -4.312
  218   HH12  ARG  31          2HH1      ARG  31  12.002  -1.019  -3.482
  219   HH21  ARG  31          1HH2      ARG  31   9.906  -1.527  -0.730
  220   HH22  ARG  31          2HH2      ARG  31  11.437  -1.903  -1.446
  221    H    THR  32           H        THR  32   5.398   4.912  -5.316
  222    HA   THR  32           HA       THR  32   7.028   6.792  -6.580
  223    HB   THR  32           HB       THR  32   5.091   7.504  -7.808
  224    HG1  THR  32           HG1      THR  32   3.346   7.757  -6.629
  225   HG21  THR  32          3HG2      THR  32   4.762   4.577  -7.142
  226   HG22  THR  32          1HG2      THR  32   5.949   5.228  -8.271
  227   HG23  THR  32          2HG2      THR  32   4.226   5.389  -8.613
  228    H    HIS  33           H        HIS  33   4.683   7.165  -3.979
  229    HA   HIS  33           HA       HIS  33   4.660  10.001  -3.969
  230    HB2  HIS  33           1HB      HIS  33   3.937   7.955  -1.869
  231    HB3  HIS  33           2HB      HIS  33   3.746   9.689  -1.622
  232    HD1  HIS  33           HD1      HIS  33   2.295  10.795  -3.815
  233    HD2  HIS  33           HD2      HIS  33   1.625   6.852  -2.690
  234    HE1  HIS  33           HE1      HIS  33   0.033  10.206  -4.744
  235    H    THR  34           H        THR  34   6.313   7.650  -1.860
  236    HA   THR  34           HA       THR  34   7.787   9.595  -0.427
  237    HB   THR  34           HB       THR  34   9.177   7.700   0.350
  238    HG1  THR  34           HG1      THR  34   9.244   6.367  -1.432
  239   HG21  THR  34          3HG2      THR  34   6.195   7.576   0.409
  240   HG22  THR  34          1HG2      THR  34   7.331   7.922   1.712
  241   HG23  THR  34          2HG2      THR  34   7.123   6.267   1.140
  242    H    GLY  35           H        GLY  35   8.670  10.952  -2.074
  243    HA2  GLY  35           1HA      GLY  35  11.338  10.549  -2.663
  244    HA3  GLY  35           2HA      GLY  35  10.455   9.954  -4.061
  245    H    GLU  36           H        GLU  36  11.715  11.699  -5.121
  246    HA   GLU  36           HA       GLU  36  10.476  14.340  -4.730
  247    HB2  GLU  36           1HB      GLU  36  13.016  14.035  -4.516
  248    HB3  GLU  36           2HB      GLU  36  13.015  13.816  -6.261
  249    HG2  GLU  36           1HG      GLU  36  11.784  16.062  -6.343
  250    HG3  GLU  36           2HG      GLU  36  12.321  16.258  -4.676
  251    H    SER  37           H        SER  37   9.026  12.431  -6.119
  252    HA   SER  37           HA       SER  37   9.347  13.185  -8.942
  253    HB2  SER  37           1HB      SER  37   8.098  11.225  -9.516
  254    HB3  SER  37           2HB      SER  37   9.286  10.735  -8.308
  255    HG   SER  37           HG       SER  37   6.573  11.376  -7.769
  256    H    GLY  38           H        GLY  38   7.876  14.423  -9.941
  257    HA2  GLY  38           1HA      GLY  38   5.311  14.712 -10.016
  258    HA3  GLY  38           2HA      GLY  38   5.539  15.267  -8.364
  259    HA   PRO  39           HA       PRO  39   5.753  18.922 -11.235
  260    HB2  PRO  39           1HB      PRO  39   3.984  20.436  -9.839
  261    HB3  PRO  39           2HB      PRO  39   3.490  19.294 -11.095
  262    HG2  PRO  39           1HG      PRO  39   3.486  18.957  -8.120
  263    HG3  PRO  39           2HG      PRO  39   2.250  18.486  -9.301
  264    HD2  PRO  39           1HD      PRO  39   4.011  16.717  -8.251
  265    HD3  PRO  39           2HD      PRO  39   3.376  16.567  -9.903
  266    H    SER  40           H        SER  40   6.893  20.806 -10.875
  267    HA   SER  40           HA       SER  40   8.752  20.903  -8.836
  268    HB2  SER  40           1HB      SER  40   8.924  22.194 -10.941
  269    HB3  SER  40           2HB      SER  40   7.643  23.266 -10.373
  270    HG   SER  40           HG       SER  40   9.105  23.617  -8.503
  271    H    SER  41           H        SER  41   8.009  20.692  -6.775
  272    HA   SER  41           HA       SER  41   6.817  23.041  -5.581
  273    HB2  SER  41           1HB      SER  41   5.421  20.359  -5.407
  274    HB3  SER  41           2HB      SER  41   4.972  21.807  -4.506
  275    HG   SER  41           HG       SER  41   4.048  21.145  -6.805
  276    H    GLY  42           H        GLY  42   6.914  23.018  -3.246
  277    HA2  GLY  42           1HA      GLY  42   7.980  20.925  -1.717
  278    HA3  GLY  42           2HA      GLY  42   9.316  21.929  -2.259
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1 -12.796 -13.700 -21.914
    2    HA2  GLY   1           1HA      GLY   1 -11.108 -15.862 -22.252
    3    HA3  GLY   1           2HA      GLY   1 -10.063 -14.505 -21.857
    4    H    SER   2           H        SER   2 -10.027 -13.696 -19.788
    5    HA   SER   2           HA       SER   2 -11.287 -15.410 -17.779
    6    HB2  SER   2           1HB      SER   2  -8.808 -14.949 -17.723
    7    HB3  SER   2           2HB      SER   2  -9.193 -13.271 -17.342
    8    HG   SER   2           HG       SER   2  -9.069 -14.083 -15.375
    9    H    SER   3           H        SER   3 -12.793 -14.715 -16.367
   10    HA   SER   3           HA       SER   3 -13.284 -11.905 -15.930
   11    HB2  SER   3           1HB      SER   3 -14.559 -12.082 -17.937
   12    HB3  SER   3           2HB      SER   3 -15.254 -13.626 -17.441
   13    HG   SER   3           HG       SER   3 -16.579 -11.634 -17.183
   14    H    GLY   4           H        GLY   4 -13.953 -11.605 -13.900
   15    HA2  GLY   4           1HA      GLY   4 -15.881 -12.943 -12.490
   16    HA3  GLY   4           2HA      GLY   4 -14.417 -13.873 -12.206
   17    H    SER   5           H        SER   5 -15.710 -10.570 -12.030
   18    HA   SER   5           HA       SER   5 -13.820  -9.214 -10.681
   19    HB2  SER   5           1HB      SER   5 -16.104  -8.358 -11.259
   20    HB3  SER   5           2HB      SER   5 -16.727  -9.195  -9.837
   21    HG   SER   5           HG       SER   5 -16.228  -7.391  -8.873
   22    H    SER   6           H        SER   6 -12.548  -9.784  -9.056
   23    HA   SER   6           HA       SER   6 -13.456 -11.686  -7.059
   24    HB2  SER   6           1HB      SER   6 -10.792 -10.418  -7.676
   25    HB3  SER   6           2HB      SER   6 -11.048 -11.366  -6.211
   26    HG   SER   6           HG       SER   6 -10.690 -13.032  -7.426
   27    H    GLY   7           H        GLY   7 -14.866  -9.293  -6.936
   28    HA2  GLY   7           1HA      GLY   7 -15.660  -7.906  -5.273
   29    HA3  GLY   7           2HA      GLY   7 -14.450  -8.587  -4.195
   30    H    GLU   8           H        GLU   8 -14.959  -5.972  -3.930
   31    HA   GLU   8           HA       GLU   8 -13.376  -4.278  -5.567
   32    HB2  GLU   8           1HB      GLU   8 -14.650  -3.954  -2.862
   33    HB3  GLU   8           2HB      GLU   8 -13.631  -2.696  -3.546
   34    HG2  GLU   8           1HG      GLU   8 -15.231  -3.009  -5.617
   35    HG3  GLU   8           2HG      GLU   8 -16.325  -3.621  -4.378
   36    H    LYS   9           H        LYS   9 -11.647  -2.840  -4.443
   37    HA   LYS   9           HA       LYS   9  -9.575  -4.653  -3.504
   38    HB2  LYS   9           1HB      LYS   9  -9.432  -1.720  -4.228
   39    HB3  LYS   9           2HB      LYS   9  -8.056  -2.751  -3.862
   40    HG2  LYS   9           1HG      LYS   9  -8.217  -3.903  -5.853
   41    HG3  LYS   9           2HG      LYS   9  -9.921  -3.496  -6.070
   42    HD2  LYS   9           1HD      LYS   9  -7.864  -1.327  -6.078
   43    HD3  LYS   9           2HD      LYS   9  -8.097  -2.317  -7.521
   44    HE2  LYS   9           1HE      LYS   9 -10.298  -0.826  -6.099
   45    HE3  LYS   9           2HE      LYS   9  -9.430  -0.214  -7.506
   46    HZ1  LYS   9           3HZ      LYS   9 -10.534  -1.578  -8.886
   47    HZ2  LYS   9           1HZ      LYS   9 -11.689  -1.619  -7.650
   48    HZ3  LYS   9           2HZ      LYS   9 -10.560  -2.869  -7.793
   49    HA   PRO  10           HA       PRO  10 -10.550  -3.389   0.692
   50    HB2  PRO  10           1HB      PRO  10  -8.870  -5.168   1.867
   51    HB3  PRO  10           2HB      PRO  10 -10.462  -5.617   1.244
   52    HG2  PRO  10           1HG      PRO  10  -7.769  -5.959  -0.018
   53    HG3  PRO  10           2HG      PRO  10  -9.127  -7.098   0.048
   54    HD2  PRO  10           1HD      PRO  10  -8.585  -5.602  -2.143
   55    HD3  PRO  10           2HD      PRO  10 -10.237  -6.071  -1.691
   56    H    TYR  11           H        TYR  11  -7.697  -3.107  -1.105
   57    HA   TYR  11           HA       TYR  11  -6.343  -1.677   1.085
   58    HB2  TYR  11           1HB      TYR  11  -5.103  -2.738  -1.460
   59    HB3  TYR  11           2HB      TYR  11  -4.256  -2.060  -0.074
   60    HD1  TYR  11           HD1      TYR  11  -6.094  -4.977  -1.342
   61    HD2  TYR  11           HD2      TYR  11  -3.884  -3.367   1.918
   62    HE1  TYR  11           HE1      TYR  11  -5.909  -7.226  -0.364
   63    HE2  TYR  11           HE2      TYR  11  -3.692  -5.611   2.904
   64    HH   TYR  11           HH       TYR  11  -4.042  -8.325   1.384
   65    H    GLU  12           H        GLU  12  -6.032   0.454   0.924
   66    HA   GLU  12           HA       GLU  12  -6.233   1.736  -1.704
   67    HB2  GLU  12           1HB      GLU  12  -7.990   2.186   0.655
   68    HB3  GLU  12           2HB      GLU  12  -7.507   3.596  -0.278
   69    HG2  GLU  12           1HG      GLU  12  -9.430   3.061  -1.358
   70    HG3  GLU  12           2HG      GLU  12  -8.288   2.106  -2.301
   71    H    CYS  13           H        CYS  13  -4.950   3.514  -1.978
   72    HA   CYS  13           HA       CYS  13  -2.794   3.854  -0.129
   73    HB2  CYS  13           1HB      CYS  13  -2.583   4.043  -2.624
   74    HB3  CYS  13           2HB      CYS  13  -3.466   5.563  -2.530
   75    H    THR  14           H        THR  14  -2.697   5.178   1.552
   76    HA   THR  14           HA       THR  14  -4.815   7.127   1.966
   77    HB   THR  14           HB       THR  14  -3.941   7.359   4.227
   78    HG1  THR  14           HG1      THR  14  -1.841   5.712   3.240
   79   HG21  THR  14          3HG2      THR  14  -4.387   4.608   3.140
   80   HG22  THR  14          1HG2      THR  14  -5.424   5.582   4.181
   81   HG23  THR  14          2HG2      THR  14  -3.977   4.821   4.842
   82    H    ASP  15           H        ASP  15  -2.627   7.517  -0.037
   83    HA   ASP  15           HA       ASP  15  -1.580  10.063   1.015
   84    HB2  ASP  15           1HB      ASP  15  -0.271   7.909  -0.562
   85    HB3  ASP  15           2HB      ASP  15   0.161   9.570  -0.957
   86    H    CYS  16           H        CYS  16  -2.918   8.349  -1.747
   87    HA   CYS  16           HA       CYS  16  -3.521  10.955  -2.983
   88    HB2  CYS  16           1HB      CYS  16  -3.337   9.854  -5.193
   89    HB3  CYS  16           2HB      CYS  16  -1.815   9.839  -4.308
   90    H    GLY  17           H        GLY  17  -4.532   7.612  -2.476
   91    HA2  GLY  17           1HA      GLY  17  -6.882   7.310  -1.809
   92    HA3  GLY  17           2HA      GLY  17  -7.300   8.465  -3.065
   93    H    LYS  18           H        LYS  18  -4.816   6.209  -3.797
   94    HA   LYS  18           HA       LYS  18  -6.353   5.082  -5.929
   95    HB2  LYS  18           1HB      LYS  18  -3.750   5.484  -5.677
   96    HB3  LYS  18           2HB      LYS  18  -3.787   3.855  -5.016
   97    HG2  LYS  18           1HG      LYS  18  -4.350   2.903  -7.016
   98    HG3  LYS  18           2HG      LYS  18  -5.146   4.361  -7.611
   99    HD2  LYS  18           1HD      LYS  18  -2.210   4.445  -7.123
  100    HD3  LYS  18           2HD      LYS  18  -2.802   3.591  -8.551
  101    HE2  LYS  18           1HE      LYS  18  -3.960   5.586  -9.297
  102    HE3  LYS  18           2HE      LYS  18  -3.479   6.442  -7.833
  103    HZ1  LYS  18           3HZ      LYS  18  -2.063   6.172 -10.243
  104    HZ2  LYS  18           1HZ      LYS  18  -1.167   5.433  -9.013
  105    HZ3  LYS  18           2HZ      LYS  18  -1.635   7.051  -8.863
  106    H    ALA  19           H        ALA  19  -6.049   2.534  -6.176
  107    HA   ALA  19           HA       ALA  19  -6.681   1.182  -3.661
  108    HB1  ALA  19           3HB      ALA  19  -8.820   1.950  -4.699
  109    HB2  ALA  19           1HB      ALA  19  -8.460   0.909  -6.077
  110    HB3  ALA  19           2HB      ALA  19  -8.700   0.205  -4.478
  111    H    PHE  20           H        PHE  20  -6.381  -1.082  -3.709
  112    HA   PHE  20           HA       PHE  20  -5.357  -2.305  -6.134
  113    HB2  PHE  20           1HB      PHE  20  -3.658  -2.167  -3.635
  114    HB3  PHE  20           2HB      PHE  20  -3.250  -3.013  -5.124
  115    HD1  PHE  20           HD1      PHE  20  -3.700   0.293  -3.577
  116    HD2  PHE  20           HD2      PHE  20  -2.368  -1.853  -7.002
  117    HE1  PHE  20           HE1      PHE  20  -2.620   2.333  -4.430
  118    HE2  PHE  20           HE2      PHE  20  -1.285   0.182  -7.861
  119    HZ   PHE  20           HZ       PHE  20  -1.409   2.279  -6.574
  120    H    GLY  21           H        GLY  21  -5.843  -4.425  -6.240
  121    HA2  GLY  21           1HA      GLY  21  -7.507  -5.564  -4.221
  122    HA3  GLY  21           2HA      GLY  21  -6.932  -6.373  -5.672
  123    H    LEU  22           H        LEU  22  -4.142  -5.416  -4.575
  124    HA   LEU  22           HA       LEU  22  -3.816  -7.679  -2.716
  125    HB2  LEU  22           1HB      LEU  22  -2.256  -6.838  -5.091
  126    HB3  LEU  22           2HB      LEU  22  -1.351  -7.457  -3.711
  127    HG   LEU  22           HG       LEU  22  -3.363  -8.894  -5.420
  128   HD11  LEU  22          1HD1      LEU  22  -0.444  -9.012  -4.943
  129   HD12  LEU  22          2HD1      LEU  22  -1.367  -9.283  -6.421
  130   HD13  LEU  22          3HD1      LEU  22  -1.286 -10.542  -5.189
  131   HD21  LEU  22          3HD2      LEU  22  -2.629  -9.358  -2.602
  132   HD22  LEU  22          1HD2      LEU  22  -2.597 -10.773  -3.654
  133   HD23  LEU  22          2HD2      LEU  22  -4.078  -9.827  -3.493
  134    H    LYS  23           H        LYS  23  -1.871  -7.477  -1.300
  135    HA   LYS  23           HA       LYS  23  -1.826  -4.819  -0.136
  136    HB2  LYS  23           1HB      LYS  23  -2.082  -6.608   1.423
  137    HB3  LYS  23           2HB      LYS  23  -0.712  -7.480   0.747
  138    HG2  LYS  23           1HG      LYS  23   0.194  -6.603   2.663
  139    HG3  LYS  23           2HG      LYS  23   0.637  -5.376   1.473
  140    HD2  LYS  23           1HD      LYS  23  -1.273  -4.018   2.147
  141    HD3  LYS  23           2HD      LYS  23  -1.758  -5.256   3.309
  142    HE2  LYS  23           1HE      LYS  23   0.959  -3.986   3.410
  143    HE3  LYS  23           2HE      LYS  23  -0.438  -3.226   4.170
  144    HZ1  LYS  23           3HZ      LYS  23   1.171  -5.217   5.221
  145    HZ2  LYS  23           1HZ      LYS  23  -0.312  -5.957   4.883
  146    HZ3  LYS  23           2HZ      LYS  23  -0.255  -4.595   5.884
  147    H    SER  24           H        SER  24   0.235  -6.907  -1.997
  148    HA   SER  24           HA       SER  24   2.630  -5.377  -1.484
  149    HB2  SER  24           1HB      SER  24   2.811  -7.778  -1.906
  150    HB3  SER  24           2HB      SER  24   2.072  -7.573  -3.494
  151    HG   SER  24           HG       SER  24   4.056  -7.318  -4.135
  152    H    GLN  25           H        GLN  25   0.093  -5.481  -3.866
  153    HA   GLN  25           HA       GLN  25   1.420  -4.045  -5.914
  154    HB2  GLN  25           1HB      GLN  25  -1.456  -4.619  -5.280
  155    HB3  GLN  25           2HB      GLN  25  -1.041  -3.501  -6.573
  156    HG2  GLN  25           1HG      GLN  25   0.508  -5.492  -7.332
  157    HG3  GLN  25           2HG      GLN  25  -0.654  -6.439  -6.404
  158   HE21  GLN  25          1HE2      GLN  25  -2.214  -7.247  -7.588
  159   HE22  GLN  25          2HE2      GLN  25  -2.910  -6.530  -8.997
  160    H    LEU  26           H        LEU  26  -0.184  -3.092  -2.990
  161    HA   LEU  26           HA       LEU  26  -0.430  -0.318  -3.762
  162    HB2  LEU  26           1HB      LEU  26  -2.114  -1.082  -2.312
  163    HB3  LEU  26           2HB      LEU  26  -0.950  -1.845  -1.231
  164    HG   LEU  26           HG       LEU  26  -0.197   0.376  -0.496
  165   HD11  LEU  26          1HD1      LEU  26  -0.832   1.513  -2.650
  166   HD12  LEU  26          2HD1      LEU  26  -1.262   2.377  -1.175
  167   HD13  LEU  26          3HD1      LEU  26  -2.499   1.499  -2.074
  168   HD21  LEU  26          3HD2      LEU  26  -2.200  -0.943   0.487
  169   HD22  LEU  26          1HD2      LEU  26  -3.176   0.342  -0.225
  170   HD23  LEU  26          2HD2      LEU  26  -1.947   0.733   0.978
  171    H    ILE  27           H        ILE  27   1.491  -2.152  -1.389
  172    HA   ILE  27           HA       ILE  27   3.002  -0.128  -0.316
  173    HB   ILE  27           HB       ILE  27   3.981  -2.899  -1.018
  174   HG12  ILE  27          1HG1      ILE  27   2.988  -1.976   1.668
  175   HG13  ILE  27          2HG1      ILE  27   1.874  -2.591   0.452
  176   HG21  ILE  27          1HG2      ILE  27   5.115  -1.700   1.351
  177   HG22  ILE  27          2HG2      ILE  27   5.921  -2.414  -0.045
  178   HG23  ILE  27          3HG2      ILE  27   5.432  -0.720  -0.080
  179   HD11  ILE  27          3HD1      ILE  27   2.996  -4.134   2.301
  180   HD12  ILE  27          1HD1      ILE  27   2.579  -4.723   0.692
  181   HD13  ILE  27          2HD1      ILE  27   4.239  -4.252   1.056
  182    H    ILE  28           H        ILE  28   3.602  -1.902  -3.327
  183    HA   ILE  28           HA       ILE  28   6.052  -0.635  -3.948
  184    HB   ILE  28           HB       ILE  28   4.048  -1.915  -5.812
  185   HG12  ILE  28          1HG1      ILE  28   6.616  -3.161  -4.889
  186   HG13  ILE  28          2HG1      ILE  28   5.186  -3.246  -3.867
  187   HG21  ILE  28          1HG2      ILE  28   5.317  -1.117  -7.453
  188   HG22  ILE  28          2HG2      ILE  28   6.503  -0.487  -6.311
  189   HG23  ILE  28          3HG2      ILE  28   6.614  -2.157  -6.866
  190   HD11  ILE  28          3HD1      ILE  28   4.354  -4.007  -6.430
  191   HD12  ILE  28          1HD1      ILE  28   5.887  -4.828  -6.140
  192   HD13  ILE  28          2HD1      ILE  28   4.551  -5.027  -5.005
  193    H    HIS  29           H        HIS  29   2.711   0.231  -4.490
  194    HA   HIS  29           HA       HIS  29   3.191   2.256  -6.428
  195    HB2  HIS  29           1HB      HIS  29   0.984   1.595  -6.462
  196    HB3  HIS  29           2HB      HIS  29   0.890   1.447  -4.710
  197    HD1  HIS  29           HD1      HIS  29   0.759   4.032  -7.448
  198    HD2  HIS  29           HD2      HIS  29  -0.040   3.681  -3.386
  199    HE1  HIS  29           HE1      HIS  29  -0.426   6.156  -6.810
  200    H    GLN  30           H        GLN  30   2.477   2.423  -2.939
  201    HA   GLN  30           HA       GLN  30   2.594   5.119  -2.528
  202    HB2  GLN  30           1HB      GLN  30   3.744   2.967  -0.743
  203    HB3  GLN  30           2HB      GLN  30   3.397   4.616  -0.239
  204    HG2  GLN  30           1HG      GLN  30   1.196   3.041  -1.451
  205    HG3  GLN  30           2HG      GLN  30   1.709   2.634   0.186
  206   HE21  GLN  30          1HE2      GLN  30  -0.440   3.301   0.794
  207   HE22  GLN  30          2HE2      GLN  30  -0.778   4.978   1.036
  208    H    ARG  31           H        ARG  31   5.167   3.049  -3.473
  209    HA   ARG  31           HA       ARG  31   7.411   4.373  -2.525
  210    HB2  ARG  31           1HB      ARG  31   7.028   2.987  -5.185
  211    HB3  ARG  31           2HB      ARG  31   8.585   3.433  -4.499
  212    HG2  ARG  31           1HG      ARG  31   7.861   2.001  -2.484
  213    HG3  ARG  31           2HG      ARG  31   6.660   1.333  -3.591
  214    HD2  ARG  31           1HD      ARG  31   8.433  -0.131  -3.842
  215    HD3  ARG  31           2HD      ARG  31   8.680   0.993  -5.178
  216    HE   ARG  31           HE       ARG  31  10.602   1.739  -4.163
  217   HH11  ARG  31          1HH1      ARG  31   8.778  -0.209  -1.928
  218   HH12  ARG  31          2HH1      ARG  31  10.048  -0.280  -0.751
  219   HH21  ARG  31          1HH2      ARG  31  12.282   1.652  -2.622
  220   HH22  ARG  31          2HH2      ARG  31  12.040   0.779  -1.147
  221    H    THR  32           H        THR  32   5.389   5.094  -5.321
  222    HA   THR  32           HA       THR  32   6.991   7.037  -6.531
  223    HB   THR  32           HB       THR  32   5.065   7.760  -7.720
  224    HG1  THR  32           HG1      THR  32   3.552   8.141  -6.164
  225   HG21  THR  32          3HG2      THR  32   3.828   5.297  -7.782
  226   HG22  THR  32          1HG2      THR  32   5.452   4.915  -7.212
  227   HG23  THR  32          2HG2      THR  32   5.231   5.771  -8.738
  228    H    HIS  33           H        HIS  33   4.665   7.285  -3.891
  229    HA   HIS  33           HA       HIS  33   4.668  10.115  -3.727
  230    HB2  HIS  33           1HB      HIS  33   3.945   7.967  -1.732
  231    HB3  HIS  33           2HB      HIS  33   3.767   9.686  -1.394
  232    HD1  HIS  33           HD1      HIS  33   2.415  10.828  -3.735
  233    HD2  HIS  33           HD2      HIS  33   1.513   7.008  -2.374
  234    HE1  HIS  33           HE1      HIS  33   0.116  10.324  -4.622
  235    H    THR  34           H        THR  34   6.216   7.694  -1.610
  236    HA   THR  34           HA       THR  34   7.625   9.197   0.104
  237    HB   THR  34           HB       THR  34   9.417   7.518   0.107
  238    HG1  THR  34           HG1      THR  34   8.956   5.726  -1.523
  239   HG21  THR  34          3HG2      THR  34   7.698   6.684   1.367
  240   HG22  THR  34          1HG2      THR  34   7.767   5.444   0.116
  241   HG23  THR  34          2HG2      THR  34   6.552   6.719   0.027
  242    H    GLY  35           H        GLY  35   8.711   8.481  -3.213
  243    HA2  GLY  35           1HA      GLY  35   9.872  11.042  -3.565
  244    HA3  GLY  35           2HA      GLY  35  11.120   9.873  -3.157
  245    H    GLU  36           H        GLU  36   8.839  10.924  -5.558
  246    HA   GLU  36           HA       GLU  36  10.379   9.722  -7.648
  247    HB2  GLU  36           1HB      GLU  36   8.801   7.885  -6.684
  248    HB3  GLU  36           2HB      GLU  36   7.539   8.760  -7.540
  249    HG2  GLU  36           1HG      GLU  36   8.322   8.169  -9.592
  250    HG3  GLU  36           2HG      GLU  36   9.993   8.050  -9.045
  251    H    SER  37           H        SER  37  10.188  10.890  -9.465
  252    HA   SER  37           HA       SER  37   9.141  13.344  -9.665
  253    HB2  SER  37           1HB      SER  37   9.021  13.048 -12.121
  254    HB3  SER  37           2HB      SER  37  10.497  12.361 -11.444
  255    HG   SER  37           HG       SER  37   9.523  10.312 -11.563
  256    H    GLY  38           H        GLY  38   7.215  14.337  -9.892
  257    HA2  GLY  38           1HA      GLY  38   4.938  13.934 -11.046
  258    HA3  GLY  38           2HA      GLY  38   4.834  12.608  -9.897
  259    HA   PRO  39           HA       PRO  39   3.677  16.938  -8.085
  260    HB2  PRO  39           1HB      PRO  39   1.100  17.234  -8.885
  261    HB3  PRO  39           2HB      PRO  39   2.468  17.887  -9.793
  262    HG2  PRO  39           1HG      PRO  39   0.910  15.374 -10.263
  263    HG3  PRO  39           2HG      PRO  39   1.481  16.573 -11.438
  264    HD2  PRO  39           1HD      PRO  39   2.759  14.224 -11.016
  265    HD3  PRO  39           2HD      PRO  39   3.618  15.710 -11.470
  266    H    SER  40           H        SER  40   3.494  16.270  -6.028
  267    HA   SER  40           HA       SER  40   1.179  14.585  -5.327
  268    HB2  SER  40           1HB      SER  40   3.229  13.324  -5.000
  269    HB3  SER  40           2HB      SER  40   3.926  14.640  -4.055
  270    HG   SER  40           HG       SER  40   2.463  14.243  -2.439
  271    H    SER  41           H        SER  41  -0.160  16.338  -4.876
  272    HA   SER  41           HA       SER  41   0.631  18.450  -3.118
  273    HB2  SER  41           1HB      SER  41  -1.100  18.769  -4.848
  274    HB3  SER  41           2HB      SER  41  -2.142  17.619  -4.010
  275    HG   SER  41           HG       SER  41  -1.405  20.223  -3.281
  276    H    GLY  42           H        GLY  42   1.173  17.863  -1.091
  277    HA2  GLY  42           1HA      GLY  42  -0.849  17.170   0.758
  278    HA3  GLY  42           2HA      GLY  42   0.109  15.745   0.383
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1 -26.182   4.484 -14.414
    2    HA2  GLY   1           1HA      GLY   1 -24.689   4.043 -12.718
    3    HA3  GLY   1           2HA      GLY   1 -25.885   2.958 -12.026
    4    H    SER   2           H        SER   2 -23.308   3.217 -14.418
    5    HA   SER   2           HA       SER   2 -23.249   0.360 -14.859
    6    HB2  SER   2           1HB      SER   2 -22.692   2.161 -16.600
    7    HB3  SER   2           2HB      SER   2 -21.152   2.334 -15.758
    8    HG   SER   2           HG       SER   2 -20.772   0.117 -16.161
    9    H    SER   3           H        SER   3 -22.762  -0.545 -12.866
   10    HA   SER   3           HA       SER   3 -19.995  -0.725 -12.226
   11    HB2  SER   3           1HB      SER   3 -20.216   1.328 -11.066
   12    HB3  SER   3           2HB      SER   3 -21.789   0.879 -10.407
   13    HG   SER   3           HG       SER   3 -20.095   0.683  -8.865
   14    H    GLY   4           H        GLY   4 -19.540  -2.389 -10.720
   15    HA2  GLY   4           1HA      GLY   4 -21.564  -3.764  -9.275
   16    HA3  GLY   4           2HA      GLY   4 -21.226  -4.591 -10.788
   17    H    SER   5           H        SER   5 -20.401  -6.413  -9.745
   18    HA   SER   5           HA       SER   5 -18.377  -6.328  -7.777
   19    HB2  SER   5           1HB      SER   5 -18.080  -8.737  -8.289
   20    HB3  SER   5           2HB      SER   5 -19.775  -8.304  -8.067
   21    HG   SER   5           HG       SER   5 -18.779  -8.162 -10.657
   22    H    SER   6           H        SER   6 -16.565  -5.208  -8.247
   23    HA   SER   6           HA       SER   6 -15.180  -5.782 -10.772
   24    HB2  SER   6           1HB      SER   6 -15.594  -3.418 -10.383
   25    HB3  SER   6           2HB      SER   6 -14.823  -3.513  -8.800
   26    HG   SER   6           HG       SER   6 -13.654  -3.661 -11.358
   27    H    GLY   7           H        GLY   7 -14.519  -5.381  -7.294
   28    HA2  GLY   7           1HA      GLY   7 -12.883  -7.658  -7.107
   29    HA3  GLY   7           2HA      GLY   7 -11.853  -6.257  -7.361
   30    H    GLU   8           H        GLU   8 -13.678  -4.469  -5.904
   31    HA   GLU   8           HA       GLU   8 -13.958  -3.656  -3.798
   32    HB2  GLU   8           1HB      GLU   8 -14.200  -6.609  -3.335
   33    HB3  GLU   8           2HB      GLU   8 -14.200  -5.502  -1.969
   34    HG2  GLU   8           1HG      GLU   8 -16.066  -4.273  -3.250
   35    HG3  GLU   8           2HG      GLU   8 -16.195  -5.765  -4.180
   36    H    LYS   9           H        LYS   9 -11.410  -3.538  -4.686
   37    HA   LYS   9           HA       LYS   9  -9.379  -4.745  -3.280
   38    HB2  LYS   9           1HB      LYS   9  -9.452  -1.839  -4.110
   39    HB3  LYS   9           2HB      LYS   9  -8.011  -2.800  -3.804
   40    HG2  LYS   9           1HG      LYS   9  -8.404  -4.146  -5.726
   41    HG3  LYS   9           2HG      LYS   9 -10.007  -3.444  -5.961
   42    HD2  LYS   9           1HD      LYS   9  -8.967  -1.258  -6.392
   43    HD3  LYS   9           2HD      LYS   9  -7.372  -1.988  -6.195
   44    HE2  LYS   9           1HE      LYS   9  -9.410  -2.804  -8.265
   45    HE3  LYS   9           2HE      LYS   9  -8.039  -1.736  -8.563
   46    HZ1  LYS   9           3HZ      LYS   9  -7.894  -4.577  -7.712
   47    HZ2  LYS   9           1HZ      LYS   9  -6.560  -3.557  -7.911
   48    HZ3  LYS   9           2HZ      LYS   9  -7.514  -3.970  -9.244
   49    HA   PRO  10           HA       PRO  10 -10.494  -3.299   0.839
   50    HB2  PRO  10           1HB      PRO  10  -8.809  -4.991   2.129
   51    HB3  PRO  10           2HB      PRO  10 -10.388  -5.492   1.513
   52    HG2  PRO  10           1HG      PRO  10  -7.676  -5.870   0.304
   53    HG3  PRO  10           2HG      PRO  10  -9.021  -7.020   0.415
   54    HD2  PRO  10           1HD      PRO  10  -8.468  -5.639  -1.848
   55    HD3  PRO  10           2HD      PRO  10 -10.120  -6.102  -1.391
   56    H    TYR  11           H        TYR  11  -7.519  -3.239  -0.860
   57    HA   TYR  11           HA       TYR  11  -6.225  -1.656   1.247
   58    HB2  TYR  11           1HB      TYR  11  -4.976  -2.746  -1.280
   59    HB3  TYR  11           2HB      TYR  11  -4.140  -2.061   0.109
   60    HD1  TYR  11           HD1      TYR  11  -6.041  -4.972  -1.114
   61    HD2  TYR  11           HD2      TYR  11  -3.704  -3.374   2.062
   62    HE1  TYR  11           HE1      TYR  11  -5.859  -7.217  -0.126
   63    HE2  TYR  11           HE2      TYR  11  -3.515  -5.614   3.058
   64    HH   TYR  11           HH       TYR  11  -4.321  -8.436   1.403
   65    H    GLU  12           H        GLU  12  -6.037   0.478   1.056
   66    HA   GLU  12           HA       GLU  12  -6.286   1.690  -1.611
   67    HB2  GLU  12           1HB      GLU  12  -7.899   2.217   0.832
   68    HB3  GLU  12           2HB      GLU  12  -7.450   3.602  -0.153
   69    HG2  GLU  12           1HG      GLU  12  -9.424   3.086  -1.133
   70    HG3  GLU  12           2HG      GLU  12  -8.361   2.062  -2.096
   71    H    CYS  13           H        CYS  13  -5.060   3.511  -1.981
   72    HA   CYS  13           HA       CYS  13  -2.773   3.850  -0.282
   73    HB2  CYS  13           1HB      CYS  13  -2.813   3.993  -2.833
   74    HB3  CYS  13           2HB      CYS  13  -3.519   5.593  -2.627
   75    H    THR  14           H        THR  14  -2.578   5.206   1.364
   76    HA   THR  14           HA       THR  14  -4.648   7.193   1.841
   77    HB   THR  14           HB       THR  14  -3.586   7.488   4.044
   78    HG1  THR  14           HG1      THR  14  -1.862   5.924   4.534
   79   HG21  THR  14          3HG2      THR  14  -4.639   5.680   4.875
   80   HG22  THR  14          1HG2      THR  14  -3.665   4.557   3.928
   81   HG23  THR  14          2HG2      THR  14  -5.058   5.351   3.194
   82    H    ASP  15           H        ASP  15  -2.662   7.568  -0.307
   83    HA   ASP  15           HA       ASP  15  -1.479  10.092   0.652
   84    HB2  ASP  15           1HB      ASP  15  -0.310   7.900  -0.982
   85    HB3  ASP  15           2HB      ASP  15   0.116   9.549  -1.429
   86    H    CYS  16           H        CYS  16  -2.986   8.365  -2.021
   87    HA   CYS  16           HA       CYS  16  -3.686  10.968  -3.209
   88    HB2  CYS  16           1HB      CYS  16  -3.571   9.913  -5.436
   89    HB3  CYS  16           2HB      CYS  16  -2.014   9.882  -4.615
   90    H    GLY  17           H        GLY  17  -4.619   7.651  -2.541
   91    HA2  GLY  17           1HA      GLY  17  -6.922   7.289  -1.814
   92    HA3  GLY  17           2HA      GLY  17  -7.421   8.428  -3.056
   93    H    LYS  18           H        LYS  18  -4.945   6.115  -3.770
   94    HA   LYS  18           HA       LYS  18  -6.574   4.961  -5.848
   95    HB2  LYS  18           1HB      LYS  18  -3.721   4.812  -5.022
   96    HB3  LYS  18           2HB      LYS  18  -4.363   3.458  -5.942
   97    HG2  LYS  18           1HG      LYS  18  -5.122   5.094  -7.669
   98    HG3  LYS  18           2HG      LYS  18  -4.254   6.346  -6.777
   99    HD2  LYS  18           1HD      LYS  18  -2.174   5.032  -7.032
  100    HD3  LYS  18           2HD      LYS  18  -3.064   3.857  -8.002
  101    HE2  LYS  18           1HE      LYS  18  -3.711   5.937  -9.429
  102    HE3  LYS  18           2HE      LYS  18  -2.311   6.677  -8.653
  103    HZ1  LYS  18           3HZ      LYS  18  -1.913   4.029  -9.795
  104    HZ2  LYS  18           1HZ      LYS  18  -0.881   5.369  -9.781
  105    HZ3  LYS  18           2HZ      LYS  18  -2.148   5.290 -10.898
  106    H    ALA  19           H        ALA  19  -6.133   2.408  -6.073
  107    HA   ALA  19           HA       ALA  19  -6.603   1.093  -3.502
  108    HB1  ALA  19           3HB      ALA  19  -8.533   1.216  -5.777
  109    HB2  ALA  19           1HB      ALA  19  -8.473  -0.221  -4.755
  110    HB3  ALA  19           2HB      ALA  19  -8.828   1.353  -4.043
  111    H    PHE  20           H        PHE  20  -6.413  -1.255  -3.620
  112    HA   PHE  20           HA       PHE  20  -5.309  -2.438  -6.003
  113    HB2  PHE  20           1HB      PHE  20  -3.557  -2.217  -3.547
  114    HB3  PHE  20           2HB      PHE  20  -3.150  -3.035  -5.053
  115    HD1  PHE  20           HD1      PHE  20  -3.992   0.297  -3.649
  116    HD2  PHE  20           HD2      PHE  20  -2.082  -1.884  -6.765
  117    HE1  PHE  20           HE1      PHE  20  -3.026   2.387  -4.515
  118    HE2  PHE  20           HE2      PHE  20  -1.112   0.203  -7.636
  119    HZ   PHE  20           HZ       PHE  20  -1.583   2.342  -6.510
  120    H    GLY  21           H        GLY  21  -6.319  -4.329  -6.074
  121    HA2  GLY  21           1HA      GLY  21  -7.657  -5.560  -3.973
  122    HA3  GLY  21           2HA      GLY  21  -7.151  -6.374  -5.445
  123    H    LEU  22           H        LEU  22  -4.311  -5.418  -4.502
  124    HA   LEU  22           HA       LEU  22  -3.887  -7.698  -2.683
  125    HB2  LEU  22           1HB      LEU  22  -2.418  -6.753  -5.075
  126    HB3  LEU  22           2HB      LEU  22  -1.454  -7.377  -3.738
  127    HG   LEU  22           HG       LEU  22  -3.474  -8.833  -5.423
  128   HD11  LEU  22          1HD1      LEU  22  -1.450  -9.049  -6.472
  129   HD12  LEU  22          2HD1      LEU  22  -1.398 -10.433  -5.381
  130   HD13  LEU  22          3HD1      LEU  22  -0.533  -8.952  -4.968
  131   HD21  LEU  22          3HD2      LEU  22  -4.097  -9.888  -3.542
  132   HD22  LEU  22          1HD2      LEU  22  -2.702  -9.307  -2.632
  133   HD23  LEU  22          2HD2      LEU  22  -2.543 -10.708  -3.692
  134    H    LYS  23           H        LYS  23  -1.826  -7.478  -1.380
  135    HA   LYS  23           HA       LYS  23  -1.839  -4.856  -0.117
  136    HB2  LYS  23           1HB      LYS  23  -2.009  -6.687   1.401
  137    HB3  LYS  23           2HB      LYS  23  -0.646  -7.515   0.660
  138    HG2  LYS  23           1HG      LYS  23   0.341  -6.675   2.538
  139    HG3  LYS  23           2HG      LYS  23   0.660  -5.365   1.398
  140    HD2  LYS  23           1HD      LYS  23  -1.371  -4.211   2.234
  141    HD3  LYS  23           2HD      LYS  23  -1.559  -5.486   3.440
  142    HE2  LYS  23           1HE      LYS  23   0.597  -4.918   4.406
  143    HE3  LYS  23           2HE      LYS  23   0.852  -3.692   3.165
  144    HZ1  LYS  23           3HZ      LYS  23  -0.910  -2.394   4.028
  145    HZ2  LYS  23           1HZ      LYS  23   0.043  -2.842   5.353
  146    HZ3  LYS  23           2HZ      LYS  23  -1.425  -3.629   5.062
  147    H    SER  24           H        SER  24   0.260  -6.905  -2.012
  148    HA   SER  24           HA       SER  24   2.601  -5.277  -1.566
  149    HB2  SER  24           1HB      SER  24   2.703  -7.747  -2.004
  150    HB3  SER  24           2HB      SER  24   2.187  -7.423  -3.658
  151    HG   SER  24           HG       SER  24   4.108  -5.884  -3.567
  152    H    GLN  25           H        GLN  25   0.044  -5.524  -3.920
  153    HA   GLN  25           HA       GLN  25   1.266  -4.090  -6.019
  154    HB2  GLN  25           1HB      GLN  25  -1.633  -4.500  -5.286
  155    HB3  GLN  25           2HB      GLN  25  -1.120  -3.664  -6.746
  156    HG2  GLN  25           1HG      GLN  25   0.155  -5.744  -7.355
  157    HG3  GLN  25           2HG      GLN  25  -0.665  -6.541  -6.014
  158   HE21  GLN  25          1HE2      GLN  25  -1.000  -5.181  -9.183
  159   HE22  GLN  25          2HE2      GLN  25  -2.582  -5.795  -9.506
  160    H    LEU  26           H        LEU  26  -0.244  -3.095  -3.059
  161    HA   LEU  26           HA       LEU  26  -0.523  -0.335  -3.887
  162    HB2  LEU  26           1HB      LEU  26  -2.195  -1.069  -2.410
  163    HB3  LEU  26           2HB      LEU  26  -1.025  -1.819  -1.328
  164    HG   LEU  26           HG       LEU  26  -0.228   0.495  -0.750
  165   HD11  LEU  26          1HD1      LEU  26  -1.371   1.424  -2.885
  166   HD12  LEU  26          2HD1      LEU  26  -1.366   2.392  -1.411
  167   HD13  LEU  26          3HD1      LEU  26  -2.812   1.493  -1.871
  168   HD21  LEU  26          3HD2      LEU  26  -2.931   0.745   0.137
  169   HD22  LEU  26          1HD2      LEU  26  -1.509   0.218   1.038
  170   HD23  LEU  26          2HD2      LEU  26  -2.472  -0.959   0.145
  171    H    ILE  27           H        ILE  27   1.460  -2.163  -1.569
  172    HA   ILE  27           HA       ILE  27   2.969  -0.105  -0.522
  173    HB   ILE  27           HB       ILE  27   3.951  -2.884  -1.182
  174   HG12  ILE  27          1HG1      ILE  27   2.955  -1.945   1.495
  175   HG13  ILE  27          2HG1      ILE  27   1.835  -2.556   0.283
  176   HG21  ILE  27          1HG2      ILE  27   5.449  -0.750  -0.372
  177   HG22  ILE  27          2HG2      ILE  27   5.032  -1.512   1.162
  178   HG23  ILE  27          3HG2      ILE  27   5.855  -2.443  -0.089
  179   HD11  ILE  27          3HD1      ILE  27   2.415  -4.673   0.657
  180   HD12  ILE  27          1HD1      ILE  27   4.135  -4.290   0.729
  181   HD13  ILE  27          2HD1      ILE  27   3.120  -4.060   2.153
  182    H    ILE  28           H        ILE  28   3.509  -1.923  -3.514
  183    HA   ILE  28           HA       ILE  28   5.971  -0.746  -4.198
  184    HB   ILE  28           HB       ILE  28   3.842  -1.939  -5.974
  185   HG12  ILE  28          1HG1      ILE  28   6.480  -3.170  -5.217
  186   HG13  ILE  28          2HG1      ILE  28   5.070  -3.338  -4.176
  187   HG21  ILE  28          1HG2      ILE  28   5.173  -0.501  -7.335
  188   HG22  ILE  28          2HG2      ILE  28   6.662  -1.092  -6.600
  189   HG23  ILE  28          3HG2      ILE  28   5.705  -2.156  -7.630
  190   HD11  ILE  28          3HD1      ILE  28   4.232  -4.005  -6.773
  191   HD12  ILE  28          1HD1      ILE  28   5.777  -4.814  -6.509
  192   HD13  ILE  28          2HD1      ILE  28   4.442  -5.074  -5.386
  193    H    HIS  29           H        HIS  29   2.646   0.241  -4.759
  194    HA   HIS  29           HA       HIS  29   3.242   2.325  -6.599
  195    HB2  HIS  29           1HB      HIS  29   1.020   1.605  -6.677
  196    HB3  HIS  29           2HB      HIS  29   0.854   1.616  -4.924
  197    HD1  HIS  29           HD1      HIS  29   1.244   4.106  -7.768
  198    HD2  HIS  29           HD2      HIS  29  -0.373   3.830  -3.951
  199    HE1  HIS  29           HE1      HIS  29   0.027   6.275  -7.395
  200    H    GLN  30           H        GLN  30   2.453   2.356  -3.125
  201    HA   GLN  30           HA       GLN  30   2.585   5.028  -2.590
  202    HB2  GLN  30           1HB      GLN  30   3.502   2.670  -0.959
  203    HB3  GLN  30           2HB      GLN  30   3.561   4.311  -0.327
  204    HG2  GLN  30           1HG      GLN  30   1.144   4.520  -0.682
  205    HG3  GLN  30           2HG      GLN  30   1.099   2.859  -1.270
  206   HE21  GLN  30          1HE2      GLN  30  -0.473   2.613   0.472
  207   HE22  GLN  30          2HE2      GLN  30   0.098   2.270   2.066
  208    H    ARG  31           H        ARG  31   5.162   2.973  -3.569
  209    HA   ARG  31           HA       ARG  31   7.392   4.267  -2.536
  210    HB2  ARG  31           1HB      ARG  31   7.069   2.933  -5.231
  211    HB3  ARG  31           2HB      ARG  31   8.609   3.354  -4.494
  212    HG2  ARG  31           1HG      ARG  31   7.762   1.891  -2.519
  213    HG3  ARG  31           2HG      ARG  31   6.667   1.224  -3.731
  214    HD2  ARG  31           1HD      ARG  31   8.526  -0.189  -3.803
  215    HD3  ARG  31           2HD      ARG  31   8.759   0.900  -5.170
  216    HE   ARG  31           HE       ARG  31  10.057   1.959  -2.914
  217   HH11  ARG  31          1HH1      ARG  31  10.313  -0.682  -5.168
  218   HH12  ARG  31          2HH1      ARG  31  12.034  -0.811  -5.021
  219   HH21  ARG  31          1HH2      ARG  31  12.323   1.799  -2.712
  220   HH22  ARG  31          2HH2      ARG  31  13.177   0.600  -3.624
  221    H    THR  32           H        THR  32   5.456   5.027  -5.388
  222    HA   THR  32           HA       THR  32   7.087   6.994  -6.511
  223    HB   THR  32           HB       THR  32   5.122   7.810  -7.668
  224    HG1  THR  32           HG1      THR  32   3.507   7.888  -6.205
  225   HG21  THR  32          3HG2      THR  32   6.131   5.390  -8.016
  226   HG22  THR  32          1HG2      THR  32   4.707   5.926  -8.907
  227   HG23  THR  32          2HG2      THR  32   4.523   4.899  -7.484
  228    H    HIS  33           H        HIS  33   4.738   7.174  -3.899
  229    HA   HIS  33           HA       HIS  33   4.705  10.008  -3.702
  230    HB2  HIS  33           1HB      HIS  33   3.939   7.819  -1.770
  231    HB3  HIS  33           2HB      HIS  33   3.759   9.530  -1.391
  232    HD1  HIS  33           HD1      HIS  33   2.330  10.827  -3.476
  233    HD2  HIS  33           HD2      HIS  33   1.648   6.795  -2.742
  234    HE1  HIS  33           HE1      HIS  33   0.082  10.330  -4.488
  235    H    THR  34           H        THR  34   6.342   7.503  -1.768
  236    HA   THR  34           HA       THR  34   7.806   9.368  -0.197
  237    HB   THR  34           HB       THR  34   9.150   7.398   0.511
  238    HG1  THR  34           HG1      THR  34   7.813   6.281  -1.670
  239   HG21  THR  34          3HG2      THR  34   7.080   7.922   1.680
  240   HG22  THR  34          1HG2      THR  34   7.293   6.175   1.574
  241   HG23  THR  34          2HG2      THR  34   6.156   6.992   0.501
  242    H    GLY  35           H        GLY  35   8.967  10.779  -1.470
  243    HA2  GLY  35           1HA      GLY  35  11.263  11.154  -2.147
  244    HA3  GLY  35           2HA      GLY  35  11.242   9.568  -2.906
  245    H    GLU  36           H        GLU  36   9.076  12.395  -3.078
  246    HA   GLU  36           HA       GLU  36   9.056  12.122  -5.988
  247    HB2  GLU  36           1HB      GLU  36   7.146  13.657  -5.925
  248    HB3  GLU  36           2HB      GLU  36   6.890  12.274  -4.871
  249    HG2  GLU  36           1HG      GLU  36   7.300  13.563  -2.928
  250    HG3  GLU  36           2HG      GLU  36   7.901  14.922  -3.877
  251    H    SER  37           H        SER  37   9.947  14.379  -3.449
  252    HA   SER  37           HA       SER  37  11.012  16.213  -5.492
  253    HB2  SER  37           1HB      SER  37  10.081  16.678  -2.662
  254    HB3  SER  37           2HB      SER  37  11.080  17.853  -3.516
  255    HG   SER  37           HG       SER  37   9.270  17.407  -5.221
  256    H    GLY  38           H        GLY  38  13.085  17.203  -5.094
  257    HA2  GLY  38           1HA      GLY  38  15.199  15.598  -4.717
  258    HA3  GLY  38           2HA      GLY  38  15.247  17.290  -4.247
  259    HA   PRO  39           HA       PRO  39  15.563  14.238  -0.567
  260    HB2  PRO  39           1HB      PRO  39  18.260  14.142  -0.279
  261    HB3  PRO  39           2HB      PRO  39  17.357  12.982  -1.260
  262    HG2  PRO  39           1HG      PRO  39  18.888  15.406  -2.122
  263    HG3  PRO  39           2HG      PRO  39  18.843  13.792  -2.855
  264    HD2  PRO  39           1HD      PRO  39  17.418  15.876  -3.833
  265    HD3  PRO  39           2HD      PRO  39  16.846  14.198  -3.931
  266    H    SER  40           H        SER  40  16.214  17.340  -1.455
  267    HA   SER  40           HA       SER  40  17.582  18.274   0.884
  268    HB2  SER  40           1HB      SER  40  16.042  19.780  -1.244
  269    HB3  SER  40           2HB      SER  40  17.030  20.532   0.008
  270    HG   SER  40           HG       SER  40  18.315  20.345  -1.775
  271    H    SER  41           H        SER  41  15.816  16.910   2.117
  272    HA   SER  41           HA       SER  41  14.024  16.858   3.528
  273    HB2  SER  41           1HB      SER  41  14.466  19.844   3.713
  274    HB3  SER  41           2HB      SER  41  13.759  18.789   4.937
  275    HG   SER  41           HG       SER  41  15.806  17.751   5.086
  276    H    GLY  42           H        GLY  42  13.110  16.736   1.026
  277    HA2  GLY  42           1HA      GLY  42  11.139  18.823   0.564
  278    HA3  GLY  42           2HA      GLY  42  11.455  17.438  -0.470
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1 -17.641  -0.905 -22.567
    2    HA2  GLY   1           1HA      GLY   1 -19.827  -2.060 -21.510
    3    HA3  GLY   1           2HA      GLY   1 -19.574  -3.031 -22.953
    4    H    SER   2           H        SER   2 -17.625  -4.253 -23.146
    5    HA   SER   2           HA       SER   2 -16.922  -5.789 -21.027
    6    HB2  SER   2           1HB      SER   2 -16.204  -5.927 -23.531
    7    HB3  SER   2           2HB      SER   2 -14.785  -5.029 -22.996
    8    HG   SER   2           HG       SER   2 -14.808  -6.823 -21.275
    9    H    SER   3           H        SER   3 -15.500  -5.752 -19.346
   10    HA   SER   3           HA       SER   3 -13.825  -3.362 -19.013
   11    HB2  SER   3           1HB      SER   3 -14.513  -3.096 -16.713
   12    HB3  SER   3           2HB      SER   3 -15.958  -3.112 -17.723
   13    HG   SER   3           HG       SER   3 -16.085  -4.448 -15.813
   14    H    GLY   4           H        GLY   4 -11.965  -3.643 -17.728
   15    HA2  GLY   4           1HA      GLY   4 -10.720  -6.157 -17.950
   16    HA3  GLY   4           2HA      GLY   4 -10.125  -4.805 -16.999
   17    H    SER   5           H        SER   5  -9.422  -6.706 -15.650
   18    HA   SER   5           HA       SER   5 -11.518  -7.968 -14.092
   19    HB2  SER   5           1HB      SER   5  -8.532  -8.256 -14.244
   20    HB3  SER   5           2HB      SER   5  -9.418  -8.927 -12.874
   21    HG   SER   5           HG       SER   5 -10.457  -9.494 -15.375
   22    H    SER   6           H        SER   6 -12.361  -6.012 -13.147
   23    HA   SER   6           HA       SER   6 -10.663  -4.906 -11.009
   24    HB2  SER   6           1HB      SER   6 -13.108  -3.651 -12.278
   25    HB3  SER   6           2HB      SER   6 -12.046  -2.903 -11.085
   26    HG   SER   6           HG       SER   6 -11.146  -3.809 -13.614
   27    H    GLY   7           H        GLY   7 -11.449  -4.765  -8.921
   28    HA2  GLY   7           1HA      GLY   7 -14.151  -5.672  -8.339
   29    HA3  GLY   7           2HA      GLY   7 -12.860  -6.723  -7.775
   30    H    GLU   8           H        GLU   8 -14.023  -6.156  -5.699
   31    HA   GLU   8           HA       GLU   8 -13.636  -3.530  -4.624
   32    HB2  GLU   8           1HB      GLU   8 -15.416  -5.332  -4.001
   33    HB3  GLU   8           2HB      GLU   8 -14.162  -5.952  -2.936
   34    HG2  GLU   8           1HG      GLU   8 -14.875  -3.062  -2.825
   35    HG3  GLU   8           2HG      GLU   8 -15.929  -4.250  -2.059
   36    H    LYS   9           H        LYS   9 -11.556  -2.904  -4.435
   37    HA   LYS   9           HA       LYS   9  -9.528  -4.712  -3.442
   38    HB2  LYS   9           1HB      LYS   9  -9.312  -1.761  -4.058
   39    HB3  LYS   9           2HB      LYS   9  -7.977  -2.882  -3.825
   40    HG2  LYS   9           1HG      LYS   9  -8.260  -3.863  -5.880
   41    HG3  LYS   9           2HG      LYS   9  -9.968  -3.427  -5.973
   42    HD2  LYS   9           1HD      LYS   9  -9.365  -1.093  -6.331
   43    HD3  LYS   9           2HD      LYS   9  -7.654  -1.501  -6.191
   44    HE2  LYS   9           1HE      LYS   9  -9.316  -2.937  -8.204
   45    HE3  LYS   9           2HE      LYS   9  -8.821  -1.279  -8.542
   46    HZ1  LYS   9           3HZ      LYS   9  -6.505  -2.284  -7.783
   47    HZ2  LYS   9           1HZ      LYS   9  -7.039  -2.354  -9.387
   48    HZ3  LYS   9           2HZ      LYS   9  -7.209  -3.702  -8.379
   49    HA   PRO  10           HA       PRO  10 -10.459  -3.522   0.774
   50    HB2  PRO  10           1HB      PRO  10  -8.690  -5.240   1.909
   51    HB3  PRO  10           2HB      PRO  10 -10.268  -5.751   1.298
   52    HG2  PRO  10           1HG      PRO  10  -7.578  -5.959   0.002
   53    HG3  PRO  10           2HG      PRO  10  -8.884  -7.157   0.069
   54    HD2  PRO  10           1HD      PRO  10  -8.433  -5.614  -2.109
   55    HD3  PRO  10           2HD      PRO  10 -10.057  -6.159  -1.645
   56    H    TYR  11           H        TYR  11  -7.581  -3.183  -1.017
   57    HA   TYR  11           HA       TYR  11  -6.306  -1.667   1.160
   58    HB2  TYR  11           1HB      TYR  11  -4.993  -2.688  -1.363
   59    HB3  TYR  11           2HB      TYR  11  -4.196  -2.010   0.053
   60    HD1  TYR  11           HD1      TYR  11  -5.874  -4.959  -1.333
   61    HD2  TYR  11           HD2      TYR  11  -3.897  -3.331   2.064
   62    HE1  TYR  11           HE1      TYR  11  -5.658  -7.218  -0.384
   63    HE2  TYR  11           HE2      TYR  11  -3.674  -5.585   3.022
   64    HH   TYR  11           HH       TYR  11  -4.868  -8.446   1.286
   65    H    GLU  12           H        GLU  12  -5.741   0.446   0.876
   66    HA   GLU  12           HA       GLU  12  -6.120   1.685  -1.739
   67    HB2  GLU  12           1HB      GLU  12  -7.792   2.187   0.669
   68    HB3  GLU  12           2HB      GLU  12  -7.333   3.580  -0.299
   69    HG2  GLU  12           1HG      GLU  12  -9.293   3.042  -1.307
   70    HG3  GLU  12           2HG      GLU  12  -8.189   2.066  -2.274
   71    H    CYS  13           H        CYS  13  -4.872   3.488  -2.081
   72    HA   CYS  13           HA       CYS  13  -2.612   3.825  -0.374
   73    HB2  CYS  13           1HB      CYS  13  -2.683   4.096  -2.912
   74    HB3  CYS  13           2HB      CYS  13  -3.419   5.669  -2.622
   75    H    THR  14           H        THR  14  -2.417   5.099   1.336
   76    HA   THR  14           HA       THR  14  -4.512   7.025   1.939
   77    HB   THR  14           HB       THR  14  -3.334   7.253   4.132
   78    HG1  THR  14           HG1      THR  14  -1.599   5.915   4.564
   79   HG21  THR  14          3HG2      THR  14  -4.186   4.526   3.180
   80   HG22  THR  14          1HG2      THR  14  -5.132   5.713   4.077
   81   HG23  THR  14          2HG2      THR  14  -3.802   4.867   4.867
   82    H    ASP  15           H        ASP  15  -2.593   7.561  -0.217
   83    HA   ASP  15           HA       ASP  15  -1.459  10.063   0.847
   84    HB2  ASP  15           1HB      ASP  15  -0.199   7.956  -0.828
   85    HB3  ASP  15           2HB      ASP  15   0.181   9.629  -1.228
   86    H    CYS  16           H        CYS  16  -2.923   8.381  -1.868
   87    HA   CYS  16           HA       CYS  16  -3.633  10.999  -3.017
   88    HB2  CYS  16           1HB      CYS  16  -3.494  10.010  -5.256
   89    HB3  CYS  16           2HB      CYS  16  -1.947   9.900  -4.422
   90    H    GLY  17           H        GLY  17  -4.545   7.632  -2.514
   91    HA2  GLY  17           1HA      GLY  17  -6.856   7.267  -1.750
   92    HA3  GLY  17           2HA      GLY  17  -7.355   8.426  -2.974
   93    H    LYS  18           H        LYS  18  -4.860   6.187  -3.783
   94    HA   LYS  18           HA       LYS  18  -6.467   5.056  -5.872
   95    HB2  LYS  18           1HB      LYS  18  -3.631   4.862  -4.998
   96    HB3  LYS  18           2HB      LYS  18  -4.269   3.535  -5.958
   97    HG2  LYS  18           1HG      LYS  18  -5.034   5.310  -7.612
   98    HG3  LYS  18           2HG      LYS  18  -3.998   6.424  -6.717
   99    HD2  LYS  18           1HD      LYS  18  -2.550   5.697  -8.348
  100    HD3  LYS  18           2HD      LYS  18  -2.204   4.543  -7.058
  101    HE2  LYS  18           1HE      LYS  18  -3.986   3.069  -8.162
  102    HE3  LYS  18           2HE      LYS  18  -3.831   4.144  -9.550
  103    HZ1  LYS  18           3HZ      LYS  18  -1.906   2.222  -8.464
  104    HZ2  LYS  18           1HZ      LYS  18  -1.304   3.618  -9.206
  105    HZ3  LYS  18           2HZ      LYS  18  -2.299   2.562 -10.074
  106    H    ALA  19           H        ALA  19  -6.279   2.566  -6.185
  107    HA   ALA  19           HA       ALA  19  -6.730   1.179  -3.636
  108    HB1  ALA  19           3HB      ALA  19  -8.513   0.686  -5.999
  109    HB2  ALA  19           1HB      ALA  19  -8.755   0.224  -4.314
  110    HB3  ALA  19           2HB      ALA  19  -8.887   1.917  -4.793
  111    H    PHE  20           H        PHE  20  -6.307  -1.053  -3.655
  112    HA   PHE  20           HA       PHE  20  -5.274  -2.255  -6.094
  113    HB2  PHE  20           1HB      PHE  20  -3.572  -2.093  -3.599
  114    HB3  PHE  20           2HB      PHE  20  -3.138  -2.873  -5.117
  115    HD1  PHE  20           HD1      PHE  20  -3.940   0.413  -3.603
  116    HD2  PHE  20           HD2      PHE  20  -2.088  -1.672  -6.818
  117    HE1  PHE  20           HE1      PHE  20  -2.949   2.522  -4.394
  118    HE2  PHE  20           HE2      PHE  20  -1.094   0.433  -7.615
  119    HZ   PHE  20           HZ       PHE  20  -1.523   2.533  -6.402
  120    H    GLY  21           H        GLY  21  -6.115  -4.222  -6.231
  121    HA2  GLY  21           1HA      GLY  21  -7.590  -5.457  -4.203
  122    HA3  GLY  21           2HA      GLY  21  -6.995  -6.259  -5.649
  123    H    LEU  22           H        LEU  22  -4.186  -5.494  -4.812
  124    HA   LEU  22           HA       LEU  22  -3.840  -7.694  -2.891
  125    HB2  LEU  22           1HB      LEU  22  -2.285  -6.728  -5.217
  126    HB3  LEU  22           2HB      LEU  22  -1.367  -7.348  -3.847
  127    HG   LEU  22           HG       LEU  22  -3.325  -8.819  -5.593
  128   HD11  LEU  22          1HD1      LEU  22  -1.296  -9.023  -6.620
  129   HD12  LEU  22          2HD1      LEU  22  -1.206 -10.382  -5.501
  130   HD13  LEU  22          3HD1      LEU  22  -0.391  -8.867  -5.114
  131   HD21  LEU  22          3HD2      LEU  22  -2.355 -10.674  -3.835
  132   HD22  LEU  22          1HD2      LEU  22  -3.954  -9.934  -3.758
  133   HD23  LEU  22          2HD2      LEU  22  -2.632  -9.279  -2.791
  134    H    LYS  23           H        LYS  23  -1.875  -7.484  -1.473
  135    HA   LYS  23           HA       LYS  23  -1.934  -4.867  -0.206
  136    HB2  LYS  23           1HB      LYS  23  -2.181  -6.756   1.261
  137    HB3  LYS  23           2HB      LYS  23  -0.727  -7.510   0.620
  138    HG2  LYS  23           1HG      LYS  23   0.118  -6.652   2.542
  139    HG3  LYS  23           2HG      LYS  23   0.381  -5.269   1.477
  140    HD2  LYS  23           1HD      LYS  23  -1.950  -4.499   2.252
  141    HD3  LYS  23           2HD      LYS  23  -1.747  -5.672   3.555
  142    HE2  LYS  23           1HE      LYS  23  -0.922  -3.754   4.528
  143    HE3  LYS  23           2HE      LYS  23   0.549  -4.483   3.887
  144    HZ1  LYS  23           3HZ      LYS  23   0.046  -1.989   3.463
  145    HZ2  LYS  23           1HZ      LYS  23  -0.951  -2.576   2.229
  146    HZ3  LYS  23           2HZ      LYS  23   0.702  -2.934   2.222
  147    H    SER  24           H        SER  24   0.224  -6.876  -2.060
  148    HA   SER  24           HA       SER  24   2.563  -5.290  -1.473
  149    HB2  SER  24           1HB      SER  24   2.665  -7.743  -1.984
  150    HB3  SER  24           2HB      SER  24   2.200  -7.368  -3.643
  151    HG   SER  24           HG       SER  24   4.279  -7.161  -3.908
  152    H    GLN  25           H        GLN  25   0.100  -5.442  -3.937
  153    HA   GLN  25           HA       GLN  25   1.416  -3.946  -5.933
  154    HB2  GLN  25           1HB      GLN  25  -1.442  -4.599  -5.331
  155    HB3  GLN  25           2HB      GLN  25  -1.074  -3.395  -6.559
  156    HG2  GLN  25           1HG      GLN  25   0.544  -5.307  -7.416
  157    HG3  GLN  25           2HG      GLN  25  -0.623  -6.322  -6.570
  158   HE21  GLN  25          1HE2      GLN  25  -2.612  -6.636  -7.430
  159   HE22  GLN  25          2HE2      GLN  25  -3.112  -6.009  -8.960
  160    H    LEU  26           H        LEU  26  -0.254  -3.039  -3.023
  161    HA   LEU  26           HA       LEU  26  -0.484  -0.255  -3.761
  162    HB2  LEU  26           1HB      LEU  26  -2.197  -1.063  -2.359
  163    HB3  LEU  26           2HB      LEU  26  -1.045  -1.806  -1.251
  164    HG   LEU  26           HG       LEU  26  -0.327   0.473  -0.561
  165   HD11  LEU  26          1HD1      LEU  26  -1.363   2.404  -1.288
  166   HD12  LEU  26          2HD1      LEU  26  -2.781   1.544  -1.888
  167   HD13  LEU  26          3HD1      LEU  26  -1.258   1.458  -2.773
  168   HD21  LEU  26          3HD2      LEU  26  -3.292   0.143  -0.203
  169   HD22  LEU  26          1HD2      LEU  26  -2.112   0.804   0.929
  170   HD23  LEU  26          2HD2      LEU  26  -2.124  -0.925   0.578
  171    H    ILE  27           H        ILE  27   1.423  -2.148  -1.430
  172    HA   ILE  27           HA       ILE  27   2.897  -0.127  -0.274
  173    HB   ILE  27           HB       ILE  27   3.886  -2.888  -0.997
  174   HG12  ILE  27          1HG1      ILE  27   2.845  -1.989   1.680
  175   HG13  ILE  27          2HG1      ILE  27   1.760  -2.608   0.441
  176   HG21  ILE  27          1HG2      ILE  27   4.959  -1.611   1.396
  177   HG22  ILE  27          2HG2      ILE  27   5.787  -2.480   0.105
  178   HG23  ILE  27          3HG2      ILE  27   5.382  -0.776  -0.099
  179   HD11  ILE  27          3HD1      ILE  27   2.203  -4.476   1.710
  180   HD12  ILE  27          1HD1      ILE  27   3.368  -4.631   0.395
  181   HD13  ILE  27          2HD1      ILE  27   3.889  -4.029   1.969
  182    H    ILE  28           H        ILE  28   3.553  -1.853  -3.301
  183    HA   ILE  28           HA       ILE  28   6.019  -0.606  -3.862
  184    HB   ILE  28           HB       ILE  28   4.012  -1.774  -5.794
  185   HG12  ILE  28          1HG1      ILE  28   6.509  -3.053  -4.676
  186   HG13  ILE  28          2HG1      ILE  28   4.913  -3.287  -3.970
  187   HG21  ILE  28          1HG2      ILE  28   6.909  -1.680  -6.402
  188   HG22  ILE  28          2HG2      ILE  28   5.519  -1.566  -7.480
  189   HG23  ILE  28          3HG2      ILE  28   6.007  -0.169  -6.522
  190   HD11  ILE  28          3HD1      ILE  28   4.560  -3.844  -6.659
  191   HD12  ILE  28          1HD1      ILE  28   6.124  -4.554  -6.259
  192   HD13  ILE  28          2HD1      ILE  28   4.688  -5.009  -5.341
  193    H    HIS  29           H        HIS  29   2.688   0.265  -4.607
  194    HA   HIS  29           HA       HIS  29   3.296   2.396  -6.374
  195    HB2  HIS  29           1HB      HIS  29   1.102   1.609  -6.545
  196    HB3  HIS  29           2HB      HIS  29   0.865   1.604  -4.800
  197    HD1  HIS  29           HD1      HIS  29   1.143   4.042  -7.684
  198    HD2  HIS  29           HD2      HIS  29  -0.311   3.856  -3.797
  199    HE1  HIS  29           HE1      HIS  29  -0.111   6.193  -7.332
  200    H    GLN  30           H        GLN  30   2.549   2.289  -2.904
  201    HA   GLN  30           HA       GLN  30   2.522   4.988  -2.340
  202    HB2  GLN  30           1HB      GLN  30   3.429   2.622  -0.720
  203    HB3  GLN  30           2HB      GLN  30   3.461   4.251  -0.059
  204    HG2  GLN  30           1HG      GLN  30   0.959   4.260  -0.895
  205    HG3  GLN  30           2HG      GLN  30   1.150   2.515  -0.725
  206   HE21  GLN  30          1HE2      GLN  30  -0.588   2.968   0.887
  207   HE22  GLN  30          2HE2      GLN  30  -0.097   3.337   2.501
  208    H    ARG  31           H        ARG  31   5.158   3.055  -3.347
  209    HA   ARG  31           HA       ARG  31   7.306   4.468  -2.201
  210    HB2  ARG  31           1HB      ARG  31   7.199   2.955  -4.818
  211    HB3  ARG  31           2HB      ARG  31   8.667   3.455  -3.989
  212    HG2  ARG  31           1HG      ARG  31   7.946   2.056  -2.046
  213    HG3  ARG  31           2HG      ARG  31   6.635   1.445  -3.057
  214    HD2  ARG  31           1HD      ARG  31   8.310  -0.156  -3.301
  215    HD3  ARG  31           2HD      ARG  31   8.483   0.851  -4.738
  216    HE   ARG  31           HE       ARG  31  10.530   1.553  -3.968
  217   HH11  ARG  31          1HH1      ARG  31   8.830  -0.104  -1.422
  218   HH12  ARG  31          2HH1      ARG  31  10.201  -0.159  -0.365
  219   HH21  ARG  31          1HH2      ARG  31  12.343   1.486  -2.585
  220   HH22  ARG  31          2HH2      ARG  31  12.199   0.746  -1.027
  221    H    THR  32           H        THR  32   5.673   4.827  -5.335
  222    HA   THR  32           HA       THR  32   7.244   6.839  -6.420
  223    HB   THR  32           HB       THR  32   5.406   5.613  -7.610
  224    HG1  THR  32           HG1      THR  32   4.661   7.724  -8.654
  225   HG21  THR  32          3HG2      THR  32   3.290   5.757  -6.930
  226   HG22  THR  32          1HG2      THR  32   3.326   7.513  -7.082
  227   HG23  THR  32          2HG2      THR  32   3.823   6.749  -5.573
  228    H    HIS  33           H        HIS  33   5.103   6.973  -3.754
  229    HA   HIS  33           HA       HIS  33   4.665   9.830  -3.903
  230    HB2  HIS  33           1HB      HIS  33   3.880   7.676  -1.961
  231    HB3  HIS  33           2HB      HIS  33   3.698   9.376  -1.537
  232    HD1  HIS  33           HD1      HIS  33   2.456  10.674  -3.840
  233    HD2  HIS  33           HD2      HIS  33   1.495   6.765  -2.813
  234    HE1  HIS  33           HE1      HIS  33   0.206  10.240  -4.876
  235    H    THR  34           H        THR  34   6.353   7.613  -1.683
  236    HA   THR  34           HA       THR  34   7.526   9.607  -0.088
  237    HB   THR  34           HB       THR  34   9.092   7.864   0.667
  238    HG1  THR  34           HG1      THR  34   8.960   6.897  -1.653
  239   HG21  THR  34          3HG2      THR  34   7.101   6.055   0.989
  240   HG22  THR  34          1HG2      THR  34   6.171   7.488   0.552
  241   HG23  THR  34          2HG2      THR  34   7.256   7.530   1.942
  242    H    GLY  35           H        GLY  35   8.104   8.855  -3.296
  243    HA2  GLY  35           1HA      GLY  35  10.750  10.161  -3.164
  244    HA3  GLY  35           2HA      GLY  35  10.450   8.798  -4.231
  245    H    GLU  36           H        GLU  36   8.860  11.904  -3.476
  246    HA   GLU  36           HA       GLU  36   9.054  12.661  -6.281
  247    HB2  GLU  36           1HB      GLU  36   6.849  11.376  -5.774
  248    HB3  GLU  36           2HB      GLU  36   6.366  12.857  -4.959
  249    HG2  GLU  36           1HG      GLU  36   5.557  12.710  -7.280
  250    HG3  GLU  36           2HG      GLU  36   6.581  14.115  -6.988
  251    H    SER  37           H        SER  37   8.689  14.907  -6.657
  252    HA   SER  37           HA       SER  37   8.961  16.531  -4.214
  253    HB2  SER  37           1HB      SER  37  10.153  18.173  -5.626
  254    HB3  SER  37           2HB      SER  37  10.951  16.601  -5.637
  255    HG   SER  37           HG       SER  37  10.828  16.891  -7.728
  256    H    GLY  38           H        GLY  38   6.656  16.665  -4.001
  257    HA2  GLY  38           1HA      GLY  38   5.570  18.911  -5.466
  258    HA3  GLY  38           2HA      GLY  38   4.743  17.389  -5.764
  259    HA   PRO  39           HA       PRO  39   2.585  19.323  -2.204
  260    HB2  PRO  39           1HB      PRO  39   0.126  18.448  -2.950
  261    HB3  PRO  39           2HB      PRO  39   0.851  19.931  -3.583
  262    HG2  PRO  39           1HG      PRO  39   0.712  17.210  -4.824
  263    HG3  PRO  39           2HG      PRO  39   0.446  18.796  -5.572
  264    HD2  PRO  39           1HD      PRO  39   2.770  17.432  -5.836
  265    HD3  PRO  39           2HD      PRO  39   2.703  19.205  -5.802
  266    H    SER  40           H        SER  40   1.507  18.342  -0.423
  267    HA   SER  40           HA       SER  40   1.247  16.717   1.149
  268    HB2  SER  40           1HB      SER  40   0.333  15.416  -1.381
  269    HB3  SER  40           2HB      SER  40   0.503  14.416   0.062
  270    HG   SER  40           HG       SER  40  -0.772  16.334   1.019
  271    H    SER  41           H        SER  41   3.883  17.155   0.300
  272    HA   SER  41           HA       SER  41   5.172  14.614  -0.134
  273    HB2  SER  41           1HB      SER  41   6.075  17.447   0.161
  274    HB3  SER  41           2HB      SER  41   7.250  16.160   0.430
  275    HG   SER  41           HG       SER  41   7.323  15.851  -1.640
  276    H    GLY  42           H        GLY  42   4.900  16.929   2.547
  277    HA2  GLY  42           1HA      GLY  42   5.093  16.620   4.816
  278    HA3  GLY  42           2HA      GLY  42   4.944  14.895   4.518
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1 -20.845   1.311 -20.678
    2    HA2  GLY   1           1HA      GLY   1 -20.595  -0.969 -20.774
    3    HA3  GLY   1           2HA      GLY   1 -19.052  -0.737 -19.965
    4    H    SER   2           H        SER   2 -21.784  -2.411 -19.731
    5    HA   SER   2           HA       SER   2 -22.005  -2.191 -16.810
    6    HB2  SER   2           1HB      SER   2 -23.870  -3.070 -18.968
    7    HB3  SER   2           2HB      SER   2 -24.039  -3.809 -17.376
    8    HG   SER   2           HG       SER   2 -24.206  -1.673 -16.519
    9    H    SER   3           H        SER   3 -21.318  -3.774 -15.512
   10    HA   SER   3           HA       SER   3 -21.132  -6.506 -16.336
   11    HB2  SER   3           1HB      SER   3 -19.101  -5.530 -17.417
   12    HB3  SER   3           2HB      SER   3 -18.523  -5.060 -15.818
   13    HG   SER   3           HG       SER   3 -17.661  -7.073 -16.514
   14    H    GLY   4           H        GLY   4 -20.501  -7.924 -14.604
   15    HA2  GLY   4           1HA      GLY   4 -20.488  -6.613 -11.957
   16    HA3  GLY   4           2HA      GLY   4 -21.513  -8.001 -12.290
   17    H    SER   5           H        SER   5 -18.188  -6.913 -11.935
   18    HA   SER   5           HA       SER   5 -17.412  -9.709 -11.415
   19    HB2  SER   5           1HB      SER   5 -16.397  -8.772 -13.493
   20    HB3  SER   5           2HB      SER   5 -15.629  -7.522 -12.514
   21    HG   SER   5           HG       SER   5 -14.901  -9.606 -11.297
   22    H    SER   6           H        SER   6 -16.387 -10.146  -9.542
   23    HA   SER   6           HA       SER   6 -16.508  -8.326  -7.411
   24    HB2  SER   6           1HB      SER   6 -16.521 -10.756  -7.073
   25    HB3  SER   6           2HB      SER   6 -14.860 -10.855  -7.657
   26    HG   SER   6           HG       SER   6 -14.981 -10.810  -5.366
   27    H    GLY   7           H        GLY   7 -15.393  -6.463  -7.485
   28    HA2  GLY   7           1HA      GLY   7 -12.469  -6.672  -7.837
   29    HA3  GLY   7           2HA      GLY   7 -13.387  -5.383  -8.602
   30    H    GLU   8           H        GLU   8 -13.675  -6.740  -5.335
   31    HA   GLU   8           HA       GLU   8 -13.700  -4.087  -4.209
   32    HB2  GLU   8           1HB      GLU   8 -14.055  -6.857  -3.128
   33    HB3  GLU   8           2HB      GLU   8 -13.748  -5.527  -2.020
   34    HG2  GLU   8           1HG      GLU   8 -16.035  -5.586  -2.039
   35    HG3  GLU   8           2HG      GLU   8 -15.709  -4.378  -3.280
   36    H    LYS   9           H        LYS   9 -11.907  -2.997  -3.796
   37    HA   LYS   9           HA       LYS   9  -9.423  -4.459  -3.262
   38    HB2  LYS   9           1HB      LYS   9  -9.914  -1.565  -3.981
   39    HB3  LYS   9           2HB      LYS   9  -8.329  -2.251  -3.652
   40    HG2  LYS   9           1HG      LYS   9  -8.292  -3.456  -5.612
   41    HG3  LYS   9           2HG      LYS   9 -10.051  -3.474  -5.758
   42    HD2  LYS   9           1HD      LYS   9  -9.846  -0.931  -6.070
   43    HD3  LYS   9           2HD      LYS   9  -8.133  -1.244  -6.360
   44    HE2  LYS   9           1HE      LYS   9 -10.397  -2.541  -7.872
   45    HE3  LYS   9           2HE      LYS   9  -9.494  -1.136  -8.434
   46    HZ1  LYS   9           3HZ      LYS   9  -8.241  -2.697  -9.422
   47    HZ2  LYS   9           1HZ      LYS   9  -8.717  -3.928  -8.363
   48    HZ3  LYS   9           2HZ      LYS   9  -7.512  -2.835  -7.901
   49    HA   PRO  10           HA       PRO  10 -10.353  -3.353   1.030
   50    HB2  PRO  10           1HB      PRO  10  -8.614  -5.148   2.088
   51    HB3  PRO  10           2HB      PRO  10 -10.234  -5.590   1.537
   52    HG2  PRO  10           1HG      PRO  10  -7.606  -5.902   0.137
   53    HG3  PRO  10           2HG      PRO  10  -8.957  -7.046   0.250
   54    HD2  PRO  10           1HD      PRO  10  -8.527  -5.510  -1.938
   55    HD3  PRO  10           2HD      PRO  10 -10.153  -5.991  -1.414
   56    H    TYR  11           H        TYR  11  -7.569  -3.067  -0.890
   57    HA   TYR  11           HA       TYR  11  -6.151  -1.614   1.245
   58    HB2  TYR  11           1HB      TYR  11  -4.947  -2.723  -1.295
   59    HB3  TYR  11           2HB      TYR  11  -4.087  -2.062   0.092
   60    HD1  TYR  11           HD2      TYR  11  -3.860  -3.357   2.148
   61    HD2  TYR  11           HD1      TYR  11  -5.856  -4.966  -1.247
   62    HE1  TYR  11           HE2      TYR  11  -3.707  -5.607   3.132
   63    HE2  TYR  11           HE1      TYR  11  -5.710  -7.220  -0.273
   64    HH   TYR  11           HH       TYR  11  -5.259  -8.384   1.614
   65    H    GLU  12           H        GLU  12  -5.739   0.501   0.997
   66    HA   GLU  12           HA       GLU  12  -6.047   1.712  -1.654
   67    HB2  GLU  12           1HB      GLU  12  -7.662   2.279   0.778
   68    HB3  GLU  12           2HB      GLU  12  -7.182   3.652  -0.209
   69    HG2  GLU  12           1HG      GLU  12  -9.168   3.164  -1.186
   70    HG3  GLU  12           2HG      GLU  12  -8.112   2.138  -2.155
   71    H    CYS  13           H        CYS  13  -4.902   3.643  -1.965
   72    HA   CYS  13           HA       CYS  13  -2.571   3.905  -0.284
   73    HB2  CYS  13           1HB      CYS  13  -2.522   4.044  -2.800
   74    HB3  CYS  13           2HB      CYS  13  -3.343   5.596  -2.667
   75    H    THR  14           H        THR  14  -2.362   5.257   1.364
   76    HA   THR  14           HA       THR  14  -4.427   7.233   1.876
   77    HB   THR  14           HB       THR  14  -3.156   7.591   4.027
   78    HG1  THR  14           HG1      THR  14  -1.202   6.786   4.037
   79   HG21  THR  14          3HG2      THR  14  -5.062   6.146   4.052
   80   HG22  THR  14          1HG2      THR  14  -3.783   5.351   4.968
   81   HG23  THR  14          2HG2      THR  14  -4.143   4.829   3.322
   82    H    ASP  15           H        ASP  15  -2.565   7.663  -0.338
   83    HA   ASP  15           HA       ASP  15  -1.379  10.198   0.582
   84    HB2  ASP  15           1HB      ASP  15  -0.202   8.014  -1.056
   85    HB3  ASP  15           2HB      ASP  15   0.179   9.666  -1.533
   86    H    CYS  16           H        CYS  16  -2.871   8.418  -2.071
   87    HA   CYS  16           HA       CYS  16  -3.652  10.998  -3.260
   88    HB2  CYS  16           1HB      CYS  16  -3.606   9.867  -5.476
   89    HB3  CYS  16           2HB      CYS  16  -2.021   9.962  -4.716
   90    H    GLY  17           H        GLY  17  -4.518   7.643  -2.626
   91    HA2  GLY  17           1HA      GLY  17  -6.810   7.281  -1.807
   92    HA3  GLY  17           2HA      GLY  17  -7.344   8.389  -3.062
   93    H    LYS  18           H        LYS  18  -4.836   6.212  -3.915
   94    HA   LYS  18           HA       LYS  18  -6.468   4.973  -5.907
   95    HB2  LYS  18           1HB      LYS  18  -3.882   5.477  -5.864
   96    HB3  LYS  18           2HB      LYS  18  -3.794   3.882  -5.128
   97    HG2  LYS  18           1HG      LYS  18  -4.490   2.811  -7.036
   98    HG3  LYS  18           2HG      LYS  18  -5.334   4.232  -7.655
   99    HD2  LYS  18           1HD      LYS  18  -2.379   4.375  -7.333
  100    HD3  LYS  18           2HD      LYS  18  -3.028   3.431  -8.676
  101    HE2  LYS  18           1HE      LYS  18  -4.357   5.419  -9.353
  102    HE3  LYS  18           2HE      LYS  18  -3.553   6.341  -8.083
  103    HZ1  LYS  18           3HZ      LYS  18  -2.612   5.652 -10.686
  104    HZ2  LYS  18           1HZ      LYS  18  -1.516   5.176  -9.488
  105    HZ3  LYS  18           2HZ      LYS  18  -2.007   6.791  -9.591
  106    H    ALA  19           H        ALA  19  -6.308   2.490  -6.150
  107    HA   ALA  19           HA       ALA  19  -6.667   1.166  -3.553
  108    HB1  ALA  19           3HB      ALA  19  -8.594   1.106  -5.864
  109    HB2  ALA  19           1HB      ALA  19  -8.626  -0.061  -4.541
  110    HB3  ALA  19           2HB      ALA  19  -8.895   1.652  -4.214
  111    H    PHE  20           H        PHE  20  -6.370  -1.122  -3.585
  112    HA   PHE  20           HA       PHE  20  -5.370  -2.350  -6.015
  113    HB2  PHE  20           1HB      PHE  20  -3.617  -2.180  -3.556
  114    HB3  PHE  20           2HB      PHE  20  -3.225  -2.996  -5.066
  115    HD1  PHE  20           HD1      PHE  20  -3.754   0.288  -3.484
  116    HD2  PHE  20           HD2      PHE  20  -2.377  -1.801  -6.927
  117    HE1  PHE  20           HE1      PHE  20  -2.742   2.364  -4.334
  118    HE2  PHE  20           HE2      PHE  20  -1.362   0.270  -7.782
  119    HZ   PHE  20           HZ       PHE  20  -1.543   2.356  -6.485
  120    H    GLY  21           H        GLY  21  -6.222  -4.315  -6.116
  121    HA2  GLY  21           1HA      GLY  21  -7.669  -5.502  -4.028
  122    HA3  GLY  21           2HA      GLY  21  -7.148  -6.320  -5.494
  123    H    LEU  22           H        LEU  22  -4.303  -5.458  -4.599
  124    HA   LEU  22           HA       LEU  22  -3.931  -7.686  -2.706
  125    HB2  LEU  22           1HB      LEU  22  -2.461  -6.869  -5.146
  126    HB3  LEU  22           2HB      LEU  22  -1.505  -7.488  -3.801
  127    HG   LEU  22           HG       LEU  22  -3.587  -8.916  -5.430
  128   HD11  LEU  22          1HD1      LEU  22  -1.612  -9.321  -6.477
  129   HD12  LEU  22          2HD1      LEU  22  -1.536 -10.591  -5.256
  130   HD13  LEU  22          3HD1      LEU  22  -0.656  -9.082  -5.014
  131   HD21  LEU  22          3HD2      LEU  22  -2.667  -9.455  -2.651
  132   HD22  LEU  22          1HD2      LEU  22  -2.929 -10.820  -3.737
  133   HD23  LEU  22          2HD2      LEU  22  -4.250  -9.705  -3.387
  134    H    LYS  23           H        LYS  23  -2.056  -7.500  -1.273
  135    HA   LYS  23           HA       LYS  23  -1.898  -4.840  -0.156
  136    HB2  LYS  23           1HB      LYS  23  -2.116  -6.600   1.428
  137    HB3  LYS  23           2HB      LYS  23  -0.808  -7.519   0.695
  138    HG2  LYS  23           1HG      LYS  23   0.155  -6.648   2.611
  139    HG3  LYS  23           2HG      LYS  23   0.679  -5.527   1.353
  140    HD2  LYS  23           1HD      LYS  23  -1.860  -4.931   2.779
  141    HD3  LYS  23           2HD      LYS  23  -0.345  -4.685   3.652
  142    HE2  LYS  23           1HE      LYS  23   0.433  -3.336   1.663
  143    HE3  LYS  23           2HE      LYS  23  -1.225  -3.412   1.069
  144    HZ1  LYS  23           3HZ      LYS  23  -1.074  -1.406   2.233
  145    HZ2  LYS  23           1HZ      LYS  23  -0.219  -2.096   3.520
  146    HZ3  LYS  23           2HZ      LYS  23  -1.859  -2.449   3.308
  147    H    SER  24           H        SER  24   0.137  -7.010  -1.987
  148    HA   SER  24           HA       SER  24   2.548  -5.505  -1.575
  149    HB2  SER  24           1HB      SER  24   2.219  -8.035  -2.245
  150    HB3  SER  24           2HB      SER  24   2.209  -7.381  -3.883
  151    HG   SER  24           HG       SER  24   4.241  -6.376  -3.348
  152    H    GLN  25           H        GLN  25  -0.023  -5.579  -3.943
  153    HA   GLN  25           HA       GLN  25   1.262  -4.106  -5.976
  154    HB2  GLN  25           1HB      GLN  25  -1.603  -4.655  -5.283
  155    HB3  GLN  25           2HB      GLN  25  -1.209  -3.511  -6.560
  156    HG2  GLN  25           1HG      GLN  25   0.305  -5.517  -7.384
  157    HG3  GLN  25           2HG      GLN  25  -0.879  -6.455  -6.475
  158   HE21  GLN  25          1HE2      GLN  25  -2.404  -7.229  -7.726
  159   HE22  GLN  25          2HE2      GLN  25  -3.111  -6.440  -9.090
  160    H    LEU  26           H        LEU  26  -0.355  -3.169  -3.034
  161    HA   LEU  26           HA       LEU  26  -0.567  -0.389  -3.740
  162    HB2  LEU  26           1HB      LEU  26  -2.189  -1.157  -2.229
  163    HB3  LEU  26           2HB      LEU  26  -0.987  -1.952  -1.214
  164    HG   LEU  26           HG       LEU  26  -0.178   0.255  -0.479
  165   HD11  LEU  26          1HD1      LEU  26  -0.593   1.864  -2.017
  166   HD12  LEU  26          2HD1      LEU  26  -2.030   2.096  -1.022
  167   HD13  LEU  26          3HD1      LEU  26  -2.131   1.156  -2.510
  168   HD21  LEU  26          3HD2      LEU  26  -1.889   0.636   1.064
  169   HD22  LEU  26          1HD2      LEU  26  -2.078  -1.062   0.629
  170   HD23  LEU  26          2HD2      LEU  26  -3.149   0.151  -0.071
  171    H    ILE  27           H        ILE  27   1.496  -2.296  -1.561
  172    HA   ILE  27           HA       ILE  27   3.045  -0.287  -0.488
  173    HB   ILE  27           HB       ILE  27   3.988  -3.034  -1.316
  174   HG12  ILE  27          1HG1      ILE  27   3.123  -2.171   1.436
  175   HG13  ILE  27          2HG1      ILE  27   1.966  -2.794   0.265
  176   HG21  ILE  27          1HG2      ILE  27   5.258  -1.925   1.017
  177   HG22  ILE  27          2HG2      ILE  27   5.981  -2.555  -0.461
  178   HG23  ILE  27          3HG2      ILE  27   5.475  -0.868  -0.377
  179   HD11  ILE  27          3HD1      ILE  27   4.186  -4.197   1.668
  180   HD12  ILE  27          1HD1      ILE  27   2.503  -4.678   1.455
  181   HD13  ILE  27          2HD1      ILE  27   3.629  -4.786   0.102
  182    H    ILE  28           H        ILE  28   3.573  -2.034  -3.537
  183    HA   ILE  28           HA       ILE  28   5.962  -0.768  -4.269
  184    HB   ILE  28           HB       ILE  28   3.804  -1.891  -6.059
  185   HG12  ILE  28          1HG1      ILE  28   6.393  -3.167  -5.167
  186   HG13  ILE  28          2HG1      ILE  28   4.851  -3.447  -4.366
  187   HG21  ILE  28          1HG2      ILE  28   5.354  -1.886  -7.833
  188   HG22  ILE  28          2HG2      ILE  28   5.457  -0.282  -7.110
  189   HG23  ILE  28          3HG2      ILE  28   6.697  -1.486  -6.763
  190   HD11  ILE  28          3HD1      ILE  28   3.952  -4.499  -6.288
  191   HD12  ILE  28          1HD1      ILE  28   5.320  -3.997  -7.281
  192   HD13  ILE  28          2HD1      ILE  28   5.547  -5.197  -6.008
  193    H    HIS  29           H        HIS  29   2.607   0.185  -4.682
  194    HA   HIS  29           HA       HIS  29   3.099   2.333  -6.476
  195    HB2  HIS  29           1HB      HIS  29   0.884   1.556  -6.457
  196    HB3  HIS  29           2HB      HIS  29   0.794   1.579  -4.698
  197    HD1  HIS  29           HD1      HIS  29   0.684   3.878  -7.677
  198    HD2  HIS  29           HD2      HIS  29  -0.052   3.964  -3.589
  199    HE1  HIS  29           HE1      HIS  29  -0.444   6.084  -7.243
  200    H    GLN  30           H        GLN  30   2.444   2.262  -2.973
  201    HA   GLN  30           HA       GLN  30   2.569   4.908  -2.354
  202    HB2  GLN  30           1HB      GLN  30   3.788   2.620  -0.801
  203    HB3  GLN  30           2HB      GLN  30   3.504   4.228  -0.149
  204    HG2  GLN  30           1HG      GLN  30   1.048   3.784  -0.916
  205    HG3  GLN  30           2HG      GLN  30   1.551   2.096  -0.854
  206   HE21  GLN  30          1HE2      GLN  30   0.081   1.732   0.840
  207   HE22  GLN  30          2HE2      GLN  30   0.422   2.247   2.453
  208    H    ARG  31           H        ARG  31   5.125   2.955  -3.558
  209    HA   ARG  31           HA       ARG  31   7.366   4.328  -2.596
  210    HB2  ARG  31           1HB      ARG  31   7.031   2.957  -5.270
  211    HB3  ARG  31           2HB      ARG  31   8.561   3.368  -4.508
  212    HG2  ARG  31           1HG      ARG  31   7.810   1.886  -2.578
  213    HG3  ARG  31           2HG      ARG  31   6.556   1.302  -3.673
  214    HD2  ARG  31           1HD      ARG  31   8.211  -0.236  -4.066
  215    HD3  ARG  31           2HD      ARG  31   8.581   0.963  -5.305
  216    HE   ARG  31           HE       ARG  31   9.962   1.390  -2.818
  217   HH11  ARG  31          1HH1      ARG  31  10.021  -0.248  -5.889
  218   HH12  ARG  31          2HH1      ARG  31  11.743  -0.431  -5.906
  219   HH21  ARG  31          1HH2      ARG  31  12.231   1.156  -2.828
  220   HH22  ARG  31          2HH2      ARG  31  12.999   0.367  -4.164
  221    H    THR  32           H        THR  32   5.646   4.743  -5.692
  222    HA   THR  32           HA       THR  32   7.091   6.835  -6.740
  223    HB   THR  32           HB       THR  32   5.093   5.568  -7.765
  224    HG1  THR  32           HG1      THR  32   4.550   7.720  -8.915
  225   HG21  THR  32          3HG2      THR  32   3.399   6.099  -6.140
  226   HG22  THR  32          1HG2      THR  32   2.965   6.866  -7.667
  227   HG23  THR  32          2HG2      THR  32   3.663   7.828  -6.365
  228    H    HIS  33           H        HIS  33   5.007   6.853  -4.006
  229    HA   HIS  33           HA       HIS  33   4.619   9.725  -4.021
  230    HB2  HIS  33           1HB      HIS  33   3.797   7.508  -2.160
  231    HB3  HIS  33           2HB      HIS  33   3.613   9.199  -1.702
  232    HD1  HIS  33           HD1      HIS  33   2.332  10.587  -3.870
  233    HD2  HIS  33           HD2      HIS  33   1.487   6.579  -3.177
  234    HE1  HIS  33           HE1      HIS  33   0.110  10.168  -4.971
  235    H    THR  34           H        THR  34   6.208   7.374  -1.861
  236    HA   THR  34           HA       THR  34   7.440   9.268  -0.197
  237    HB   THR  34           HB       THR  34   9.037   7.392   0.371
  238    HG1  THR  34           HG1      THR  34   8.036   5.306  -0.555
  239   HG21  THR  34          3HG2      THR  34   6.368   7.757   1.026
  240   HG22  THR  34          1HG2      THR  34   7.520   6.727   1.874
  241   HG23  THR  34          2HG2      THR  34   6.478   6.043   0.626
  242    H    GLY  35           H        GLY  35   8.618  10.870  -1.106
  243    HA2  GLY  35           1HA      GLY  35  11.071  11.178  -1.610
  244    HA3  GLY  35           2HA      GLY  35  10.787  10.072  -2.946
  245    H    GLU  36           H        GLU  36   8.748  12.736  -1.805
  246    HA   GLU  36           HA       GLU  36   9.457  14.358  -4.105
  247    HB2  GLU  36           1HB      GLU  36   7.509  12.637  -4.609
  248    HB3  GLU  36           2HB      GLU  36   6.538  13.834  -3.764
  249    HG2  GLU  36           1HG      GLU  36   6.509  14.136  -6.197
  250    HG3  GLU  36           2HG      GLU  36   7.167  15.534  -5.348
  251    H    SER  37           H        SER  37   8.805  16.529  -3.925
  252    HA   SER  37           HA       SER  37   8.961  17.747  -1.516
  253    HB2  SER  37           1HB      SER  37   7.835  19.704  -2.520
  254    HB3  SER  37           2HB      SER  37   9.001  18.983  -3.629
  255    HG   SER  37           HG       SER  37   6.186  18.884  -3.698
  256    H    GLY  38           H        GLY  38   5.938  16.735  -3.092
  257    HA2  GLY  38           1HA      GLY  38   3.864  16.278  -2.220
  258    HA3  GLY  38           2HA      GLY  38   4.666  16.057  -0.672
  259    HA   PRO  39           HA       PRO  39   3.153  20.669  -1.155
  260    HB2  PRO  39           1HB      PRO  39   0.909  20.886  -2.667
  261    HB3  PRO  39           2HB      PRO  39   2.536  21.072  -3.331
  262    HG2  PRO  39           1HG      PRO  39   0.724  18.690  -3.397
  263    HG3  PRO  39           2HG      PRO  39   1.737  19.361  -4.688
  264    HD2  PRO  39           1HD      PRO  39   2.474  17.201  -3.232
  265    HD3  PRO  39           2HD      PRO  39   3.650  18.364  -3.878
  266    H    SER  40           H        SER  40   1.703  17.772  -0.418
  267    HA   SER  40           HA       SER  40  -0.480  19.058   1.081
  268    HB2  SER  40           1HB      SER  40  -1.513  16.812   1.174
  269    HB3  SER  40           2HB      SER  40  -1.250  17.345  -0.486
  270    HG   SER  40           HG       SER  40   0.072  15.357   0.982
  271    H    SER  41           H        SER  41  -0.160  19.312   3.179
  272    HA   SER  41           HA       SER  41   1.989  18.689   4.672
  273    HB2  SER  41           1HB      SER  41  -0.895  18.995   5.389
  274    HB3  SER  41           2HB      SER  41   0.228  18.456   6.638
  275    HG   SER  41           HG       SER  41   0.556  20.532   6.835
  276    H    GLY  42           H        GLY  42   2.945  16.943   5.517
  277    HA2  GLY  42           1HA      GLY  42   2.122  14.749   6.719
  278    HA3  GLY  42           2HA      GLY  42   1.674  14.347   5.068
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1 -31.553  -1.998  -8.117
    2    HA2  GLY   1           1HA      GLY   1 -32.404  -1.844 -10.396
    3    HA3  GLY   1           2HA      GLY   1 -31.231  -0.567 -10.680
    4    H    SER   2           H        SER   2 -28.891  -1.507  -9.878
    5    HA   SER   2           HA       SER   2 -28.433  -4.224 -10.689
    6    HB2  SER   2           1HB      SER   2 -27.918  -1.958 -12.563
    7    HB3  SER   2           2HB      SER   2 -26.753  -3.281 -12.516
    8    HG   SER   2           HG       SER   2 -29.159  -3.204 -13.690
    9    H    SER   3           H        SER   3 -26.905  -4.902  -9.356
   10    HA   SER   3           HA       SER   3 -25.373  -3.284  -7.698
   11    HB2  SER   3           1HB      SER   3 -24.726  -6.095  -8.622
   12    HB3  SER   3           2HB      SER   3 -24.065  -5.297  -7.194
   13    HG   SER   3           HG       SER   3 -26.757  -6.043  -7.676
   14    H    GLY   4           H        GLY   4 -22.853  -3.515  -7.651
   15    HA2  GLY   4           1HA      GLY   4 -21.548  -3.512 -10.213
   16    HA3  GLY   4           2HA      GLY   4 -21.738  -1.898  -9.545
   17    H    SER   5           H        SER   5 -20.837  -5.090  -8.229
   18    HA   SER   5           HA       SER   5 -18.430  -3.819  -7.100
   19    HB2  SER   5           1HB      SER   5 -20.284  -5.845  -5.845
   20    HB3  SER   5           2HB      SER   5 -18.659  -5.538  -5.234
   21    HG   SER   5           HG       SER   5 -19.249  -3.410  -4.831
   22    H    SER   6           H        SER   6 -17.251  -4.506  -8.948
   23    HA   SER   6           HA       SER   6 -16.710  -7.403  -8.991
   24    HB2  SER   6           1HB      SER   6 -17.850  -6.519 -11.052
   25    HB3  SER   6           2HB      SER   6 -16.429  -5.515 -11.338
   26    HG   SER   6           HG       SER   6 -15.366  -7.779 -11.040
   27    H    GLY   7           H        GLY   7 -14.805  -7.796  -8.083
   28    HA2  GLY   7           1HA      GLY   7 -12.514  -7.746  -7.793
   29    HA3  GLY   7           2HA      GLY   7 -12.425  -6.527  -9.056
   30    H    GLU   8           H        GLU   8 -13.896  -6.686  -5.809
   31    HA   GLU   8           HA       GLU   8 -13.424  -3.965  -5.238
   32    HB2  GLU   8           1HB      GLU   8 -14.126  -4.468  -2.996
   33    HB3  GLU   8           2HB      GLU   8 -15.128  -5.390  -4.108
   34    HG2  GLU   8           1HG      GLU   8 -12.744  -6.495  -2.643
   35    HG3  GLU   8           2HG      GLU   8 -14.417  -6.663  -2.113
   36    H    LYS   9           H        LYS   9 -11.823  -2.929  -4.120
   37    HA   LYS   9           HA       LYS   9  -9.407  -4.517  -3.552
   38    HB2  LYS   9           1HB      LYS   9  -9.557  -1.586  -4.276
   39    HB3  LYS   9           2HB      LYS   9  -8.094  -2.535  -4.052
   40    HG2  LYS   9           1HG      LYS   9  -8.506  -3.797  -6.016
   41    HG3  LYS   9           2HG      LYS   9 -10.141  -3.150  -6.165
   42    HD2  LYS   9           1HD      LYS   9  -9.290  -0.962  -6.672
   43    HD3  LYS   9           2HD      LYS   9  -7.636  -1.477  -6.331
   44    HE2  LYS   9           1HE      LYS   9  -7.448  -2.639  -8.296
   45    HE3  LYS   9           2HE      LYS   9  -9.180  -2.953  -8.402
   46    HZ1  LYS   9           3HZ      LYS   9  -7.818  -0.372  -8.949
   47    HZ2  LYS   9           1HZ      LYS   9  -9.496  -0.589  -8.943
   48    HZ3  LYS   9           2HZ      LYS   9  -8.543  -1.392 -10.087
   49    HA   PRO  10           HA       PRO  10 -10.610  -3.142   0.603
   50    HB2  PRO  10           1HB      PRO  10  -9.168  -5.057   1.877
   51    HB3  PRO  10           2HB      PRO  10 -10.775  -5.354   1.202
   52    HG2  PRO  10           1HG      PRO  10  -8.088  -6.001   0.052
   53    HG3  PRO  10           2HG      PRO  10  -9.558  -6.992   0.088
   54    HD2  PRO  10           1HD      PRO  10  -8.784  -5.613  -2.110
   55    HD3  PRO  10           2HD      PRO  10 -10.491  -5.898  -1.713
   56    H    TYR  11           H        TYR  11  -7.852  -2.872  -1.172
   57    HA   TYR  11           HA       TYR  11  -6.376  -1.652   1.069
   58    HB2  TYR  11           1HB      TYR  11  -5.182  -2.902  -1.413
   59    HB3  TYR  11           2HB      TYR  11  -4.293  -2.210  -0.061
   60    HD1  TYR  11           HD1      TYR  11  -6.267  -5.071  -1.215
   61    HD2  TYR  11           HD2      TYR  11  -4.093  -3.407   2.042
   62    HE1  TYR  11           HE1      TYR  11  -6.250  -7.269  -0.111
   63    HE2  TYR  11           HE2      TYR  11  -4.070  -5.600   3.155
   64    HH   TYR  11           HH       TYR  11  -5.968  -7.916   2.694
   65    H    GLU  12           H        GLU  12  -6.237   0.478   0.927
   66    HA   GLU  12           HA       GLU  12  -6.273   1.717  -1.747
   67    HB2  GLU  12           1HB      GLU  12  -8.244   2.030   0.033
   68    HB3  GLU  12           2HB      GLU  12  -7.161   3.286   0.617
   69    HG2  GLU  12           1HG      GLU  12  -7.184   4.372  -1.530
   70    HG3  GLU  12           2HG      GLU  12  -8.147   3.065  -2.217
   71    H    CYS  13           H        CYS  13  -5.028   3.627  -2.032
   72    HA   CYS  13           HA       CYS  13  -2.558   3.584  -0.553
   73    HB2  CYS  13           1HB      CYS  13  -2.569   3.927  -2.988
   74    HB3  CYS  13           2HB      CYS  13  -3.479   5.419  -2.776
   75    H    THR  14           H        THR  14  -2.177   4.695   1.234
   76    HA   THR  14           HA       THR  14  -4.005   6.748   2.117
   77    HB   THR  14           HB       THR  14  -2.574   6.838   4.145
   78    HG1  THR  14           HG1      THR  14  -1.112   4.755   2.855
   79   HG21  THR  14          3HG2      THR  14  -3.309   4.800   5.040
   80   HG22  THR  14          1HG2      THR  14  -3.144   3.959   3.499
   81   HG23  THR  14          2HG2      THR  14  -4.446   5.126   3.732
   82    H    ASP  15           H        ASP  15  -2.460   7.337  -0.263
   83    HA   ASP  15           HA       ASP  15  -1.072   9.743   0.707
   84    HB2  ASP  15           1HB      ASP  15   0.358   7.726  -0.265
   85    HB3  ASP  15           2HB      ASP  15  -0.119   8.441  -1.802
   86    H    CYS  16           H        CYS  16  -2.834   8.162  -1.904
   87    HA   CYS  16           HA       CYS  16  -3.707  10.818  -2.821
   88    HB2  CYS  16           1HB      CYS  16  -3.727   9.924  -5.149
   89    HB3  CYS  16           2HB      CYS  16  -2.113  10.035  -4.455
   90    H    GLY  17           H        GLY  17  -4.420   7.432  -2.328
   91    HA2  GLY  17           1HA      GLY  17  -6.699   6.986  -1.483
   92    HA3  GLY  17           2HA      GLY  17  -7.280   8.045  -2.760
   93    H    LYS  18           H        LYS  18  -4.860   6.508  -4.220
   94    HA   LYS  18           HA       LYS  18  -6.301   5.050  -6.005
   95    HB2  LYS  18           1HB      LYS  18  -3.703   5.517  -5.758
   96    HB3  LYS  18           2HB      LYS  18  -3.704   3.882  -5.110
   97    HG2  LYS  18           1HG      LYS  18  -4.217   2.935  -7.115
   98    HG3  LYS  18           2HG      LYS  18  -5.104   4.351  -7.684
   99    HD2  LYS  18           1HD      LYS  18  -2.692   5.445  -7.578
  100    HD3  LYS  18           2HD      LYS  18  -2.189   3.764  -7.772
  101    HE2  LYS  18           1HE      LYS  18  -4.243   5.010  -9.571
  102    HE3  LYS  18           2HE      LYS  18  -2.518   5.185  -9.886
  103    HZ1  LYS  18           3HZ      LYS  18  -4.218   2.832 -10.118
  104    HZ2  LYS  18           1HZ      LYS  18  -2.650   2.571  -9.539
  105    HZ3  LYS  18           2HZ      LYS  18  -2.884   3.300 -11.047
  106    H    ALA  19           H        ALA  19  -6.270   2.609  -6.304
  107    HA   ALA  19           HA       ALA  19  -6.753   1.220  -3.757
  108    HB1  ALA  19           3HB      ALA  19  -8.940   1.648  -4.416
  109    HB2  ALA  19           1HB      ALA  19  -8.577   1.407  -6.125
  110    HB3  ALA  19           2HB      ALA  19  -8.645   0.023  -5.034
  111    H    PHE  20           H        PHE  20  -6.453  -1.054  -3.804
  112    HA   PHE  20           HA       PHE  20  -5.377  -2.264  -6.212
  113    HB2  PHE  20           1HB      PHE  20  -3.727  -2.077  -3.683
  114    HB3  PHE  20           2HB      PHE  20  -3.292  -2.983  -5.128
  115    HD1  PHE  20           HD2      PHE  20  -2.550  -1.846  -7.134
  116    HD2  PHE  20           HD1      PHE  20  -3.574   0.328  -3.621
  117    HE1  PHE  20           HE2      PHE  20  -1.441   0.149  -8.050
  118    HE2  PHE  20           HE1      PHE  20  -2.467   2.328  -4.532
  119    HZ   PHE  20           HZ       PHE  20  -1.397   2.240  -6.749
  120    H    GLY  21           H        GLY  21  -6.090  -4.288  -6.367
  121    HA2  GLY  21           1HA      GLY  21  -7.699  -5.468  -4.371
  122    HA3  GLY  21           2HA      GLY  21  -7.096  -6.276  -5.811
  123    H    LEU  22           H        LEU  22  -4.301  -5.439  -4.783
  124    HA   LEU  22           HA       LEU  22  -4.031  -7.674  -2.883
  125    HB2  LEU  22           1HB      LEU  22  -2.424  -6.819  -5.221
  126    HB3  LEU  22           2HB      LEU  22  -1.547  -7.456  -3.831
  127    HG   LEU  22           HG       LEU  22  -3.530  -8.864  -5.597
  128   HD11  LEU  22          1HD1      LEU  22  -1.504  -9.250  -6.545
  129   HD12  LEU  22          2HD1      LEU  22  -1.479 -10.533  -5.336
  130   HD13  LEU  22          3HD1      LEU  22  -0.625  -9.020  -5.033
  131   HD21  LEU  22          3HD2      LEU  22  -4.300  -9.845  -3.726
  132   HD22  LEU  22          1HD2      LEU  22  -2.916  -9.331  -2.761
  133   HD23  LEU  22          2HD2      LEU  22  -2.788 -10.750  -3.800
  134    H    LYS  23           H        LYS  23  -2.227  -7.499  -1.351
  135    HA   LYS  23           HA       LYS  23  -2.149  -4.849  -0.196
  136    HB2  LYS  23           1HB      LYS  23  -2.466  -6.639   1.346
  137    HB3  LYS  23           2HB      LYS  23  -1.095  -7.529   0.699
  138    HG2  LYS  23           1HG      LYS  23  -0.217  -6.681   2.638
  139    HG3  LYS  23           2HG      LYS  23   0.268  -5.448   1.472
  140    HD2  LYS  23           1HD      LYS  23  -1.737  -4.132   2.105
  141    HD3  LYS  23           2HD      LYS  23  -2.096  -5.336   3.345
  142    HE2  LYS  23           1HE      LYS  23  -0.961  -3.505   4.386
  143    HE3  LYS  23           2HE      LYS  23   0.142  -4.879   4.338
  144    HZ1  LYS  23           3HZ      LYS  23   0.902  -3.768   2.131
  145    HZ2  LYS  23           1HZ      LYS  23   1.480  -3.189   3.611
  146    HZ3  LYS  23           2HZ      LYS  23   0.233  -2.371   2.813
  147    H    SER  24           H        SER  24  -0.028  -6.978  -1.960
  148    HA   SER  24           HA       SER  24   2.362  -5.486  -1.376
  149    HB2  SER  24           1HB      SER  24   2.506  -7.879  -1.862
  150    HB3  SER  24           2HB      SER  24   1.819  -7.612  -3.463
  151    HG   SER  24           HG       SER  24   3.844  -5.988  -3.320
  152    H    GLN  25           H        GLN  25  -0.074  -5.528  -3.879
  153    HA   GLN  25           HA       GLN  25   1.328  -4.043  -5.827
  154    HB2  GLN  25           1HB      GLN  25  -1.568  -4.607  -5.301
  155    HB3  GLN  25           2HB      GLN  25  -1.115  -3.434  -6.530
  156    HG2  GLN  25           1HG      GLN  25   0.455  -5.418  -7.311
  157    HG3  GLN  25           2HG      GLN  25  -0.779  -6.376  -6.495
  158   HE21  GLN  25          1HE2      GLN  25  -2.782  -6.569  -7.390
  159   HE22  GLN  25          2HE2      GLN  25  -3.192  -5.961  -8.955
  160    H    LEU  26           H        LEU  26  -0.362  -3.136  -2.934
  161    HA   LEU  26           HA       LEU  26  -0.547  -0.342  -3.639
  162    HB2  LEU  26           1HB      LEU  26  -2.273  -1.077  -2.247
  163    HB3  LEU  26           2HB      LEU  26  -1.168  -1.946  -1.185
  164    HG   LEU  26           HG       LEU  26  -0.322   0.234  -0.359
  165   HD11  LEU  26          1HD1      LEU  26  -2.674   1.589  -1.576
  166   HD12  LEU  26          2HD1      LEU  26  -1.222   1.368  -2.552
  167   HD13  LEU  26          3HD1      LEU  26  -1.136   2.261  -1.033
  168   HD21  LEU  26          3HD2      LEU  26  -3.254  -0.392  -0.100
  169   HD22  LEU  26          1HD2      LEU  26  -2.445   0.842   0.867
  170   HD23  LEU  26          2HD2      LEU  26  -1.940  -0.844   0.988
  171    H    ILE  27           H        ILE  27   1.323  -2.275  -1.309
  172    HA   ILE  27           HA       ILE  27   2.825  -0.299  -0.131
  173    HB   ILE  27           HB       ILE  27   3.768  -3.061  -0.909
  174   HG12  ILE  27          1HG1      ILE  27   2.727  -2.117   1.763
  175   HG13  ILE  27          2HG1      ILE  27   1.691  -2.850   0.544
  176   HG21  ILE  27          1HG2      ILE  27   5.732  -2.615   0.026
  177   HG22  ILE  27          2HG2      ILE  27   5.253  -0.920   0.102
  178   HG23  ILE  27          3HG2      ILE  27   4.955  -1.983   1.478
  179   HD11  ILE  27          3HD1      ILE  27   4.120  -4.355   1.250
  180   HD12  ILE  27          1HD1      ILE  27   2.885  -4.225   2.502
  181   HD13  ILE  27          2HD1      ILE  27   2.480  -4.920   0.932
  182    H    ILE  28           H        ILE  28   3.513  -2.007  -3.167
  183    HA   ILE  28           HA       ILE  28   5.964  -0.725  -3.707
  184    HB   ILE  28           HB       ILE  28   3.983  -1.948  -5.631
  185   HG12  ILE  28          1HG1      ILE  28   6.566  -3.151  -4.656
  186   HG13  ILE  28          2HG1      ILE  28   5.060  -3.372  -3.773
  187   HG21  ILE  28          1HG2      ILE  28   6.075  -2.158  -7.075
  188   HG22  ILE  28          2HG2      ILE  28   5.343  -0.560  -6.942
  189   HG23  ILE  28          3HG2      ILE  28   6.788  -0.947  -6.009
  190   HD11  ILE  28          3HD1      ILE  28   4.748  -5.157  -5.050
  191   HD12  ILE  28          1HD1      ILE  28   4.384  -4.031  -6.357
  192   HD13  ILE  28          2HD1      ILE  28   6.016  -4.674  -6.176
  193    H    HIS  29           H        HIS  29   2.629   0.100  -4.487
  194    HA   HIS  29           HA       HIS  29   3.219   2.237  -6.249
  195    HB2  HIS  29           1HB      HIS  29   1.033   1.382  -6.398
  196    HB3  HIS  29           2HB      HIS  29   0.786   1.466  -4.656
  197    HD1  HIS  29           HD1      HIS  29   1.085   3.760  -7.656
  198    HD2  HIS  29           HD2      HIS  29  -0.419   3.755  -3.783
  199    HE1  HIS  29           HE1      HIS  29  -0.183   5.919  -7.425
  200    H    GLN  30           H        GLN  30   2.380   2.163  -2.793
  201    HA   GLN  30           HA       GLN  30   2.340   4.844  -2.228
  202    HB2  GLN  30           1HB      GLN  30   3.223   2.466  -0.630
  203    HB3  GLN  30           2HB      GLN  30   3.370   4.084   0.044
  204    HG2  GLN  30           1HG      GLN  30   0.896   4.352  -0.526
  205    HG3  GLN  30           2HG      GLN  30   0.888   2.602  -0.738
  206   HE21  GLN  30          1HE2      GLN  30   0.335   1.483   0.978
  207   HE22  GLN  30          2HE2      GLN  30   0.503   1.983   2.623
  208    H    ARG  31           H        ARG  31   5.018   2.959  -3.224
  209    HA   ARG  31           HA       ARG  31   7.141   4.404  -2.086
  210    HB2  ARG  31           1HB      ARG  31   7.034   2.908  -4.712
  211    HB3  ARG  31           2HB      ARG  31   8.505   3.448  -3.915
  212    HG2  ARG  31           1HG      ARG  31   7.579   2.045  -1.912
  213    HG3  ARG  31           2HG      ARG  31   6.651   1.240  -3.179
  214    HD2  ARG  31           1HD      ARG  31   8.530  -0.059  -3.184
  215    HD3  ARG  31           2HD      ARG  31   9.000   1.157  -4.371
  216    HE   ARG  31           HE       ARG  31  10.585   1.940  -2.904
  217   HH11  ARG  31          1HH1      ARG  31   8.428  -0.231  -1.245
  218   HH12  ARG  31          2HH1      ARG  31   9.396  -0.304   0.191
  219   HH21  ARG  31          1HH2      ARG  31  11.868   1.852  -1.020
  220   HH22  ARG  31          2HH2      ARG  31  11.352   0.882   0.318
  221    H    THR  32           H        THR  32   5.557   4.739  -5.255
  222    HA   THR  32           HA       THR  32   7.053   6.783  -6.328
  223    HB   THR  32           HB       THR  32   5.160   5.566  -7.460
  224    HG1  THR  32           HG1      THR  32   5.282   7.133  -8.876
  225   HG21  THR  32          3HG2      THR  32   2.967   6.012  -7.037
  226   HG22  THR  32          1HG2      THR  32   3.285   7.675  -6.546
  227   HG23  THR  32          2HG2      THR  32   3.611   6.348  -5.430
  228    H    HIS  33           H        HIS  33   4.938   6.900  -3.626
  229    HA   HIS  33           HA       HIS  33   4.632   9.790  -3.724
  230    HB2  HIS  33           1HB      HIS  33   3.668   7.692  -1.778
  231    HB3  HIS  33           2HB      HIS  33   3.410   9.418  -1.538
  232    HD1  HIS  33           HD1      HIS  33   2.167  10.565  -3.781
  233    HD2  HIS  33           HD2      HIS  33   1.592   6.519  -3.033
  234    HE1  HIS  33           HE1      HIS  33   0.085   9.938  -5.044
  235    H    THR  34           H        THR  34   7.292   8.531  -3.429
  236    HA   THR  34           HA       THR  34   8.069   9.860  -0.920
  237    HB   THR  34           HB       THR  34   9.741   8.193  -0.467
  238    HG1  THR  34           HG1      THR  34   9.685   6.256  -1.924
  239   HG21  THR  34          3HG2      THR  34   8.349   6.608   0.384
  240   HG22  THR  34          1HG2      THR  34   7.487   6.389  -1.138
  241   HG23  THR  34          2HG2      THR  34   7.121   7.773  -0.108
  242    H    GLY  35           H        GLY  35   8.500  11.707  -2.287
  243    HA2  GLY  35           1HA      GLY  35   9.748  12.957  -3.801
  244    HA3  GLY  35           2HA      GLY  35  11.049  12.333  -2.798
  245    H    GLU  36           H        GLU  36   9.345  12.022  -5.821
  246    HA   GLU  36           HA       GLU  36  10.250   9.749  -6.955
  247    HB2  GLU  36           1HB      GLU  36   8.878  11.455  -8.113
  248    HB3  GLU  36           2HB      GLU  36  10.314  12.450  -8.310
  249    HG2  GLU  36           1HG      GLU  36  11.324  10.823  -9.744
  250    HG3  GLU  36           2HG      GLU  36  10.023   9.675  -9.431
  251    H    SER  37           H        SER  37  12.121  12.775  -6.817
  252    HA   SER  37           HA       SER  37  14.545  11.203  -7.391
  253    HB2  SER  37           1HB      SER  37  13.868  13.069  -8.999
  254    HB3  SER  37           2HB      SER  37  14.280  14.194  -7.705
  255    HG   SER  37           HG       SER  37  15.943  13.425  -9.399
  256    H    GLY  38           H        GLY  38  16.394  11.510  -6.142
  257    HA2  GLY  38           1HA      GLY  38  17.306  13.161  -4.371
  258    HA3  GLY  38           2HA      GLY  38  15.857  12.684  -3.499
  259    HA   PRO  39           HA       PRO  39  18.221   9.476  -1.646
  260    HB2  PRO  39           1HB      PRO  39  16.193   7.858  -0.847
  261    HB3  PRO  39           2HB      PRO  39  16.573   9.388  -0.048
  262    HG2  PRO  39           1HG      PRO  39  14.456   8.784  -2.077
  263    HG3  PRO  39           2HG      PRO  39  14.345   9.761  -0.602
  264    HD2  PRO  39           1HD      PRO  39  14.632  10.861  -3.059
  265    HD3  PRO  39           2HD      PRO  39  15.314  11.601  -1.596
  266    H    SER  40           H        SER  40  16.289   9.043  -4.413
  267    HA   SER  40           HA       SER  40  16.050   6.454  -5.004
  268    HB2  SER  40           1HB      SER  40  15.643   8.283  -6.622
  269    HB3  SER  40           2HB      SER  40  17.382   8.435  -6.868
  270    HG   SER  40           HG       SER  40  17.250   6.111  -7.457
  271    H    SER  41           H        SER  41  17.261   4.689  -4.934
  272    HA   SER  41           HA       SER  41  19.064   3.313  -4.724
  273    HB2  SER  41           1HB      SER  41  20.063   5.321  -6.739
  274    HB3  SER  41           2HB      SER  41  21.043   3.943  -6.237
  275    HG   SER  41           HG       SER  41  19.966   3.074  -7.862
  276    H    GLY  42           H        GLY  42  18.818   4.954  -2.582
  277    HA2  GLY  42           1HA      GLY  42  21.276   6.357  -2.037
  278    HA3  GLY  42           2HA      GLY  42  19.957   6.082  -0.909
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1  -9.685   3.870 -20.388
    2    HA2  GLY   1           1HA      GLY   1  -9.669   1.009 -20.050
    3    HA3  GLY   1           2HA      GLY   1  -8.758   1.857 -18.809
    4    H    SER   2           H        SER   2 -11.902   2.205 -20.460
    5    HA   SER   2           HA       SER   2 -13.118   3.335 -18.120
    6    HB2  SER   2           1HB      SER   2 -14.058   2.597 -20.866
    7    HB3  SER   2           2HB      SER   2 -15.252   2.885 -19.601
    8    HG   SER   2           HG       SER   2 -14.968   4.884 -20.250
    9    H    SER   3           H        SER   3 -13.777   0.351 -19.964
   10    HA   SER   3           HA       SER   3 -14.671  -0.886 -17.442
   11    HB2  SER   3           1HB      SER   3 -16.269  -2.218 -18.753
   12    HB3  SER   3           2HB      SER   3 -16.565  -0.492 -18.961
   13    HG   SER   3           HG       SER   3 -16.496  -1.925 -20.912
   14    H    GLY   4           H        GLY   4 -13.237  -2.347 -16.799
   15    HA2  GLY   4           1HA      GLY   4 -12.207  -4.261 -18.772
   16    HA3  GLY   4           2HA      GLY   4 -11.052  -3.378 -17.784
   17    H    SER   5           H        SER   5 -10.710  -3.979 -15.683
   18    HA   SER   5           HA       SER   5 -12.340  -6.187 -14.632
   19    HB2  SER   5           1HB      SER   5 -10.106  -6.924 -15.677
   20    HB3  SER   5           2HB      SER   5  -9.344  -6.132 -14.298
   21    HG   SER   5           HG       SER   5  -9.945  -7.727 -13.065
   22    H    SER   6           H        SER   6 -13.362  -5.019 -13.075
   23    HA   SER   6           HA       SER   6 -11.656  -3.660 -11.093
   24    HB2  SER   6           1HB      SER   6 -13.435  -2.339 -12.495
   25    HB3  SER   6           2HB      SER   6 -14.583  -3.063 -11.369
   26    HG   SER   6           HG       SER   6 -13.498  -0.912 -10.869
   27    H    GLY   7           H        GLY   7 -12.260  -3.834  -8.869
   28    HA2  GLY   7           1HA      GLY   7 -14.205  -5.919  -8.201
   29    HA3  GLY   7           2HA      GLY   7 -12.538  -6.174  -7.708
   30    H    GLU   8           H        GLU   8 -12.847  -6.095  -5.520
   31    HA   GLU   8           HA       GLU   8 -13.857  -3.545  -4.442
   32    HB2  GLU   8           1HB      GLU   8 -13.885  -6.270  -3.133
   33    HB3  GLU   8           2HB      GLU   8 -14.473  -4.781  -2.408
   34    HG2  GLU   8           1HG      GLU   8 -16.241  -4.617  -3.999
   35    HG3  GLU   8           2HG      GLU   8 -15.585  -5.954  -4.943
   36    H    LYS   9           H        LYS   9 -11.269  -3.571  -5.225
   37    HA   LYS   9           HA       LYS   9  -9.203  -4.431  -3.777
   38    HB2  LYS   9           1HB      LYS   9  -9.621  -1.528  -4.513
   39    HB3  LYS   9           2HB      LYS   9  -8.073  -2.274  -4.137
   40    HG2  LYS   9           1HG      LYS   9  -8.094  -3.561  -6.103
   41    HG3  LYS   9           2HG      LYS   9  -9.806  -3.241  -6.388
   42    HD2  LYS   9           1HD      LYS   9  -9.291  -0.876  -6.784
   43    HD3  LYS   9           2HD      LYS   9  -7.579  -1.206  -6.510
   44    HE2  LYS   9           1HE      LYS   9  -7.779  -2.908  -8.398
   45    HE3  LYS   9           2HE      LYS   9  -9.331  -2.155  -8.761
   46    HZ1  LYS   9           3HZ      LYS   9  -6.686  -0.805  -8.752
   47    HZ2  LYS   9           1HZ      LYS   9  -8.166  -0.030  -9.018
   48    HZ3  LYS   9           2HZ      LYS   9  -7.611  -1.191 -10.115
   49    HA   PRO  10           HA       PRO  10 -10.625  -3.266   0.370
   50    HB2  PRO  10           1HB      PRO  10  -9.045  -5.070   1.643
   51    HB3  PRO  10           2HB      PRO  10 -10.599  -5.497   0.917
   52    HG2  PRO  10           1HG      PRO  10  -7.835  -5.867  -0.171
   53    HG3  PRO  10           2HG      PRO  10  -9.207  -6.990  -0.198
   54    HD2  PRO  10           1HD      PRO  10  -8.508  -5.493  -2.343
   55    HD3  PRO  10           2HD      PRO  10 -10.191  -5.943  -2.000
   56    H    TYR  11           H        TYR  11  -7.649  -3.029  -1.232
   57    HA   TYR  11           HA       TYR  11  -6.415  -1.634   1.047
   58    HB2  TYR  11           1HB      TYR  11  -5.048  -2.657  -1.448
   59    HB3  TYR  11           2HB      TYR  11  -4.272  -2.015  -0.004
   60    HD1  TYR  11           HD1      TYR  11  -6.091  -4.883  -1.417
   61    HD2  TYR  11           HD2      TYR  11  -3.995  -3.371   1.963
   62    HE1  TYR  11           HE1      TYR  11  -5.980  -7.153  -0.478
   63    HE2  TYR  11           HE2      TYR  11  -3.878  -5.637   2.911
   64    HH   TYR  11           HH       TYR  11  -4.581  -8.418   1.121
   65    H    GLU  12           H        GLU  12  -6.333   0.505   0.977
   66    HA   GLU  12           HA       GLU  12  -6.420   1.833  -1.652
   67    HB2  GLU  12           1HB      GLU  12  -8.016   2.317   0.812
   68    HB3  GLU  12           2HB      GLU  12  -7.520   3.723  -0.120
   69    HG2  GLU  12           1HG      GLU  12  -9.557   3.273  -1.050
   70    HG3  GLU  12           2HG      GLU  12  -8.490   2.378  -2.131
   71    H    CYS  13           H        CYS  13  -5.114   3.605  -1.953
   72    HA   CYS  13           HA       CYS  13  -2.883   3.839  -0.130
   73    HB2  CYS  13           1HB      CYS  13  -2.520   3.804  -2.568
   74    HB3  CYS  13           2HB      CYS  13  -3.447   5.293  -2.723
   75    H    THR  14           H        THR  14  -3.323   4.962   1.678
   76    HA   THR  14           HA       THR  14  -5.144   7.067   1.935
   77    HB   THR  14           HB       THR  14  -3.917   7.632   4.038
   78    HG1  THR  14           HG1      THR  14  -2.175   5.587   3.087
   79   HG21  THR  14          3HG2      THR  14  -5.457   5.423   3.459
   80   HG22  THR  14          1HG2      THR  14  -5.012   5.972   5.074
   81   HG23  THR  14          2HG2      THR  14  -4.055   4.727   4.271
   82    H    ASP  15           H        ASP  15  -1.957   7.011   0.646
   83    HA   ASP  15           HA       ASP  15  -1.161   9.665   1.090
   84    HB2  ASP  15           1HB      ASP  15   0.155   7.635   0.109
   85    HB3  ASP  15           2HB      ASP  15  -0.461   8.207  -1.438
   86    H    CYS  16           H        CYS  16  -2.553   8.265  -1.885
   87    HA   CYS  16           HA       CYS  16  -3.532  10.954  -2.577
   88    HB2  CYS  16           1HB      CYS  16  -3.567  10.178  -4.912
   89    HB3  CYS  16           2HB      CYS  16  -1.959  10.037  -4.209
   90    H    GLY  17           H        GLY  17  -4.403   7.521  -2.511
   91    HA2  GLY  17           1HA      GLY  17  -6.709   7.192  -1.532
   92    HA3  GLY  17           2HA      GLY  17  -7.235   8.320  -2.773
   93    H    LYS  18           H        LYS  18  -4.749   6.381  -3.914
   94    HA   LYS  18           HA       LYS  18  -6.349   5.121  -5.849
   95    HB2  LYS  18           1HB      LYS  18  -3.742   5.572  -5.702
   96    HB3  LYS  18           2HB      LYS  18  -3.725   3.931  -5.070
   97    HG2  LYS  18           1HG      LYS  18  -4.324   3.007  -7.063
   98    HG3  LYS  18           2HG      LYS  18  -5.223   4.434  -7.582
   99    HD2  LYS  18           1HD      LYS  18  -2.795   5.506  -7.553
  100    HD3  LYS  18           2HD      LYS  18  -2.321   3.823  -7.799
  101    HE2  LYS  18           1HE      LYS  18  -3.943   3.753  -9.714
  102    HE3  LYS  18           2HE      LYS  18  -4.141   5.495  -9.524
  103    HZ1  LYS  18           3HZ      LYS  18  -2.485   5.491 -11.043
  104    HZ2  LYS  18           1HZ      LYS  18  -1.878   3.984 -10.571
  105    HZ3  LYS  18           2HZ      LYS  18  -1.513   5.364  -9.664
  106    H    ALA  19           H        ALA  19  -5.967   2.571  -6.120
  107    HA   ALA  19           HA       ALA  19  -6.498   1.208  -3.587
  108    HB1  ALA  19           3HB      ALA  19  -8.422   1.532  -5.821
  109    HB2  ALA  19           1HB      ALA  19  -8.362  -0.034  -5.010
  110    HB3  ALA  19           2HB      ALA  19  -8.707   1.427  -4.083
  111    H    PHE  20           H        PHE  20  -6.389  -1.152  -3.777
  112    HA   PHE  20           HA       PHE  20  -5.282  -2.302  -6.169
  113    HB2  PHE  20           1HB      PHE  20  -3.539  -2.176  -3.700
  114    HB3  PHE  20           2HB      PHE  20  -3.142  -2.966  -5.222
  115    HD1  PHE  20           HD1      PHE  20  -3.662   0.287  -3.578
  116    HD2  PHE  20           HD2      PHE  20  -2.297  -1.736  -7.065
  117    HE1  PHE  20           HE1      PHE  20  -2.644   2.376  -4.387
  118    HE2  PHE  20           HE2      PHE  20  -1.277   0.350  -7.880
  119    HZ   PHE  20           HZ       PHE  20  -1.449   2.409  -6.540
  120    H    GLY  21           H        GLY  21  -6.064  -4.297  -6.307
  121    HA2  GLY  21           1HA      GLY  21  -7.583  -5.512  -4.296
  122    HA3  GLY  21           2HA      GLY  21  -6.961  -6.326  -5.723
  123    H    LEU  22           H        LEU  22  -4.167  -5.562  -4.851
  124    HA   LEU  22           HA       LEU  22  -3.857  -7.737  -2.897
  125    HB2  LEU  22           1HB      LEU  22  -2.253  -6.798  -5.205
  126    HB3  LEU  22           2HB      LEU  22  -1.371  -7.427  -3.815
  127    HG   LEU  22           HG       LEU  22  -3.294  -8.872  -5.618
  128   HD11  LEU  22          1HD1      LEU  22  -1.250  -9.172  -6.561
  129   HD12  LEU  22          2HD1      LEU  22  -1.191 -10.475  -5.375
  130   HD13  LEU  22          3HD1      LEU  22  -0.388  -8.942  -5.039
  131   HD21  LEU  22          3HD2      LEU  22  -2.781 -10.820  -4.008
  132   HD22  LEU  22          1HD2      LEU  22  -4.022  -9.653  -3.555
  133   HD23  LEU  22          2HD2      LEU  22  -2.414  -9.553  -2.837
  134    H    LYS  23           H        LYS  23  -1.955  -7.519  -1.424
  135    HA   LYS  23           HA       LYS  23  -2.011  -4.886  -0.200
  136    HB2  LYS  23           1HB      LYS  23  -2.279  -6.726   1.304
  137    HB3  LYS  23           2HB      LYS  23  -0.854  -7.535   0.666
  138    HG2  LYS  23           1HG      LYS  23   0.008  -6.678   2.588
  139    HG3  LYS  23           2HG      LYS  23   0.347  -5.341   1.486
  140    HD2  LYS  23           1HD      LYS  23  -1.807  -4.301   2.213
  141    HD3  LYS  23           2HD      LYS  23  -1.948  -5.573   3.429
  142    HE2  LYS  23           1HE      LYS  23   0.542  -3.927   3.272
  143    HE3  LYS  23           2HE      LYS  23  -0.894  -3.272   4.058
  144    HZ1  LYS  23           3HZ      LYS  23  -0.246  -5.949   4.886
  145    HZ2  LYS  23           1HZ      LYS  23  -0.612  -4.587   5.820
  146    HZ3  LYS  23           2HZ      LYS  23   0.963  -4.825   5.253
  147    H    SER  24           H        SER  24   0.178  -6.921  -1.991
  148    HA   SER  24           HA       SER  24   2.517  -5.357  -1.380
  149    HB2  SER  24           1HB      SER  24   2.399  -7.865  -2.046
  150    HB3  SER  24           2HB      SER  24   2.310  -7.260  -3.699
  151    HG   SER  24           HG       SER  24   4.453  -7.578  -3.224
  152    H    GLN  25           H        GLN  25   0.127  -5.510  -3.937
  153    HA   GLN  25           HA       GLN  25   1.454  -3.985  -5.877
  154    HB2  GLN  25           1HB      GLN  25  -1.431  -4.544  -5.286
  155    HB3  GLN  25           2HB      GLN  25  -1.000  -3.380  -6.533
  156    HG2  GLN  25           1HG      GLN  25   0.543  -5.361  -7.348
  157    HG3  GLN  25           2HG      GLN  25  -0.651  -6.324  -6.479
  158   HE21  GLN  25          1HE2      GLN  25  -2.334  -6.959  -7.608
  159   HE22  GLN  25          2HE2      GLN  25  -2.943  -6.212  -9.042
  160    H    LEU  26           H        LEU  26  -0.306  -3.062  -3.005
  161    HA   LEU  26           HA       LEU  26  -0.457  -0.276  -3.697
  162    HB2  LEU  26           1HB      LEU  26  -2.162  -1.032  -2.278
  163    HB3  LEU  26           2HB      LEU  26  -1.027  -1.861  -1.216
  164    HG   LEU  26           HG       LEU  26  -0.211   0.346  -0.437
  165   HD11  LEU  26          1HD1      LEU  26  -2.402   1.340  -2.241
  166   HD12  LEU  26          2HD1      LEU  26  -0.693   1.772  -2.262
  167   HD13  LEU  26          3HD1      LEU  26  -1.719   2.303  -0.930
  168   HD21  LEU  26          3HD2      LEU  26  -3.131  -0.317  -0.136
  169   HD22  LEU  26          1HD2      LEU  26  -2.327   0.941   0.803
  170   HD23  LEU  26          2HD2      LEU  26  -1.800  -0.736   0.943
  171    H    ILE  27           H        ILE  27   1.435  -2.181  -1.358
  172    HA   ILE  27           HA       ILE  27   2.952  -0.187  -0.230
  173    HB   ILE  27           HB       ILE  27   3.919  -2.951  -0.971
  174   HG12  ILE  27          1HG1      ILE  27   2.844  -2.050   1.697
  175   HG13  ILE  27          2HG1      ILE  27   1.793  -2.711   0.449
  176   HG21  ILE  27          1HG2      ILE  27   5.013  -1.796   1.443
  177   HG22  ILE  27          2HG2      ILE  27   5.840  -2.505   0.057
  178   HG23  ILE  27          3HG2      ILE  27   5.370  -0.805   0.029
  179   HD11  ILE  27          3HD1      ILE  27   2.505  -4.363   2.143
  180   HD12  ILE  27          1HD1      ILE  27   2.960  -4.800   0.497
  181   HD13  ILE  27          2HD1      ILE  27   4.170  -4.147   1.602
  182    H    ILE  28           H        ILE  28   3.619  -1.962  -3.233
  183    HA   ILE  28           HA       ILE  28   6.069  -0.715  -3.822
  184    HB   ILE  28           HB       ILE  28   4.049  -1.893  -5.734
  185   HG12  ILE  28          1HG1      ILE  28   6.563  -3.179  -4.677
  186   HG13  ILE  28          2HG1      ILE  28   5.006  -3.369  -3.880
  187   HG21  ILE  28          1HG2      ILE  28   6.656  -2.159  -6.732
  188   HG22  ILE  28          2HG2      ILE  28   5.359  -1.145  -7.362
  189   HG23  ILE  28          3HG2      ILE  28   6.505  -0.486  -6.195
  190   HD11  ILE  28          3HD1      ILE  28   5.898  -4.378  -6.544
  191   HD12  ILE  28          1HD1      ILE  28   5.164  -5.256  -5.202
  192   HD13  ILE  28          2HD1      ILE  28   4.184  -4.168  -6.187
  193    H    HIS  29           H        HIS  29   2.743   0.195  -4.491
  194    HA   HIS  29           HA       HIS  29   3.337   2.295  -6.308
  195    HB2  HIS  29           1HB      HIS  29   1.132   1.574  -6.451
  196    HB3  HIS  29           2HB      HIS  29   0.935   1.503  -4.702
  197    HD1  HIS  29           HD1      HIS  29   1.352   4.143  -7.408
  198    HD2  HIS  29           HD2      HIS  29  -0.396   3.627  -3.674
  199    HE1  HIS  29           HE1      HIS  29   0.070   6.261  -6.968
  200    H    GLN  30           H        GLN  30   2.474   2.314  -2.850
  201    HA   GLN  30           HA       GLN  30   2.561   4.994  -2.325
  202    HB2  GLN  30           1HB      GLN  30   3.448   2.654  -0.652
  203    HB3  GLN  30           2HB      GLN  30   3.457   4.298  -0.028
  204    HG2  GLN  30           1HG      GLN  30   0.963   4.256  -0.901
  205    HG3  GLN  30           2HG      GLN  30   1.174   2.521  -0.673
  206   HE21  GLN  30          1HE2      GLN  30  -0.325   2.484   1.003
  207   HE22  GLN  30          2HE2      GLN  30   0.037   3.112   2.571
  208    H    ARG  31           H        ARG  31   5.172   2.968  -3.246
  209    HA   ARG  31           HA       ARG  31   7.348   4.337  -2.137
  210    HB2  ARG  31           1HB      ARG  31   7.173   2.832  -4.754
  211    HB3  ARG  31           2HB      ARG  31   8.669   3.321  -3.969
  212    HG2  ARG  31           1HG      ARG  31   7.881   1.957  -1.972
  213    HG3  ARG  31           2HG      ARG  31   6.667   1.282  -3.060
  214    HD2  ARG  31           1HD      ARG  31   8.369  -0.252  -3.273
  215    HD3  ARG  31           2HD      ARG  31   8.718   0.841  -4.611
  216    HE   ARG  31           HE       ARG  31  10.633   1.514  -3.531
  217   HH11  ARG  31          1HH1      ARG  31   8.652  -0.351  -1.360
  218   HH12  ARG  31          2HH1      ARG  31   9.878  -0.478  -0.143
  219   HH21  ARG  31          1HH2      ARG  31  12.256   1.353  -1.936
  220   HH22  ARG  31          2HH2      ARG  31  11.927   0.492  -0.471
  221    H    THR  32           H        THR  32   5.887   4.677  -5.371
  222    HA   THR  32           HA       THR  32   7.451   6.688  -6.391
  223    HB   THR  32           HB       THR  32   5.561   5.491  -7.571
  224    HG1  THR  32           HG1      THR  32   6.508   7.154  -8.681
  225   HG21  THR  32          3HG2      THR  32   3.950   6.335  -5.644
  226   HG22  THR  32          1HG2      THR  32   3.365   6.073  -7.287
  227   HG23  THR  32          2HG2      THR  32   3.754   7.704  -6.738
  228    H    HIS  33           H        HIS  33   4.824   6.946  -4.070
  229    HA   HIS  33           HA       HIS  33   4.539   9.750  -4.121
  230    HB2  HIS  33           1HB      HIS  33   3.862   7.618  -2.120
  231    HB3  HIS  33           2HB      HIS  33   3.669   9.318  -1.702
  232    HD1  HIS  33           HD1      HIS  33   2.349  10.564  -4.010
  233    HD2  HIS  33           HD2      HIS  33   1.445   6.680  -2.843
  234    HE1  HIS  33           HE1      HIS  33   0.068  10.092  -4.956
  235    H    THR  34           H        THR  34   6.600   7.607  -2.211
  236    HA   THR  34           HA       THR  34   7.742   9.810  -0.724
  237    HB   THR  34           HB       THR  34   9.280   8.021   0.185
  238    HG1  THR  34           HG1      THR  34   7.520   6.114  -0.892
  239   HG21  THR  34          3HG2      THR  34   7.398   8.603   1.502
  240   HG22  THR  34          1HG2      THR  34   7.409   6.842   1.427
  241   HG23  THR  34          2HG2      THR  34   6.289   7.760   0.421
  242    H    GLY  35           H        GLY  35   8.092  10.246  -3.423
  243    HA2  GLY  35           1HA      GLY  35  11.006  10.247  -3.576
  244    HA3  GLY  35           2HA      GLY  35  10.154   9.433  -4.881
  245    H    GLU  36           H        GLU  36  10.135  10.670  -6.629
  246    HA   GLU  36           HA       GLU  36  10.127  13.570  -6.363
  247    HB2  GLU  36           1HB      GLU  36  10.532  13.574  -8.793
  248    HB3  GLU  36           2HB      GLU  36  11.710  12.596  -7.929
  249    HG2  GLU  36           1HG      GLU  36   9.299  11.259  -9.037
  250    HG3  GLU  36           2HG      GLU  36  10.580  11.751 -10.144
  251    H    SER  37           H        SER  37   8.033  10.965  -7.335
  252    HA   SER  37           HA       SER  37   5.862  10.885  -8.020
  253    HB2  SER  37           1HB      SER  37   5.985  13.258  -6.214
  254    HB3  SER  37           2HB      SER  37   4.509  13.002  -7.145
  255    HG   SER  37           HG       SER  37   5.688  10.934  -5.624
  256    H    GLY  38           H        GLY  38   7.599  11.796  -9.972
  257    HA2  GLY  38           1HA      GLY  38   7.721  13.015 -11.926
  258    HA3  GLY  38           2HA      GLY  38   5.986  12.740 -11.957
  259    HA   PRO  39           HA       PRO  39   5.655  17.148 -11.939
  260    HB2  PRO  39           1HB      PRO  39   2.964  17.282 -11.607
  261    HB3  PRO  39           2HB      PRO  39   3.721  16.846 -13.143
  262    HG2  PRO  39           1HG      PRO  39   2.536  15.070 -11.045
  263    HG3  PRO  39           2HG      PRO  39   2.380  14.977 -12.809
  264    HD2  PRO  39           1HD      PRO  39   4.081  13.400 -11.412
  265    HD3  PRO  39           2HD      PRO  39   4.429  13.953 -13.063
  266    H    SER  40           H        SER  40   5.228  18.847 -10.491
  267    HA   SER  40           HA       SER  40   5.771  18.419  -7.820
  268    HB2  SER  40           1HB      SER  40   5.829  20.617  -9.140
  269    HB3  SER  40           2HB      SER  40   4.109  20.750  -8.770
  270    HG   SER  40           HG       SER  40   4.736  21.554  -6.943
  271    H    SER  41           H        SER  41   2.583  19.385  -9.101
  272    HA   SER  41           HA       SER  41   1.207  18.810  -6.699
  273    HB2  SER  41           1HB      SER  41   0.190  19.112  -9.533
  274    HB3  SER  41           2HB      SER  41  -0.848  19.007  -8.111
  275    HG   SER  41           HG       SER  41   0.002  20.924  -7.368
  276    H    GLY  42           H        GLY  42  -0.060  17.069  -6.095
  277    HA2  GLY  42           1HA      GLY  42  -0.409  14.791  -7.820
  278    HA3  GLY  42           2HA      GLY  42   0.785  14.522  -6.559
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1 -24.890  -9.706  -9.468
    2    HA2  GLY   1           1HA      GLY   1 -22.642  -9.708  -7.553
    3    HA3  GLY   1           2HA      GLY   1 -24.219 -10.343  -7.110
    4    H    SER   2           H        SER   2 -21.575 -10.763  -9.437
    5    HA   SER   2           HA       SER   2 -22.439 -13.480 -10.004
    6    HB2  SER   2           1HB      SER   2 -20.182 -11.780 -11.075
    7    HB3  SER   2           2HB      SER   2 -20.422 -13.464 -11.538
    8    HG   SER   2           HG       SER   2 -21.518 -11.417 -12.661
    9    H    SER   3           H        SER   3 -21.470 -15.310  -9.298
   10    HA   SER   3           HA       SER   3 -19.623 -15.050  -7.080
   11    HB2  SER   3           1HB      SER   3 -19.969 -17.488  -6.816
   12    HB3  SER   3           2HB      SER   3 -21.495 -16.605  -6.869
   13    HG   SER   3           HG       SER   3 -21.093 -17.172  -9.325
   14    H    GLY   4           H        GLY   4 -17.596 -14.590  -7.774
   15    HA2  GLY   4           1HA      GLY   4 -15.871 -16.547  -8.635
   16    HA3  GLY   4           2HA      GLY   4 -16.440 -15.777 -10.108
   17    H    SER   5           H        SER   5 -14.712 -14.653 -10.789
   18    HA   SER   5           HA       SER   5 -12.778 -13.442  -9.183
   19    HB2  SER   5           1HB      SER   5 -13.641 -13.008 -12.032
   20    HB3  SER   5           2HB      SER   5 -12.380 -12.011 -11.308
   21    HG   SER   5           HG       SER   5 -11.356 -14.084 -10.751
   22    H    SER   6           H        SER   6 -13.420 -12.094  -7.592
   23    HA   SER   6           HA       SER   6 -15.470 -10.121  -7.975
   24    HB2  SER   6           1HB      SER   6 -13.507 -10.453  -5.692
   25    HB3  SER   6           2HB      SER   6 -14.950  -9.439  -5.676
   26    HG   SER   6           HG       SER   6 -14.780 -12.259  -5.771
   27    H    GLY   7           H        GLY   7 -14.895  -7.798  -7.130
   28    HA2  GLY   7           1HA      GLY   7 -12.326  -6.920  -8.259
   29    HA3  GLY   7           2HA      GLY   7 -13.813  -6.200  -8.859
   30    H    GLU   8           H        GLU   8 -12.931  -7.092  -5.541
   31    HA   GLU   8           HA       GLU   8 -13.352  -4.278  -4.785
   32    HB2  GLU   8           1HB      GLU   8 -13.885  -6.861  -3.357
   33    HB3  GLU   8           2HB      GLU   8 -13.643  -5.380  -2.441
   34    HG2  GLU   8           1HG      GLU   8 -15.998  -5.789  -2.781
   35    HG3  GLU   8           2HG      GLU   8 -15.498  -4.335  -3.642
   36    H    LYS   9           H        LYS   9 -11.624  -3.173  -4.177
   37    HA   LYS   9           HA       LYS   9  -9.206  -4.642  -3.395
   38    HB2  LYS   9           1HB      LYS   9  -9.458  -1.735  -4.182
   39    HB3  LYS   9           2HB      LYS   9  -7.968  -2.646  -3.975
   40    HG2  LYS   9           1HG      LYS   9  -8.537  -4.043  -5.883
   41    HG3  LYS   9           2HG      LYS   9 -10.057  -3.169  -6.081
   42    HD2  LYS   9           1HD      LYS   9  -8.680  -1.072  -6.352
   43    HD3  LYS   9           2HD      LYS   9  -7.257  -2.114  -6.433
   44    HE2  LYS   9           1HE      LYS   9  -9.643  -2.263  -8.273
   45    HE3  LYS   9           2HE      LYS   9  -8.102  -1.501  -8.662
   46    HZ1  LYS   9           3HZ      LYS   9  -8.584  -3.942  -9.376
   47    HZ2  LYS   9           1HZ      LYS   9  -8.120  -4.303  -7.789
   48    HZ3  LYS   9           2HZ      LYS   9  -7.045  -3.507  -8.824
   49    HA   PRO  10           HA       PRO  10 -10.470  -3.191   0.717
   50    HB2  PRO  10           1HB      PRO  10  -8.958  -5.010   2.049
   51    HB3  PRO  10           2HB      PRO  10 -10.551  -5.388   1.383
   52    HG2  PRO  10           1HG      PRO  10  -7.840  -5.967   0.254
   53    HG3  PRO  10           2HG      PRO  10  -9.271  -7.012   0.319
   54    HD2  PRO  10           1HD      PRO  10  -8.547  -5.671  -1.919
   55    HD3  PRO  10           2HD      PRO  10 -10.243  -6.008  -1.515
   56    H    TYR  11           H        TYR  11  -7.637  -3.009  -1.031
   57    HA   TYR  11           HA       TYR  11  -6.234  -1.632   1.165
   58    HB2  TYR  11           1HB      TYR  11  -4.996  -2.867  -1.303
   59    HB3  TYR  11           2HB      TYR  11  -4.139  -2.154   0.059
   60    HD1  TYR  11           HD1      TYR  11  -6.075  -5.052  -1.093
   61    HD2  TYR  11           HD2      TYR  11  -3.877  -3.362   2.134
   62    HE1  TYR  11           HE1      TYR  11  -6.011  -7.251   0.007
   63    HE2  TYR  11           HE2      TYR  11  -3.806  -5.556   3.243
   64    HH   TYR  11           HH       TYR  11  -5.597  -7.833   2.930
   65    H    GLU  12           H        GLU  12  -6.130   0.498   0.981
   66    HA   GLU  12           HA       GLU  12  -6.228   1.685  -1.715
   67    HB2  GLU  12           1HB      GLU  12  -8.202   1.970   0.067
   68    HB3  GLU  12           2HB      GLU  12  -7.156   3.269   0.623
   69    HG2  GLU  12           1HG      GLU  12  -7.225   4.320  -1.536
   70    HG3  GLU  12           2HG      GLU  12  -8.134   2.967  -2.206
   71    H    CYS  13           H        CYS  13  -5.094   3.690  -1.997
   72    HA   CYS  13           HA       CYS  13  -2.598   3.731  -0.547
   73    HB2  CYS  13           1HB      CYS  13  -2.583   4.040  -2.967
   74    HB3  CYS  13           2HB      CYS  13  -3.613   5.460  -2.812
   75    H    THR  14           H        THR  14  -2.251   4.877   1.225
   76    HA   THR  14           HA       THR  14  -4.146   6.878   2.087
   77    HB   THR  14           HB       THR  14  -2.756   7.027   4.120
   78    HG1  THR  14           HG1      THR  14  -0.706   6.590   3.627
   79   HG21  THR  14          3HG2      THR  14  -2.832   4.155   4.034
   80   HG22  THR  14          1HG2      THR  14  -4.254   4.822   3.233
   81   HG23  THR  14          2HG2      THR  14  -3.887   5.272   4.899
   82    H    ASP  15           H        ASP  15  -2.582   7.463  -0.303
   83    HA   ASP  15           HA       ASP  15  -1.296   9.939   0.633
   84    HB2  ASP  15           1HB      ASP  15   0.216   7.957  -0.280
   85    HB3  ASP  15           2HB      ASP  15  -0.271   8.618  -1.838
   86    H    CYS  16           H        CYS  16  -2.977   8.246  -1.960
   87    HA   CYS  16           HA       CYS  16  -3.920  10.853  -2.948
   88    HB2  CYS  16           1HB      CYS  16  -3.903   9.896  -5.251
   89    HB3  CYS  16           2HB      CYS  16  -2.296  10.069  -4.552
   90    H    GLY  17           H        GLY  17  -4.549   7.467  -2.357
   91    HA2  GLY  17           1HA      GLY  17  -6.811   6.969  -1.520
   92    HA3  GLY  17           2HA      GLY  17  -7.421   7.997  -2.808
   93    H    LYS  18           H        LYS  18  -4.975   6.513  -4.267
   94    HA   LYS  18           HA       LYS  18  -6.379   4.994  -6.025
   95    HB2  LYS  18           1HB      LYS  18  -3.793   5.528  -5.789
   96    HB3  LYS  18           2HB      LYS  18  -3.752   3.901  -5.123
   97    HG2  LYS  18           1HG      LYS  18  -4.243   2.918  -7.116
   98    HG3  LYS  18           2HG      LYS  18  -5.169   4.304  -7.698
   99    HD2  LYS  18           1HD      LYS  18  -2.816   5.481  -7.645
  100    HD3  LYS  18           2HD      LYS  18  -2.227   3.820  -7.751
  101    HE2  LYS  18           1HE      LYS  18  -4.344   4.798  -9.626
  102    HE3  LYS  18           2HE      LYS  18  -2.649   5.178  -9.926
  103    HZ1  LYS  18           3HZ      LYS  18  -3.501   3.119 -11.030
  104    HZ2  LYS  18           1HZ      LYS  18  -3.634   2.416  -9.497
  105    HZ3  LYS  18           2HZ      LYS  18  -2.120   2.894 -10.078
  106    H    ALA  19           H        ALA  19  -6.331   2.564  -6.299
  107    HA   ALA  19           HA       ALA  19  -6.753   1.186  -3.734
  108    HB1  ALA  19           3HB      ALA  19  -8.932   1.810  -4.666
  109    HB2  ALA  19           1HB      ALA  19  -8.539   0.945  -6.152
  110    HB3  ALA  19           2HB      ALA  19  -8.712   0.061  -4.635
  111    H    PHE  20           H        PHE  20  -6.278  -1.020  -3.703
  112    HA   PHE  20           HA       PHE  20  -5.232  -2.251  -6.128
  113    HB2  PHE  20           1HB      PHE  20  -3.584  -2.015  -3.601
  114    HB3  PHE  20           2HB      PHE  20  -3.126  -2.901  -5.052
  115    HD1  PHE  20           HD1      PHE  20  -3.583   0.417  -3.571
  116    HD2  PHE  20           HD2      PHE  20  -2.338  -1.759  -7.011
  117    HE1  PHE  20           HE1      PHE  20  -2.535   2.451  -4.475
  118    HE2  PHE  20           HE2      PHE  20  -1.287   0.271  -7.919
  119    HZ   PHE  20           HZ       PHE  20  -1.384   2.380  -6.651
  120    H    GLY  21           H        GLY  21  -6.096  -4.207  -6.271
  121    HA2  GLY  21           1HA      GLY  21  -7.553  -5.428  -4.194
  122    HA3  GLY  21           2HA      GLY  21  -7.063  -6.206  -5.692
  123    H    LEU  22           H        LEU  22  -4.248  -5.180  -4.510
  124    HA   LEU  22           HA       LEU  22  -3.847  -7.558  -2.818
  125    HB2  LEU  22           1HB      LEU  22  -2.353  -6.612  -5.198
  126    HB3  LEU  22           2HB      LEU  22  -1.413  -7.291  -3.870
  127    HG   LEU  22           HG       LEU  22  -3.468  -8.651  -5.591
  128   HD11  LEU  22          1HD1      LEU  22  -0.536  -8.916  -5.091
  129   HD12  LEU  22          2HD1      LEU  22  -1.416  -8.862  -6.618
  130   HD13  LEU  22          3HD1      LEU  22  -1.472 -10.315  -5.620
  131   HD21  LEU  22          3HD2      LEU  22  -2.616 -10.591  -3.899
  132   HD22  LEU  22          1HD2      LEU  22  -4.136  -9.712  -3.727
  133   HD23  LEU  22          2HD2      LEU  22  -2.717  -9.209  -2.807
  134    H    LYS  23           H        LYS  23  -2.178  -7.401  -1.234
  135    HA   LYS  23           HA       LYS  23  -2.011  -4.794  -0.049
  136    HB2  LYS  23           1HB      LYS  23  -2.238  -6.619   1.455
  137    HB3  LYS  23           2HB      LYS  23  -0.907  -7.494   0.711
  138    HG2  LYS  23           1HG      LYS  23   0.022  -6.701   2.672
  139    HG3  LYS  23           2HG      LYS  23   0.540  -5.505   1.482
  140    HD2  LYS  23           1HD      LYS  23  -1.283  -4.030   2.157
  141    HD3  LYS  23           2HD      LYS  23  -1.836  -5.234   3.325
  142    HE2  LYS  23           1HE      LYS  23  -0.593  -3.921   4.712
  143    HE3  LYS  23           2HE      LYS  23   0.668  -5.025   4.164
  144    HZ1  LYS  23           3HZ      LYS  23   0.544  -2.962   2.314
  145    HZ2  LYS  23           1HZ      LYS  23   1.776  -3.272   3.431
  146    HZ3  LYS  23           2HZ      LYS  23   0.508  -2.229   3.838
  147    H    SER  24           H        SER  24   0.016  -6.750  -2.062
  148    HA   SER  24           HA       SER  24   2.419  -5.243  -1.489
  149    HB2  SER  24           1HB      SER  24   3.550  -6.824  -2.726
  150    HB3  SER  24           2HB      SER  24   2.136  -7.769  -2.260
  151    HG   SER  24           HG       SER  24   1.988  -8.044  -4.348
  152    H    GLN  25           H        GLN  25  -0.012  -5.440  -4.029
  153    HA   GLN  25           HA       GLN  25   1.254  -3.832  -5.942
  154    HB2  GLN  25           1HB      GLN  25  -1.675  -4.295  -5.377
  155    HB3  GLN  25           2HB      GLN  25  -1.084  -3.409  -6.777
  156    HG2  GLN  25           1HG      GLN  25   0.197  -5.442  -7.433
  157    HG3  GLN  25           2HG      GLN  25  -0.605  -6.303  -6.120
  158   HE21  GLN  25          1HE2      GLN  25  -0.913  -4.977  -9.282
  159   HE22  GLN  25          2HE2      GLN  25  -2.496  -5.583  -9.618
  160    H    LEU  26           H        LEU  26  -0.117  -3.034  -2.922
  161    HA   LEU  26           HA       LEU  26  -0.527  -0.234  -3.617
  162    HB2  LEU  26           1HB      LEU  26  -2.209  -1.020  -2.208
  163    HB3  LEU  26           2HB      LEU  26  -1.072  -1.902  -1.191
  164    HG   LEU  26           HG       LEU  26  -0.253   0.246  -0.294
  165   HD11  LEU  26          1HD1      LEU  26  -2.581   1.558  -1.658
  166   HD12  LEU  26          2HD1      LEU  26  -0.973   1.524  -2.382
  167   HD13  LEU  26          3HD1      LEU  26  -1.221   2.309  -0.822
  168   HD21  LEU  26          3HD2      LEU  26  -2.001   0.536   1.217
  169   HD22  LEU  26          1HD2      LEU  26  -2.222  -1.118   0.645
  170   HD23  LEU  26          2HD2      LEU  26  -3.235   0.179   0.008
  171    H    ILE  27           H        ILE  27   1.488  -2.188  -1.442
  172    HA   ILE  27           HA       ILE  27   2.950  -0.136  -0.266
  173    HB   ILE  27           HB       ILE  27   3.973  -2.888  -0.976
  174   HG12  ILE  27          1HG1      ILE  27   2.879  -2.101   1.704
  175   HG13  ILE  27          2HG1      ILE  27   1.779  -2.593   0.420
  176   HG21  ILE  27          1HG2      ILE  27   5.846  -2.399   0.121
  177   HG22  ILE  27          2HG2      ILE  27   5.336  -0.713   0.072
  178   HG23  ILE  27          3HG2      ILE  27   4.954  -1.708   1.476
  179   HD11  ILE  27          3HD1      ILE  27   2.704  -4.322   2.148
  180   HD12  ILE  27          1HD1      ILE  27   2.497  -4.760   0.452
  181   HD13  ILE  27          2HD1      ILE  27   4.096  -4.339   1.066
  182    H    ILE  28           H        ILE  28   3.585  -1.918  -3.267
  183    HA   ILE  28           HA       ILE  28   6.045  -0.688  -3.872
  184    HB   ILE  28           HB       ILE  28   4.006  -1.891  -5.748
  185   HG12  ILE  28          1HG1      ILE  28   6.568  -3.210  -4.956
  186   HG13  ILE  28          2HG1      ILE  28   5.219  -3.242  -3.825
  187   HG21  ILE  28          1HG2      ILE  28   5.855  -2.077  -7.341
  188   HG22  ILE  28          2HG2      ILE  28   5.519  -0.396  -6.931
  189   HG23  ILE  28          3HG2      ILE  28   6.907  -1.217  -6.218
  190   HD11  ILE  28          3HD1      ILE  28   5.077  -5.234  -5.045
  191   HD12  ILE  28          1HD1      ILE  28   3.840  -4.181  -5.730
  192   HD13  ILE  28          2HD1      ILE  28   5.369  -4.415  -6.579
  193    H    HIS  29           H        HIS  29   2.715   0.220  -4.541
  194    HA   HIS  29           HA       HIS  29   3.304   2.310  -6.368
  195    HB2  HIS  29           1HB      HIS  29   1.096   1.540  -6.464
  196    HB3  HIS  29           2HB      HIS  29   0.904   1.585  -4.714
  197    HD1  HIS  29           HD1      HIS  29   1.229   3.985  -7.635
  198    HD2  HIS  29           HD2      HIS  29  -0.301   3.836  -3.775
  199    HE1  HIS  29           HE1      HIS  29  -0.007   6.152  -7.318
  200    H    GLN  30           H        GLN  30   2.465   2.349  -2.905
  201    HA   GLN  30           HA       GLN  30   2.539   5.022  -2.378
  202    HB2  GLN  30           1HB      GLN  30   3.508   2.696  -0.729
  203    HB3  GLN  30           2HB      GLN  30   3.508   4.340  -0.105
  204    HG2  GLN  30           1HG      GLN  30   1.057   4.432  -0.617
  205    HG3  GLN  30           2HG      GLN  30   1.139   2.708  -0.972
  206   HE21  GLN  30          1HE2      GLN  30  -0.563   3.073   0.850
  207   HE22  GLN  30          2HE2      GLN  30   0.027   2.804   2.451
  208    H    ARG  31           H        ARG  31   5.171   3.023  -3.331
  209    HA   ARG  31           HA       ARG  31   7.348   4.427  -2.289
  210    HB2  ARG  31           1HB      ARG  31   7.123   2.934  -4.908
  211    HB3  ARG  31           2HB      ARG  31   8.634   3.447  -4.169
  212    HG2  ARG  31           1HG      ARG  31   7.855   2.068  -2.138
  213    HG3  ARG  31           2HG      ARG  31   6.724   1.328  -3.273
  214    HD2  ARG  31           1HD      ARG  31   8.530  -0.098  -3.417
  215    HD3  ARG  31           2HD      ARG  31   8.843   1.011  -4.752
  216    HE   ARG  31           HE       ARG  31  10.706   1.758  -3.649
  217   HH11  ARG  31          1HH1      ARG  31   8.697  -0.019  -1.429
  218   HH12  ARG  31          2HH1      ARG  31   9.872  -0.013  -0.157
  219   HH21  ARG  31          1HH2      ARG  31  12.261   1.773  -1.981
  220   HH22  ARG  31          2HH2      ARG  31  11.899   1.008  -0.471
  221    H    THR  32           H        THR  32   5.504   4.927  -5.266
  222    HA   THR  32           HA       THR  32   7.078   6.888  -6.451
  223    HB   THR  32           HB       THR  32   5.151   7.543  -7.725
  224    HG1  THR  32           HG1      THR  32   3.470   7.783  -6.389
  225   HG21  THR  32          3HG2      THR  32   4.906   4.602  -7.087
  226   HG22  THR  32          1HG2      THR  32   6.097   5.301  -8.183
  227   HG23  THR  32          2HG2      THR  32   4.378   5.405  -8.565
  228    H    HIS  33           H        HIS  33   4.589   7.180  -3.963
  229    HA   HIS  33           HA       HIS  33   4.520  10.012  -3.917
  230    HB2  HIS  33           1HB      HIS  33   3.729   7.936  -1.872
  231    HB3  HIS  33           2HB      HIS  33   3.480   9.663  -1.634
  232    HD1  HIS  33           HD1      HIS  33   2.059  10.774  -3.791
  233    HD2  HIS  33           HD2      HIS  33   1.562   6.738  -2.937
  234    HE1  HIS  33           HE1      HIS  33  -0.114  10.120  -4.875
  235    H    THR  34           H        THR  34   6.232   7.626  -1.919
  236    HA   THR  34           HA       THR  34   7.607   9.665  -0.419
  237    HB   THR  34           HB       THR  34   8.815   7.806   0.640
  238    HG1  THR  34           HG1      THR  34   7.395   6.218  -1.256
  239   HG21  THR  34          3HG2      THR  34   6.287   8.467   1.085
  240   HG22  THR  34          1HG2      THR  34   7.049   7.117   1.924
  241   HG23  THR  34          2HG2      THR  34   6.010   6.816   0.530
  242    H    GLY  35           H        GLY  35   8.064  10.041  -3.131
  243    HA2  GLY  35           1HA      GLY  35  10.909   9.275  -3.373
  244    HA3  GLY  35           2HA      GLY  35   9.832   9.397  -4.756
  245    H    GLU  36           H        GLU  36  12.198  10.957  -3.055
  246    HA   GLU  36           HA       GLU  36  11.282  13.611  -3.945
  247    HB2  GLU  36           1HB      GLU  36  11.841  13.101  -1.448
  248    HB3  GLU  36           2HB      GLU  36  13.513  13.207  -1.982
  249    HG2  GLU  36           1HG      GLU  36  13.126  15.472  -2.785
  250    HG3  GLU  36           2HG      GLU  36  11.440  15.369  -2.281
  251    H    SER  37           H        SER  37  12.344  11.927  -5.846
  252    HA   SER  37           HA       SER  37  14.657  13.448  -6.680
  253    HB2  SER  37           1HB      SER  37  16.090  11.494  -7.061
  254    HB3  SER  37           2HB      SER  37  15.682  11.640  -5.351
  255    HG   SER  37           HG       SER  37  15.470   9.486  -6.204
  256    H    GLY  38           H        GLY  38  14.879  13.534  -8.881
  257    HA2  GLY  38           1HA      GLY  38  13.985  11.703 -10.761
  258    HA3  GLY  38           2HA      GLY  38  12.630  12.777 -10.447
  259    HA   PRO  39           HA       PRO  39  15.925  14.586 -13.437
  260    HB2  PRO  39           1HB      PRO  39  14.893  13.814 -15.826
  261    HB3  PRO  39           2HB      PRO  39  16.100  12.866 -14.950
  262    HG2  PRO  39           1HG      PRO  39  13.131  12.501 -15.076
  263    HG3  PRO  39           2HG      PRO  39  14.413  11.279 -15.162
  264    HD2  PRO  39           1HD      PRO  39  13.007  11.759 -12.899
  265    HD3  PRO  39           2HD      PRO  39  14.706  11.244 -12.876
  266    H    SER  40           H        SER  40  12.688  14.712 -12.704
  267    HA   SER  40           HA       SER  40  11.820  16.617 -14.661
  268    HB2  SER  40           1HB      SER  40   9.799  16.790 -13.319
  269    HB3  SER  40           2HB      SER  40  10.255  15.093 -13.469
  270    HG   SER  40           HG       SER  40  10.960  16.721 -11.258
  271    H    SER  41           H        SER  41  14.073  17.713 -13.951
  272    HA   SER  41           HA       SER  41  13.588  19.651 -11.813
  273    HB2  SER  41           1HB      SER  41  15.972  20.206 -12.039
  274    HB3  SER  41           2HB      SER  41  15.748  18.473 -11.801
  275    HG   SER  41           HG       SER  41  17.194  18.766 -13.473
  276    H    GLY  42           H        GLY  42  14.485  19.541 -15.251
  277    HA2  GLY  42           1HA      GLY  42  14.395  21.149 -16.893
  278    HA3  GLY  42           2HA      GLY  42  12.891  21.613 -16.109
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1 -14.690  -4.438 -25.378
    2    HA2  GLY   1           1HA      GLY   1 -14.387  -6.461 -24.073
    3    HA3  GLY   1           2HA      GLY   1 -13.245  -5.577 -23.072
    4    H    SER   2           H        SER   2 -14.423  -6.219 -21.210
    5    HA   SER   2           HA       SER   2 -17.094  -5.942 -20.688
    6    HB2  SER   2           1HB      SER   2 -16.549  -5.879 -18.361
    7    HB3  SER   2           2HB      SER   2 -15.310  -6.862 -19.141
    8    HG   SER   2           HG       SER   2 -13.894  -5.152 -19.015
    9    H    SER   3           H        SER   3 -18.448  -4.329 -19.923
   10    HA   SER   3           HA       SER   3 -17.491  -1.592 -20.415
   11    HB2  SER   3           1HB      SER   3 -20.215  -2.862 -20.621
   12    HB3  SER   3           2HB      SER   3 -20.023  -1.111 -20.527
   13    HG   SER   3           HG       SER   3 -20.066  -1.774 -22.686
   14    H    GLY   4           H        GLY   4 -16.551  -1.474 -18.286
   15    HA2  GLY   4           1HA      GLY   4 -17.030  -0.113 -16.333
   16    HA3  GLY   4           2HA      GLY   4 -18.592  -0.912 -16.230
   17    H    SER   5           H        SER   5 -15.708  -0.709 -14.762
   18    HA   SER   5           HA       SER   5 -15.828  -3.498 -13.814
   19    HB2  SER   5           1HB      SER   5 -13.432  -3.451 -13.454
   20    HB3  SER   5           2HB      SER   5 -13.764  -2.984 -15.122
   21    HG   SER   5           HG       SER   5 -13.036  -1.037 -14.730
   22    H    SER   6           H        SER   6 -16.001  -3.824 -11.670
   23    HA   SER   6           HA       SER   6 -15.629  -1.525  -9.875
   24    HB2  SER   6           1HB      SER   6 -17.957  -3.461  -9.813
   25    HB3  SER   6           2HB      SER   6 -17.651  -2.195  -8.625
   26    HG   SER   6           HG       SER   6 -17.654  -0.804 -10.666
   27    H    GLY   7           H        GLY   7 -13.742  -3.532 -10.320
   28    HA2  GLY   7           1HA      GLY   7 -13.772  -5.772  -8.726
   29    HA3  GLY   7           2HA      GLY   7 -12.322  -4.841  -9.072
   30    H    GLU   8           H        GLU   8 -12.930  -6.259  -6.646
   31    HA   GLU   8           HA       GLU   8 -13.452  -4.127  -4.714
   32    HB2  GLU   8           1HB      GLU   8 -13.265  -7.124  -4.465
   33    HB3  GLU   8           2HB      GLU   8 -13.332  -6.069  -3.061
   34    HG2  GLU   8           1HG      GLU   8 -15.486  -5.198  -3.821
   35    HG3  GLU   8           2HG      GLU   8 -15.420  -6.270  -5.219
   36    H    LYS   9           H        LYS   9 -11.849  -3.081  -3.754
   37    HA   LYS   9           HA       LYS   9  -9.262  -4.435  -3.416
   38    HB2  LYS   9           1HB      LYS   9  -9.618  -1.575  -4.332
   39    HB3  LYS   9           2HB      LYS   9  -8.084  -2.379  -4.026
   40    HG2  LYS   9           1HG      LYS   9  -8.167  -3.582  -5.960
   41    HG3  LYS   9           2HG      LYS   9  -9.931  -3.605  -6.001
   42    HD2  LYS   9           1HD      LYS   9  -9.789  -1.102  -6.463
   43    HD3  LYS   9           2HD      LYS   9  -8.071  -1.369  -6.769
   44    HE2  LYS   9           1HE      LYS   9  -8.833  -3.182  -8.403
   45    HE3  LYS   9           2HE      LYS   9 -10.437  -2.464  -8.263
   46    HZ1  LYS   9           3HZ      LYS   9  -8.010  -0.961  -9.074
   47    HZ2  LYS   9           1HZ      LYS   9  -9.606  -0.402  -9.092
   48    HZ3  LYS   9           2HZ      LYS   9  -9.125  -1.621 -10.162
   49    HA   PRO  10           HA       PRO  10 -10.489  -2.874   0.675
   50    HB2  PRO  10           1HB      PRO  10  -8.995  -4.685   2.038
   51    HB3  PRO  10           2HB      PRO  10 -10.601  -5.053   1.397
   52    HG2  PRO  10           1HG      PRO  10  -7.911  -5.706   0.258
   53    HG3  PRO  10           2HG      PRO  10  -9.359  -6.724   0.363
   54    HD2  PRO  10           1HD      PRO  10  -8.634  -5.453  -1.915
   55    HD3  PRO  10           2HD      PRO  10 -10.331  -5.751  -1.487
   56    H    TYR  11           H        TYR  11  -7.673  -2.782  -1.104
   57    HA   TYR  11           HA       TYR  11  -6.199  -1.418   1.051
   58    HB2  TYR  11           1HB      TYR  11  -5.070  -2.634  -1.477
   59    HB3  TYR  11           2HB      TYR  11  -4.150  -1.934  -0.149
   60    HD1  TYR  11           HD1      TYR  11  -6.242  -4.790  -1.173
   61    HD2  TYR  11           HD2      TYR  11  -3.714  -3.180   1.847
   62    HE1  TYR  11           HE1      TYR  11  -6.143  -6.996  -0.088
   63    HE2  TYR  11           HE2      TYR  11  -3.607  -5.381   2.939
   64    HH   TYR  11           HH       TYR  11  -4.875  -8.243   1.436
   65    H    GLU  12           H        GLU  12  -6.161   0.715   0.905
   66    HA   GLU  12           HA       GLU  12  -6.201   1.947  -1.771
   67    HB2  GLU  12           1HB      GLU  12  -7.895   2.470   0.600
   68    HB3  GLU  12           2HB      GLU  12  -7.313   3.888  -0.261
   69    HG2  GLU  12           1HG      GLU  12  -8.562   3.460  -2.104
   70    HG3  GLU  12           2HG      GLU  12  -8.498   1.713  -1.879
   71    H    CYS  13           H        CYS  13  -4.765   3.556  -2.147
   72    HA   CYS  13           HA       CYS  13  -2.515   3.814  -0.470
   73    HB2  CYS  13           1HB      CYS  13  -2.645   4.193  -2.990
   74    HB3  CYS  13           2HB      CYS  13  -3.304   5.782  -2.614
   75    H    THR  14           H        THR  14  -2.194   5.020   1.272
   76    HA   THR  14           HA       THR  14  -4.207   6.923   2.104
   77    HB   THR  14           HB       THR  14  -2.769   7.156   4.148
   78    HG1  THR  14           HG1      THR  14  -1.197   5.214   4.163
   79   HG21  THR  14          3HG2      THR  14  -4.429   5.054   3.361
   80   HG22  THR  14          1HG2      THR  14  -3.958   5.473   5.007
   81   HG23  THR  14          2HG2      THR  14  -3.029   4.279   4.100
   82    H    ASP  15           H        ASP  15  -2.460   7.499  -0.234
   83    HA   ASP  15           HA       ASP  15  -1.380  10.065   0.729
   84    HB2  ASP  15           1HB      ASP  15  -0.110   7.985  -0.971
   85    HB3  ASP  15           2HB      ASP  15   0.164   9.664  -1.429
   86    H    CYS  16           H        CYS  16  -2.951   8.269  -1.840
   87    HA   CYS  16           HA       CYS  16  -3.852  10.826  -2.988
   88    HB2  CYS  16           1HB      CYS  16  -3.817   9.715  -5.231
   89    HB3  CYS  16           2HB      CYS  16  -2.221   9.951  -4.525
   90    H    GLY  17           H        GLY  17  -4.522   7.454  -2.297
   91    HA2  GLY  17           1HA      GLY  17  -6.747   6.904  -1.481
   92    HA3  GLY  17           2HA      GLY  17  -7.392   8.041  -2.656
   93    H    LYS  18           H        LYS  18  -4.834   6.191  -3.877
   94    HA   LYS  18           HA       LYS  18  -6.349   4.998  -5.892
   95    HB2  LYS  18           1HB      LYS  18  -3.591   4.660  -4.838
   96    HB3  LYS  18           2HB      LYS  18  -4.220   3.371  -5.855
   97    HG2  LYS  18           1HG      LYS  18  -4.751   5.106  -7.577
   98    HG3  LYS  18           2HG      LYS  18  -3.883   6.272  -6.575
   99    HD2  LYS  18           1HD      LYS  18  -2.178   5.621  -7.943
  100    HD3  LYS  18           2HD      LYS  18  -2.007   4.400  -6.680
  101    HE2  LYS  18           1HE      LYS  18  -1.906   3.377  -8.884
  102    HE3  LYS  18           2HE      LYS  18  -3.343   2.841  -8.015
  103    HZ1  LYS  18           3HZ      LYS  18  -4.724   4.079  -9.363
  104    HZ2  LYS  18           1HZ      LYS  18  -3.553   3.554 -10.465
  105    HZ3  LYS  18           2HZ      LYS  18  -3.498   5.132  -9.860
  106    H    ALA  19           H        ALA  19  -5.909   2.401  -6.153
  107    HA   ALA  19           HA       ALA  19  -6.696   1.018  -3.710
  108    HB1  ALA  19           3HB      ALA  19  -8.860   1.419  -4.378
  109    HB2  ALA  19           1HB      ALA  19  -8.454   1.373  -6.094
  110    HB3  ALA  19           2HB      ALA  19  -8.540  -0.125  -5.167
  111    H    PHE  20           H        PHE  20  -6.305  -1.207  -3.743
  112    HA   PHE  20           HA       PHE  20  -5.275  -2.438  -6.158
  113    HB2  PHE  20           1HB      PHE  20  -3.541  -2.278  -3.686
  114    HB3  PHE  20           2HB      PHE  20  -3.130  -3.049  -5.214
  115    HD1  PHE  20           HD1      PHE  20  -3.810   0.211  -3.610
  116    HD2  PHE  20           HD2      PHE  20  -2.187  -1.820  -6.980
  117    HE1  PHE  20           HE1      PHE  20  -2.821   2.320  -4.401
  118    HE2  PHE  20           HE2      PHE  20  -1.194   0.286  -7.775
  119    HZ   PHE  20           HZ       PHE  20  -1.510   2.360  -6.485
  120    H    GLY  21           H        GLY  21  -6.253  -4.343  -6.248
  121    HA2  GLY  21           1HA      GLY  21  -7.684  -5.550  -4.202
  122    HA3  GLY  21           2HA      GLY  21  -7.092  -6.388  -5.629
  123    H    LEU  22           H        LEU  22  -4.292  -5.500  -4.667
  124    HA   LEU  22           HA       LEU  22  -3.968  -7.697  -2.731
  125    HB2  LEU  22           1HB      LEU  22  -2.388  -6.824  -5.081
  126    HB3  LEU  22           2HB      LEU  22  -1.491  -7.425  -3.688
  127    HG   LEU  22           HG       LEU  22  -3.455  -8.903  -5.420
  128   HD11  LEU  22          1HD1      LEU  22  -1.354 -10.506  -5.199
  129   HD12  LEU  22          2HD1      LEU  22  -0.536  -8.972  -4.908
  130   HD13  LEU  22          3HD1      LEU  22  -1.433  -9.221  -6.405
  131   HD21  LEU  22          3HD2      LEU  22  -2.799  -9.314  -2.593
  132   HD22  LEU  22          1HD2      LEU  22  -2.594 -10.741  -3.609
  133   HD23  LEU  22          2HD2      LEU  22  -4.153  -9.920  -3.546
  134    H    LYS  23           H        LYS  23  -1.966  -7.453  -1.345
  135    HA   LYS  23           HA       LYS  23  -2.008  -4.792  -0.165
  136    HB2  LYS  23           1HB      LYS  23  -2.281  -6.591   1.390
  137    HB3  LYS  23           2HB      LYS  23  -0.871  -7.431   0.758
  138    HG2  LYS  23           1HG      LYS  23   0.010  -6.531   2.655
  139    HG3  LYS  23           2HG      LYS  23   0.368  -5.238   1.507
  140    HD2  LYS  23           1HD      LYS  23  -1.986  -4.351   2.248
  141    HD3  LYS  23           2HD      LYS  23  -1.684  -5.347   3.673
  142    HE2  LYS  23           1HE      LYS  23   0.288  -4.137   4.204
  143    HE3  LYS  23           2HE      LYS  23   0.282  -3.313   2.645
  144    HZ1  LYS  23           3HZ      LYS  23  -0.844  -1.691   3.619
  145    HZ2  LYS  23           1HZ      LYS  23  -1.003  -2.571   5.055
  146    HZ3  LYS  23           2HZ      LYS  23  -2.150  -2.747   3.825
  147    H    SER  24           H        SER  24   0.123  -6.897  -1.940
  148    HA   SER  24           HA       SER  24   2.490  -5.343  -1.401
  149    HB2  SER  24           1HB      SER  24   2.847  -7.669  -1.796
  150    HB3  SER  24           2HB      SER  24   1.907  -7.629  -3.288
  151    HG   SER  24           HG       SER  24   3.624  -7.007  -4.318
  152    H    GLN  25           H        GLN  25   0.038  -5.520  -3.885
  153    HA   GLN  25           HA       GLN  25   1.360  -4.100  -5.914
  154    HB2  GLN  25           1HB      GLN  25  -1.516  -4.603  -5.247
  155    HB3  GLN  25           2HB      GLN  25  -1.107  -3.467  -6.526
  156    HG2  GLN  25           1HG      GLN  25   0.404  -5.490  -7.324
  157    HG3  GLN  25           2HG      GLN  25  -0.802  -6.411  -6.428
  158   HE21  GLN  25          1HE2      GLN  25  -2.140  -7.268  -7.849
  159   HE22  GLN  25          2HE2      GLN  25  -2.888  -6.439  -9.167
  160    H    LEU  26           H        LEU  26  -0.281  -3.050  -3.023
  161    HA   LEU  26           HA       LEU  26  -0.404  -0.284  -3.816
  162    HB2  LEU  26           1HB      LEU  26  -2.102  -1.011  -2.344
  163    HB3  LEU  26           2HB      LEU  26  -0.936  -1.741  -1.242
  164    HG   LEU  26           HG       LEU  26  -0.149   0.538  -0.647
  165   HD11  LEU  26          1HD1      LEU  26  -0.945   2.429  -1.572
  166   HD12  LEU  26          2HD1      LEU  26  -2.574   1.782  -1.761
  167   HD13  LEU  26          3HD1      LEU  26  -1.319   1.364  -2.927
  168   HD21  LEU  26          3HD2      LEU  26  -2.236   1.165   0.612
  169   HD22  LEU  26          1HD2      LEU  26  -1.687  -0.496   0.836
  170   HD23  LEU  26          2HD2      LEU  26  -3.050  -0.155  -0.230
  171    H    ILE  27           H        ILE  27   1.460  -2.135  -1.410
  172    HA   ILE  27           HA       ILE  27   3.039  -0.163  -0.362
  173    HB   ILE  27           HB       ILE  27   3.955  -2.948  -1.087
  174   HG12  ILE  27          1HG1      ILE  27   2.961  -2.009   1.596
  175   HG13  ILE  27          2HG1      ILE  27   1.861  -2.646   0.379
  176   HG21  ILE  27          1HG2      ILE  27   5.075  -1.604   1.270
  177   HG22  ILE  27          2HG2      ILE  27   5.863  -2.601   0.048
  178   HG23  ILE  27          3HG2      ILE  27   5.536  -0.899  -0.279
  179   HD11  ILE  27          3HD1      ILE  27   2.277  -4.650   1.219
  180   HD12  ILE  27          1HD1      ILE  27   3.891  -4.525   0.519
  181   HD13  ILE  27          2HD1      ILE  27   3.614  -4.039   2.193
  182    H    ILE  28           H        ILE  28   3.545  -1.912  -3.401
  183    HA   ILE  28           HA       ILE  28   6.030  -0.736  -4.041
  184    HB   ILE  28           HB       ILE  28   3.931  -1.917  -5.862
  185   HG12  ILE  28          1HG1      ILE  28   6.530  -3.208  -5.106
  186   HG13  ILE  28          2HG1      ILE  28   5.156  -3.304  -4.010
  187   HG21  ILE  28          1HG2      ILE  28   5.572  -0.317  -6.935
  188   HG22  ILE  28          2HG2      ILE  28   6.831  -1.477  -6.515
  189   HG23  ILE  28          3HG2      ILE  28   5.526  -1.949  -7.602
  190   HD11  ILE  28          3HD1      ILE  28   4.927  -5.237  -5.212
  191   HD12  ILE  28          1HD1      ILE  28   3.894  -4.142  -6.129
  192   HD13  ILE  28          2HD1      ILE  28   5.520  -4.510  -6.705
  193    H    HIS  29           H        HIS  29   2.702   0.215  -4.672
  194    HA   HIS  29           HA       HIS  29   3.305   2.314  -6.484
  195    HB2  HIS  29           1HB      HIS  29   1.089   1.591  -6.593
  196    HB3  HIS  29           2HB      HIS  29   0.905   1.575  -4.842
  197    HD1  HIS  29           HD1      HIS  29   1.234   4.075  -7.678
  198    HD2  HIS  29           HD2      HIS  29  -0.279   3.800  -3.818
  199    HE1  HIS  29           HE1      HIS  29   0.015   6.238  -7.278
  200    H    GLN  30           H        GLN  30   2.498   2.323  -3.015
  201    HA   GLN  30           HA       GLN  30   2.590   4.992  -2.463
  202    HB2  GLN  30           1HB      GLN  30   3.601   2.667  -0.830
  203    HB3  GLN  30           2HB      GLN  30   3.528   4.307  -0.201
  204    HG2  GLN  30           1HG      GLN  30   1.037   4.181  -0.963
  205    HG3  GLN  30           2HG      GLN  30   1.312   2.441  -0.891
  206   HE21  GLN  30          1HE2      GLN  30   0.809   1.539   0.960
  207   HE22  GLN  30          2HE2      GLN  30   0.827   2.302   2.510
  208    H    ARG  31           H        ARG  31   5.215   2.962  -3.406
  209    HA   ARG  31           HA       ARG  31   7.402   4.349  -2.384
  210    HB2  ARG  31           1HB      ARG  31   7.166   2.901  -5.028
  211    HB3  ARG  31           2HB      ARG  31   8.677   3.369  -4.260
  212    HG2  ARG  31           1HG      ARG  31   7.838   1.963  -2.267
  213    HG3  ARG  31           2HG      ARG  31   6.720   1.264  -3.441
  214    HD2  ARG  31           1HD      ARG  31   8.499  -0.186  -3.597
  215    HD3  ARG  31           2HD      ARG  31   8.878   0.963  -4.880
  216    HE   ARG  31           HE       ARG  31  10.192   2.021  -2.809
  217   HH11  ARG  31          1HH1      ARG  31  10.034  -1.245  -4.005
  218   HH12  ARG  31          2HH1      ARG  31  11.632  -1.654  -3.477
  219   HH21  ARG  31          1HH2      ARG  31  12.297   1.494  -2.108
  220   HH22  ARG  31          2HH2      ARG  31  12.918  -0.096  -2.397
  221    H    THR  32           H        THR  32   5.473   4.942  -5.276
  222    HA   THR  32           HA       THR  32   7.076   6.889  -6.478
  223    HB   THR  32           HB       THR  32   5.120   7.594  -7.702
  224    HG1  THR  32           HG1      THR  32   3.536   6.002  -5.956
  225   HG21  THR  32          3HG2      THR  32   4.352   5.464  -8.595
  226   HG22  THR  32          1HG2      THR  32   4.961   4.625  -7.169
  227   HG23  THR  32          2HG2      THR  32   6.086   5.402  -8.282
  228    H    HIS  33           H        HIS  33   4.626   7.159  -3.952
  229    HA   HIS  33           HA       HIS  33   4.554   9.988  -3.868
  230    HB2  HIS  33           1HB      HIS  33   3.804   7.865  -1.861
  231    HB3  HIS  33           2HB      HIS  33   3.605   9.584  -1.535
  232    HD1  HIS  33           HD1      HIS  33   2.146  10.822  -3.603
  233    HD2  HIS  33           HD2      HIS  33   1.565   6.771  -2.883
  234    HE1  HIS  33           HE1      HIS  33  -0.081  10.269  -4.632
  235    H    THR  34           H        THR  34   6.066   7.693  -1.589
  236    HA   THR  34           HA       THR  34   7.387   9.338   0.083
  237    HB   THR  34           HB       THR  34   9.163   7.658   0.308
  238    HG1  THR  34           HG1      THR  34   9.571   6.992  -1.754
  239   HG21  THR  34          3HG2      THR  34   7.662   5.647   0.654
  240   HG22  THR  34          1HG2      THR  34   6.352   6.620  -0.014
  241   HG23  THR  34          2HG2      THR  34   7.161   7.128   1.469
  242    H    GLY  35           H        GLY  35   8.463   8.483  -3.187
  243    HA2  GLY  35           1HA      GLY  35  10.918   9.891  -3.076
  244    HA3  GLY  35           2HA      GLY  35  10.084   9.389  -4.539
  245    H    GLU  36           H        GLU  36   8.597  10.806  -5.524
  246    HA   GLU  36           HA       GLU  36   9.272  13.572  -5.214
  247    HB2  GLU  36           1HB      GLU  36   8.851  12.730  -7.430
  248    HB3  GLU  36           2HB      GLU  36   7.253  12.164  -6.963
  249    HG2  GLU  36           1HG      GLU  36   6.752  14.094  -8.090
  250    HG3  GLU  36           2HG      GLU  36   6.811  14.664  -6.423
  251    H    SER  37           H        SER  37   8.283  15.070  -4.030
  252    HA   SER  37           HA       SER  37   5.474  14.873  -3.381
  253    HB2  SER  37           1HB      SER  37   6.520  13.486  -1.621
  254    HB3  SER  37           2HB      SER  37   7.535  14.853  -1.162
  255    HG   SER  37           HG       SER  37   5.237  15.889  -1.050
  256    H    GLY  38           H        GLY  38   4.578  16.829  -2.677
  257    HA2  GLY  38           1HA      GLY  38   6.415  19.124  -2.520
  258    HA3  GLY  38           2HA      GLY  38   5.078  19.162  -3.660
  259    HA   PRO  39           HA       PRO  39   3.617  21.140   0.249
  260    HB2  PRO  39           1HB      PRO  39   2.325  23.174  -1.001
  261    HB3  PRO  39           2HB      PRO  39   4.044  23.233  -0.597
  262    HG2  PRO  39           1HG      PRO  39   2.733  22.588  -3.210
  263    HG3  PRO  39           2HG      PRO  39   4.154  23.600  -2.890
  264    HD2  PRO  39           1HD      PRO  39   4.352  21.051  -3.782
  265    HD3  PRO  39           2HD      PRO  39   5.563  21.785  -2.712
  266    H    SER  40           H        SER  40   2.331  19.393  -2.227
  267    HA   SER  40           HA       SER  40  -0.289  19.757  -2.542
  268    HB2  SER  40           1HB      SER  40  -0.602  17.273  -2.437
  269    HB3  SER  40           2HB      SER  40   0.779  17.772  -3.412
  270    HG   SER  40           HG       SER  40   0.775  16.681  -0.802
  271    H    SER  41           H        SER  41   1.120  18.349   0.400
  272    HA   SER  41           HA       SER  41  -1.169  17.801   1.824
  273    HB2  SER  41           1HB      SER  41   0.168  17.963   3.832
  274    HB3  SER  41           2HB      SER  41   1.172  17.286   2.550
  275    HG   SER  41           HG       SER  41   1.925  19.502   2.224
  276    H    GLY  42           H        GLY  42  -2.757  18.960   2.712
  277    HA2  GLY  42           1HA      GLY  42  -2.409  21.891   2.819
  278    HA3  GLY  42           2HA      GLY  42  -3.942  21.087   2.515