*HEADER    UBIQUITIN BINDING PROTEIN               16-SEP-14   2MUQ              
*TITLE     SOLUTION STRUCTURE OF THE HUMAN FAAP20 UBZ                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: FANCONI ANEMIA-ASSOCIATED PROTEIN OF 20 KDA;               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UBZ, UNP RESIDUES 140-180;                                 
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: C1ORF86, FAAP20, FP7162;                                       
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET15B                                     
*KEYWDS    UBZ, FAAP20, ZINC FINGER, UBIQUITIN-BINDING, FANCONI ANEMIA,          
*KEYWDS   2 UBIQUITIN BINDING PROTEIN                                            
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    J.L.WOJTASZEK, S.WANG, P.ZHOU                                         
*REVDAT   1   03-DEC-14 2MUQ    0                                                


# NOEs
  5 ALA QB      6 ALA H     4.15  
  6 ALA HA      7 ALA H     3.24  
  6 ALA QB      7 ALA H     3.40  
  7 ALA H       7 ALA QB    3.57  
  7 ALA HA      8 LEU H     2.71  
  7 ALA QB      8 LEU H     3.37  
  7 ALA QB     27 VAL QG2   5.85  
  8 LEU HA      8 LEU QD1   5.18  
  8 LEU HA      8 LEU QD2   5.18  
  8 LEU H       8 LEU QB    3.21  
  8 LEU H       8 LEU HG    3.24  
  8 LEU H       8 LEU QD2   4.26  
  8 LEU H       8 LEU QD1   4.26  
  8 LEU H       8 LEU QQD   3.72  
  8 LEU HA      8 LEU QQD   4.04  
  8 LEU HA      9 ARG H     3.47  
  8 LEU QB      9 ARG H     4.15  
  8 LEU QD1     9 ARG H     5.67  
  8 LEU QD2     9 ARG H     5.67  
  8 LEU QQD     9 ARG H     4.72  
  8 LEU HA     10 SER H     4.29  
  8 LEU QB     10 SER H     3.71  
  8 LEU QD1    10 SER H     4.91  
  8 LEU QD2    10 SER H     4.91  
  8 LEU QQD    10 SER H     4.32  
  8 LEU QB     11 CYS H     5.79  
  8 LEU QQD    11 CYS H     5.99  
  8 LEU QD2    12 PRO HD3   5.81  
  8 LEU QD1    12 PRO HD3   5.81  
  8 LEU QQD    12 PRO QG    5.57  
  8 LEU QQD    12 PRO HD3   5.05  
  8 LEU QQD    13 MET H     5.53  
  8 LEU QB     18 PHE QD    5.02  
  8 LEU QB     18 PHE QE    4.35  
  8 LEU HG     18 PHE QE    6.06  
  8 LEU QQD    18 PHE QE    4.55  
  8 LEU H      27 VAL QG1   5.00  
  8 LEU H      27 VAL QG2   5.64  
  9 ARG HA      9 ARG HD3   5.43  
  9 ARG HA      9 ARG QG    4.07  
  9 ARG HA      9 ARG HD2   5.43  
  9 ARG H       9 ARG HB2   4.16  
  9 ARG H       9 ARG QG    4.26  
  9 ARG H       9 ARG QD    5.33  
  9 ARG HA      9 ARG QD    4.77  
  9 ARG HA     10 SER H     3.26  
  9 ARG HB3    10 SER H     4.08  
  9 ARG HB2    10 SER H     4.38  
  9 ARG QD     10 SER H     5.11  
  9 ARG H      10 SER H     5.32  
  9 ARG HA     18 PHE HB2   5.93  
  9 ARG HB2    18 PHE HB2   6.11  
  9 ARG HB3    18 PHE HB2   6.11  
  9 ARG QG     18 PHE HB2   6.11  
  9 ARG QG     18 PHE HB3   6.46  
  9 ARG HB3    18 PHE HB3   6.61  
  9 ARG HB2    18 PHE QD    5.65  
  9 ARG HB3    18 PHE QD    4.83  
  9 ARG HA     18 PHE QD    4.25  
  9 ARG QG     18 PHE QD    4.60  
  9 ARG QG     18 PHE H     5.96  
  9 ARG HB3    18 PHE H     5.40  
  9 ARG QD     18 PHE QD    5.05  
  9 ARG HD3    27 VAL QG2   5.76  
  9 ARG HD2    27 VAL QG2   5.76  
  9 ARG QD     27 VAL QG1   5.60  
  9 ARG QD     27 VAL QG2   4.90  
 10 SER H      10 SER HB3   3.94  
 10 SER H      10 SER HB2   3.91  
 10 SER HB3    11 CYS H     3.41  
 10 SER HB2    11 CYS H     3.13  
 10 SER HA     11 CYS H     2.63  
 10 SER H      12 PRO HD2   5.57  
 10 SER H      12 PRO HD3   5.52  
 10 SER HB2    15 GLN HA    5.01  
 10 SER HB3    15 GLN HA    6.66  
 10 SER HB3    16 LYS HA    7.00  
 10 SER HB2    16 LYS H     4.75  
 10 SER HB3    16 LYS H     5.88  
 10 SER HB2    17 GLU HA    4.64  
 10 SER HB3    17 GLU HA    4.27  
 10 SER HA     17 GLU HA    4.05  
 10 SER HB2    17 GLU HG3   6.31  
 10 SER HB3    17 GLU HG3   6.02  
 10 SER HA     17 GLU H     5.83  
 10 SER HB3    17 GLU H     5.41  
 10 SER HB2    17 GLU H     5.74  
 10 SER H      17 GLU HA    5.70  
 10 SER HA     18 PHE HB2   4.84  
 10 SER HA     18 PHE QE    3.84  
 10 SER H      18 PHE HB3   6.42  
 10 SER H      18 PHE HB2   5.16  
 10 SER HA     18 PHE H     3.27  
 10 SER HB3    18 PHE H     4.10  
 10 SER HB2    18 PHE H     4.31  
 10 SER H      18 PHE QD    3.97  
 10 SER H      18 PHE QE    4.66  
 11 CYS H      11 CYS HB3   2.88  
 11 CYS H      11 CYS HB2   2.87  
 11 CYS HB2    12 PRO HD2   5.51  
 11 CYS HB2    12 PRO HD3   5.61  
 11 CYS HB3    12 PRO HD2   6.42  
 11 CYS HB3    12 PRO HD3   6.25  
 11 CYS HA     12 PRO HD3   3.84  
 11 CYS H      12 PRO HD2   4.57  
 11 CYS H      12 PRO HD3   4.44  
 11 CYS H      12 PRO HA    5.46  
 11 CYS HA     13 MET H     4.22  
 11 CYS HB3    13 MET H     4.31  
 11 CYS HB2    13 MET H     4.78  
 11 CYS HA     14 CYS H     4.75  
 11 CYS HB3    14 CYS H     3.52  
 11 CYS HB2    14 CYS H     4.83  
 11 CYS HB3    15 GLN HA    6.35  
 11 CYS HB3    15 GLN H     4.10  
 11 CYS HA     15 GLN H     5.30  
 11 CYS H      15 GLN HA    5.20  
 11 CYS H      15 GLN QG    6.61  
 11 CYS HB2    16 LYS HA    6.63  
 11 CYS HB2    16 LYS HB2   5.86  
 11 CYS HB2    16 LYS HB3   5.29  
 11 CYS HB2    16 LYS HG2   6.20  
 11 CYS HB2    16 LYS HG3   6.14  
 11 CYS HB3    16 LYS HA    6.73  
 11 CYS HB3    16 LYS HB2   5.87  
 11 CYS HB3    16 LYS HB3   5.44  
 11 CYS HB3    16 LYS HG2   6.71  
 11 CYS HB3    16 LYS HG3   6.63  
 11 CYS H      16 LYS HA    5.54  
 11 CYS H      16 LYS HB2   5.35  
 11 CYS H      16 LYS HB3   4.17  
 11 CYS H      16 LYS HG2   4.72  
 11 CYS H      16 LYS HG3   6.25  
 11 CYS HB2    16 LYS H     4.00  
 11 CYS HB3    16 LYS H     3.07  
 11 CYS HA     16 LYS H     4.67  
 11 CYS H      17 GLU HA    3.79  
 11 CYS H      17 GLU QB    5.77  
 11 CYS H      17 GLU HG2   5.75  
 11 CYS HB2    18 PHE HZ    3.50  
 11 CYS HB2    18 PHE QE    3.98  
 11 CYS HB3    18 PHE QD    5.82  
 11 CYS HB2    18 PHE QD    4.74  
 11 CYS HA     18 PHE QE    4.29  
 11 CYS HB3    18 PHE QE    4.65  
 11 CYS HA     18 PHE HZ    3.89  
 11 CYS HB3    18 PHE HZ    4.07  
 11 CYS H      18 PHE HB2   5.96  
 11 CYS H      18 PHE QE    4.06  
 11 CYS H      18 PHE QD    4.56  
 11 CYS H      18 PHE HZ    4.59  
 11 CYS HA     30 HIS HD2   5.48  
 11 CYS HB3    30 HIS HD2   4.58  
 11 CYS HB2    30 HIS HD2   3.84  
 11 CYS HB2    31 LEU HA    6.94  
 11 CYS HB2    31 LEU QD2   5.34  
 11 CYS HB3    31 LEU QD2   5.96  
 11 CYS HA     31 LEU QD2   4.70  
 11 CYS H      31 LEU QD2   5.04  
 11 CYS HB2    31 LEU H     6.08  
 12 PRO HD2    13 MET QE    5.91  
 12 PRO HG2    13 MET H     3.83  
 12 PRO HG3    13 MET H     4.68  
 12 PRO HB3    13 MET H     4.46  
 12 PRO HB2    13 MET H     4.46  
 12 PRO HD2    13 MET H     3.61  
 12 PRO HD3    13 MET H     4.03  
 12 PRO QB     13 MET H     3.77  
 12 PRO HA     14 CYS H     5.01  
 12 PRO HD2    14 CYS H     5.23  
 12 PRO HG2    14 CYS H     5.79  
 12 PRO HG3    14 CYS H     6.78  
 12 PRO HD3    14 CYS H     5.95  
 12 PRO HA     15 GLN H     4.59  
 12 PRO HD3    18 PHE QE    4.87  
 12 PRO HD2    18 PHE HZ    5.42  
 12 PRO HD3    18 PHE HZ    6.03  
 12 PRO HD3    31 LEU QD2   4.64  
 12 PRO HD2    31 LEU QD2   4.43  
 13 MET HB2    13 MET QE    5.00  
 13 MET HB3    13 MET QE    5.00  
 13 MET H      13 MET HG3   4.70  
 13 MET H      13 MET HG2   4.70  
 13 MET H      13 MET QE    4.02  
 13 MET H      13 MET HB3   3.54  
 13 MET H      13 MET HB2   3.54  
 13 MET H      13 MET QB    3.03  
 13 MET H      13 MET QG    4.07  
 13 MET QB     13 MET QE    4.34  
 13 MET HG3    14 CYS H     5.22  
 13 MET HG2    14 CYS H     5.22  
 13 MET HB3    14 CYS H     3.74  
 13 MET HB2    14 CYS H     3.74  
 13 MET QE     14 CYS H     5.05  
 13 MET H      14 CYS HA    5.14  
 13 MET H      14 CYS HB2   6.48  
 13 MET H      14 CYS HB3   5.29  
 13 MET H      14 CYS H     4.27  
 13 MET QB     14 CYS H     3.24  
 13 MET QG     14 CYS H     4.57  
 13 MET H      15 GLN HA    5.29  
 13 MET HA     15 GLN H     4.92  
 13 MET QE     31 LEU HB3   5.24  
 13 MET QE     31 LEU QD2   4.33  
 13 MET QE     31 LEU HA    4.81  
 13 MET QE     31 LEU H     5.15  
 13 MET H      31 LEU QD2   4.63  
 13 MET H      31 LEU QD1   6.58  
 13 MET QE     34 CYS HB2   4.82  
 13 MET HB3    34 CYS HB2   5.62  
 13 MET HB2    34 CYS HB2   5.62  
 13 MET HB3    34 CYS HB3   5.01  
 13 MET HB2    34 CYS HB3   5.01  
 13 MET QE     34 CYS HB3   4.62  
 13 MET H      34 CYS HB3   5.61  
 13 MET H      34 CYS HB2   6.25  
 13 MET QE     34 CYS H     4.87  
 13 MET QB     34 CYS HB2   4.87  
 13 MET QB     34 CYS HB3   4.34  
 13 MET QE     35 LEU HA    5.47  
 13 MET QE     35 LEU QD1   6.14  
 13 MET QE     35 LEU QD2   6.14  
 13 MET QE     35 LEU QB    5.69  
 13 MET QE     35 LEU H     3.89  
 13 MET QG     35 LEU H     6.50  
 13 MET QE     35 LEU QQD   5.36  
 13 MET QE     36 ALA H     5.48  
 13 MET QE     37 GLU H     6.62  
 14 CYS H      14 CYS HB2   3.89  
 14 CYS H      14 CYS HB3   3.45  
 14 CYS HA     15 GLN QG    5.96  
 14 CYS HB2    15 GLN H     4.55  
 14 CYS HB3    15 GLN H     4.55  
 14 CYS H      15 GLN HA    4.37  
 14 CYS H      15 GLN H     3.89  
 14 CYS H      15 GLN QB    5.12  
 14 CYS HB3    16 LYS H     5.38  
 14 CYS HB2    16 LYS H     5.03  
 14 CYS HA     16 LYS H     5.29  
 14 CYS H      31 LEU QD2   5.55  
 14 CYS H      34 CYS HB3   5.51  
 14 CYS H      34 CYS HB2   5.86  
 15 GLN HA     15 GLN QG    4.06  
 15 GLN H      15 GLN HA    2.64  
 15 GLN H      15 GLN QG    3.90  
 15 GLN H      15 GLN HB2   4.19  
 15 GLN H      15 GLN HB3   4.19  
 15 GLN H      15 GLN QB    3.51  
 15 GLN H      16 LYS HB2   5.33  
 15 GLN H      16 LYS HB3   5.20  
 15 GLN HA     16 LYS H     3.11  
 15 GLN QG     16 LYS H     4.67  
 15 GLN HB3    16 LYS H     4.67  
 15 GLN HB2    16 LYS H     4.67  
 15 GLN H      16 LYS H     4.76  
 15 GLN QB     16 LYS H     4.03  
 16 LYS HB2    16 LYS QE    5.44  
 16 LYS HA     16 LYS HD3   5.87  
 16 LYS HA     16 LYS HD2   5.87  
 16 LYS HB3    16 LYS QE    5.78  
 16 LYS H      16 LYS HB2   3.20  
 16 LYS H      16 LYS HB3   3.08  
 16 LYS H      16 LYS HD3   5.48  
 16 LYS H      16 LYS HD2   5.48  
 16 LYS H      16 LYS HG2   4.36  
 16 LYS H      16 LYS HG3   4.96  
 16 LYS H      16 LYS QE    6.17  
 16 LYS HA     16 LYS QD    5.14  
 16 LYS HA     17 GLU H     2.51  
 16 LYS HB2    17 GLU H     3.94  
 16 LYS HB3    17 GLU H     4.33  
 16 LYS HD3    17 GLU H     5.29  
 16 LYS HD2    17 GLU H     5.29  
 16 LYS HG2    17 GLU H     3.81  
 16 LYS HG3    17 GLU H     3.98  
 16 LYS QE     17 GLU H     5.28  
 16 LYS H      17 GLU H     5.21  
 16 LYS QD     17 GLU H     4.53  
 16 LYS QE     18 PHE QD    4.73  
 16 LYS QE     18 PHE QE    5.26  
 16 LYS HB3    18 PHE QE    5.29  
 16 LYS HA     18 PHE H     6.08  
 16 LYS QD     18 PHE QD    4.92  
 16 LYS QD     18 PHE QE    4.65  
 16 LYS QE     19 ALA H     5.61  
 16 LYS QE     30 HIS HE1   4.50  
 16 LYS HB2    30 HIS HE1   4.70  
 16 LYS HB3    30 HIS HE1   4.94  
 16 LYS HD3    30 HIS HE1   4.21  
 16 LYS HD2    30 HIS HE1   4.21  
 16 LYS HG3    30 HIS HE1   5.68  
 16 LYS QD     30 HIS HE1   3.55  
 17 GLU H      17 GLU HG3   3.69  
 17 GLU H      17 GLU HG2   4.44  
 17 GLU H      17 GLU QB    2.77  
 17 GLU QB     18 PHE HB2   6.43  
 17 GLU QB     18 PHE HB3   6.65  
 17 GLU H      18 PHE HA    6.13  
 17 GLU HA     18 PHE H     2.62  
 17 GLU HG3    18 PHE H     5.07  
 17 GLU HG2    18 PHE H     4.30  
 17 GLU QB     18 PHE H     3.37  
 17 GLU QB     19 ALA H     5.51  
 18 PHE HA     18 PHE QD    2.97  
 18 PHE H      18 PHE HB3   3.77  
 18 PHE H      18 PHE HB2   3.27  
 18 PHE H      18 PHE QD    3.34  
 18 PHE H      18 PHE QE    4.99  
 18 PHE HA     19 ALA H     2.75  
 18 PHE HB3    19 ALA H     3.71  
 18 PHE HB2    19 ALA H     4.20  
 18 PHE QD     19 ALA H     3.75  
 18 PHE HA     22 LEU QD1   4.66  
 18 PHE HB2    22 LEU HB2   6.24  
 18 PHE HB2    22 LEU HB3   6.87  
 18 PHE HB2    22 LEU QD1   5.28  
 18 PHE HB2    22 LEU QD2   6.23  
 18 PHE HB3    22 LEU HB2   5.69  
 18 PHE HB3    22 LEU QD2   5.97  
 18 PHE HB3    22 LEU QD1   4.87  
 18 PHE QD     22 LEU QD1   3.55  
 18 PHE QD     22 LEU QD2   4.69  
 18 PHE QE     22 LEU QD2   5.42  
 18 PHE HB3    22 LEU H     5.27  
 18 PHE HB2    22 LEU H     6.47  
 18 PHE H      22 LEU QD1   4.84  
 18 PHE HB3    27 VAL QG2   5.15  
 18 PHE HB2    27 VAL QG1   6.61  
 18 PHE HB2    27 VAL QG2   5.34  
 18 PHE HB3    27 VAL HB    7.00  
 18 PHE HB3    27 VAL QG1   6.66  
 18 PHE QD     27 VAL HB    5.99  
 18 PHE HZ     27 VAL QG1   4.06  
 18 PHE QE     27 VAL QG1   3.89  
 18 PHE QD     27 VAL HA    4.81  
 18 PHE QD     27 VAL QG1   4.10  
 18 PHE QD     27 VAL QG2   3.85  
 18 PHE QE     27 VAL HA    4.43  
 18 PHE QE     27 VAL QG2   4.39  
 18 PHE QE     27 VAL HB    4.95  
 18 PHE HZ     27 VAL HA    4.64  
 18 PHE HZ     27 VAL QG2   5.01  
 18 PHE QE     30 HIS HB3   4.08  
 18 PHE HZ     30 HIS HB2   4.79  
 18 PHE HZ     30 HIS HD2   4.72  
 18 PHE QE     30 HIS HD2   5.92  
 18 PHE QD     30 HIS HB3   5.02  
 18 PHE QD     30 HIS HB2   5.63  
 18 PHE QE     30 HIS HB2   4.37  
 18 PHE HZ     30 HIS HB3   4.15  
 18 PHE QE     30 HIS H     5.14  
 18 PHE HZ     30 HIS H     5.36  
 18 PHE QE     31 LEU HG    4.89  
 18 PHE QD     31 LEU QD2   5.39  
 18 PHE QE     31 LEU QD2   4.06  
 18 PHE QE     31 LEU QD1   5.00  
 18 PHE HZ     31 LEU HA    5.25  
 18 PHE HZ     31 LEU HG    4.34  
 18 PHE HZ     31 LEU QD2   3.71  
 18 PHE HZ     31 LEU QD1   4.52  
 19 ALA H      19 ALA QB    2.67  
 19 ALA HA     20 PRO QD    3.29  
 19 ALA HA     20 PRO QG    5.00  
 19 ALA QB     20 PRO HD2   4.11  
 19 ALA QB     20 PRO HD3   4.11  
 19 ALA QB     20 PRO QG    5.63  
 19 ALA H      20 PRO QD    4.57  
 19 ALA HA     20 PRO QD    3.29  
 19 ALA QB     20 PRO QB    5.92  
 19 ALA QB     20 PRO QD    3.40  
 19 ALA QB     21 ARG QB    6.07  
 19 ALA HA     21 ARG H     5.59  
 19 ALA QB     21 ARG H     4.05  
 19 ALA QB     21 ARG QG    4.48  
 19 ALA QB     22 LEU HG    4.57  
 19 ALA QB     22 LEU QD1   4.40  
 19 ALA QB     22 LEU QD2   4.99  
 19 ALA QB     22 LEU HB2   6.04  
 19 ALA HA     22 LEU H     5.27  
 19 ALA QB     22 LEU H     3.82  
 19 ALA H      22 LEU HB2   4.79  
 19 ALA H      22 LEU HB3   5.12  
 19 ALA H      22 LEU HG    4.08  
 19 ALA H      22 LEU QD1   3.28  
 19 ALA H      22 LEU QD2   4.35  
 19 ALA H      27 VAL QG2   5.83  
 20 PRO QB     21 ARG H     3.96  
 20 PRO QG     21 ARG H     4.39  
 20 PRO QD     21 ARG H     4.32  
 20 PRO HA     22 LEU H     4.17  
 20 PRO QB     22 LEU H     5.19  
 20 PRO QD     22 LEU H     5.06  
 21 ARG HA     21 ARG QD    5.73  
 21 ARG H      21 ARG QD    5.03  
 21 ARG H      21 ARG QB    3.65  
 21 ARG H      21 ARG QG    3.80  
 21 ARG QD     22 LEU H     5.10  
 21 ARG QB     22 LEU H     3.90  
 21 ARG QG     22 LEU H     3.88  
 21 ARG H      22 LEU HG    5.52  
 21 ARG H      22 LEU HB2   5.67  
 21 ARG H      22 LEU H     5.77  
 21 ARG QG     22 LEU HA    5.47  
 21 ARG QG     22 LEU QD2   5.61  
 22 LEU HA     22 LEU QD1   4.68  
 22 LEU HA     22 LEU QD2   3.72  
 22 LEU HB3    22 LEU QD1   4.20  
 22 LEU H      22 LEU HB3   3.76  
 22 LEU H      22 LEU HB2   2.99  
 22 LEU H      22 LEU HG    3.05  
 22 LEU H      22 LEU QD1   3.80  
 22 LEU H      22 LEU QD2   3.70  
 22 LEU HA     23 THR QG2   5.35  
 22 LEU HA     23 THR H     2.60  
 22 LEU HB2    23 THR H     4.18  
 22 LEU HB3    23 THR H     3.39  
 22 LEU HG     23 THR H     4.83  
 22 LEU QD1    23 THR H     4.63  
 22 LEU QD2    23 THR H     3.68  
 22 LEU H      23 THR HA    5.73  
 22 LEU H      23 THR QG2   5.64  
 22 LEU HA     26 ASP HB3   5.42  
 22 LEU HB3    26 ASP HB3   4.81  
 22 LEU HB2    26 ASP HB3   5.74  
 22 LEU QD1    26 ASP HB3   5.08  
 22 LEU QD1    26 ASP HB2   5.26  
 22 LEU HG     26 ASP HB3   5.65  
 22 LEU QD2    26 ASP HB3   4.97  
 22 LEU HA     26 ASP HB2   5.16  
 22 LEU HB2    26 ASP HB2   5.22  
 22 LEU HB3    26 ASP HB2   4.34  
 22 LEU HG     26 ASP HB2   5.37  
 22 LEU QD2    26 ASP HB2   4.93  
 22 LEU HA     26 ASP H     5.47  
 22 LEU QD1    26 ASP H     6.01  
 22 LEU QD2    26 ASP H     4.96  
 22 LEU H      26 ASP HB2   5.89  
 22 LEU H      26 ASP HB3   6.34  
 22 LEU QD2    27 VAL HA    5.98  
 22 LEU QD2    27 VAL QG2   4.93  
 22 LEU HB3    27 VAL QG2   4.66  
 22 LEU HB2    27 VAL QG2   4.91  
 22 LEU QD1    27 VAL HA    5.86  
 22 LEU QD1    27 VAL QG2   4.80  
 22 LEU HG     27 VAL QG2   5.72  
 22 LEU HA     27 VAL H     6.03  
 22 LEU HB3    27 VAL H     4.18  
 22 LEU HB2    27 VAL H     5.80  
 22 LEU QD2    27 VAL H     4.70  
 22 LEU QD1    27 VAL H     4.74  
 22 LEU H      27 VAL QG2   5.85  
 22 LEU QD1    30 HIS HB3   7.00  
 22 LEU QD1    30 HIS H     6.28  
 22 LEU QD2    30 HIS H     6.01  
 23 THR HA     23 THR QG2   3.90  
 23 THR H      23 THR QG2   3.26  
 23 THR H      23 THR HB    3.96  
 23 THR HB     24 GLN H     4.38  
 23 THR QG2    24 GLN H     5.33  
 23 THR HB     25 LEU H     3.16  
 23 THR HA     25 LEU H     4.47  
 23 THR QG2    25 LEU H     4.43  
 23 THR QG2    26 ASP HB2   6.27  
 23 THR HB     26 ASP H     4.08  
 23 THR HA     26 ASP H     4.57  
 23 THR QG2    26 ASP H     4.82  
 23 THR H      26 ASP HB2   3.18  
 23 THR H      26 ASP HB3   3.49  
 23 THR H      26 ASP HA    4.93  
 23 THR HB     27 VAL H     5.71  
 23 THR HA     27 VAL H     5.31  
 23 THR QG2    27 VAL H     6.27  
 23 THR H      27 VAL QG2   4.73  
 24 GLN H      24 GLN QG    4.69  
 24 GLN H      25 LEU QB    4.92  
 24 GLN H      25 LEU QD2   6.17  
 24 GLN QG     25 LEU H     4.04  
 24 GLN HB3    25 LEU H     4.22  
 24 GLN HB2    25 LEU H     4.22  
 24 GLN QB     25 LEU H     3.67  
 24 GLN HA     26 ASP HA    7.00  
 24 GLN H      26 ASP HB2   5.69  
 24 GLN HA     26 ASP H     4.44  
 24 GLN QG     26 ASP H     5.31  
 24 GLN HB2    26 ASP H     6.09  
 24 GLN HB3    26 ASP H     6.09  
 24 GLN HA     27 VAL HB    3.92  
 24 GLN HA     27 VAL QG1   5.24  
 24 GLN HA     27 VAL QG2   4.56  
 24 GLN HA     27 VAL H     3.81  
 24 GLN QG     27 VAL H     5.63  
 24 GLN HB3    27 VAL H     6.38  
 24 GLN HB2    27 VAL H     6.38  
 24 GLN QB     27 VAL H     5.58  
 24 GLN HA     28 ASP HA    7.00  
 25 LEU HA     25 LEU QD1   4.29  
 25 LEU HA     25 LEU QD2   4.87  
 25 LEU H      25 LEU QB    2.66  
 25 LEU H      25 LEU HG    3.43  
 25 LEU H      25 LEU QD2   3.99  
 25 LEU QB     26 ASP H     3.50  
 25 LEU HG     26 ASP H     4.41  
 25 LEU H      26 ASP HA    5.23  
 25 LEU H      26 ASP HB2   4.97  
 25 LEU QD1    26 ASP H     4.50  
 25 LEU H      26 ASP H     4.43  
 25 LEU HA     27 VAL H     4.65  
 25 LEU HG     27 VAL H     5.61  
 25 LEU H      27 VAL HB    5.44  
 25 LEU H      27 VAL QG2   5.29  
 25 LEU HA     28 ASP HB2   4.08  
 25 LEU HA     28 ASP HB3   4.51  
 25 LEU HA     28 ASP H     4.04  
 25 LEU QD1    28 ASP H     5.96  
 25 LEU H      28 ASP HB2   5.72  
 25 LEU HA     29 SER H     4.54  
 25 LEU QB     29 SER H     5.24  
 25 LEU HG     29 SER H     6.31  
 25 LEU QD1    29 SER H     4.85  
 26 ASP H      26 ASP HB2   3.12  
 26 ASP H      26 ASP HB3   3.59  
 26 ASP HB3    27 VAL QG2   5.81  
 26 ASP HB2    27 VAL QG2   5.42  
 26 ASP HB2    27 VAL H     3.42  
 26 ASP HB3    27 VAL H     3.68  
 26 ASP H      27 VAL HA    5.47  
 26 ASP H      27 VAL HB    4.89  
 26 ASP H      27 VAL QG1   5.93  
 26 ASP H      27 VAL QG2   4.21  
 26 ASP H      27 VAL H     4.35  
 26 ASP HB2    28 ASP H     6.18  
 26 ASP HB3    28 ASP H     5.76  
 26 ASP HA     29 SER QB    4.15  
 26 ASP HA     29 SER HB3   4.87  
 26 ASP HA     29 SER H     3.88  
 26 ASP HB3    29 SER H     5.36  
 26 ASP HB2    29 SER H     5.84  
 26 ASP H      29 SER QB    4.95  
 26 ASP HB3    30 HIS H     5.23  
 26 ASP HB2    30 HIS H     6.34  
 26 ASP HA     30 HIS H     4.85  
 27 VAL HA     27 VAL QG2   3.73  
 27 VAL HA     27 VAL QG1   3.99  
 27 VAL H      27 VAL HB    2.90  
 27 VAL H      27 VAL QG1   3.83  
 27 VAL H      27 VAL QG2   2.89  
 27 VAL QG1    28 ASP HA    4.99  
 27 VAL HB     28 ASP H     3.13  
 27 VAL QG1    28 ASP H     3.71  
 27 VAL QG2    28 ASP H     3.89  
 27 VAL H      28 ASP HB2   5.08  
 27 VAL H      28 ASP HB3   6.19  
 27 VAL H      28 ASP H     4.56  
 27 VAL HB     29 SER H     5.05  
 27 VAL QG1    29 SER H     4.92  
 27 VAL QG2    29 SER H     5.48  
 27 VAL HA     29 SER H     4.60  
 27 VAL H      29 SER QB    5.31  
 27 VAL HA     30 HIS HB2   5.17  
 27 VAL QG1    30 HIS HB2   6.94  
 27 VAL HA     30 HIS HB3   4.60  
 27 VAL QG1    30 HIS HB3   6.21  
 27 VAL QG2    30 HIS HB3   6.30  
 27 VAL HA     30 HIS H     3.95  
 27 VAL QG1    30 HIS H     4.76  
 27 VAL QG2    30 HIS H     5.61  
 27 VAL HB     30 HIS H     6.08  
 27 VAL H      30 HIS HB3   6.27  
 27 VAL H      30 HIS HB2   6.78  
 27 VAL QG1    31 LEU HG    4.59  
 27 VAL QG1    31 LEU QD2   4.92  
 27 VAL QG1    31 LEU QD1   3.91  
 27 VAL HA     31 LEU QD1   6.57  
 27 VAL QG1    31 LEU HB2   6.23  
 27 VAL HA     31 LEU H     4.54  
 27 VAL QG1    31 LEU H     4.00  
 27 VAL QG2    31 LEU H     5.85  
 27 VAL H      31 LEU HG    6.96  
 27 VAL QG1    32 ALA H     6.24  
 28 ASP H      28 ASP HB2   3.20  
 28 ASP H      28 ASP HB3   3.48  
 28 ASP HB2    29 SER H     3.58  
 28 ASP HB3    29 SER H     3.62  
 28 ASP H      29 SER HB3   5.60  
 28 ASP H      29 SER HA    5.33  
 28 ASP H      29 SER H     4.44  
 28 ASP HB2    30 HIS H     6.20  
 28 ASP HB3    30 HIS H     5.76  
 28 ASP HA     30 HIS H     5.23  
 28 ASP HA     31 LEU HB2   4.30  
 28 ASP HA     31 LEU HB3   4.87  
 28 ASP HA     31 LEU HG    5.38  
 28 ASP HA     31 LEU QD1   4.23  
 28 ASP HA     31 LEU H     3.70  
 28 ASP HB3    31 LEU H     5.55  
 28 ASP H      31 LEU HB2   5.40  
 28 ASP H      31 LEU QD1   4.92  
 28 ASP HB2    31 LEU H     5.97  
 28 ASP HA     32 ALA H     4.44  
 28 ASP HB3    32 ALA H     5.74  
 28 ASP HB2    32 ALA H     6.43  
 29 SER H      29 SER HB3   3.13  
 29 SER H      29 SER HB2   3.06  
 29 SER HB3    30 HIS H     3.34  
 29 SER HB2    30 HIS H     3.46  
 29 SER H      30 HIS HB3   5.08  
 29 SER H      30 HIS HB2   5.55  
 29 SER H      30 HIS HA    5.49  
 29 SER H      30 HIS H     4.37  
 29 SER QB     31 LEU H     4.77  
 29 SER HA     31 LEU H     4.75  
 29 SER H      31 LEU HB2   5.76  
 29 SER H      31 LEU HG    5.71  
 29 SER H      31 LEU QD1   5.53  
 29 SER HA     32 ALA QB    4.15  
 29 SER HB3    32 ALA QB    6.16  
 29 SER HA     32 ALA H     4.03  
 29 SER HB3    32 ALA H     5.73  
 29 SER H      32 ALA QB    5.20  
 29 SER HB3    33 GLN H     6.06  
 30 HIS HA     30 HIS HE1   5.59  
 30 HIS H      30 HIS HB3   3.18  
 30 HIS H      30 HIS HB2   3.15  
 30 HIS H      30 HIS HD2   5.20  
 30 HIS HB3    31 LEU HA    6.77  
 30 HIS HB3    31 LEU QD2   6.47  
 30 HIS HB3    31 LEU QD1   7.00  
 30 HIS HD2    31 LEU HA    3.73  
 30 HIS HD2    31 LEU HG    4.86  
 30 HIS HD2    31 LEU QD2   3.81  
 30 HIS HD2    31 LEU QD1   5.72  
 30 HIS HB3    31 LEU H     3.23  
 30 HIS HB2    31 LEU H     3.99  
 30 HIS H      31 LEU HA    5.47  
 30 HIS H      31 LEU HB2   4.76  
 30 HIS H      31 LEU HB3   6.34  
 30 HIS H      31 LEU HG    4.69  
 30 HIS H      31 LEU QD2   5.83  
 30 HIS H      31 LEU QD1   6.57  
 30 HIS H      31 LEU H     4.20  
 30 HIS HB2    32 ALA H     5.66  
 30 HIS HB3    32 ALA H     5.05  
 30 HIS H      32 ALA QB    5.18  
 30 HIS HA     32 ALA H     4.69  
 30 HIS HA     33 GLN QB    4.41  
 30 HIS HA     33 GLN QG    5.74  
 30 HIS HA     33 GLN H     3.96  
 30 HIS H      33 GLN QB    5.81  
 30 HIS HB3    33 GLN H     5.65  
 30 HIS HB2    33 GLN H     5.89  
 30 HIS HA     33 GLN QG    5.74  
 30 HIS HE1    34 CYS HB2   5.10  
 30 HIS HD2    34 CYS HB3   4.87  
 30 HIS HD2    34 CYS HB2   4.27  
 30 HIS HE1    34 CYS HA    6.18  
 30 HIS HA     34 CYS H     4.59  
 31 LEU HA     31 LEU QD1   5.38  
 31 LEU HA     31 LEU QD2   3.84  
 31 LEU H      31 LEU HB2   3.06  
 31 LEU H      31 LEU HB3   3.66  
 31 LEU H      31 LEU HG    2.94  
 31 LEU H      31 LEU QD2   3.67  
 31 LEU H      31 LEU QD1   3.85  
 31 LEU HB2    32 ALA HA    6.36  
 31 LEU HB2    32 ALA H     3.37  
 31 LEU HB3    32 ALA H     3.91  
 31 LEU QD2    32 ALA H     4.99  
 31 LEU QD1    32 ALA H     4.99  
 31 LEU HG     32 ALA H     4.88  
 31 LEU H      32 ALA QB    4.62  
 31 LEU H      32 ALA HA    5.42  
 31 LEU H      32 ALA H     4.34  
 31 LEU HB2    33 GLN H     5.40  
 31 LEU HB3    33 GLN H     6.47  
 31 LEU HA     33 GLN H     5.07  
 31 LEU H      33 GLN QB    6.03  
 31 LEU HA     34 CYS HB2   4.52  
 31 LEU QD2    34 CYS HB2   5.95  
 31 LEU HA     34 CYS HB3   4.56  
 31 LEU QD2    34 CYS HB3   5.69  
 31 LEU H      34 CYS HB3   5.99  
 31 LEU H      34 CYS HB2   5.20  
 31 LEU HA     34 CYS H     3.74  
 31 LEU QD2    34 CYS H     5.37  
 31 LEU HA     35 LEU H     4.18  
 31 LEU QD2    35 LEU H     5.16  
 31 LEU H      35 LEU QQD   5.77  
 31 LEU HA     36 ALA H     6.84  
 32 ALA H      32 ALA QB    2.66  
 32 ALA QB     33 GLN QB    5.93  
 32 ALA QB     33 GLN H     3.29  
 32 ALA H      33 GLN HA    5.14  
 32 ALA H      33 GLN QB    4.55  
 32 ALA H      33 GLN H     4.28  
 32 ALA H      33 GLN QG    4.73  
 32 ALA QB     33 GLN QG    5.92  
 32 ALA H      34 CYS HB2   5.22  
 32 ALA H      34 CYS HB3   5.61  
 32 ALA HA     34 CYS H     4.72  
 32 ALA QB     34 CYS H     5.06  
 32 ALA HA     35 LEU QB    4.57  
 32 ALA HA     35 LEU H     3.86  
 32 ALA H      35 LEU HG    5.52  
 32 ALA H      35 LEU QQD   5.00  
 32 ALA HA     35 LEU QQD   5.08  
 32 ALA HA     36 ALA H     5.00  
 33 GLN H      33 GLN QB    2.82  
 33 GLN H      33 GLN HG3   3.92  
 33 GLN H      33 GLN HG2   3.92  
 33 GLN H      33 GLN QG    3.38  
 33 GLN H      34 CYS HB3   5.45  
 33 GLN H      34 CYS HB2   4.68  
 33 GLN H      34 CYS HA    5.27  
 33 GLN HG2    34 CYS H     5.09  
 33 GLN HG3    34 CYS H     5.09  
 33 GLN QB     34 CYS H     3.19  
 33 GLN H      34 CYS H     4.03  
 33 GLN QG     34 CYS H     4.47  
 33 GLN QG     35 LEU H     7.00  
 33 GLN QB     35 LEU H     5.46  
 33 GLN H      35 LEU QB    6.84  
 33 GLN QB     36 ALA QB    6.20  
 33 GLN QG     36 ALA QB    6.69  
 33 GLN HA     36 ALA HA    6.41  
 33 GLN HA     36 ALA QB    4.03  
 33 GLN HA     36 ALA H     3.68  
 33 GLN QB     36 ALA H     5.18  
 33 GLN QG     36 ALA H     5.40  
 34 CYS H      34 CYS HB3   3.22  
 34 CYS H      34 CYS HB2   2.88  
 34 CYS HB3    35 LEU H     3.41  
 34 CYS HB2    35 LEU H     3.70  
 34 CYS H      35 LEU QB    4.78  
 34 CYS H      35 LEU HG    5.45  
 34 CYS H      35 LEU QQD   5.29  
 34 CYS HA     36 ALA H     4.50  
 34 CYS HB3    36 ALA H     5.27  
 34 CYS HB2    36 ALA H     5.81  
 34 CYS H      36 ALA QB    5.45  
 34 CYS HA     37 GLU H     4.02  
 34 CYS HB3    37 GLU H     5.80  
 34 CYS HB2    37 GLU H     5.95  
 34 CYS HA     37 GLU QB    4.79  
 35 LEU QB     35 LEU QD1   3.95  
 35 LEU QB     35 LEU QD2   3.95  
 35 LEU H      35 LEU QB    2.70  
 35 LEU H      35 LEU HG    3.30  
 35 LEU H      35 LEU QD1   4.38  
 35 LEU H      35 LEU QD2   4.38  
 35 LEU H      35 LEU QQD   3.84  
 35 LEU HA     35 LEU QQD   3.88  
 35 LEU QB     36 ALA HA    5.69  
 35 LEU HA     36 ALA HA    7.00  
 35 LEU QB     36 ALA QB    7.00  
 35 LEU QB     36 ALA H     3.70  
 35 LEU HG     36 ALA H     4.73  
 35 LEU QD1    36 ALA H     5.26  
 35 LEU QD2    36 ALA H     5.26  
 35 LEU H      36 ALA HA    5.47  
 35 LEU H      36 ALA QB    4.32  
 35 LEU H      36 ALA H     4.50  
 35 LEU QQD    36 ALA H     4.44  
 35 LEU QB     37 GLU H     5.36  
 35 LEU QD1    37 GLU H     7.00  
 35 LEU QD2    37 GLU H     7.00  
 35 LEU QQD    37 GLU H     5.88  
 35 LEU HA     38 SER QB    5.16  
 35 LEU QB     38 SER H     5.45  
 35 LEU QQD    38 SER H     5.28  
 36 ALA H      36 ALA QB    2.67  
 36 ALA HA     37 GLU HA    7.00  
 36 ALA QB     37 GLU H     3.23  
 36 ALA H      37 GLU H     5.14  
 36 ALA H      37 GLU QB    5.09  
 36 ALA H      37 GLU QG    5.60  
 36 ALA HA     38 SER H     4.54  
 36 ALA QB     38 SER H     4.56  
 36 ALA HA     39 THR H     7.00  
 37 GLU H      37 GLU HG3   4.04  
 37 GLU H      37 GLU HG2   4.04  
 37 GLU H      37 GLU QB    3.06  
 37 GLU H      37 GLU QB    3.06  
 37 GLU H      37 GLU QG    3.44  
 37 GLU H      38 SER HA    5.30  
 37 GLU HG3    38 SER H     5.12  
 37 GLU HG2    38 SER H     5.12  
 37 GLU HB3    38 SER H     4.39  
 37 GLU HB2    38 SER H     4.39  
 37 GLU H      38 SER QB    4.97  
 37 GLU QB     38 SER H     3.77  
 38 SER H      38 SER QB    3.02  
 38 SER HA     39 THR H     3.39  
 38 SER QB     39 THR H     4.15  
 38 SER H      39 THR HA    5.38  
 38 SER H      39 THR HB    6.45  
 38 SER H      39 THR QG2   6.05  
 38 SER HA     40 GLU H     5.35  
 38 SER QB     40 GLU H     4.99  
 39 THR HA     39 THR QG2   4.00  
 39 THR H      39 THR HB    4.14  
 39 THR H      39 THR QG2   4.11  
 39 THR HB     40 GLU H     4.49  
 39 THR HA     40 GLU H     3.53  
 39 THR QG2    40 GLU H     4.24  
 39 THR H      40 GLU H     5.58  
 39 THR HA     41 ASP H     5.01  
 39 THR HB     41 ASP H     5.12  
 39 THR QG2    41 ASP H     5.41  
 40 GLU H      40 GLU QG    3.89  
 40 GLU H      40 GLU HB2   4.10  
 40 GLU H      40 GLU HB3   4.10  
 40 GLU H      40 GLU QB    3.23  
 40 GLU HA     41 ASP H     3.13  
 40 GLU QG     41 ASP H     4.72  
 40 GLU HB3    41 ASP H     4.67  
 40 GLU HB2    41 ASP H     4.67  
 40 GLU H      41 ASP HA    5.37  
 40 GLU HA     42 VAL H     4.98  
 40 GLU QG     42 VAL H     5.52  
 40 GLU QB     42 VAL H     5.53  
 41 ASP H      41 ASP HB3   4.01  
 41 ASP H      41 ASP HB2   4.01  
 41 ASP H      41 ASP QB    3.33  
 41 ASP HA     42 VAL H     3.14  
 41 ASP HB3    42 VAL H     4.78  
 41 ASP HB2    42 VAL H     4.78  
 41 ASP H      42 VAL QQG   5.57  
 41 ASP HA     43 THR H     5.78  
 41 ASP QB     43 THR H     5.83  
 42 VAL H      42 VAL HB    3.29  
 42 VAL H      42 VAL QG2   4.23  
 42 VAL H      42 VAL QG1   4.23  
 42 VAL H      42 VAL QQG   3.34  
 42 VAL HA     43 THR H     2.80  
 42 VAL HB     43 THR H     4.43  
 42 VAL QG2    43 THR H     4.75  
 42 VAL QG1    43 THR H     4.75  
 42 VAL H      43 THR HA    5.50  
 42 VAL H      43 THR QG2   5.49  
 42 VAL QQG    43 THR H     3.95  
 42 VAL HA     44 TRP H     5.37  
 42 VAL HB     44 TRP H     5.59  
 42 VAL QQG    44 TRP H     4.52  
 43 THR H      43 THR HB    3.82  
 43 THR H      43 THR QG2   4.04  
 43 THR HB     44 TRP H     4.20  
 43 THR HA     44 TRP H     3.51  
 43 THR QG2    44 TRP H     4.64  
 44 TRP HA     44 TRP HE3   5.51  
 44 TRP H      44 TRP HD1   4.87  
 44 TRP H      44 TRP HE3   5.57  
 44 TRP H      44 TRP QB    3.61  

# Hydrogen Bonds
11 CYS O 16 LYS H 2.50
11 CYS O 16 LYS N 3.50
16 LYS O 11 CYS H 2.50
16 LYS O 11 CYS N 3.50
19 ALA O 22 LEU H 2.50
19 ALA O 22 LEU N 3.50
23 THR O 27 VAL H 2.50
23 THR O 27 VAL N 3.50
24 GLN O 28 ASP H 2.50
24 GLN O 28 ASP N 3.50
25 LEU O 29 SER H 2.50
25 LEU O 29 SER N 3.50
26 ASP O 30 HIS H 2.50
26 ASP O 30 HIS N 3.50
27 VAL O 31 LEU H 2.50
27 VAL O 31 LEU N 3.50
28 ASP O 32 ALA H 2.50
28 ASP O 32 ALA N 3.50
29 SER O 33 GLN H 2.50
29 SER O 33 GLN N 3.50
30 HIS O 34 CYS H 2.50
30 HIS O 34 CYS N 3.50
31 LEU O 35 LEU H 2.50
31 LEU O 35 LEU N 3.50
32 ALA O 36 ALA H 2.50
32 ALA O 36 ALA N 3.50
33 GLN O 37 GLU H 2.50
33 GLN O 37 GLU N 3.50

# Dihedral Angle Constraints
  10 SER   PHI    -152.4   -84.7
  10 SER   PSI      95.2   175.5
  11 CYS   PHI    -158.6   -55.5
  11 CYS   PSI      71.3   175.9
  13 MET   PHI    -121.6   -55.5
  13 MET   PSI     -41.6    -0.5
  18 PHE   PHI    -143.1   -41.8
  18 PHE   PSI      73.6   176.3
  19 ALA   PHI    -132.5   -30.3
  19 ALA   PSI      93.2   187.5
  21 ARG   PHI     -98.8   -64.7
  21 ARG   PSI     -29.1     6.6
  22 LEU   PHI     -91.8   -49.2
  22 LEU   PSI      81.4   201.2
  23 THR   PHI    -139.5   -50.1
  23 THR   PSI     147.4   178.5
  24 GLN   PHI     -69.3   -48.7
  24 GLN   PSI     -49.6   -29.6
  25 LEU   PHI     -75.6   -52.7
  25 LEU   PSI     -51.8   -25.5
  26 ASP   PHI     -75.2   -55.2
  26 ASP   PSI     -51.9   -31.2
  27 VAL   PHI     -75.3   -55.3
  27 VAL   PSI     -53.5   -32.3
  28 ASP   PHI     -70.8   -50.8
  28 ASP   PSI     -54.8   -34.8
  29 SER   PHI     -74.7   -54.7
  29 SER   PSI     -52.3   -32.3
  30 HIS   PHI     -76.3   -54.2
  30 HIS   PSI     -52.5   -32.5
  31 LEU   PHI     -69.2   -49.2
  31 LEU   PSI     -70.4   -17.5
  32 ALA   PHI     -94.5   -37.9
  32 ALA   PSI     -59.7   -19.5
  33 GLN   PHI     -75.4   -55.4
  33 GLN   PSI     -49.3   -29.3
  34 CYS   PHI     -74.4   -54.4
  34 CYS   PSI     -55.0   -31.1
  35 LEU   PHI     -74.1   -54.1
  35 LEU   PSI     -48.1   -28.1
  36 ALA   PHI     -84.6   -47.0
  36 ALA   PSI     -52.9   -32.9
  37 GLU   PHI    -133.1   -54.0
  37 GLU   PSI     -43.0    34.4

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER   1           H        SER   1  11.112  -2.271 -17.664
    2    HA   SER   1           HA       SER   1   8.958  -3.095 -18.904
    3    HB2  SER   1           HB2      SER   1   9.935  -3.801 -16.176
    4    HB3  SER   1           HB3      SER   1   8.384  -4.462 -16.692
    5    HG   SER   1           HG       SER   1  10.905  -5.137 -17.470
    6    H    HIS   2           H        HIS   2   6.753  -3.009 -18.862
    7    HA   HIS   2           HA       HIS   2   5.553  -0.744 -17.620
    8    HB2  HIS   2           HB2      HIS   2   4.933  -2.021 -19.837
    9    HB3  HIS   2           HB3      HIS   2   3.921  -2.979 -18.760
   10    HD1  HIS   2           HD1      HIS   2   3.842  -0.014 -20.771
   11    HD2  HIS   2           HD2      HIS   2   2.090  -1.201 -17.196
   12    HE1  HIS   2           HE1      HIS   2   1.892   1.538 -20.430
   13    H    MET   3           H        MET   3   4.818  -4.223 -17.282
   14    HA   MET   3           HA       MET   3   3.504  -3.696 -14.742
   15    HB2  MET   3           HB2      MET   3   3.752  -6.122 -16.504
   16    HB3  MET   3           HB3      MET   3   3.121  -6.242 -14.867
   17    HG2  MET   3           HG2      MET   3   1.248  -4.938 -15.368
   18    HG3  MET   3           HG3      MET   3   1.970  -4.317 -16.850
   19    HE1  MET   3           HE1      MET   3   0.300  -8.535 -16.189
   20    HE2  MET   3           HE2      MET   3   2.043  -8.336 -16.004
   21    HE3  MET   3           HE3      MET   3   0.937  -7.430 -14.969
   22    H    GLY   4           H        GLY   4   5.944  -3.003 -14.223
   23    HA2  GLY   4           HA2      GLY   4   7.109  -5.316 -12.802
   24    HA3  GLY   4           HA3      GLY   4   8.122  -4.161 -13.656
   25    H    ALA   5           H        ALA   5   8.018  -1.894 -12.910
   26    HA   ALA   5           HA       ALA   5   7.725  -1.820  -9.985
   27    HB1  ALA   5           HB1      ALA   5   9.628  -0.588 -11.880
   28    HB2  ALA   5           HB2      ALA   5   9.159   0.382 -10.484
   29    HB3  ALA   5           HB3      ALA   5   9.887  -1.207 -10.250
   30    H    ALA   6           H        ALA   6   5.844  -0.967  -9.381
   31    HA   ALA   6           HA       ALA   6   5.065   1.623 -10.491
   32    HB1  ALA   6           HB1      ALA   6   3.607  -0.878 -10.881
   33    HB2  ALA   6           HB2      ALA   6   2.620   0.427 -10.224
   34    HB3  ALA   6           HB3      ALA   6   3.483   0.655 -11.744
   35    H    ALA   7           H        ALA   7   3.200   2.567  -9.187
   36    HA   ALA   7           HA       ALA   7   3.345   1.719  -6.373
   37    HB1  ALA   7           HB1      ALA   7   3.426   4.077  -5.684
   38    HB2  ALA   7           HB2      ALA   7   4.841   3.609  -6.628
   39    HB3  ALA   7           HB3      ALA   7   3.555   4.555  -7.377
   40    H    LEU   8           H        LEU   8   1.423   1.531  -5.410
   41    HA   LEU   8           HA       LEU   8  -0.913   2.735  -6.743
   42    HB2  LEU   8           HB2      LEU   8  -2.140   0.842  -5.474
   43    HB3  LEU   8           HB3      LEU   8  -1.274   0.475  -6.964
   44    HG   LEU   8           HG       LEU   8   0.637  -0.323  -5.550
   45   HD11  LEU   8          HD11      LEU   8  -1.146   0.643  -3.459
   46   HD12  LEU   8          HD12      LEU   8   0.583   0.302  -3.409
   47   HD13  LEU   8          HD13      LEU   8  -0.579  -1.006  -3.187
   48   HD21  LEU   8          HD21      LEU   8  -2.034  -1.589  -5.737
   49   HD22  LEU   8          HD22      LEU   8  -0.855  -2.347  -4.667
   50   HD23  LEU   8          HD23      LEU   8  -0.478  -2.119  -6.374
   51    H    ARG   9           H        ARG   9  -2.696   3.364  -5.357
   52    HA   ARG   9           HA       ARG   9  -1.737   4.317  -2.745
   53    HB2  ARG   9           HB2      ARG   9  -2.752   5.804  -4.738
   54    HB3  ARG   9           HB3      ARG   9  -4.247   5.389  -3.911
   55    HG2  ARG   9           HG2      ARG   9  -2.021   6.374  -2.233
   56    HG3  ARG   9           HG3      ARG   9  -2.801   7.540  -3.304
   57    HD2  ARG   9           HD2      ARG   9  -4.981   6.396  -2.277
   58    HD3  ARG   9           HD3      ARG   9  -3.869   6.111  -0.938
   59    HE   ARG   9           HE       ARG   9  -3.513   8.734  -1.472
   60   HH11  ARG   9          HH11      ARG   9  -6.341   6.785  -0.897
   61   HH12  ARG   9          HH12      ARG   9  -7.249   8.081  -0.190
   62   HH21  ARG   9          HH21      ARG   9  -4.699  10.447  -0.545
   63   HH22  ARG   9          HH22      ARG   9  -6.315  10.163   0.008
   64    H    SER  10           H        SER  10  -3.305   1.765  -3.851
   65    HA   SER  10           HA       SER  10  -4.838   1.445  -1.404
   66    HB2  SER  10           HB2      SER  10  -6.728   0.475  -3.029
   67    HB3  SER  10           HB3      SER  10  -6.709   2.161  -2.516
   68    HG   SER  10           HG       SER  10  -6.427   2.702  -4.516
   69    H    CYS  11           H        CYS  11  -5.885  -0.846  -1.436
   70    HA   CYS  11           HA       CYS  11  -3.843  -2.698  -2.466
   71    HB2  CYS  11           HB2      CYS  11  -4.386  -2.438   0.077
   72    HB3  CYS  11           HB3      CYS  11  -5.798  -3.418  -0.307
   73    HA   PRO  12           HA       PRO  12  -7.433  -3.727  -5.091
   74    HB2  PRO  12           HB2      PRO  12  -5.922  -4.689  -7.131
   75    HB3  PRO  12           HB3      PRO  12  -6.260  -2.968  -6.915
   76    HG2  PRO  12           HG2      PRO  12  -3.819  -4.527  -6.159
   77    HG3  PRO  12           HG3      PRO  12  -3.935  -2.927  -6.913
   78    HD2  PRO  12           HD2      PRO  12  -3.445  -3.260  -4.271
   79    HD3  PRO  12           HD3      PRO  12  -4.352  -1.872  -4.906
   80    H    MET  13           H        MET  13  -5.023  -5.511  -3.524
   81    HA   MET  13           HA       MET  13  -5.674  -8.097  -4.578
   82    HB2  MET  13           HB2      MET  13  -3.954  -7.056  -2.376
   83    HB3  MET  13           HB3      MET  13  -4.422  -8.750  -2.334
   84    HG2  MET  13           HG2      MET  13  -3.530  -8.938  -4.678
   85    HG3  MET  13           HG3      MET  13  -2.860  -7.322  -4.464
   86    HE1  MET  13           HE1      MET  13  -0.895  -6.720  -3.459
   87    HE2  MET  13           HE2      MET  13  -1.272  -7.045  -1.767
   88    HE3  MET  13           HE3      MET  13   0.208  -7.690  -2.481
   89    H    CYS  14           H        CYS  14  -6.679  -6.154  -1.834
   90    HA   CYS  14           HA       CYS  14  -8.716  -8.191  -1.222
   91    HB2  CYS  14           HB2      CYS  14  -8.532  -7.680   1.138
   92    HB3  CYS  14           HB3      CYS  14  -6.946  -8.128   0.520
   93    H    GLN  15           H        GLN  15  -8.386  -5.386  -2.641
   94    HA   GLN  15           HA       GLN  15  -9.712  -3.586  -3.053
   95    HB2  GLN  15           HB2      GLN  15 -11.650  -5.558  -1.899
   96    HB3  GLN  15           HB3      GLN  15 -12.182  -3.920  -2.255
   97    HG2  GLN  15           HG2      GLN  15 -11.350  -4.252  -4.591
   98    HG3  GLN  15           HG3      GLN  15 -11.079  -5.946  -4.182
   99   HE21  GLN  15          HE21      GLN  15 -12.987  -7.123  -3.342
  100   HE22  GLN  15          HE22      GLN  15 -14.528  -6.762  -4.036
  101    H    LYS  16           H        LYS  16  -8.095  -3.115  -1.002
  102    HA   LYS  16           HA       LYS  16  -9.789  -1.858   1.056
  103    HB2  LYS  16           HB2      LYS  16  -8.349  -3.525   2.040
  104    HB3  LYS  16           HB3      LYS  16  -6.943  -2.857   1.222
  105    HG2  LYS  16           HG2      LYS  16  -6.885  -0.976   2.605
  106    HG3  LYS  16           HG3      LYS  16  -8.537  -1.232   3.171
  107    HD2  LYS  16           HD2      LYS  16  -7.721  -3.374   4.222
  108    HD3  LYS  16           HD3      LYS  16  -6.081  -2.842   3.844
  109    HE2  LYS  16           HE2      LYS  16  -6.530  -0.762   5.139
  110    HE3  LYS  16           HE3      LYS  16  -8.086  -1.444   5.610
  111    HZ1  LYS  16           HZ1      LYS  16  -6.846  -3.333   6.589
  112    HZ2  LYS  16           HZ2      LYS  16  -6.522  -1.854   7.342
  113    HZ3  LYS  16           HZ3      LYS  16  -5.398  -2.517   6.266
  114    H    GLU  17           H        GLU  17  -9.320   0.260   1.711
  115    HA   GLU  17           HA       GLU  17  -7.747   1.791  -0.247
  116    HB2  GLU  17           HB2      GLU  17 -10.099   2.541   1.482
  117    HB3  GLU  17           HB3      GLU  17  -9.103   3.750   0.684
  118    HG2  GLU  17           HG2      GLU  17  -9.676   2.870  -1.478
  119    HG3  GLU  17           HG3      GLU  17 -10.555   1.534  -0.740
  120    H    PHE  18           H        PHE  18  -5.967   2.827   0.381
  121    HA   PHE  18           HA       PHE  18  -5.143   2.652   3.150
  122    HB2  PHE  18           HB2      PHE  18  -3.738   3.715   0.693
  123    HB3  PHE  18           HB3      PHE  18  -3.007   3.631   2.293
  124    HD1  PHE  18           HD2      PHE  18  -3.860   1.040   3.277
  125    HD2  PHE  18           HD1      PHE  18  -2.628   2.191  -0.631
  126    HE1  PHE  18           HE2      PHE  18  -3.141  -1.270   2.828
  127    HE2  PHE  18           HE1      PHE  18  -1.907  -0.118  -1.087
  128    HZ   PHE  18           HZ       PHE  18  -2.163  -1.851   0.643
  129    H    ALA  19           H        ALA  19  -5.173   4.249   4.604
  130    HA   ALA  19           HA       ALA  19  -6.608   6.623   4.151
  131    HB1  ALA  19           HB1      ALA  19  -4.994   7.054   6.400
  132    HB2  ALA  19           HB2      ALA  19  -6.662   6.481   6.366
  133    HB3  ALA  19           HB3      ALA  19  -5.332   5.323   6.371
  134    HA   PRO  20           HA       PRO  20  -3.693   9.514   2.602
  135    HB2  PRO  20           HB2      PRO  20  -4.338  11.776   3.957
  136    HB3  PRO  20           HB3      PRO  20  -5.359  11.094   2.686
  137    HG2  PRO  20           HG2      PRO  20  -5.620  10.851   5.658
  138    HG3  PRO  20           HG3      PRO  20  -6.880  11.141   4.445
  139    HD2  PRO  20           HD2      PRO  20  -6.440   8.702   5.534
  140    HD3  PRO  20           HD3      PRO  20  -7.012   8.914   3.867
  141    H    ARG  21           H        ARG  21  -3.895   9.184   6.095
  142    HA   ARG  21           HA       ARG  21  -1.522  10.621   6.702
  143    HB2  ARG  21           HB2      ARG  21  -1.687   9.512   8.911
  144    HB3  ARG  21           HB3      ARG  21  -3.198  10.257   8.409
  145    HG2  ARG  21           HG2      ARG  21  -4.221   8.211   8.008
  146    HG3  ARG  21           HG3      ARG  21  -2.681   7.354   7.905
  147    HD2  ARG  21           HD2      ARG  21  -2.332   7.577  10.267
  148    HD3  ARG  21           HD3      ARG  21  -3.740   8.627  10.423
  149    HE   ARG  21           HE       ARG  21  -4.604   6.210   9.343
  150   HH11  ARG  21          HH11      ARG  21  -3.212   7.410  12.299
  151   HH12  ARG  21          HH12      ARG  21  -3.960   6.205  13.295
  152   HH21  ARG  21          HH21      ARG  21  -5.594   4.618  10.642
  153   HH22  ARG  21          HH22      ARG  21  -5.314   4.617  12.351
  154    H    LEU  22           H        LEU  22  -2.165   7.394   5.626
  155    HA   LEU  22           HA       LEU  22   0.173   6.113   6.511
  156    HB2  LEU  22           HB2      LEU  22  -1.624   5.626   4.150
  157    HB3  LEU  22           HB3      LEU  22  -0.257   4.584   4.537
  158    HG   LEU  22           HG       LEU  22  -2.598   5.087   6.372
  159   HD11  LEU  22          HD11      LEU  22  -3.426   2.937   5.737
  160   HD12  LEU  22          HD12      LEU  22  -2.027   2.645   4.704
  161   HD13  LEU  22          HD13      LEU  22  -3.198   3.890   4.270
  162   HD21  LEU  22          HD21      LEU  22  -1.465   3.977   7.927
  163   HD22  LEU  22          HD22      LEU  22  -0.042   4.094   6.893
  164   HD23  LEU  22          HD23      LEU  22  -1.084   2.674   6.802
  165    H    THR  23           H        THR  23   2.106   5.608   5.401
  166    HA   THR  23           HA       THR  23   2.851   7.611   3.375
  167    HB   THR  23           HB       THR  23   5.252   6.820   4.162
  168    HG1  THR  23           HG1      THR  23   4.015   5.324   5.701
  169   HG21  THR  23          HG21      THR  23   4.550   9.105   4.317
  170   HG22  THR  23          HG22      THR  23   5.197   8.637   5.890
  171   HG23  THR  23          HG23      THR  23   3.454   8.734   5.647
  172    H    GLN  24           H        GLN  24   4.759   6.825   1.980
  173    HA   GLN  24           HA       GLN  24   3.922   4.790   0.317
  174    HB2  GLN  24           HB2      GLN  24   6.164   4.836  -0.655
  175    HB3  GLN  24           HB3      GLN  24   5.587   6.465  -0.333
  176    HG2  GLN  24           HG2      GLN  24   6.886   6.166   1.911
  177    HG3  GLN  24           HG3      GLN  24   7.745   4.917   1.013
  178   HE21  GLN  24          HE21      GLN  24   8.833   7.343   2.055
  179   HE22  GLN  24          HE22      GLN  24   9.423   8.259   0.713
  180    H    LEU  25           H        LEU  25   5.964   4.619   3.165
  181    HA   LEU  25           HA       LEU  25   6.813   1.931   2.777
  182    HB2  LEU  25           HB2      LEU  25   7.709   2.051   4.963
  183    HB3  LEU  25           HB3      LEU  25   7.943   3.633   4.222
  184    HG   LEU  25           HG       LEU  25   5.662   4.131   5.507
  185   HD11  LEU  25          HD11      LEU  25   6.219   2.977   7.845
  186   HD12  LEU  25          HD12      LEU  25   6.780   1.700   6.767
  187   HD13  LEU  25          HD13      LEU  25   5.114   2.267   6.668
  188   HD21  LEU  25          HD21      LEU  25   7.437   4.551   7.534
  189   HD22  LEU  25          HD22      LEU  25   7.207   5.621   6.151
  190   HD23  LEU  25          HD23      LEU  25   8.506   4.427   6.136
  191    H    ASP  26           H        ASP  26   4.097   3.442   4.418
  192    HA   ASP  26           HA       ASP  26   3.179   1.175   5.815
  193    HB2  ASP  26           HB2      ASP  26   1.809   3.679   4.846
  194    HB3  ASP  26           HB3      ASP  26   0.939   2.422   5.721
  195    H    VAL  27           H        VAL  27   2.324   2.474   2.622
  196    HA   VAL  27           HA       VAL  27   0.319   0.677   1.945
  197    HB   VAL  27           HB       VAL  27   2.363   1.932   0.106
  198   HG11  VAL  27          HG11      VAL  27   0.327   0.011  -0.411
  199   HG12  VAL  27          HG12      VAL  27  -0.140   1.541  -1.157
  200   HG13  VAL  27          HG13      VAL  27   1.412   0.803  -1.551
  201   HG21  VAL  27          HG21      VAL  27  -0.153   2.903   1.356
  202   HG22  VAL  27          HG22      VAL  27   1.340   3.771   0.996
  203   HG23  VAL  27          HG23      VAL  27   0.201   3.402  -0.298
  204    H    ASP  28           H        ASP  28   3.806   0.440   1.253
  205    HA   ASP  28           HA       ASP  28   3.704  -2.081   0.015
  206    HB2  ASP  28           HB2      ASP  28   5.819  -0.351   1.166
  207    HB3  ASP  28           HB3      ASP  28   6.210  -2.062   1.012
  208    H    SER  29           H        SER  29   3.956  -1.123   3.379
  209    HA   SER  29           HA       SER  29   4.772  -3.508   4.537
  210    HB2  SER  29           HB2      SER  29   4.195  -1.130   5.560
  211    HB3  SER  29           HB3      SER  29   2.652  -1.908   5.907
  212    HG   SER  29           HG       SER  29   3.873  -3.572   6.970
  213    H    HIS  30           H        HIS  30   1.443  -2.403   3.915
  214    HA   HIS  30           HA       HIS  30   0.272  -4.872   4.749
  215    HB2  HIS  30           HB2      HIS  30  -0.962  -2.752   4.874
  216    HB3  HIS  30           HB3      HIS  30  -0.908  -2.613   3.118
  217    HD1  HIS  30           HD1      HIS  30  -3.101  -3.636   5.711
  218    HD2  HIS  30           HD2      HIS  30  -2.241  -5.056   1.903
  219    HE1  HIS  30           HE1      HIS  30  -5.067  -5.065   5.066
  220    H    LEU  31           H        LEU  31   1.256  -3.494   1.672
  221    HA   LEU  31           HA       LEU  31  -0.009  -5.277  -0.060
  222    HB2  LEU  31           HB2      LEU  31   2.498  -3.654  -0.240
  223    HB3  LEU  31           HB3      LEU  31   2.059  -4.762  -1.538
  224    HG   LEU  31           HG       LEU  31   0.407  -2.426  -0.579
  225   HD11  LEU  31          HD11      LEU  31   1.464  -1.154  -2.061
  226   HD12  LEU  31          HD12      LEU  31   1.278  -2.367  -3.327
  227   HD13  LEU  31          HD13      LEU  31   2.653  -2.448  -2.226
  228   HD21  LEU  31          HD21      LEU  31  -0.034  -4.489  -2.724
  229   HD22  LEU  31          HD22      LEU  31  -0.877  -2.940  -2.693
  230   HD23  LEU  31          HD23      LEU  31  -1.085  -4.084  -1.365
  231    H    ALA  32           H        ALA  32   2.777  -5.676   1.968
  232    HA   ALA  32           HA       ALA  32   3.694  -8.069   0.631
  233    HB1  ALA  32           HB1      ALA  32   5.019  -6.267   2.067
  234    HB2  ALA  32           HB2      ALA  32   4.640  -7.406   3.360
  235    HB3  ALA  32           HB3      ALA  32   5.543  -7.946   1.945
  236    H    GLN  33           H        GLN  33   1.952  -7.244   3.596
  237    HA   GLN  33           HA       GLN  33   1.800  -9.930   4.547
  238    HB2  GLN  33           HB2      GLN  33   0.138  -7.511   5.274
  239    HB3  GLN  33           HB3      GLN  33   0.163  -9.031   6.158
  240    HG2  GLN  33           HG2      GLN  33   2.622  -8.661   6.513
  241    HG3  GLN  33           HG3      GLN  33   2.393  -7.041   5.854
  242   HE21  GLN  33          HE21      GLN  33   2.690  -5.785   7.584
  243   HE22  GLN  33          HE22      GLN  33   1.784  -5.887   9.051
  244    H    CYS  34           H        CYS  34  -0.173  -7.930   2.363
  245    HA   CYS  34           HA       CYS  34  -2.483  -9.516   2.556
  246    HB2  CYS  34           HB2      CYS  34  -2.055  -7.106   1.523
  247    HB3  CYS  34           HB3      CYS  34  -1.829  -8.016   0.043
  248    H    LEU  35           H        LEU  35   0.154  -9.303   0.169
  249    HA   LEU  35           HA       LEU  35  -0.631 -11.527  -1.381
  250    HB2  LEU  35           HB2      LEU  35   1.272 -11.174  -2.609
  251    HB3  LEU  35           HB3      LEU  35   1.021  -9.585  -1.891
  252    HG   LEU  35           HG       LEU  35   2.671 -10.580  -0.059
  253   HD11  LEU  35          HD11      LEU  35   3.107 -12.226  -2.512
  254   HD12  LEU  35          HD12      LEU  35   3.124 -12.710  -0.817
  255   HD13  LEU  35          HD13      LEU  35   4.473 -11.792  -1.484
  256   HD21  LEU  35          HD21      LEU  35   4.256  -9.177  -0.927
  257   HD22  LEU  35          HD22      LEU  35   2.827  -8.602  -1.787
  258   HD23  LEU  35          HD23      LEU  35   3.961  -9.690  -2.589
  259    H    ALA  36           H        ALA  36   1.227 -11.216   1.540
  260    HA   ALA  36           HA       ALA  36   2.519 -13.742   1.449
  261    HB1  ALA  36           HB1      ALA  36   2.930 -13.384   3.845
  262    HB2  ALA  36           HB2      ALA  36   3.335 -11.963   2.883
  263    HB3  ALA  36           HB3      ALA  36   1.838 -11.999   3.814
  264    H    GLU  37           H        GLU  37  -0.620 -12.660   2.567
  265    HA   GLU  37           HA       GLU  37  -1.261 -15.069   3.969
  266    HB2  GLU  37           HB2      GLU  37  -2.755 -12.622   3.133
  267    HB3  GLU  37           HB3      GLU  37  -3.674 -14.048   3.596
  268    HG2  GLU  37           HG2      GLU  37  -2.484 -14.075   5.755
  269    HG3  GLU  37           HG3      GLU  37  -1.660 -12.588   5.289
  270    H    SER  38           H        SER  38  -1.758 -13.861   0.710
  271    HA   SER  38           HA       SER  38  -2.558 -14.826  -1.190
  272    HB2  SER  38           HB2      SER  38  -1.745 -16.946  -1.674
  273    HB3  SER  38           HB3      SER  38  -0.685 -16.468  -0.348
  274    HG   SER  38           HG       SER  38  -1.931 -18.634  -0.372
  275    H    THR  39           H        THR  39  -4.398 -14.377   1.039
  276    HA   THR  39           HA       THR  39  -6.337 -16.549   0.692
  277    HB   THR  39           HB       THR  39  -6.454 -14.212   2.607
  278    HG1  THR  39           HG1      THR  39  -4.721 -15.714   3.030
  279   HG21  THR  39          HG21      THR  39  -8.071 -15.873   3.757
  280   HG22  THR  39          HG22      THR  39  -8.163 -16.637   2.170
  281   HG23  THR  39          HG23      THR  39  -8.650 -14.954   2.369
  282    H    GLU  40           H        GLU  40  -6.679 -15.786  -1.554
  283    HA   GLU  40           HA       GLU  40  -8.374 -13.389  -1.699
  284    HB2  GLU  40           HB2      GLU  40  -7.962 -13.446  -4.118
  285    HB3  GLU  40           HB3      GLU  40  -6.459 -13.371  -3.210
  286    HG2  GLU  40           HG2      GLU  40  -7.516 -16.024  -4.052
  287    HG3  GLU  40           HG3      GLU  40  -6.719 -14.991  -5.239
  288    H    ASP  41           H        ASP  41  -9.265 -15.982  -0.683
  289    HA   ASP  41           HA       ASP  41 -11.431 -16.457  -2.617
  290    HB2  ASP  41           HB2      ASP  41 -11.404 -18.869  -1.797
  291    HB3  ASP  41           HB3      ASP  41 -10.074 -18.387  -2.847
  292    H    VAL  42           H        VAL  42 -11.515 -14.669  -0.448
  293    HA   VAL  42           HA       VAL  42 -12.647 -15.792   1.885
  294    HB   VAL  42           HB       VAL  42 -13.126 -13.011   0.812
  295   HG11  VAL  42          HG11      VAL  42 -13.064 -13.939   3.673
  296   HG12  VAL  42          HG12      VAL  42 -13.634 -12.394   3.039
  297   HG13  VAL  42          HG13      VAL  42 -14.544 -13.870   2.718
  298   HG21  VAL  42          HG21      VAL  42 -10.781 -14.220   2.215
  299   HG22  VAL  42          HG22      VAL  42 -10.817 -13.086   0.865
  300   HG23  VAL  42          HG23      VAL  42 -11.195 -12.529   2.495
  301    H    THR  43           H        THR  43 -14.438 -16.985   1.858
  302    HA   THR  43           HA       THR  43 -16.724 -16.036   0.256
  303    HB   THR  43           HB       THR  43 -17.515 -18.369   0.179
  304    HG1  THR  43           HG1      THR  43 -16.662 -19.543   1.746
  305   HG21  THR  43          HG21      THR  43 -14.694 -17.977  -0.824
  306   HG22  THR  43          HG22      THR  43 -16.178 -17.549  -1.676
  307   HG23  THR  43          HG23      THR  43 -15.796 -19.242  -1.364
  308    H    TRP  44           H        TRP  44 -17.206 -14.691   2.159
  309    HA   TRP  44           HA       TRP  44 -18.714 -16.237   4.159
  310    HB2  TRP  44           HB2      TRP  44 -16.609 -15.357   5.139
  311    HB3  TRP  44           HB3      TRP  44 -17.122 -13.725   4.719
  312    HD1  TRP  44           HD1      TRP  44 -19.308 -12.765   6.065
  313    HE1  TRP  44           HE1      TRP  44 -20.152 -13.295   8.437
  314    HE3  TRP  44           HE3      TRP  44 -16.785 -17.139   6.866
  315    HZ2  TRP  44           HZ2      TRP  44 -19.795 -15.301  10.392
  316    HZ3  TRP  44           HZ3      TRP  44 -17.091 -18.300   9.013
  317    HH2  TRP  44           HH2      TRP  44 -18.565 -17.399  10.738
  Start of MODEL    2
    1    H1   SER   1           H        SER   1  -0.085   5.630 -17.029
    2    HA   SER   1           HA       SER   1  -1.938   3.477 -17.788
    3    HB2  SER   1           HB2      SER   1  -0.048   2.531 -19.058
    4    HB3  SER   1           HB3      SER   1  -0.402   4.182 -19.566
    5    HG   SER   1           HG       SER   1   1.796   4.023 -19.297
    6    H    HIS   2           H        HIS   2  -2.278   2.090 -16.183
    7    HA   HIS   2           HA       HIS   2  -0.619   1.745 -13.945
    8    HB2  HIS   2           HB2      HIS   2  -2.052  -0.096 -13.349
    9    HB3  HIS   2           HB3      HIS   2  -3.052   1.173 -14.052
   10    HD1  HIS   2           HD1      HIS   2  -3.721   0.753 -16.648
   11    HD2  HIS   2           HD2      HIS   2  -2.341  -2.535 -14.516
   12    HE1  HIS   2           HE1      HIS   2  -4.446  -1.259 -17.972
   13    H    MET   3           H        MET   3  -0.625   0.248 -17.083
   14    HA   MET   3           HA       MET   3   0.788  -2.094 -16.552
   15    HB2  MET   3           HB2      MET   3   0.608  -0.320 -18.971
   16    HB3  MET   3           HB3      MET   3   1.645  -1.741 -18.970
   17    HG2  MET   3           HG2      MET   3  -0.123  -3.204 -18.889
   18    HG3  MET   3           HG3      MET   3  -1.207  -2.019 -18.161
   19    HE1  MET   3           HE1      MET   3  -3.465  -1.807 -20.208
   20    HE2  MET   3           HE2      MET   3  -2.949  -3.042 -21.355
   21    HE3  MET   3           HE3      MET   3  -2.713  -3.291 -19.625
   22    H    GLY   4           H        GLY   4   2.830  -2.518 -15.989
   23    HA2  GLY   4           HA2      GLY   4   5.201  -2.128 -16.244
   24    HA3  GLY   4           HA3      GLY   4   4.855  -0.410 -16.378
   25    H    ALA   5           H        ALA   5   6.631  -0.401 -14.725
   26    HA   ALA   5           HA       ALA   5   5.921  -1.260 -12.059
   27    HB1  ALA   5           HB1      ALA   5   8.292   0.244 -13.150
   28    HB2  ALA   5           HB2      ALA   5   8.089  -0.159 -11.444
   29    HB3  ALA   5           HB3      ALA   5   8.220  -1.444 -12.644
   30    H    ALA   6           H        ALA   6   3.927   0.047 -12.005
   31    HA   ALA   6           HA       ALA   6   4.400   2.905 -11.525
   32    HB1  ALA   6           HB1      ALA   6   2.439   3.279 -12.498
   33    HB2  ALA   6           HB2      ALA   6   2.388   1.564 -12.913
   34    HB3  ALA   6           HB3      ALA   6   1.626   2.135 -11.429
   35    H    ALA   7           H        ALA   7   2.537   3.693  -9.854
   36    HA   ALA   7           HA       ALA   7   2.967   2.086  -7.420
   37    HB1  ALA   7           HB1      ALA   7   4.011   4.461  -7.695
   38    HB2  ALA   7           HB2      ALA   7   2.382   5.010  -7.302
   39    HB3  ALA   7           HB3      ALA   7   3.268   3.992  -6.167
   40    H    LEU   8           H        LEU   8   1.270   1.957  -5.897
   41    HA   LEU   8           HA       LEU   8  -1.383   2.693  -6.945
   42    HB2  LEU   8           HB2      LEU   8  -2.132   0.614  -5.601
   43    HB3  LEU   8           HB3      LEU   8  -1.417   0.406  -7.199
   44    HG   LEU   8           HG       LEU   8   0.366   0.227  -4.821
   45   HD11  LEU   8          HD11      LEU   8  -1.224  -1.206  -3.961
   46   HD12  LEU   8          HD12      LEU   8  -0.223  -2.302  -4.912
   47   HD13  LEU   8          HD13      LEU   8  -1.764  -1.735  -5.554
   48   HD21  LEU   8          HD21      LEU   8   0.676  -1.804  -6.803
   49   HD22  LEU   8          HD22      LEU   8   1.780  -0.501  -6.366
   50   HD23  LEU   8          HD23      LEU   8   0.545  -0.236  -7.597
   51    H    ARG   9           H        ARG   9  -2.821   3.576  -5.532
   52    HA   ARG   9           HA       ARG   9  -1.774   4.234  -2.873
   53    HB2  ARG   9           HB2      ARG   9  -2.687   5.947  -4.663
   54    HB3  ARG   9           HB3      ARG   9  -4.246   5.484  -3.993
   55    HG2  ARG   9           HG2      ARG   9  -3.577   7.415  -2.829
   56    HG3  ARG   9           HG3      ARG   9  -3.307   6.065  -1.725
   57    HD2  ARG   9           HD2      ARG   9  -1.345   7.246  -1.490
   58    HD3  ARG   9           HD3      ARG   9  -0.906   6.084  -2.742
   59    HE   ARG   9           HE       ARG   9  -1.913   8.561  -3.786
   60   HH11  ARG   9          HH11      ARG   9   0.909   6.896  -2.611
   61   HH12  ARG   9          HH12      ARG   9   2.024   7.901  -3.477
   62   HH21  ARG   9          HH21      ARG   9  -0.456   9.892  -4.931
   63   HH22  ARG   9          HH22      ARG   9   1.247   9.606  -4.795
   64    H    SER  10           H        SER  10  -3.280   1.731  -3.901
   65    HA   SER  10           HA       SER  10  -4.903   1.438  -1.518
   66    HB2  SER  10           HB2      SER  10  -6.756   0.437  -3.129
   67    HB3  SER  10           HB3      SER  10  -6.722   2.156  -2.742
   68    HG   SER  10           HG       SER  10  -6.357   2.555  -4.764
   69    H    CYS  11           H        CYS  11  -5.874  -0.859  -1.482
   70    HA   CYS  11           HA       CYS  11  -3.811  -2.704  -2.479
   71    HB2  CYS  11           HB2      CYS  11  -4.277  -2.405   0.050
   72    HB3  CYS  11           HB3      CYS  11  -5.737  -3.339  -0.259
   73    HA   PRO  12           HA       PRO  12  -7.418  -3.858  -5.033
   74    HB2  PRO  12           HB2      PRO  12  -5.915  -4.828  -7.076
   75    HB3  PRO  12           HB3      PRO  12  -6.290  -3.111  -6.890
   76    HG2  PRO  12           HG2      PRO  12  -3.803  -4.599  -6.140
   77    HG3  PRO  12           HG3      PRO  12  -3.967  -3.017  -6.925
   78    HD2  PRO  12           HD2      PRO  12  -3.429  -3.285  -4.285
   79    HD3  PRO  12           HD3      PRO  12  -4.377  -1.931  -4.934
   80    H    MET  13           H        MET  13  -4.950  -5.553  -3.460
   81    HA   MET  13           HA       MET  13  -5.524  -8.175  -4.456
   82    HB2  MET  13           HB2      MET  13  -3.844  -7.021  -2.290
   83    HB3  MET  13           HB3      MET  13  -4.302  -8.712  -2.143
   84    HG2  MET  13           HG2      MET  13  -3.362  -9.114  -4.397
   85    HG3  MET  13           HG3      MET  13  -2.808  -7.441  -4.422
   86    HE1  MET  13           HE1      MET  13  -1.728  -6.479  -2.321
   87    HE2  MET  13           HE2      MET  13  -0.431  -7.276  -1.431
   88    HE3  MET  13           HE3      MET  13  -0.188  -6.811  -3.115
   89    H    CYS  14           H        CYS  14  -6.602  -6.225  -1.739
   90    HA   CYS  14           HA       CYS  14  -8.588  -8.311  -1.119
   91    HB2  CYS  14           HB2      CYS  14  -8.467  -7.713   1.231
   92    HB3  CYS  14           HB3      CYS  14  -6.861  -8.140   0.651
   93    H    GLN  15           H        GLN  15  -8.229  -5.407  -2.476
   94    HA   GLN  15           HA       GLN  15  -9.642  -3.700  -2.992
   95    HB2  GLN  15           HB2      GLN  15 -11.247  -5.834  -2.916
   96    HB3  GLN  15           HB3      GLN  15 -11.940  -4.942  -1.568
   97    HG2  GLN  15           HG2      GLN  15 -12.379  -3.048  -2.990
   98    HG3  GLN  15           HG3      GLN  15 -11.572  -3.838  -4.343
   99   HE21  GLN  15          HE21      GLN  15 -13.571  -3.492  -5.480
  100   HE22  GLN  15          HE22      GLN  15 -14.880  -4.599  -5.269
  101    H    LYS  16           H        LYS  16  -8.097  -3.149  -0.910
  102    HA   LYS  16           HA       LYS  16  -9.897  -1.845   1.027
  103    HB2  LYS  16           HB2      LYS  16  -8.673  -3.513   2.214
  104    HB3  LYS  16           HB3      LYS  16  -7.163  -3.050   1.439
  105    HG2  LYS  16           HG2      LYS  16  -7.038  -1.036   2.676
  106    HG3  LYS  16           HG3      LYS  16  -8.694  -1.215   3.259
  107    HD2  LYS  16           HD2      LYS  16  -8.006  -3.256   4.475
  108    HD3  LYS  16           HD3      LYS  16  -6.344  -2.977   3.950
  109    HE2  LYS  16           HE2      LYS  16  -7.696  -0.708   5.271
  110    HE3  LYS  16           HE3      LYS  16  -7.339  -2.100   6.291
  111    HZ1  LYS  16           HZ1      LYS  16  -5.591  -0.097   5.427
  112    HZ2  LYS  16           HZ2      LYS  16  -5.084  -1.551   4.727
  113    HZ3  LYS  16           HZ3      LYS  16  -5.248  -1.433   6.407
  114    H    GLU  17           H        GLU  17  -9.591   0.295   1.454
  115    HA   GLU  17           HA       GLU  17  -7.775   1.712  -0.340
  116    HB2  GLU  17           HB2      GLU  17 -10.257   2.403   1.139
  117    HB3  GLU  17           HB3      GLU  17  -9.102   3.701   0.868
  118    HG2  GLU  17           HG2      GLU  17  -9.533   2.178  -1.540
  119    HG3  GLU  17           HG3      GLU  17 -11.052   2.787  -0.887
  120    H    PHE  18           H        PHE  18  -6.077   2.924   0.319
  121    HA   PHE  18           HA       PHE  18  -5.206   2.579   3.069
  122    HB2  PHE  18           HB2      PHE  18  -3.849   3.726   0.625
  123    HB3  PHE  18           HB3      PHE  18  -3.100   3.683   2.219
  124    HD1  PHE  18           HD2      PHE  18  -3.732   1.100   3.269
  125    HD2  PHE  18           HD1      PHE  18  -2.802   2.204  -0.735
  126    HE1  PHE  18           HE2      PHE  18  -2.927  -1.184   2.829
  127    HE2  PHE  18           HE1      PHE  18  -1.997  -0.077  -1.182
  128    HZ   PHE  18           HZ       PHE  18  -2.059  -1.775   0.601
  129    H    ALA  19           H        ALA  19  -5.055   4.151   4.577
  130    HA   ALA  19           HA       ALA  19  -6.602   6.498   4.294
  131    HB1  ALA  19           HB1      ALA  19  -5.088   5.186   6.395
  132    HB2  ALA  19           HB2      ALA  19  -4.983   6.944   6.486
  133    HB3  ALA  19           HB3      ALA  19  -6.559   6.154   6.496
  134    HA   PRO  20           HA       PRO  20  -3.822   9.506   2.720
  135    HB2  PRO  20           HB2      PRO  20  -4.450  11.702   4.187
  136    HB3  PRO  20           HB3      PRO  20  -5.514  11.044   2.939
  137    HG2  PRO  20           HG2      PRO  20  -5.632  10.688   5.909
  138    HG3  PRO  20           HG3      PRO  20  -6.952  10.995   4.766
  139    HD2  PRO  20           HD2      PRO  20  -6.413   8.527   5.742
  140    HD3  PRO  20           HD3      PRO  20  -7.065   8.787   4.112
  141    H    ARG  21           H        ARG  21  -3.878   9.120   6.223
  142    HA   ARG  21           HA       ARG  21  -1.491  10.556   6.751
  143    HB2  ARG  21           HB2      ARG  21  -1.593   9.595   8.956
  144    HB3  ARG  21           HB3      ARG  21  -3.223  10.025   8.456
  145    HG2  ARG  21           HG2      ARG  21  -3.388   7.560   7.700
  146    HG3  ARG  21           HG3      ARG  21  -1.995   7.319   8.755
  147    HD2  ARG  21           HD2      ARG  21  -4.622   8.544   9.590
  148    HD3  ARG  21           HD3      ARG  21  -4.139   6.875   9.889
  149    HE   ARG  21           HE       ARG  21  -3.328   9.186  11.356
  150   HH11  ARG  21          HH11      ARG  21  -2.332   6.012  10.333
  151   HH12  ARG  21          HH12      ARG  21  -1.233   5.788  11.654
  152   HH21  ARG  21          HH21      ARG  21  -1.886   8.905  13.099
  153   HH22  ARG  21          HH22      ARG  21  -0.981   7.435  13.228
  154    H    LEU  22           H        LEU  22  -2.143   7.362   5.607
  155    HA   LEU  22           HA       LEU  22   0.266   6.105   6.375
  156    HB2  LEU  22           HB2      LEU  22  -1.678   5.573   4.143
  157    HB3  LEU  22           HB3      LEU  22  -0.272   4.555   4.448
  158    HG   LEU  22           HG       LEU  22  -2.496   5.037   6.428
  159   HD11  LEU  22          HD11      LEU  22  -2.045   2.469   4.971
  160   HD12  LEU  22          HD12      LEU  22  -3.005   3.750   4.232
  161   HD13  LEU  22          HD13      LEU  22  -3.496   3.060   5.780
  162   HD21  LEU  22          HD21      LEU  22  -1.308   3.867   7.908
  163   HD22  LEU  22          HD22      LEU  22   0.079   4.163   6.858
  164   HD23  LEU  22          HD23      LEU  22  -0.839   2.663   6.708
  165    H    THR  23           H        THR  23   2.120   5.617   5.125
  166    HA   THR  23           HA       THR  23   2.637   7.542   2.952
  167    HB   THR  23           HB       THR  23   5.109   7.183   3.675
  168    HG1  THR  23           HG1      THR  23   5.359   6.621   5.835
  169   HG21  THR  23          HG21      THR  23   4.344   9.348   3.929
  170   HG22  THR  23          HG22      THR  23   4.695   8.910   5.600
  171   HG23  THR  23          HG23      THR  23   3.034   8.871   5.009
  172    H    GLN  24           H        GLN  24   4.700   6.762   1.677
  173    HA   GLN  24           HA       GLN  24   3.995   4.541   0.187
  174    HB2  GLN  24           HB2      GLN  24   5.613   6.330  -0.486
  175    HB3  GLN  24           HB3      GLN  24   6.810   5.573   0.556
  176    HG2  GLN  24           HG2      GLN  24   6.490   3.475  -0.800
  177    HG3  GLN  24           HG3      GLN  24   5.554   4.453  -1.929
  178   HE21  GLN  24          HE21      GLN  24   6.586   5.832  -3.296
  179   HE22  GLN  24          HE22      GLN  24   8.305   5.925  -3.445
  180    H    LEU  25           H        LEU  25   6.022   4.759   3.046
  181    HA   LEU  25           HA       LEU  25   7.032   2.104   2.915
  182    HB2  LEU  25           HB2      LEU  25   7.883   2.478   5.096
  183    HB3  LEU  25           HB3      LEU  25   8.047   3.988   4.203
  184    HG   LEU  25           HG       LEU  25   5.731   4.499   5.405
  185   HD11  LEU  25          HD11      LEU  25   6.877   2.213   6.860
  186   HD12  LEU  25          HD12      LEU  25   5.212   2.787   6.770
  187   HD13  LEU  25          HD13      LEU  25   6.357   3.572   7.857
  188   HD21  LEU  25          HD21      LEU  25   7.200   5.417   7.336
  189   HD22  LEU  25          HD22      LEU  25   7.441   6.029   5.699
  190   HD23  LEU  25          HD23      LEU  25   8.546   4.824   6.362
  191    H    ASP  26           H        ASP  26   4.190   3.581   4.347
  192    HA   ASP  26           HA       ASP  26   3.413   1.317   5.892
  193    HB2  ASP  26           HB2      ASP  26   1.827   3.692   4.897
  194    HB3  ASP  26           HB3      ASP  26   1.207   2.487   6.021
  195    H    VAL  27           H        VAL  27   2.415   2.575   2.724
  196    HA   VAL  27           HA       VAL  27   0.428   0.728   2.130
  197    HB   VAL  27           HB       VAL  27   2.375   2.011   0.208
  198   HG11  VAL  27          HG11      VAL  27   1.380   0.862  -1.408
  199   HG12  VAL  27          HG12      VAL  27   0.362   0.047  -0.220
  200   HG13  VAL  27          HG13      VAL  27  -0.171   1.562  -0.949
  201   HG21  VAL  27          HG21      VAL  27   1.202   3.675   1.507
  202   HG22  VAL  27          HG22      VAL  27   0.556   3.653  -0.133
  203   HG23  VAL  27          HG23      VAL  27  -0.342   2.890   1.177
  204    H    ASP  28           H        ASP  28   3.920   0.527   1.540
  205    HA   ASP  28           HA       ASP  28   3.878  -1.954   0.201
  206    HB2  ASP  28           HB2      ASP  28   5.943  -0.256   1.492
  207    HB3  ASP  28           HB3      ASP  28   6.346  -1.957   1.271
  208    H    SER  29           H        SER  29   4.005  -1.090   3.598
  209    HA   SER  29           HA       SER  29   4.778  -3.529   4.695
  210    HB2  SER  29           HB2      SER  29   4.245  -1.170   5.785
  211    HB3  SER  29           HB3      SER  29   2.677  -1.919   6.082
  212    HG   SER  29           HG       SER  29   3.670  -2.700   7.769
  213    H    HIS  30           H        HIS  30   1.480  -2.325   4.085
  214    HA   HIS  30           HA       HIS  30   0.207  -4.743   4.854
  215    HB2  HIS  30           HB2      HIS  30  -0.940  -2.554   4.845
  216    HB3  HIS  30           HB3      HIS  30  -0.840  -2.521   3.087
  217    HD1  HIS  30           HD1      HIS  30  -3.132  -3.309   5.672
  218    HD2  HIS  30           HD2      HIS  30  -2.213  -5.005   1.991
  219    HE1  HIS  30           HE1      HIS  30  -5.125  -4.717   5.063
  220    H    LEU  31           H        LEU  31   1.360  -3.462   1.788
  221    HA   LEU  31           HA       LEU  31   0.138  -5.329   0.083
  222    HB2  LEU  31           HB2      LEU  31   2.615  -3.653  -0.140
  223    HB3  LEU  31           HB3      LEU  31   2.144  -4.769  -1.421
  224    HG   LEU  31           HG       LEU  31   0.463  -2.469  -0.424
  225   HD11  LEU  31          HD11      LEU  31   1.047  -1.770  -2.910
  226   HD12  LEU  31          HD12      LEU  31   2.502  -2.704  -2.566
  227   HD13  LEU  31          HD13      LEU  31   2.078  -1.328  -1.550
  228   HD21  LEU  31          HD21      LEU  31  -0.667  -2.993  -2.694
  229   HD22  LEU  31          HD22      LEU  31  -1.047  -3.996  -1.294
  230   HD23  LEU  31          HD23      LEU  31   0.087  -4.577  -2.516
  231    H    ALA  32           H        ALA  32   2.822  -5.599   2.228
  232    HA   ALA  32           HA       ALA  32   3.947  -7.933   0.948
  233    HB1  ALA  32           HB1      ALA  32   5.348  -6.308   2.181
  234    HB2  ALA  32           HB2      ALA  32   4.548  -6.798   3.676
  235    HB3  ALA  32           HB3      ALA  32   5.520  -7.961   2.773
  236    H    GLN  33           H        GLN  33   2.017  -7.233   3.837
  237    HA   GLN  33           HA       GLN  33   1.890  -9.967   4.670
  238    HB2  GLN  33           HB2      GLN  33   0.424  -7.471   5.495
  239    HB3  GLN  33           HB3      GLN  33   0.009  -9.047   6.156
  240    HG2  GLN  33           HG2      GLN  33   2.564  -9.165   6.689
  241    HG3  GLN  33           HG3      GLN  33   2.465  -7.410   6.550
  242   HE21  GLN  33          HE21      GLN  33   3.005  -7.263   8.765
  243   HE22  GLN  33          HE22      GLN  33   1.823  -7.556   9.991
  244    H    CYS  34           H        CYS  34  -0.069  -7.864   2.564
  245    HA   CYS  34           HA       CYS  34  -2.336  -9.548   2.613
  246    HB2  CYS  34           HB2      CYS  34  -2.014  -7.023   1.843
  247    HB3  CYS  34           HB3      CYS  34  -1.758  -7.763   0.275
  248    H    LEU  35           H        LEU  35   0.575  -9.211   0.662
  249    HA   LEU  35           HA       LEU  35  -0.036 -10.915  -1.460
  250    HB2  LEU  35           HB2      LEU  35   2.480  -9.975  -0.179
  251    HB3  LEU  35           HB3      LEU  35   2.573 -11.301  -1.335
  252    HG   LEU  35           HG       LEU  35   1.306  -8.654  -1.999
  253   HD11  LEU  35          HD11      LEU  35   3.297  -7.762  -2.665
  254   HD12  LEU  35          HD12      LEU  35   4.047  -9.337  -2.919
  255   HD13  LEU  35          HD13      LEU  35   3.845  -8.711  -1.283
  256   HD21  LEU  35          HD21      LEU  35   2.540 -10.683  -3.840
  257   HD22  LEU  35          HD22      LEU  35   1.447  -9.355  -4.237
  258   HD23  LEU  35          HD23      LEU  35   0.846 -10.759  -3.353
  259    H    ALA  36           H        ALA  36   1.478 -11.633   1.669
  260    HA   ALA  36           HA       ALA  36   1.974 -14.354   1.229
  261    HB1  ALA  36           HB1      ALA  36   1.335 -13.977   3.966
  262    HB2  ALA  36           HB2      ALA  36   2.927 -14.112   3.216
  263    HB3  ALA  36           HB3      ALA  36   2.167 -12.530   3.397
  264    H    GLU  37           H        GLU  37  -0.891 -12.682   2.452
  265    HA   GLU  37           HA       GLU  37  -2.367 -14.893   3.286
  266    HB2  GLU  37           HB2      GLU  37  -3.345 -12.303   2.070
  267    HB3  GLU  37           HB3      GLU  37  -4.363 -13.464   2.910
  268    HG2  GLU  37           HG2      GLU  37  -1.975 -12.352   4.298
  269    HG3  GLU  37           HG3      GLU  37  -3.430 -11.367   4.148
  270    H    SER  38           H        SER  38  -1.823 -13.587   0.085
  271    HA   SER  38           HA       SER  38  -2.423 -14.288  -1.999
  272    HB2  SER  38           HB2      SER  38  -2.046 -16.536  -2.444
  273    HB3  SER  38           HB3      SER  38  -1.198 -16.338  -0.911
  274    HG   SER  38           HG       SER  38  -2.565 -18.186  -0.935
  275    H    THR  39           H        THR  39  -4.541 -13.405  -0.222
  276    HA   THR  39           HA       THR  39  -6.822 -15.096  -0.631
  277    HB   THR  39           HB       THR  39  -7.042 -12.184   0.058
  278    HG1  THR  39           HG1      THR  39  -6.542 -12.718   2.209
  279   HG21  THR  39          HG21      THR  39  -8.792 -13.189   1.617
  280   HG22  THR  39          HG22      THR  39  -8.559 -14.695   0.729
  281   HG23  THR  39          HG23      THR  39  -9.137 -13.256  -0.110
  282    H    GLU  40           H        GLU  40  -5.135 -12.957  -2.598
  283    HA   GLU  40           HA       GLU  40  -7.309 -11.851  -4.078
  284    HB2  GLU  40           HB2      GLU  40  -4.799 -11.100  -3.908
  285    HB3  GLU  40           HB3      GLU  40  -4.580 -12.210  -5.254
  286    HG2  GLU  40           HG2      GLU  40  -6.726 -10.146  -5.382
  287    HG3  GLU  40           HG3      GLU  40  -5.051  -9.692  -5.691
  288    H    ASP  41           H        ASP  41  -8.568 -13.785  -4.432
  289    HA   ASP  41           HA       ASP  41  -7.599 -15.318  -6.752
  290    HB2  ASP  41           HB2      ASP  41  -9.255 -16.386  -4.455
  291    HB3  ASP  41           HB3      ASP  41  -8.792 -17.293  -5.894
  292    H    VAL  42           H        VAL  42  -9.193 -12.919  -6.724
  293    HA   VAL  42           HA       VAL  42 -11.864 -13.869  -7.460
  294    HB   VAL  42           HB       VAL  42 -11.772 -11.950  -5.942
  295   HG11  VAL  42          HG11      VAL  42 -10.426 -10.190  -6.218
  296   HG12  VAL  42          HG12      VAL  42  -9.624 -11.141  -7.470
  297   HG13  VAL  42          HG13      VAL  42 -10.891  -9.995  -7.907
  298   HG21  VAL  42          HG21      VAL  42 -13.516 -10.837  -6.912
  299   HG22  VAL  42          HG22      VAL  42 -12.731 -10.748  -8.488
  300   HG23  VAL  42          HG23      VAL  42 -13.463 -12.261  -7.951
  301    H    THR  43           H        THR  43 -12.509 -14.020  -9.511
  302    HA   THR  43           HA       THR  43 -10.744 -12.923 -11.598
  303    HB   THR  43           HB       THR  43 -11.495 -14.663 -13.079
  304    HG1  THR  43           HG1      THR  43 -13.124 -15.672 -10.976
  305   HG21  THR  43          HG21      THR  43 -10.101 -15.158 -10.669
  306   HG22  THR  43          HG22      THR  43  -9.990 -16.043 -12.191
  307   HG23  THR  43          HG23      THR  43 -11.146 -16.547 -10.958
  308    H    TRP  44           H        TRP  44 -13.983 -13.024 -10.361
  309    HA   TRP  44           HA       TRP  44 -15.239 -11.918 -12.685
  310    HB2  TRP  44           HB2      TRP  44 -16.330 -13.284 -10.787
  311    HB3  TRP  44           HB3      TRP  44 -16.351 -11.767  -9.891
  312    HD1  TRP  44           HD1      TRP  44 -17.432 -12.777 -13.495
  313    HE1  TRP  44           HE1      TRP  44 -19.744 -11.735 -13.938
  314    HE3  TRP  44           HE3      TRP  44 -18.137 -10.431  -9.008
  315    HZ2  TRP  44           HZ2      TRP  44 -21.618 -10.129 -12.566
  316    HZ3  TRP  44           HZ3      TRP  44 -20.216  -9.162  -8.654
  317    HH2  TRP  44           HH2      TRP  44 -21.919  -9.015 -10.398
  Start of MODEL    3
    1    H1   SER   1           H        SER   1  -9.028   5.322 -17.940
    2    HA   SER   1           HA       SER   1  -7.920   6.545 -15.497
    3    HB2  SER   1           HB2      SER   1  -6.921   4.357 -14.982
    4    HB3  SER   1           HB3      SER   1  -8.675   4.236 -15.119
    5    HG   SER   1           HG       SER   1  -6.688   3.359 -16.916
    6    H    HIS   2           H        HIS   2  -6.691   8.053 -16.677
    7    HA   HIS   2           HA       HIS   2  -4.876   7.262 -18.732
    8    HB2  HIS   2           HB2      HIS   2  -5.895   9.586 -18.349
    9    HB3  HIS   2           HB3      HIS   2  -4.663   9.790 -17.107
   10    HD1  HIS   2           HD1      HIS   2  -4.434   8.427 -20.659
   11    HD2  HIS   2           HD2      HIS   2  -2.738  11.324 -18.210
   12    HE1  HIS   2           HE1      HIS   2  -2.631   9.505 -22.041
   13    H    MET   3           H        MET   3  -2.573   7.283 -18.635
   14    HA   MET   3           HA       MET   3  -1.519   5.940 -16.376
   15    HB2  MET   3           HB2      MET   3  -0.010   7.280 -18.628
   16    HB3  MET   3           HB3      MET   3   0.622   6.057 -17.532
   17    HG2  MET   3           HG2      MET   3  -1.268   4.570 -18.435
   18    HG3  MET   3           HG3      MET   3  -1.376   5.753 -19.737
   19    HE1  MET   3           HE1      MET   3   0.728   5.323 -22.077
   20    HE2  MET   3           HE2      MET   3   0.190   3.644 -22.013
   21    HE3  MET   3           HE3      MET   3  -0.921   4.943 -21.577
   22    H    GLY   4           H        GLY   4  -1.648   7.130 -14.512
   23    HA2  GLY   4           HA2      GLY   4  -0.496   9.820 -14.479
   24    HA3  GLY   4           HA3      GLY   4  -1.431   9.077 -13.189
   25    H    ALA   5           H        ALA   5  -0.388   7.393 -11.916
   26    HA   ALA   5           HA       ALA   5   2.504   7.888 -11.693
   27    HB1  ALA   5           HB1      ALA   5   2.264   7.117  -9.356
   28    HB2  ALA   5           HB2      ALA   5   1.287   8.540  -9.717
   29    HB3  ALA   5           HB3      ALA   5   0.527   6.953  -9.617
   30    H    ALA   6           H        ALA   6   3.712   5.976 -10.682
   31    HA   ALA   6           HA       ALA   6   2.973   3.564 -12.187
   32    HB1  ALA   6           HB1      ALA   6   5.292   2.935 -12.099
   33    HB2  ALA   6           HB2      ALA   6   5.172   4.601 -12.668
   34    HB3  ALA   6           HB3      ALA   6   5.653   4.270 -11.003
   35    H    ALA   7           H        ALA   7   2.360   4.662  -9.271
   36    HA   ALA   7           HA       ALA   7   2.819   2.061  -7.960
   37    HB1  ALA   7           HB1      ALA   7   3.052   3.177  -5.843
   38    HB2  ALA   7           HB2      ALA   7   4.184   3.890  -6.991
   39    HB3  ALA   7           HB3      ALA   7   2.695   4.739  -6.580
   40    H    LEU   8           H        LEU   8   1.254   1.836  -6.003
   41    HA   LEU   8           HA       LEU   8  -1.436   2.628  -6.911
   42    HB2  LEU   8           HB2      LEU   8  -2.145   0.544  -5.600
   43    HB3  LEU   8           HB3      LEU   8  -1.379   0.325  -7.173
   44    HG   LEU   8           HG       LEU   8   0.331   0.210  -4.737
   45   HD11  LEU   8          HD11      LEU   8  -0.301  -2.393  -5.042
   46   HD12  LEU   8          HD12      LEU   8  -1.866  -1.644  -5.362
   47   HD13  LEU   8          HD13      LEU   8  -1.036  -1.333  -3.837
   48   HD21  LEU   8          HD21      LEU   8   1.085  -1.796  -6.368
   49   HD22  LEU   8          HD22      LEU   8   1.696  -0.145  -6.495
   50   HD23  LEU   8          HD23      LEU   8   0.383  -0.684  -7.544
   51    H    ARG   9           H        ARG   9  -2.796   3.572  -5.485
   52    HA   ARG   9           HA       ARG   9  -1.703   4.191  -2.837
   53    HB2  ARG   9           HB2      ARG   9  -2.635   5.919  -4.607
   54    HB3  ARG   9           HB3      ARG   9  -4.181   5.473  -3.899
   55    HG2  ARG   9           HG2      ARG   9  -3.485   7.381  -2.732
   56    HG3  ARG   9           HG3      ARG   9  -3.148   6.027  -1.651
   57    HD2  ARG   9           HD2      ARG   9  -1.266   7.502  -1.610
   58    HD3  ARG   9           HD3      ARG   9  -0.800   6.039  -2.476
   59    HE   ARG   9           HE       ARG   9  -0.476   7.304  -4.351
   60   HH11  ARG   9          HH11      ARG   9  -2.408   9.112  -2.089
   61   HH12  ARG   9          HH12      ARG   9  -2.366  10.572  -3.022
   62   HH21  ARG   9          HH21      ARG   9  -0.414   9.220  -5.587
   63   HH22  ARG   9          HH22      ARG   9  -1.232  10.632  -5.011
   64    H    SER  10           H        SER  10  -3.256   1.711  -3.851
   65    HA   SER  10           HA       SER  10  -4.841   1.425  -1.440
   66    HB2  SER  10           HB2      SER  10  -6.708   0.429  -3.074
   67    HB3  SER  10           HB3      SER  10  -6.695   2.126  -2.593
   68    HG   SER  10           HG       SER  10  -6.235   2.675  -4.573
   69    H    CYS  11           H        CYS  11  -5.869  -0.868  -1.441
   70    HA   CYS  11           HA       CYS  11  -3.816  -2.728  -2.438
   71    HB2  CYS  11           HB2      CYS  11  -4.354  -2.429   0.100
   72    HB3  CYS  11           HB3      CYS  11  -5.767  -3.414  -0.263
   73    HA   PRO  12           HA       PRO  12  -7.407  -3.814  -5.040
   74    HB2  PRO  12           HB2      PRO  12  -5.894  -4.795  -7.070
   75    HB3  PRO  12           HB3      PRO  12  -6.243  -3.073  -6.878
   76    HG2  PRO  12           HG2      PRO  12  -3.790  -4.606  -6.106
   77    HG3  PRO  12           HG3      PRO  12  -3.918  -3.018  -6.883
   78    HD2  PRO  12           HD2      PRO  12  -3.420  -3.310  -4.238
   79    HD3  PRO  12           HD3      PRO  12  -4.337  -1.937  -4.891
   80    H    MET  13           H        MET  13  -4.982  -5.559  -3.454
   81    HA   MET  13           HA       MET  13  -5.619  -8.165  -4.468
   82    HB2  MET  13           HB2      MET  13  -3.953  -7.124  -2.202
   83    HB3  MET  13           HB3      MET  13  -4.330  -8.839  -2.302
   84    HG2  MET  13           HG2      MET  13  -3.377  -8.814  -4.621
   85    HG3  MET  13           HG3      MET  13  -2.821  -7.173  -4.294
   86    HE1  MET  13           HE1      MET  13   0.257  -7.520  -2.239
   87    HE2  MET  13           HE2      MET  13  -0.530  -6.725  -3.601
   88    HE3  MET  13           HE3      MET  13  -1.273  -6.677  -2.001
   89    H    CYS  14           H        CYS  14  -6.673  -6.166  -1.795
   90    HA   CYS  14           HA       CYS  14  -8.683  -8.213  -1.138
   91    HB2  CYS  14           HB2      CYS  14  -8.501  -7.674   1.217
   92    HB3  CYS  14           HB3      CYS  14  -6.913  -8.121   0.604
   93    H    GLN  15           H        GLN  15  -8.359  -5.423  -2.589
   94    HA   GLN  15           HA       GLN  15  -9.692  -3.632  -3.022
   95    HB2  GLN  15           HB2      GLN  15 -11.624  -5.596  -1.846
   96    HB3  GLN  15           HB3      GLN  15 -12.162  -3.964  -2.220
   97    HG2  GLN  15           HG2      GLN  15 -11.332  -4.317  -4.552
   98    HG3  GLN  15           HG3      GLN  15 -11.048  -6.005  -4.126
   99   HE21  GLN  15          HE21      GLN  15 -12.893  -4.696  -6.060
  100   HE22  GLN  15          HE22      GLN  15 -14.458  -5.319  -5.675
  101    H    LYS  16           H        LYS  16  -8.077  -3.131  -0.978
  102    HA   LYS  16           HA       LYS  16  -9.776  -1.849   1.061
  103    HB2  LYS  16           HB2      LYS  16  -8.339  -3.511   2.067
  104    HB3  LYS  16           HB3      LYS  16  -6.929  -2.845   1.252
  105    HG2  LYS  16           HG2      LYS  16  -7.113  -0.805   2.558
  106    HG3  LYS  16           HG3      LYS  16  -8.564  -1.427   3.348
  107    HD2  LYS  16           HD2      LYS  16  -7.337  -3.147   4.434
  108    HD3  LYS  16           HD3      LYS  16  -5.903  -2.836   3.452
  109    HE2  LYS  16           HE2      LYS  16  -5.914  -0.504   4.487
  110    HE3  LYS  16           HE3      LYS  16  -7.071  -1.150   5.650
  111    HZ1  LYS  16           HZ1      LYS  16  -5.076  -1.479   6.710
  112    HZ2  LYS  16           HZ2      LYS  16  -4.232  -1.830   5.286
  113    HZ3  LYS  16           HZ3      LYS  16  -5.283  -2.977   5.950
  114    H    GLU  17           H        GLU  17  -9.287   0.273   1.707
  115    HA   GLU  17           HA       GLU  17  -7.710   1.777  -0.269
  116    HB2  GLU  17           HB2      GLU  17 -10.034   2.597   1.473
  117    HB3  GLU  17           HB3      GLU  17  -9.060   3.749   0.572
  118    HG2  GLU  17           HG2      GLU  17  -9.689   2.683  -1.516
  119    HG3  GLU  17           HG3      GLU  17 -10.627   1.480  -0.633
  120    H    PHE  18           H        PHE  18  -5.924   2.803   0.354
  121    HA   PHE  18           HA       PHE  18  -5.101   2.650   3.120
  122    HB2  PHE  18           HB2      PHE  18  -3.706   3.735   0.666
  123    HB3  PHE  18           HB3      PHE  18  -2.974   3.639   2.264
  124    HD1  PHE  18           HD2      PHE  18  -3.769   1.046   3.243
  125    HD2  PHE  18           HD1      PHE  18  -2.637   2.217  -0.690
  126    HE1  PHE  18           HE2      PHE  18  -3.042  -1.256   2.770
  127    HE2  PHE  18           HE1      PHE  18  -1.910  -0.084  -1.169
  128    HZ   PHE  18           HZ       PHE  18  -2.111  -1.825   0.562
  129    H    ALA  19           H        ALA  19  -5.157   4.242   4.578
  130    HA   ALA  19           HA       ALA  19  -6.606   6.606   4.130
  131    HB1  ALA  19           HB1      ALA  19  -5.167   7.170   6.374
  132    HB2  ALA  19           HB2      ALA  19  -6.672   6.249   6.341
  133    HB3  ALA  19           HB3      ALA  19  -5.121   5.406   6.350
  134    HA   PRO  20           HA       PRO  20  -3.718   9.522   2.578
  135    HB2  PRO  20           HB2      PRO  20  -4.382  11.778   3.934
  136    HB3  PRO  20           HB3      PRO  20  -5.398  11.087   2.664
  137    HG2  PRO  20           HG2      PRO  20  -5.653  10.842   5.637
  138    HG3  PRO  20           HG3      PRO  20  -6.917  11.121   4.425
  139    HD2  PRO  20           HD2      PRO  20  -6.454   8.685   5.512
  140    HD3  PRO  20           HD3      PRO  20  -7.030   8.893   3.846
  141    H    ARG  21           H        ARG  21  -3.920   9.208   6.075
  142    HA   ARG  21           HA       ARG  21  -1.551  10.657   6.672
  143    HB2  ARG  21           HB2      ARG  21  -1.728   9.655   8.893
  144    HB3  ARG  21           HB3      ARG  21  -3.293  10.244   8.348
  145    HG2  ARG  21           HG2      ARG  21  -4.103   8.079   7.966
  146    HG3  ARG  21           HG3      ARG  21  -2.485   7.375   8.022
  147    HD2  ARG  21           HD2      ARG  21  -2.394   7.423  10.309
  148    HD3  ARG  21           HD3      ARG  21  -3.480   8.807  10.429
  149    HE   ARG  21           HE       ARG  21  -4.209   6.070  10.539
  150   HH11  ARG  21          HH11      ARG  21  -5.287   9.163   9.360
  151   HH12  ARG  21          HH12      ARG  21  -6.968   8.749   9.428
  152   HH21  ARG  21          HH21      ARG  21  -6.419   5.513  10.633
  153   HH22  ARG  21          HH22      ARG  21  -7.611   6.673  10.153
  154    H    LEU  22           H        LEU  22  -2.181   7.427   5.605
  155    HA   LEU  22           HA       LEU  22   0.171   6.167   6.501
  156    HB2  LEU  22           HB2      LEU  22  -1.658   5.636   4.176
  157    HB3  LEU  22           HB3      LEU  22  -0.268   4.614   4.539
  158    HG   LEU  22           HG       LEU  22  -2.545   5.105   6.455
  159   HD11  LEU  22          HD11      LEU  22  -2.103   2.622   4.824
  160   HD12  LEU  22          HD12      LEU  22  -3.161   3.928   4.291
  161   HD13  LEU  22          HD13      LEU  22  -3.509   3.069   5.791
  162   HD21  LEU  22          HD21      LEU  22  -0.924   2.686   6.681
  163   HD22  LEU  22          HD22      LEU  22  -1.445   3.824   7.923
  164   HD23  LEU  22          HD23      LEU  22  -0.017   4.176   6.946
  165    H    THR  23           H        THR  23   2.085   5.631   5.354
  166    HA   THR  23           HA       THR  23   2.795   7.608   3.286
  167    HB   THR  23           HB       THR  23   5.206   6.980   4.045
  168    HG1  THR  23           HG1      THR  23   5.010   6.570   6.459
  169   HG21  THR  23          HG21      THR  23   5.206   8.773   5.649
  170   HG22  THR  23          HG22      THR  23   3.473   8.589   5.919
  171   HG23  THR  23          HG23      THR  23   4.066   9.176   4.365
  172    H    GLN  24           H        GLN  24   4.858   6.740   2.038
  173    HA   GLN  24           HA       GLN  24   3.998   4.670   0.381
  174    HB2  GLN  24           HB2      GLN  24   6.205   4.737  -0.615
  175    HB3  GLN  24           HB3      GLN  24   5.669   6.375  -0.261
  176    HG2  GLN  24           HG2      GLN  24   7.017   6.264   1.845
  177    HG3  GLN  24           HG3      GLN  24   7.673   4.735   1.263
  178   HE21  GLN  24          HE21      GLN  24   9.644   6.163   1.606
  179   HE22  GLN  24          HE22      GLN  24  10.196   7.043   0.226
  180    H    LEU  25           H        LEU  25   6.006   4.613   3.255
  181    HA   LEU  25           HA       LEU  25   6.897   1.926   2.957
  182    HB2  LEU  25           HB2      LEU  25   7.748   2.120   5.163
  183    HB3  LEU  25           HB3      LEU  25   7.999   3.669   4.360
  184    HG   LEU  25           HG       LEU  25   5.697   4.224   5.582
  185   HD11  LEU  25          HD11      LEU  25   5.143   2.366   6.775
  186   HD12  LEU  25          HD12      LEU  25   6.149   3.184   7.970
  187   HD13  LEU  25          HD13      LEU  25   6.821   1.872   7.002
  188   HD21  LEU  25          HD21      LEU  25   8.536   4.427   6.434
  189   HD22  LEU  25          HD22      LEU  25   7.286   4.873   7.596
  190   HD23  LEU  25          HD23      LEU  25   7.377   5.697   6.039
  191    H    ASP  26           H        ASP  26   4.101   3.439   4.422
  192    HA   ASP  26           HA       ASP  26   3.209   1.172   5.881
  193    HB2  ASP  26           HB2      ASP  26   1.921   3.727   4.971
  194    HB3  ASP  26           HB3      ASP  26   0.947   2.451   5.697
  195    H    VAL  27           H        VAL  27   2.377   2.476   2.688
  196    HA   VAL  27           HA       VAL  27   0.362   0.690   2.002
  197    HB   VAL  27           HB       VAL  27   2.413   1.940   0.170
  198   HG11  VAL  27          HG11      VAL  27   1.452   0.839  -1.499
  199   HG12  VAL  27          HG12      VAL  27   0.381   0.025  -0.357
  200   HG13  VAL  27          HG13      VAL  27  -0.103   1.559  -1.082
  201   HG21  VAL  27          HG21      VAL  27   0.118   3.339  -0.183
  202   HG22  VAL  27          HG22      VAL  27   0.020   2.964   1.537
  203   HG23  VAL  27          HG23      VAL  27   1.422   3.825   0.901
  204    H    ASP  28           H        ASP  28   3.856   0.437   1.368
  205    HA   ASP  28           HA       ASP  28   3.750  -2.079   0.106
  206    HB2  ASP  28           HB2      ASP  28   5.870  -0.369   1.287
  207    HB3  ASP  28           HB3      ASP  28   6.250  -2.078   1.097
  208    H    SER  29           H        SER  29   3.989  -1.127   3.473
  209    HA   SER  29           HA       SER  29   4.788  -3.521   4.627
  210    HB2  SER  29           HB2      SER  29   4.228  -1.139   5.653
  211    HB3  SER  29           HB3      SER  29   2.681  -1.910   6.000
  212    HG   SER  29           HG       SER  29   3.658  -2.755   7.647
  213    H    HIS  30           H        HIS  30   1.476  -2.392   3.972
  214    HA   HIS  30           HA       HIS  30   0.282  -4.853   4.808
  215    HB2  HIS  30           HB2      HIS  30  -0.934  -2.722   4.940
  216    HB3  HIS  30           HB3      HIS  30  -0.881  -2.579   3.186
  217    HD1  HIS  30           HD1      HIS  30  -3.086  -3.578   5.772
  218    HD2  HIS  30           HD2      HIS  30  -2.226  -5.026   1.974
  219    HE1  HIS  30           HE1      HIS  30  -5.061  -4.993   5.129
  220    H    LEU  31           H        LEU  31   1.277  -3.465   1.738
  221    HA   LEU  31           HA       LEU  31   0.002  -5.259   0.009
  222    HB2  LEU  31           HB2      LEU  31   2.470  -3.581  -0.198
  223    HB3  LEU  31           HB3      LEU  31   2.042  -4.699  -1.492
  224    HG   LEU  31           HG       LEU  31   0.350  -2.400  -0.511
  225   HD11  LEU  31          HD11      LEU  31   1.920  -2.747  -3.062
  226   HD12  LEU  31          HD12      LEU  31   2.331  -1.665  -1.732
  227   HD13  LEU  31          HD13      LEU  31   0.863  -1.390  -2.670
  228   HD21  LEU  31          HD21      LEU  31  -0.250  -4.740  -2.113
  229   HD22  LEU  31          HD22      LEU  31  -0.558  -3.239  -2.988
  230   HD23  LEU  31          HD23      LEU  31  -1.335  -3.529  -1.430
  231    H    ALA  32           H        ALA  32   2.808  -5.615   2.012
  232    HA   ALA  32           HA       ALA  32   3.766  -7.979   0.649
  233    HB1  ALA  32           HB1      ALA  32   4.681  -7.186   3.378
  234    HB2  ALA  32           HB2      ALA  32   5.593  -7.908   2.051
  235    HB3  ALA  32           HB3      ALA  32   5.134  -6.206   1.984
  236    H    GLN  33           H        GLN  33   1.987  -7.204   3.598
  237    HA   GLN  33           HA       GLN  33   1.907  -9.908   4.533
  238    HB2  GLN  33           HB2      GLN  33   0.382  -7.427   5.321
  239    HB3  GLN  33           HB3      GLN  33   0.148  -8.985   6.103
  240    HG2  GLN  33           HG2      GLN  33   2.678  -8.925   6.521
  241    HG3  GLN  33           HG3      GLN  33   2.554  -7.208   6.137
  242   HE21  GLN  33          HE21      GLN  33   0.173  -6.538   7.264
  243   HE22  GLN  33          HE22      GLN  33   0.254  -6.729   8.980
  244    H    CYS  34           H        CYS  34  -0.121  -7.895   2.412
  245    HA   CYS  34           HA       CYS  34  -2.412  -9.507   2.617
  246    HB2  CYS  34           HB2      CYS  34  -2.024  -7.078   1.615
  247    HB3  CYS  34           HB3      CYS  34  -1.812  -7.962   0.117
  248    H    LEU  35           H        LEU  35   0.185  -9.232   0.193
  249    HA   LEU  35           HA       LEU  35  -0.586 -11.389  -1.424
  250    HB2  LEU  35           HB2      LEU  35   1.354 -11.041  -2.586
  251    HB3  LEU  35           HB3      LEU  35   1.155  -9.481  -1.789
  252    HG   LEU  35           HG       LEU  35   2.712 -10.646   0.026
  253   HD11  LEU  35          HD11      LEU  35   4.455 -11.781  -1.733
  254   HD12  LEU  35          HD12      LEU  35   2.901 -12.346  -2.348
  255   HD13  LEU  35          HD13      LEU  35   3.358 -12.670  -0.676
  256   HD21  LEU  35          HD21      LEU  35   3.001  -8.589  -1.587
  257   HD22  LEU  35          HD22      LEU  35   4.100  -9.683  -2.428
  258   HD23  LEU  35          HD23      LEU  35   4.383  -9.277  -0.734
  259    H    ALA  36           H        ALA  36   1.181 -11.254   1.564
  260    HA   ALA  36           HA       ALA  36   2.438 -13.778   1.438
  261    HB1  ALA  36           HB1      ALA  36   2.549 -13.567   3.930
  262    HB2  ALA  36           HB2      ALA  36   3.203 -12.190   3.044
  263    HB3  ALA  36           HB3      ALA  36   1.605 -12.084   3.786
  264    H    GLU  37           H        GLU  37  -0.768 -12.754   2.457
  265    HA   GLU  37           HA       GLU  37  -1.439 -15.464   3.310
  266    HB2  GLU  37           HB2      GLU  37  -3.541 -14.496   4.090
  267    HB3  GLU  37           HB3      GLU  37  -2.170 -13.592   4.717
  268    HG2  GLU  37           HG2      GLU  37  -2.568 -11.779   3.303
  269    HG3  GLU  37           HG3      GLU  37  -3.614 -12.721   2.242
  270    H    SER  38           H        SER  38  -1.910 -13.285   0.661
  271    HA   SER  38           HA       SER  38  -4.208 -14.419  -0.494
  272    HB2  SER  38           HB2      SER  38  -2.928 -12.226  -1.086
  273    HB3  SER  38           HB3      SER  38  -1.995 -13.263  -2.164
  274    HG   SER  38           HG       SER  38  -4.366 -12.195  -2.604
  275    H    THR  39           H        THR  39  -1.011 -15.587  -0.229
  276    HA   THR  39           HA       THR  39  -0.913 -17.219  -2.547
  277    HB   THR  39           HB       THR  39   0.913 -18.425  -1.386
  278    HG1  THR  39           HG1      THR  39   0.647 -16.618   0.768
  279   HG21  THR  39          HG21      THR  39   1.767 -15.758  -0.694
  280   HG22  THR  39          HG22      THR  39   0.864 -15.751  -2.209
  281   HG23  THR  39          HG23      THR  39   2.281 -16.786  -2.031
  282    H    GLU  40           H        GLU  40  -2.865 -18.347  -2.699
  283    HA   GLU  40           HA       GLU  40  -3.630 -20.139  -0.541
  284    HB2  GLU  40           HB2      GLU  40  -4.905 -19.803  -3.260
  285    HB3  GLU  40           HB3      GLU  40  -5.601 -20.608  -1.862
  286    HG2  GLU  40           HG2      GLU  40  -5.493 -18.400  -0.669
  287    HG3  GLU  40           HG3      GLU  40  -5.072 -17.673  -2.219
  288    H    ASP  41           H        ASP  41  -1.599 -21.368  -0.740
  289    HA   ASP  41           HA       ASP  41  -1.621 -23.252  -3.000
  290    HB2  ASP  41           HB2      ASP  41   0.737 -23.763  -2.265
  291    HB3  ASP  41           HB3      ASP  41   0.484 -22.126  -2.864
  292    H    VAL  42           H        VAL  42  -3.544 -23.895  -1.341
  293    HA   VAL  42           HA       VAL  42  -2.473 -26.197   0.142
  294    HB   VAL  42           HB       VAL  42  -4.700 -24.406   1.120
  295   HG11  VAL  42          HG11      VAL  42  -4.366 -25.860   3.210
  296   HG12  VAL  42          HG12      VAL  42  -5.251 -26.554   1.850
  297   HG13  VAL  42          HG13      VAL  42  -3.564 -26.993   2.124
  298   HG21  VAL  42          HG21      VAL  42  -1.845 -24.295   1.472
  299   HG22  VAL  42          HG22      VAL  42  -3.085 -23.167   2.020
  300   HG23  VAL  42          HG23      VAL  42  -2.653 -24.556   3.018
  301    H    THR  43           H        THR  43  -3.082 -27.743  -1.295
  302    HA   THR  43           HA       THR  43  -5.624 -27.740  -2.608
  303    HB   THR  43           HB       THR  43  -3.753 -28.803  -3.710
  304    HG1  THR  43           HG1      THR  43  -4.748 -30.931  -4.016
  305   HG21  THR  43          HG21      THR  43  -2.242 -29.971  -2.564
  306   HG22  THR  43          HG22      THR  43  -3.450 -31.218  -2.255
  307   HG23  THR  43          HG23      THR  43  -3.251 -29.884  -1.120
  308    H    TRP  44           H        TRP  44  -4.366 -29.064   0.352
  309    HA   TRP  44           HA       TRP  44  -6.731 -30.735   0.735
  310    HB2  TRP  44           HB2      TRP  44  -4.286 -30.394   2.486
  311    HB3  TRP  44           HB3      TRP  44  -5.573 -31.571   2.730
  312    HD1  TRP  44           HD1      TRP  44  -2.280 -31.180   1.085
  313    HE1  TRP  44           HE1      TRP  44  -1.783 -33.204  -0.425
  314    HE3  TRP  44           HE3      TRP  44  -6.935 -33.293   1.001
  315    HZ2  TRP  44           HZ2      TRP  44  -3.179 -35.405  -1.510
  316    HZ3  TRP  44           HZ3      TRP  44  -7.271 -35.357  -0.297
  317    HH2  TRP  44           HH2      TRP  44  -5.430 -36.389  -1.526
  Start of MODEL    4
    1    H1   SER   1           H        SER   1  14.854  -1.108  -1.010
    2    HA   SER   1           HA       SER   1  13.805   1.177  -1.392
    3    HB2  SER   1           HB2      SER   1  16.112   2.376  -1.184
    4    HB3  SER   1           HB3      SER   1  15.590   1.295   0.108
    5    HG   SER   1           HG       SER   1  17.833   1.123  -1.003
    6    H    HIS   2           H        HIS   2  13.414   0.236  -3.877
    7    HA   HIS   2           HA       HIS   2  15.104   1.654  -5.760
    8    HB2  HIS   2           HB2      HIS   2  12.593   0.034  -6.236
    9    HB3  HIS   2           HB3      HIS   2  13.687   0.633  -7.481
   10    HD1  HIS   2           HD1      HIS   2  16.155  -0.431  -7.434
   11    HD2  HIS   2           HD2      HIS   2  13.264  -2.396  -5.188
   12    HE1  HIS   2           HE1      HIS   2  17.100  -2.716  -6.973
   13    H    MET   3           H        MET   3  13.744   2.773  -7.616
   14    HA   MET   3           HA       MET   3  11.427   4.220  -6.760
   15    HB2  MET   3           HB2      MET   3  12.465   6.468  -6.877
   16    HB3  MET   3           HB3      MET   3  13.063   5.509  -5.530
   17    HG2  MET   3           HG2      MET   3  15.033   6.315  -6.286
   18    HG3  MET   3           HG3      MET   3  14.929   4.872  -7.291
   19    HE1  MET   3           HE1      MET   3  14.002   8.399  -6.834
   20    HE2  MET   3           HE2      MET   3  15.313   9.004  -7.848
   21    HE3  MET   3           HE3      MET   3  13.651   9.049  -8.436
   22    H    GLY   4           H        GLY   4  10.829   5.931  -8.426
   23    HA2  GLY   4           HA2      GLY   4  11.176   6.736 -10.701
   24    HA3  GLY   4           HA3      GLY   4  11.845   5.159 -11.089
   25    H    ALA   5           H        ALA   5   9.809   3.654  -9.697
   26    HA   ALA   5           HA       ALA   5   7.720   3.851 -11.726
   27    HB1  ALA   5           HB1      ALA   5   9.035   1.700 -10.679
   28    HB2  ALA   5           HB2      ALA   5   7.515   1.674  -9.785
   29    HB3  ALA   5           HB3      ALA   5   7.501   1.629 -11.548
   30    H    ALA   6           H        ALA   6   5.572   4.179 -11.289
   31    HA   ALA   6           HA       ALA   6   4.929   5.669  -8.957
   32    HB1  ALA   6           HB1      ALA   6   2.839   4.486 -10.738
   33    HB2  ALA   6           HB2      ALA   6   2.868   6.054  -9.930
   34    HB3  ALA   6           HB3      ALA   6   3.894   5.768 -11.335
   35    H    ALA   7           H        ALA   7   3.665   5.137  -7.195
   36    HA   ALA   7           HA       ALA   7   3.405   2.258  -6.683
   37    HB1  ALA   7           HB1      ALA   7   3.521   4.612  -4.807
   38    HB2  ALA   7           HB2      ALA   7   3.197   2.957  -4.291
   39    HB3  ALA   7           HB3      ALA   7   4.741   3.361  -5.042
   40    H    LEU   8           H        LEU   8   1.518   1.643  -5.260
   41    HA   LEU   8           HA       LEU   8  -0.905   2.802  -6.406
   42    HB2  LEU   8           HB2      LEU   8  -0.852   0.412  -4.610
   43    HB3  LEU   8           HB3      LEU   8  -1.992   0.816  -5.892
   44    HG   LEU   8           HG       LEU   8   0.864  -0.031  -6.367
   45   HD11  LEU   8          HD11      LEU   8  -1.639  -1.683  -6.649
   46   HD12  LEU   8          HD12      LEU   8  -0.511  -1.803  -5.299
   47   HD13  LEU   8          HD13      LEU   8   0.023  -2.201  -6.931
   48   HD21  LEU   8          HD21      LEU   8  -0.950   1.261  -8.026
   49   HD22  LEU   8          HD22      LEU   8  -1.052  -0.436  -8.497
   50   HD23  LEU   8          HD23      LEU   8   0.505   0.394  -8.521
   51    H    ARG   9           H        ARG   9  -2.519   3.734  -5.223
   52    HA   ARG   9           HA       ARG   9  -1.810   4.520  -2.500
   53    HB2  ARG   9           HB2      ARG   9  -3.465   5.651  -4.663
   54    HB3  ARG   9           HB3      ARG   9  -4.120   5.855  -3.043
   55    HG2  ARG   9           HG2      ARG   9  -2.816   7.781  -3.614
   56    HG3  ARG   9           HG3      ARG   9  -1.979   6.878  -2.351
   57    HD2  ARG   9           HD2      ARG   9  -0.338   6.120  -3.804
   58    HD3  ARG   9           HD3      ARG   9  -1.341   6.382  -5.230
   59    HE   ARG   9           HE       ARG   9  -0.627   8.564  -5.300
   60   HH11  ARG   9          HH11      ARG   9   0.275   7.137  -2.256
   61   HH12  ARG   9          HH12      ARG   9   1.286   8.463  -1.785
   62   HH21  ARG   9          HH21      ARG   9   0.700  10.316  -4.692
   63   HH22  ARG   9          HH22      ARG   9   1.526  10.272  -3.171
   64    H    SER  10           H        SER  10  -3.246   1.947  -3.718
   65    HA   SER  10           HA       SER  10  -4.891   1.545  -1.364
   66    HB2  SER  10           HB2      SER  10  -6.712   0.605  -3.063
   67    HB3  SER  10           HB3      SER  10  -6.711   2.294  -2.555
   68    HG   SER  10           HG       SER  10  -5.796   2.872  -4.470
   69    H    CYS  11           H        CYS  11  -5.863  -0.753  -1.445
   70    HA   CYS  11           HA       CYS  11  -3.777  -2.549  -2.484
   71    HB2  CYS  11           HB2      CYS  11  -4.334  -2.364   0.048
   72    HB3  CYS  11           HB3      CYS  11  -5.761  -3.312  -0.360
   73    HA   PRO  12           HA       PRO  12  -7.284  -3.596  -5.203
   74    HB2  PRO  12           HB2      PRO  12  -5.710  -4.534  -7.207
   75    HB3  PRO  12           HB3      PRO  12  -6.066  -2.816  -6.988
   76    HG2  PRO  12           HG2      PRO  12  -3.637  -4.367  -6.176
   77    HG3  PRO  12           HG3      PRO  12  -3.742  -2.761  -6.922
   78    HD2  PRO  12           HD2      PRO  12  -3.322  -3.111  -4.271
   79    HD3  PRO  12           HD3      PRO  12  -4.220  -1.724  -4.920
   80    H    MET  13           H        MET  13  -4.903  -5.378  -3.587
   81    HA   MET  13           HA       MET  13  -5.502  -7.959  -4.677
   82    HB2  MET  13           HB2      MET  13  -3.420  -7.004  -3.256
   83    HB3  MET  13           HB3      MET  13  -4.338  -7.760  -1.960
   84    HG2  MET  13           HG2      MET  13  -4.365  -9.857  -3.315
   85    HG3  MET  13           HG3      MET  13  -3.261  -9.071  -4.440
   86    HE1  MET  13           HE1      MET  13  -0.355  -8.226  -1.757
   87    HE2  MET  13           HE2      MET  13  -0.939  -7.844  -3.377
   88    HE3  MET  13           HE3      MET  13  -1.834  -7.287  -1.962
   89    H    CYS  14           H        CYS  14  -6.523  -6.109  -1.852
   90    HA   CYS  14           HA       CYS  14  -8.595  -8.147  -1.362
   91    HB2  CYS  14           HB2      CYS  14  -8.487  -7.655   1.008
   92    HB3  CYS  14           HB3      CYS  14  -6.879  -8.083   0.431
   93    H    GLN  15           H        GLN  15  -8.254  -5.325  -2.744
   94    HA   GLN  15           HA       GLN  15  -9.588  -3.534  -3.177
   95    HB2  GLN  15           HB2      GLN  15 -11.538  -5.535  -2.096
   96    HB3  GLN  15           HB3      GLN  15 -12.075  -3.900  -2.461
   97    HG2  GLN  15           HG2      GLN  15 -11.568  -4.133  -4.746
   98    HG3  GLN  15           HG3      GLN  15 -10.637  -5.602  -4.468
   99   HE21  GLN  15          HE21      GLN  15 -12.173  -7.185  -3.037
  100   HE22  GLN  15          HE22      GLN  15 -13.666  -7.531  -3.833
  101    H    LYS  16           H        LYS  16  -8.037  -3.064  -1.077
  102    HA   LYS  16           HA       LYS  16  -9.802  -1.855   0.949
  103    HB2  LYS  16           HB2      LYS  16  -8.353  -3.503   1.950
  104    HB3  LYS  16           HB3      LYS  16  -6.941  -2.801   1.170
  105    HG2  LYS  16           HG2      LYS  16  -7.255  -0.752   2.497
  106    HG3  LYS  16           HG3      LYS  16  -8.620  -1.516   3.315
  107    HD2  LYS  16           HD2      LYS  16  -7.050  -3.341   4.024
  108    HD3  LYS  16           HD3      LYS  16  -5.728  -2.365   3.382
  109    HE2  LYS  16           HE2      LYS  16  -7.626  -1.105   5.296
  110    HE3  LYS  16           HE3      LYS  16  -6.435  -2.243   5.925
  111    HZ1  LYS  16           HZ1      LYS  16  -4.863  -0.752   4.429
  112    HZ2  LYS  16           HZ2      LYS  16  -5.216  -0.358   6.034
  113    HZ3  LYS  16           HZ3      LYS  16  -6.044   0.408   4.774
  114    H    GLU  17           H        GLU  17  -9.370   0.261   1.655
  115    HA   GLU  17           HA       GLU  17  -7.783   1.843  -0.252
  116    HB2  GLU  17           HB2      GLU  17 -10.269   2.431   1.315
  117    HB3  GLU  17           HB3      GLU  17  -9.230   3.752   0.797
  118    HG2  GLU  17           HG2      GLU  17  -9.442   2.900  -1.539
  119    HG3  GLU  17           HG3      GLU  17 -10.644   1.753  -0.946
  120    H    PHE  18           H        PHE  18  -6.023   2.861   0.443
  121    HA   PHE  18           HA       PHE  18  -5.275   2.679   3.224
  122    HB2  PHE  18           HB2      PHE  18  -3.840   3.892   0.853
  123    HB3  PHE  18           HB3      PHE  18  -3.148   3.712   2.462
  124    HD1  PHE  18           HD2      PHE  18  -4.063   1.030   3.212
  125    HD2  PHE  18           HD1      PHE  18  -2.590   2.495  -0.503
  126    HE1  PHE  18           HE2      PHE  18  -3.294  -1.233   2.628
  127    HE2  PHE  18           HE1      PHE  18  -1.820   0.234  -1.093
  128    HZ   PHE  18           HZ       PHE  18  -2.170  -1.634   0.474
  129    H    ALA  19           H        ALA  19  -5.141   4.304   4.693
  130    HA   ALA  19           HA       ALA  19  -6.737   6.619   4.295
  131    HB1  ALA  19           HB1      ALA  19  -5.361   5.338   6.491
  132    HB2  ALA  19           HB2      ALA  19  -5.195   7.093   6.556
  133    HB3  ALA  19           HB3      ALA  19  -6.798   6.361   6.503
  134    HA   PRO  20           HA       PRO  20  -3.907   9.627   2.813
  135    HB2  PRO  20           HB2      PRO  20  -4.615  11.839   4.218
  136    HB3  PRO  20           HB3      PRO  20  -5.618  11.156   2.931
  137    HG2  PRO  20           HG2      PRO  20  -5.870  10.841   5.898
  138    HG3  PRO  20           HG3      PRO  20  -7.138  11.122   4.691
  139    HD2  PRO  20           HD2      PRO  20  -6.628   8.672   5.725
  140    HD3  PRO  20           HD3      PRO  20  -7.207   8.905   4.064
  141    H    ARG  21           H        ARG  21  -3.884   8.736   6.117
  142    HA   ARG  21           HA       ARG  21  -1.618  10.386   6.837
  143    HB2  ARG  21           HB2      ARG  21  -1.791   9.402   9.011
  144    HB3  ARG  21           HB3      ARG  21  -3.423   9.751   8.458
  145    HG2  ARG  21           HG2      ARG  21  -3.624   7.364   7.769
  146    HG3  ARG  21           HG3      ARG  21  -2.059   7.072   8.529
  147    HD2  ARG  21           HD2      ARG  21  -2.903   7.652  10.676
  148    HD3  ARG  21           HD3      ARG  21  -4.401   8.276   9.986
  149    HE   ARG  21           HE       ARG  21  -4.285   5.629   9.243
  150   HH11  ARG  21          HH11      ARG  21  -4.315   7.413  12.232
  151   HH12  ARG  21          HH12      ARG  21  -5.105   6.157  13.126
  152   HH21  ARG  21          HH21      ARG  21  -5.325   3.967  10.408
  153   HH22  ARG  21          HH22      ARG  21  -5.679   4.196  12.087
  154    H    LEU  22           H        LEU  22  -2.213   7.191   5.635
  155    HA   LEU  22           HA       LEU  22   0.198   5.958   6.416
  156    HB2  LEU  22           HB2      LEU  22  -1.710   5.449   4.150
  157    HB3  LEU  22           HB3      LEU  22  -0.280   4.455   4.421
  158    HG   LEU  22           HG       LEU  22  -2.524   4.814   6.406
  159   HD11  LEU  22          HD11      LEU  22  -1.938   2.547   4.506
  160   HD12  LEU  22          HD12      LEU  22  -3.326   3.634   4.451
  161   HD13  LEU  22          HD13      LEU  22  -3.138   2.513   5.799
  162   HD21  LEU  22          HD21      LEU  22   0.082   4.002   6.821
  163   HD22  LEU  22          HD22      LEU  22  -0.801   2.486   6.644
  164   HD23  LEU  22          HD23      LEU  22  -1.298   3.658   7.866
  165    H    THR  23           H        THR  23   2.091   5.530   5.208
  166    HA   THR  23           HA       THR  23   2.667   7.573   3.165
  167    HB   THR  23           HB       THR  23   5.132   6.875   3.857
  168    HG1  THR  23           HG1      THR  23   3.696   6.492   6.287
  169   HG21  THR  23          HG21      THR  23   3.430   8.697   5.562
  170   HG22  THR  23          HG22      THR  23   4.146   9.133   4.011
  171   HG23  THR  23          HG23      THR  23   5.182   8.761   5.387
  172    H    GLN  24           H        GLN  24   4.670   6.818   1.788
  173    HA   GLN  24           HA       GLN  24   3.828   4.789   0.099
  174    HB2  GLN  24           HB2      GLN  24   6.117   4.847  -0.841
  175    HB3  GLN  24           HB3      GLN  24   5.431   6.451  -0.624
  176    HG2  GLN  24           HG2      GLN  24   6.699   6.274   1.693
  177    HG3  GLN  24           HG3      GLN  24   7.693   5.147   0.773
  178   HE21  GLN  24          HE21      GLN  24   9.482   6.492   0.846
  179   HE22  GLN  24          HE22      GLN  24   9.585   7.946  -0.082
  180    H    LEU  25           H        LEU  25   6.028   4.647   2.852
  181    HA   LEU  25           HA       LEU  25   6.854   1.964   2.454
  182    HB2  LEU  25           HB2      LEU  25   7.790   2.087   4.643
  183    HB3  LEU  25           HB3      LEU  25   8.052   3.636   3.844
  184    HG   LEU  25           HG       LEU  25   5.827   4.257   5.159
  185   HD11  LEU  25          HD11      LEU  25   6.525   3.068   7.516
  186   HD12  LEU  25          HD12      LEU  25   6.739   1.755   6.360
  187   HD13  LEU  25          HD13      LEU  25   5.183   2.576   6.484
  188   HD21  LEU  25          HD21      LEU  25   8.689   4.284   6.011
  189   HD22  LEU  25          HD22      LEU  25   7.442   4.885   7.105
  190   HD23  LEU  25          HD23      LEU  25   7.651   5.620   5.515
  191    H    ASP  26           H        ASP  26   4.171   3.449   4.161
  192    HA   ASP  26           HA       ASP  26   3.328   1.185   5.611
  193    HB2  ASP  26           HB2      ASP  26   1.902   3.662   4.658
  194    HB3  ASP  26           HB3      ASP  26   1.063   2.400   5.557
  195    H    VAL  27           H        VAL  27   2.436   2.403   2.405
  196    HA   VAL  27           HA       VAL  27   0.407   0.602   1.799
  197    HB   VAL  27           HB       VAL  27   2.434   1.812  -0.087
  198   HG11  VAL  27          HG11      VAL  27   0.396  -0.128  -0.544
  199   HG12  VAL  27          HG12      VAL  27  -0.063   1.380  -1.338
  200   HG13  VAL  27          HG13      VAL  27   1.489   0.624  -1.705
  201   HG21  VAL  27          HG21      VAL  27   1.408   3.671   0.739
  202   HG22  VAL  27          HG22      VAL  27   0.241   3.246  -0.514
  203   HG23  VAL  27          HG23      VAL  27  -0.068   2.804   1.165
  204    H    ASP  28           H        ASP  28   3.874   0.341   1.008
  205    HA   ASP  28           HA       ASP  28   3.756  -2.205  -0.150
  206    HB2  ASP  28           HB2      ASP  28   5.884  -0.461   0.949
  207    HB3  ASP  28           HB3      ASP  28   6.269  -2.177   0.844
  208    H    SER  29           H        SER  29   4.034  -1.190   3.196
  209    HA   SER  29           HA       SER  29   4.835  -3.570   4.382
  210    HB2  SER  29           HB2      SER  29   4.323  -1.166   5.374
  211    HB3  SER  29           HB3      SER  29   2.767  -1.905   5.754
  212    HG   SER  29           HG       SER  29   4.256  -3.677   6.625
  213    H    HIS  30           H        HIS  30   1.514  -2.409   3.816
  214    HA   HIS  30           HA       HIS  30   0.290  -4.813   4.722
  215    HB2  HIS  30           HB2      HIS  30  -0.901  -2.668   4.731
  216    HB3  HIS  30           HB3      HIS  30  -0.823  -2.608   2.973
  217    HD1  HIS  30           HD1      HIS  30  -3.046  -3.507   5.603
  218    HD2  HIS  30           HD2      HIS  30  -2.219  -5.033   1.828
  219    HE1  HIS  30           HE1      HIS  30  -5.043  -4.907   4.992
  220    H    LEU  31           H        LEU  31   1.349  -3.627   1.593
  221    HA   LEU  31           HA       LEU  31   0.048  -5.494  -0.042
  222    HB2  LEU  31           HB2      LEU  31   2.583  -3.918  -0.345
  223    HB3  LEU  31           HB3      LEU  31   2.047  -5.043  -1.591
  224    HG   LEU  31           HG       LEU  31   0.541  -2.610  -0.628
  225   HD11  LEU  31          HD11      LEU  31   2.499  -3.074  -2.756
  226   HD12  LEU  31          HD12      LEU  31   1.981  -1.572  -1.993
  227   HD13  LEU  31          HD13      LEU  31   1.015  -2.282  -3.286
  228   HD21  LEU  31          HD21      LEU  31  -0.108  -4.656  -2.746
  229   HD22  LEU  31          HD22      LEU  31  -0.946  -3.116  -2.553
  230   HD23  LEU  31          HD23      LEU  31  -1.015  -4.325  -1.270
  231    H    ALA  32           H        ALA  32   2.778  -5.802   2.047
  232    HA   ALA  32           HA       ALA  32   3.789  -8.207   0.812
  233    HB1  ALA  32           HB1      ALA  32   4.509  -7.270   3.567
  234    HB2  ALA  32           HB2      ALA  32   5.489  -8.164   2.406
  235    HB3  ALA  32           HB3      ALA  32   5.133  -6.459   2.131
  236    H    GLN  33           H        GLN  33   1.970  -7.381   3.744
  237    HA   GLN  33           HA       GLN  33   1.748 -10.091   4.624
  238    HB2  GLN  33           HB2      GLN  33   0.229  -7.606   5.426
  239    HB3  GLN  33           HB3      GLN  33   0.080  -9.162   6.229
  240    HG2  GLN  33           HG2      GLN  33   2.673  -8.945   6.476
  241    HG3  GLN  33           HG3      GLN  33   2.341  -7.229   6.246
  242   HE21  GLN  33          HE21      GLN  33   2.894  -9.412   8.531
  243   HE22  GLN  33          HE22      GLN  33   1.966  -8.763   9.835
  244    H    CYS  34           H        CYS  34  -0.162  -7.962   2.504
  245    HA   CYS  34           HA       CYS  34  -2.535  -9.437   2.654
  246    HB2  CYS  34           HB2      CYS  34  -2.050  -7.061   1.665
  247    HB3  CYS  34           HB3      CYS  34  -1.708  -7.928   0.181
  248    H    LEU  35           H        LEU  35   0.208  -9.426   0.390
  249    HA   LEU  35           HA       LEU  35  -0.717 -11.640  -1.152
  250    HB2  LEU  35           HB2      LEU  35   1.160 -11.355  -2.440
  251    HB3  LEU  35           HB3      LEU  35   0.947  -9.741  -1.766
  252    HG   LEU  35           HG       LEU  35   2.632 -10.705   0.054
  253   HD11  LEU  35          HD11      LEU  35   2.876 -12.497  -2.291
  254   HD12  LEU  35          HD12      LEU  35   3.166 -12.817  -0.581
  255   HD13  LEU  35          HD13      LEU  35   4.369 -11.944  -1.531
  256   HD21  LEU  35          HD21      LEU  35   4.127  -9.265  -0.844
  257   HD22  LEU  35          HD22      LEU  35   2.747  -8.819  -1.847
  258   HD23  LEU  35          HD23      LEU  35   3.965  -9.934  -2.468
  259    H    ALA  36           H        ALA  36   1.224 -11.280   1.708
  260    HA   ALA  36           HA       ALA  36   2.505 -13.802   1.663
  261    HB1  ALA  36           HB1      ALA  36   1.824 -11.986   3.970
  262    HB2  ALA  36           HB2      ALA  36   2.858 -13.410   4.087
  263    HB3  ALA  36           HB3      ALA  36   3.344 -12.048   3.076
  264    H    GLU  37           H        GLU  37  -0.624 -12.714   2.836
  265    HA   GLU  37           HA       GLU  37  -1.213 -15.275   4.062
  266    HB2  GLU  37           HB2      GLU  37  -3.322 -14.283   4.706
  267    HB3  GLU  37           HB3      GLU  37  -2.020 -13.160   5.065
  268    HG2  GLU  37           HG2      GLU  37  -2.574 -11.777   3.238
  269    HG3  GLU  37           HG3      GLU  37  -3.648 -12.994   2.549
  270    H    SER  38           H        SER  38  -1.784 -13.624   1.066
  271    HA   SER  38           HA       SER  38  -3.503 -15.848   0.181
  272    HB2  SER  38           HB2      SER  38  -4.673 -13.684   0.165
  273    HB3  SER  38           HB3      SER  38  -3.417 -13.010  -0.873
  274    HG   SER  38           HG       SER  38  -4.581 -13.737  -2.455
  275    H    THR  39           H        THR  39  -1.081 -16.642   0.021
  276    HA   THR  39           HA       THR  39   0.559 -15.780  -2.076
  277    HB   THR  39           HB       THR  39   1.518 -18.124  -1.986
  278    HG1  THR  39           HG1      THR  39   0.536 -19.595  -0.798
  279   HG21  THR  39          HG21      THR  39   2.679 -17.713   0.007
  280   HG22  THR  39          HG22      THR  39   1.290 -16.929   0.761
  281   HG23  THR  39          HG23      THR  39   2.174 -16.111  -0.527
  282    H    GLU  40           H        GLU  40  -0.314 -15.510  -4.061
  283    HA   GLU  40           HA       GLU  40  -1.946 -17.649  -5.207
  284    HB2  GLU  40           HB2      GLU  40  -1.477 -14.771  -5.889
  285    HB3  GLU  40           HB3      GLU  40  -2.067 -15.868  -7.130
  286    HG2  GLU  40           HG2      GLU  40  -3.907 -16.489  -5.501
  287    HG3  GLU  40           HG3      GLU  40  -3.390 -15.098  -4.550
  288    H    ASP  41           H        ASP  41   0.368 -18.747  -5.024
  289    HA   ASP  41           HA       ASP  41   1.996 -18.186  -7.378
  290    HB2  ASP  41           HB2      ASP  41   3.499 -19.952  -6.415
  291    HB3  ASP  41           HB3      ASP  41   3.240 -18.565  -5.358
  292    H    VAL  42           H        VAL  42  -0.424 -19.009  -8.199
  293    HA   VAL  42           HA       VAL  42  -0.312 -21.885  -8.692
  294    HB   VAL  42           HB       VAL  42  -2.424 -19.874  -9.485
  295   HG11  VAL  42          HG11      VAL  42  -2.393 -22.887  -9.610
  296   HG12  VAL  42          HG12      VAL  42  -3.820 -21.882  -9.878
  297   HG13  VAL  42          HG13      VAL  42  -2.442 -21.770 -10.975
  298   HG21  VAL  42          HG21      VAL  42  -2.222 -21.775  -7.159
  299   HG22  VAL  42          HG22      VAL  42  -2.404 -20.021  -7.114
  300   HG23  VAL  42          HG23      VAL  42  -3.737 -21.031  -7.672
  301    H    THR  43           H        THR  43   1.014 -22.451 -10.297
  302    HA   THR  43           HA       THR  43   1.232 -20.756 -12.671
  303    HB   THR  43           HB       THR  43   3.037 -22.505 -13.283
  304    HG1  THR  43           HG1      THR  43   3.185 -22.956 -10.512
  305   HG21  THR  43          HG21      THR  43   4.030 -20.531 -12.765
  306   HG22  THR  43          HG22      THR  43   4.517 -21.416 -11.320
  307   HG23  THR  43          HG23      THR  43   3.118 -20.342 -11.267
  308    H    TRP  44           H        TRP  44  -0.084 -23.778 -11.610
  309    HA   TRP  44           HA       TRP  44  -1.422 -24.118 -14.147
  310    HB2  TRP  44           HB2      TRP  44  -0.608 -26.326 -14.632
  311    HB3  TRP  44           HB3      TRP  44   0.788 -25.268 -14.445
  312    HD1  TRP  44           HD1      TRP  44   2.146 -25.501 -12.052
  313    HE1  TRP  44           HE1      TRP  44   2.506 -27.578 -10.575
  314    HE3  TRP  44           HE3      TRP  44  -1.608 -28.454 -13.875
  315    HZ2  TRP  44           HZ2      TRP  44   1.351 -30.131 -10.229
  316    HZ3  TRP  44           HZ3      TRP  44  -1.913 -30.700 -12.916
  317    HH2  TRP  44           HH2      TRP  44  -0.463 -31.519 -11.132
  Start of MODEL    5
    1    H1   SER   1           H        SER   1  14.403  11.692 -13.177
    2    HA   SER   1           HA       SER   1  16.051  11.039 -10.825
    3    HB2  SER   1           HB2      SER   1  14.534  13.513 -11.605
    4    HB3  SER   1           HB3      SER   1  14.906  13.191  -9.912
    5    HG   SER   1           HG       SER   1  16.620  13.794 -12.034
    6    H    HIS   2           H        HIS   2  14.341   9.102 -11.313
    7    HA   HIS   2           HA       HIS   2  12.612   9.127  -9.052
    8    HB2  HIS   2           HB2      HIS   2  10.494   8.727 -10.330
    9    HB3  HIS   2           HB3      HIS   2  11.116  10.368 -10.469
   10    HD1  HIS   2           HD1      HIS   2  10.468   7.280 -12.450
   11    HD2  HIS   2           HD2      HIS   2  12.044  11.081 -13.029
   12    HE1  HIS   2           HE1      HIS   2  10.619   7.573 -14.944
   13    H    MET   3           H        MET   3  11.999   7.074  -8.441
   14    HA   MET   3           HA       MET   3  13.023   4.898 -10.141
   15    HB2  MET   3           HB2      MET   3  13.206   3.599  -8.013
   16    HB3  MET   3           HB3      MET   3  14.257   5.007  -8.087
   17    HG2  MET   3           HG2      MET   3  12.902   6.224  -6.597
   18    HG3  MET   3           HG3      MET   3  11.578   5.069  -6.741
   19    HE1  MET   3           HE1      MET   3  11.166   3.260  -5.653
   20    HE2  MET   3           HE2      MET   3  12.464   2.066  -5.600
   21    HE3  MET   3           HE3      MET   3  11.860   2.780  -4.104
   22    H    GLY   4           H        GLY   4  10.393   6.062 -10.407
   23    HA2  GLY   4           HA2      GLY   4   8.836   3.766 -10.656
   24    HA3  GLY   4           HA3      GLY   4   8.427   4.493  -9.109
   25    H    ALA   5           H        ALA   5   7.747   4.444 -12.383
   26    HA   ALA   5           HA       ALA   5   6.812   7.173 -12.595
   27    HB1  ALA   5           HB1      ALA   5   7.700   6.194 -14.581
   28    HB2  ALA   5           HB2      ALA   5   6.610   4.813 -14.455
   29    HB3  ALA   5           HB3      ALA   5   5.966   6.414 -14.821
   30    H    ALA   6           H        ALA   6   5.388   3.946 -12.278
   31    HA   ALA   6           HA       ALA   6   2.794   5.229 -11.716
   32    HB1  ALA   6           HB1      ALA   6   2.498   3.961 -13.673
   33    HB2  ALA   6           HB2      ALA   6   3.421   2.602 -13.031
   34    HB3  ALA   6           HB3      ALA   6   1.828   2.973 -12.374
   35    H    ALA   7           H        ALA   7   1.653   4.605  -9.915
   36    HA   ALA   7           HA       ALA   7   2.731   2.484  -8.223
   37    HB1  ALA   7           HB1      ALA   7   3.753   4.771  -7.639
   38    HB2  ALA   7           HB2      ALA   7   2.161   5.151  -6.981
   39    HB3  ALA   7           HB3      ALA   7   3.082   3.796  -6.332
   40    H    LEU   8           H        LEU   8   1.259   2.449  -6.108
   41    HA   LEU   8           HA       LEU   8  -1.538   2.781  -6.967
   42    HB2  LEU   8           HB2      LEU   8  -2.012   0.695  -5.640
   43    HB3  LEU   8           HB3      LEU   8  -1.134   0.471  -7.151
   44    HG   LEU   8           HG       LEU   8   0.969   0.522  -5.589
   45   HD11  LEU   8          HD11      LEU   8  -1.108   0.723  -3.696
   46   HD12  LEU   8          HD12      LEU   8   0.618   0.522  -3.403
   47   HD13  LEU   8          HD13      LEU   8  -0.424  -0.894  -3.540
   48   HD21  LEU   8          HD21      LEU   8   0.729  -1.939  -5.281
   49   HD22  LEU   8          HD22      LEU   8   0.398  -1.383  -6.921
   50   HD23  LEU   8          HD23      LEU   8  -0.937  -1.799  -5.846
   51    H    ARG   9           H        ARG   9  -2.975   3.503  -5.452
   52    HA   ARG   9           HA       ARG   9  -1.820   4.296  -2.862
   53    HB2  ARG   9           HB2      ARG   9  -2.794   5.993  -4.639
   54    HB3  ARG   9           HB3      ARG   9  -4.329   5.519  -3.924
   55    HG2  ARG   9           HG2      ARG   9  -3.687   7.437  -2.759
   56    HG3  ARG   9           HG3      ARG   9  -3.278   6.101  -1.681
   57    HD2  ARG   9           HD2      ARG   9  -1.433   7.585  -1.641
   58    HD3  ARG   9           HD3      ARG   9  -0.946   6.204  -2.626
   59    HE   ARG   9           HE       ARG   9  -1.967   8.079  -4.376
   60   HH11  ARG   9          HH11      ARG   9   0.644   7.885  -2.082
   61   HH12  ARG   9          HH12      ARG   9   1.661   8.989  -2.949
   62   HH21  ARG   9          HH21      ARG   9  -0.638   9.532  -5.526
   63   HH22  ARG   9          HH22      ARG   9   0.931   9.926  -4.908
   64    H    SER  10           H        SER  10  -3.362   1.791  -3.884
   65    HA   SER  10           HA       SER  10  -4.900   1.468  -1.448
   66    HB2  SER  10           HB2      SER  10  -6.788   0.475  -3.060
   67    HB3  SER  10           HB3      SER  10  -6.782   2.166  -2.559
   68    HG   SER  10           HG       SER  10  -6.433   1.085  -5.035
   69    H    CYS  11           H        CYS  11  -5.910  -0.832  -1.454
   70    HA   CYS  11           HA       CYS  11  -3.860  -2.664  -2.503
   71    HB2  CYS  11           HB2      CYS  11  -4.350  -2.404   0.043
   72    HB3  CYS  11           HB3      CYS  11  -5.778  -3.376  -0.304
   73    HA   PRO  12           HA       PRO  12  -7.469  -3.756  -5.074
   74    HB2  PRO  12           HB2      PRO  12  -5.972  -4.723  -7.122
   75    HB3  PRO  12           HB3      PRO  12  -6.323  -3.003  -6.918
   76    HG2  PRO  12           HG2      PRO  12  -3.861  -4.533  -6.175
   77    HG3  PRO  12           HG3      PRO  12  -3.999  -2.941  -6.944
   78    HD2  PRO  12           HD2      PRO  12  -3.477  -3.245  -4.304
   79    HD3  PRO  12           HD3      PRO  12  -4.403  -1.871  -4.942
   80    H    MET  13           H        MET  13  -5.022  -5.503  -3.521
   81    HA   MET  13           HA       MET  13  -5.657  -8.105  -4.543
   82    HB2  MET  13           HB2      MET  13  -3.916  -7.010  -2.390
   83    HB3  MET  13           HB3      MET  13  -4.395  -8.699  -2.270
   84    HG2  MET  13           HG2      MET  13  -3.503  -9.060  -4.553
   85    HG3  MET  13           HG3      MET  13  -2.922  -7.397  -4.546
   86    HE1  MET  13           HE1      MET  13  -0.420  -6.747  -3.254
   87    HE2  MET  13           HE2      MET  13  -1.847  -6.584  -2.230
   88    HE3  MET  13           HE3      MET  13  -0.407  -7.397  -1.614
   89    H    CYS  14           H        CYS  14  -6.647  -6.159  -1.790
   90    HA   CYS  14           HA       CYS  14  -8.667  -8.207  -1.158
   91    HB2  CYS  14           HB2      CYS  14  -8.474  -7.673   1.199
   92    HB3  CYS  14           HB3      CYS  14  -6.889  -8.116   0.573
   93    H    GLN  15           H        GLN  15  -8.376  -5.413  -2.601
   94    HA   GLN  15           HA       GLN  15  -9.723  -3.628  -3.016
   95    HB2  GLN  15           HB2      GLN  15 -11.633  -5.609  -1.831
   96    HB3  GLN  15           HB3      GLN  15 -12.184  -3.979  -2.199
   97    HG2  GLN  15           HG2      GLN  15 -11.236  -4.387  -4.539
   98    HG3  GLN  15           HG3      GLN  15 -11.189  -6.088  -4.077
   99   HE21  GLN  15          HE21      GLN  15 -13.007  -7.258  -4.170
  100   HE22  GLN  15          HE22      GLN  15 -14.565  -6.629  -4.570
  101    H    LYS  16           H        LYS  16  -8.096  -3.125  -0.981
  102    HA   LYS  16           HA       LYS  16  -9.787  -1.865   1.077
  103    HB2  LYS  16           HB2      LYS  16  -8.326  -3.515   2.063
  104    HB3  LYS  16           HB3      LYS  16  -6.930  -2.837   1.236
  105    HG2  LYS  16           HG2      LYS  16  -6.973  -0.885   2.580
  106    HG3  LYS  16           HG3      LYS  16  -8.551  -1.303   3.249
  107    HD2  LYS  16           HD2      LYS  16  -7.642  -3.123   4.477
  108    HD3  LYS  16           HD3      LYS  16  -6.103  -3.017   3.620
  109    HE2  LYS  16           HE2      LYS  16  -5.717  -0.808   4.628
  110    HE3  LYS  16           HE3      LYS  16  -7.239  -0.955   5.508
  111    HZ1  LYS  16           HZ1      LYS  16  -6.120  -3.171   6.309
  112    HZ2  LYS  16           HZ2      LYS  16  -5.790  -1.700   7.075
  113    HZ3  LYS  16           HZ3      LYS  16  -4.694  -2.332   5.952
  114    H    GLU  17           H        GLU  17  -9.312   0.258   1.728
  115    HA   GLU  17           HA       GLU  17  -7.773   1.787  -0.258
  116    HB2  GLU  17           HB2      GLU  17 -10.143   2.491   1.452
  117    HB3  GLU  17           HB3      GLU  17  -9.138   3.741   0.733
  118    HG2  GLU  17           HG2      GLU  17  -9.598   2.799  -1.491
  119    HG3  GLU  17           HG3      GLU  17 -10.658   1.606  -0.745
  120    H    PHE  18           H        PHE  18  -5.987   2.826   0.349
  121    HA   PHE  18           HA       PHE  18  -5.129   2.667   3.103
  122    HB2  PHE  18           HB2      PHE  18  -3.777   3.774   0.635
  123    HB3  PHE  18           HB3      PHE  18  -3.022   3.683   2.225
  124    HD1  PHE  18           HD2      PHE  18  -3.823   1.069   3.192
  125    HD2  PHE  18           HD1      PHE  18  -2.662   2.281  -0.719
  126    HE1  PHE  18           HE2      PHE  18  -3.077  -1.224   2.707
  127    HE2  PHE  18           HE1      PHE  18  -1.914  -0.011  -1.211
  128    HZ   PHE  18           HZ       PHE  18  -2.122  -1.768   0.503
  129    H    ALA  19           H        ALA  19  -5.143   4.259   4.568
  130    HA   ALA  19           HA       ALA  19  -6.628   6.615   4.143
  131    HB1  ALA  19           HB1      ALA  19  -6.512   6.840   6.366
  132    HB2  ALA  19           HB2      ALA  19  -5.734   5.256   6.340
  133    HB3  ALA  19           HB3      ALA  19  -4.752   6.720   6.380
  134    HA   PRO  20           HA       PRO  20  -3.757   9.553   2.600
  135    HB2  PRO  20           HB2      PRO  20  -4.424  11.797   3.974
  136    HB3  PRO  20           HB3      PRO  20  -5.442  11.111   2.703
  137    HG2  PRO  20           HG2      PRO  20  -5.685  10.844   5.674
  138    HG3  PRO  20           HG3      PRO  20  -6.955  11.127   4.469
  139    HD2  PRO  20           HD2      PRO  20  -6.479   8.685   5.538
  140    HD3  PRO  20           HD3      PRO  20  -7.062   8.902   3.876
  141    H    ARG  21           H        ARG  21  -3.923   9.148   6.079
  142    HA   ARG  21           HA       ARG  21  -1.564  10.625   6.686
  143    HB2  ARG  21           HB2      ARG  21  -1.703   9.437   8.885
  144    HB3  ARG  21           HB3      ARG  21  -3.176  10.279   8.426
  145    HG2  ARG  21           HG2      ARG  21  -4.271   8.260   7.868
  146    HG3  ARG  21           HG3      ARG  21  -2.765   7.343   7.944
  147    HD2  ARG  21           HD2      ARG  21  -3.329   6.838  10.041
  148    HD3  ARG  21           HD3      ARG  21  -2.942   8.511  10.439
  149    HE   ARG  21           HE       ARG  21  -5.573   7.332  10.220
  150   HH11  ARG  21          HH11      ARG  21  -3.695  10.263  10.299
  151   HH12  ARG  21          HH12      ARG  21  -5.026  11.257  10.791
  152   HH21  ARG  21          HH21      ARG  21  -7.332   8.631  10.869
  153   HH22  ARG  21          HH22      ARG  21  -7.095  10.327  11.116
  154    H    LEU  22           H        LEU  22  -2.193   7.394   5.607
  155    HA   LEU  22           HA       LEU  22   0.159   6.127   6.473
  156    HB2  LEU  22           HB2      LEU  22  -1.658   5.638   4.129
  157    HB3  LEU  22           HB3      LEU  22  -0.271   4.610   4.484
  158    HG   LEU  22           HG       LEU  22  -2.590   5.062   6.360
  159   HD11  LEU  22          HD11      LEU  22  -2.020   2.602   4.727
  160   HD12  LEU  22          HD12      LEU  22  -3.143   3.860   4.213
  161   HD13  LEU  22          HD13      LEU  22  -3.447   2.961   5.699
  162   HD21  LEU  22          HD21      LEU  22  -0.943   2.684   6.679
  163   HD22  LEU  22          HD22      LEU  22  -1.480   3.861   7.878
  164   HD23  LEU  22          HD23      LEU  22  -0.041   4.182   6.909
  165    H    THR  23           H        THR  23   2.087   5.632   5.344
  166    HA   THR  23           HA       THR  23   2.802   7.640   3.310
  167    HB   THR  23           HB       THR  23   5.217   6.887   4.105
  168    HG1  THR  23           HG1      THR  23   3.739   6.603   6.515
  169   HG21  THR  23          HG21      THR  23   3.402   8.800   5.573
  170   HG22  THR  23          HG22      THR  23   4.473   9.166   4.221
  171   HG23  THR  23          HG23      THR  23   5.150   8.734   5.790
  172    H    GLN  24           H        GLN  24   4.780   6.845   1.971
  173    HA   GLN  24           HA       GLN  24   3.953   4.778   0.316
  174    HB2  GLN  24           HB2      GLN  24   6.287   4.814  -0.576
  175    HB3  GLN  24           HB3      GLN  24   5.532   6.400  -0.479
  176    HG2  GLN  24           HG2      GLN  24   6.768   6.903   1.537
  177    HG3  GLN  24           HG3      GLN  24   7.468   5.285   1.538
  178   HE21  GLN  24          HE21      GLN  24   7.541   8.439   0.136
  179   HE22  GLN  24          HE22      GLN  24   8.984   8.226  -0.790
  180    H    LEU  25           H        LEU  25   6.028   4.703   3.148
  181    HA   LEU  25           HA       LEU  25   6.922   2.022   2.793
  182    HB2  LEU  25           HB2      LEU  25   7.896   2.212   4.924
  183    HB3  LEU  25           HB3      LEU  25   8.025   3.807   4.187
  184    HG   LEU  25           HG       LEU  25   5.771   4.187   5.553
  185   HD11  LEU  25          HD11      LEU  25   6.806   2.888   7.816
  186   HD12  LEU  25          HD12      LEU  25   6.750   1.680   6.533
  187   HD13  LEU  25          HD13      LEU  25   5.289   2.561   6.979
  188   HD21  LEU  25          HD21      LEU  25   7.021   5.449   7.035
  189   HD22  LEU  25          HD22      LEU  25   8.114   5.294   5.659
  190   HD23  LEU  25          HD23      LEU  25   8.338   4.279   7.085
  191    H    ASP  26           H        ASP  26   4.207   3.524   4.437
  192    HA   ASP  26           HA       ASP  26   3.361   1.254   5.894
  193    HB2  ASP  26           HB2      ASP  26   1.913   3.728   4.950
  194    HB3  ASP  26           HB3      ASP  26   1.123   2.478   5.909
  195    H    VAL  27           H        VAL  27   2.515   2.493   2.689
  196    HA   VAL  27           HA       VAL  27   0.458   0.703   2.081
  197    HB   VAL  27           HB       VAL  27   2.454   1.953   0.190
  198   HG11  VAL  27          HG11      VAL  27   0.323   0.071  -0.247
  199   HG12  VAL  27          HG12      VAL  27  -0.012   1.591  -1.079
  200   HG13  VAL  27          HG13      VAL  27   1.493   0.724  -1.393
  201   HG21  VAL  27          HG21      VAL  27   1.414   3.750   1.222
  202   HG22  VAL  27          HG22      VAL  27   0.401   3.485  -0.195
  203   HG23  VAL  27          HG23      VAL  27  -0.122   2.900   1.383
  204    H    ASP  28           H        ASP  28   3.932   0.472   1.334
  205    HA   ASP  28           HA       ASP  28   3.834  -2.036   0.085
  206    HB2  ASP  28           HB2      ASP  28   5.948  -0.333   1.280
  207    HB3  ASP  28           HB3      ASP  28   6.333  -2.041   1.092
  208    H    SER  29           H        SER  29   4.067  -1.121   3.463
  209    HA   SER  29           HA       SER  29   4.863  -3.527   4.592
  210    HB2  SER  29           HB2      SER  29   4.323  -1.165   5.652
  211    HB3  SER  29           HB3      SER  29   2.755  -1.908   5.967
  212    HG   SER  29           HG       SER  29   5.298  -2.841   6.815
  213    H    HIS  30           H        HIS  30   1.540  -2.380   4.005
  214    HA   HIS  30           HA       HIS  30   0.320  -4.813   4.823
  215    HB2  HIS  30           HB2      HIS  30  -0.881  -2.667   4.841
  216    HB3  HIS  30           HB3      HIS  30  -0.780  -2.594   3.085
  217    HD1  HIS  30           HD1      HIS  30  -3.008  -3.572   5.700
  218    HD2  HIS  30           HD2      HIS  30  -2.165  -4.978   1.883
  219    HE1  HIS  30           HE1      HIS  30  -4.991  -4.974   5.047
  220    H    LEU  31           H        LEU  31   1.367  -3.523   1.720
  221    HA   LEU  31           HA       LEU  31   0.143  -5.354   0.017
  222    HB2  LEU  31           HB2      LEU  31   2.707  -3.809  -0.169
  223    HB3  LEU  31           HB3      LEU  31   2.190  -4.892  -1.460
  224    HG   LEU  31           HG       LEU  31   0.659  -2.485  -0.472
  225   HD11  LEU  31          HD11      LEU  31   1.351  -1.363  -2.427
  226   HD12  LEU  31          HD12      LEU  31   2.046  -2.829  -3.116
  227   HD13  LEU  31          HD13      LEU  31   2.814  -2.058  -1.728
  228   HD21  LEU  31          HD21      LEU  31  -1.089  -3.247  -1.606
  229   HD22  LEU  31          HD22      LEU  31  -0.224  -4.763  -1.859
  230   HD23  LEU  31          HD23      LEU  31  -0.104  -3.469  -3.052
  231    H    ALA  32           H        ALA  32   2.891  -5.706   2.110
  232    HA   ALA  32           HA       ALA  32   3.874  -8.108   0.871
  233    HB1  ALA  32           HB1      ALA  32   4.543  -7.267   3.666
  234    HB2  ALA  32           HB2      ALA  32   5.548  -8.105   2.482
  235    HB3  ALA  32           HB3      ALA  32   5.188  -6.390   2.277
  236    H    GLN  33           H        GLN  33   2.020  -7.336   3.799
  237    HA   GLN  33           HA       GLN  33   1.761 -10.035   4.650
  238    HB2  GLN  33           HB2      GLN  33   0.234  -7.529   5.352
  239    HB3  GLN  33           HB3      GLN  33  -0.086  -9.088   6.100
  240    HG2  GLN  33           HG2      GLN  33   2.693  -8.027   6.118
  241    HG3  GLN  33           HG3      GLN  33   1.506  -7.347   7.228
  242   HE21  GLN  33          HE21      GLN  33   1.287  -8.314   9.112
  243   HE22  GLN  33          HE22      GLN  33   1.776  -9.928   9.489
  244    H    CYS  34           H        CYS  34  -0.129  -7.929   2.470
  245    HA   CYS  34           HA       CYS  34  -2.410  -9.585   2.475
  246    HB2  CYS  34           HB2      CYS  34  -2.003  -7.079   1.648
  247    HB3  CYS  34           HB3      CYS  34  -1.755  -7.874   0.107
  248    H    LEU  35           H        LEU  35   0.627  -9.444   0.751
  249    HA   LEU  35           HA       LEU  35  -0.059 -11.301  -1.313
  250    HB2  LEU  35           HB2      LEU  35   2.500 -10.096  -0.328
  251    HB3  LEU  35           HB3      LEU  35   2.517 -11.398  -1.516
  252    HG   LEU  35           HG       LEU  35   0.960  -8.874  -1.986
  253   HD11  LEU  35          HD11      LEU  35   3.492  -8.952  -3.361
  254   HD12  LEU  35          HD12      LEU  35   3.719  -8.940  -1.613
  255   HD13  LEU  35          HD13      LEU  35   2.778  -7.666  -2.387
  256   HD21  LEU  35          HD21      LEU  35   2.230 -10.860  -3.867
  257   HD22  LEU  35          HD22      LEU  35   1.198  -9.499  -4.306
  258   HD23  LEU  35          HD23      LEU  35   0.530 -10.856  -3.397
  259    H    ALA  36           H        ALA  36   1.175 -11.541   1.925
  260    HA   ALA  36           HA       ALA  36   2.257 -14.158   1.741
  261    HB1  ALA  36           HB1      ALA  36   1.192 -12.749   4.185
  262    HB2  ALA  36           HB2      ALA  36   2.289 -14.129   4.157
  263    HB3  ALA  36           HB3      ALA  36   2.823 -12.567   3.539
  264    H    GLU  37           H        GLU  37  -0.944 -12.896   2.493
  265    HA   GLU  37           HA       GLU  37  -2.128 -15.215   3.487
  266    HB2  GLU  37           HB2      GLU  37  -4.171 -14.146   3.212
  267    HB3  GLU  37           HB3      GLU  37  -3.051 -12.795   3.309
  268    HG2  GLU  37           HG2      GLU  37  -4.177 -12.103   1.494
  269    HG3  GLU  37           HG3      GLU  37  -3.051 -13.171   0.660
  270    H    SER  38           H        SER  38  -1.169 -14.392   0.281
  271    HA   SER  38           HA       SER  38  -2.675 -16.664  -0.818
  272    HB2  SER  38           HB2      SER  38  -2.756 -14.258  -1.830
  273    HB3  SER  38           HB3      SER  38  -1.185 -14.681  -2.511
  274    HG   SER  38           HG       SER  38  -2.106 -16.226  -3.723
  275    H    THR  39           H        THR  39  -1.460 -18.442  -0.479
  276    HA   THR  39           HA       THR  39   1.369 -18.354  -1.290
  277    HB   THR  39           HB       THR  39   0.150 -20.553   0.361
  278    HG1  THR  39           HG1      THR  39   0.332 -19.356   2.132
  279   HG21  THR  39          HG21      THR  39   2.651 -20.348   1.225
  280   HG22  THR  39          HG22      THR  39   2.883 -19.635  -0.372
  281   HG23  THR  39          HG23      THR  39   2.242 -21.272  -0.220
  282    H    GLU  40           H        GLU  40  -0.334 -18.500  -3.373
  283    HA   GLU  40           HA       GLU  40  -0.364 -21.346  -4.129
  284    HB2  GLU  40           HB2      GLU  40  -2.037 -19.030  -5.104
  285    HB3  GLU  40           HB3      GLU  40  -2.013 -20.602  -5.891
  286    HG2  GLU  40           HG2      GLU  40  -2.673 -21.562  -3.627
  287    HG3  GLU  40           HG3      GLU  40  -3.026 -19.899  -3.160
  288    H    ASP  41           H        ASP  41   2.048 -20.042  -4.270
  289    HA   ASP  41           HA       ASP  41   2.399 -19.656  -7.171
  290    HB2  ASP  41           HB2      ASP  41   2.799 -17.637  -5.623
  291    HB3  ASP  41           HB3      ASP  41   4.246 -18.493  -5.096
  292    H    VAL  42           H        VAL  42   2.435 -22.194  -6.307
  293    HA   VAL  42           HA       VAL  42   5.297 -22.881  -6.133
  294    HB   VAL  42           HB       VAL  42   2.940 -24.540  -5.226
  295   HG11  VAL  42          HG11      VAL  42   4.327 -26.271  -5.347
  296   HG12  VAL  42          HG12      VAL  42   5.662 -25.226  -5.839
  297   HG13  VAL  42          HG13      VAL  42   5.335 -25.493  -4.126
  298   HG21  VAL  42          HG21      VAL  42   3.336 -22.614  -3.775
  299   HG22  VAL  42          HG22      VAL  42   3.764 -24.119  -2.963
  300   HG23  VAL  42          HG23      VAL  42   5.030 -23.078  -3.612
  301    H    THR  43           H        THR  43   5.927 -23.243  -8.181
  302    HA   THR  43           HA       THR  43   4.220 -24.911  -9.899
  303    HB   THR  43           HB       THR  43   4.712 -22.843 -10.982
  304    HG1  THR  43           HG1      THR  43   5.131 -23.920 -12.746
  305   HG21  THR  43          HG21      THR  43   6.565 -22.018  -9.737
  306   HG22  THR  43          HG22      THR  43   7.112 -22.181 -11.406
  307   HG23  THR  43          HG23      THR  43   7.573 -23.387 -10.205
  308    H    TRP  44           H        TRP  44   7.281 -24.749  -8.290
  309    HA   TRP  44           HA       TRP  44   8.491 -26.890  -9.785
  310    HB2  TRP  44           HB2      TRP  44   9.729 -25.006  -8.588
  311    HB3  TRP  44           HB3      TRP  44   9.381 -25.865  -7.090
  312    HD1  TRP  44           HD1      TRP  44  10.939 -26.856 -10.520
  313    HE1  TRP  44           HE1      TRP  44  12.987 -28.341 -10.047
  314    HE3  TRP  44           HE3      TRP  44  10.707 -26.957  -5.414
  315    HZ2  TRP  44           HZ2      TRP  44  14.327 -29.415  -7.806
  316    HZ3  TRP  44           HZ3      TRP  44  12.408 -28.237  -4.181
  317    HH2  TRP  44           HH2      TRP  44  14.180 -29.440  -5.354
  Start of MODEL    6
    1    H1   SER   1           H        SER   1  -5.410 -10.876 -16.567
    2    HA   SER   1           HA       SER   1  -5.785  -8.060 -16.186
    3    HB2  SER   1           HB2      SER   1  -6.608  -8.812 -13.896
    4    HB3  SER   1           HB3      SER   1  -7.476  -9.471 -15.283
    5    HG   SER   1           HG       SER   1  -6.941 -11.375 -14.608
    6    H    HIS   2           H        HIS   2  -3.108  -8.457 -16.554
    7    HA   HIS   2           HA       HIS   2  -1.967  -8.114 -13.860
    8    HB2  HIS   2           HB2      HIS   2   0.234  -8.645 -15.026
    9    HB3  HIS   2           HB3      HIS   2  -0.901  -9.980 -14.856
   10    HD1  HIS   2           HD1      HIS   2   0.929  -8.001 -17.361
   11    HD2  HIS   2           HD2      HIS   2  -2.214 -10.716 -17.304
   12    HE1  HIS   2           HE1      HIS   2   0.632  -8.735 -19.747
   13    H    MET   3           H        MET   3  -3.252  -5.956 -14.943
   14    HA   MET   3           HA       MET   3  -1.090  -4.242 -15.962
   15    HB2  MET   3           HB2      MET   3  -3.136  -4.410 -17.363
   16    HB3  MET   3           HB3      MET   3  -4.072  -3.748 -16.029
   17    HG2  MET   3           HG2      MET   3  -3.663  -1.970 -17.519
   18    HG3  MET   3           HG3      MET   3  -2.605  -1.721 -16.132
   19    HE1  MET   3           HE1      MET   3  -1.947   0.026 -18.041
   20    HE2  MET   3           HE2      MET   3  -0.415  -0.285 -17.225
   21    HE3  MET   3           HE3      MET   3  -0.487  -0.266 -18.988
   22    H    GLY   4           H        GLY   4  -0.124  -3.796 -13.962
   23    HA2  GLY   4           HA2      GLY   4  -1.800  -2.261 -12.074
   24    HA3  GLY   4           HA3      GLY   4  -0.372  -3.176 -11.613
   25    H    ALA   5           H        ALA   5   0.833  -1.557 -10.742
   26    HA   ALA   5           HA       ALA   5   2.125   0.233 -12.587
   27    HB1  ALA   5           HB1      ALA   5   0.808   1.996 -12.266
   28    HB2  ALA   5           HB2      ALA   5  -0.086   1.176 -10.986
   29    HB3  ALA   5           HB3      ALA   5   1.400   2.045 -10.605
   30    H    ALA   6           H        ALA   6   3.666   1.740 -11.270
   31    HA   ALA   6           HA       ALA   6   5.082   0.003  -9.401
   32    HB1  ALA   6           HB1      ALA   6   6.993   1.403  -9.766
   33    HB2  ALA   6           HB2      ALA   6   6.270   1.027 -11.331
   34    HB3  ALA   6           HB3      ALA   6   6.008   2.609 -10.597
   35    H    ALA   7           H        ALA   7   2.671   2.030  -9.003
   36    HA   ALA   7           HA       ALA   7   3.298   2.597  -6.279
   37    HB1  ALA   7           HB1      ALA   7   4.416   4.436  -7.832
   38    HB2  ALA   7           HB2      ALA   7   2.793   5.122  -7.753
   39    HB3  ALA   7           HB3      ALA   7   3.702   4.836  -6.269
   40    H    LEU   8           H        LEU   8   1.414   2.002  -5.428
   41    HA   LEU   8           HA       LEU   8  -1.058   3.052  -6.642
   42    HB2  LEU   8           HB2      LEU   8  -2.090   1.009  -5.426
   43    HB3  LEU   8           HB3      LEU   8  -1.275   0.788  -6.973
   44    HG   LEU   8           HG       LEU   8   0.758   0.064  -5.686
   45   HD11  LEU   8          HD11      LEU   8  -0.262  -0.856  -3.328
   46   HD12  LEU   8          HD12      LEU   8  -1.027   0.727  -3.469
   47   HD13  LEU   8          HD13      LEU   8   0.730   0.590  -3.513
   48   HD21  LEU   8          HD21      LEU   8   0.093  -2.090  -5.827
   49   HD22  LEU   8          HD22      LEU   8  -1.322  -1.370  -6.597
   50   HD23  LEU   8          HD23      LEU   8  -1.375  -1.814  -4.890
   51    H    ARG   9           H        ARG   9  -2.711   3.741  -5.251
   52    HA   ARG   9           HA       ARG   9  -1.766   4.459  -2.566
   53    HB2  ARG   9           HB2      ARG   9  -2.695   6.133  -4.388
   54    HB3  ARG   9           HB3      ARG   9  -4.251   5.608  -3.759
   55    HG2  ARG   9           HG2      ARG   9  -3.725   7.546  -2.561
   56    HG3  ARG   9           HG3      ARG   9  -3.358   6.215  -1.462
   57    HD2  ARG   9           HD2      ARG   9  -1.471   7.493  -1.214
   58    HD3  ARG   9           HD3      ARG   9  -0.965   6.422  -2.521
   59    HE   ARG   9           HE       ARG   9  -2.116   8.668  -3.687
   60   HH11  ARG   9          HH11      ARG   9   0.641   7.881  -1.711
   61   HH12  ARG   9          HH12      ARG   9   1.616   9.173  -2.328
   62   HH21  ARG   9          HH21      ARG   9  -0.842  10.373  -4.508
   63   HH22  ARG   9          HH22      ARG   9   0.771  10.590  -3.918
   64    H    SER  10           H        SER  10  -3.207   1.928  -3.713
   65    HA   SER  10           HA       SER  10  -4.831   1.520  -1.347
   66    HB2  SER  10           HB2      SER  10  -6.670   0.554  -2.979
   67    HB3  SER  10           HB3      SER  10  -6.650   2.268  -2.563
   68    HG   SER  10           HG       SER  10  -5.213   2.375  -4.550
   69    H    CYS  11           H        CYS  11  -5.825  -0.802  -1.487
   70    HA   CYS  11           HA       CYS  11  -3.709  -2.573  -2.516
   71    HB2  CYS  11           HB2      CYS  11  -4.151  -2.393   0.016
   72    HB3  CYS  11           HB3      CYS  11  -5.628  -3.293  -0.312
   73    HA   PRO  12           HA       PRO  12  -7.267  -3.695  -5.135
   74    HB2  PRO  12           HB2      PRO  12  -5.732  -4.644  -7.164
   75    HB3  PRO  12           HB3      PRO  12  -6.099  -2.927  -6.958
   76    HG2  PRO  12           HG2      PRO  12  -3.637  -4.443  -6.185
   77    HG3  PRO  12           HG3      PRO  12  -3.775  -2.848  -6.948
   78    HD2  PRO  12           HD2      PRO  12  -3.289  -3.160  -4.303
   79    HD3  PRO  12           HD3      PRO  12  -4.216  -1.790  -4.949
   80    H    MET  13           H        MET  13  -4.842  -5.430  -3.540
   81    HA   MET  13           HA       MET  13  -5.425  -8.032  -4.587
   82    HB2  MET  13           HB2      MET  13  -3.335  -7.041  -3.214
   83    HB3  MET  13           HB3      MET  13  -4.229  -7.770  -1.886
   84    HG2  MET  13           HG2      MET  13  -4.265  -9.900  -3.190
   85    HG3  MET  13           HG3      MET  13  -3.180  -9.135  -4.349
   86    HE1  MET  13           HE1      MET  13  -1.729  -7.284  -1.930
   87    HE2  MET  13           HE2      MET  13  -0.241  -8.210  -1.729
   88    HE3  MET  13           HE3      MET  13  -0.853  -7.866  -3.348
   89    H    CYS  14           H        CYS  14  -6.447  -6.150  -1.786
   90    HA   CYS  14           HA       CYS  14  -8.489  -8.205  -1.245
   91    HB2  CYS  14           HB2      CYS  14  -8.355  -7.688   1.120
   92    HB3  CYS  14           HB3      CYS  14  -6.753  -8.113   0.528
   93    H    GLN  15           H        GLN  15  -8.163  -5.367  -2.629
   94    HA   GLN  15           HA       GLN  15  -9.509  -3.583  -3.052
   95    HB2  GLN  15           HB2      GLN  15 -11.516  -5.514  -1.901
   96    HB3  GLN  15           HB3      GLN  15 -11.978  -3.933  -2.514
   97    HG2  GLN  15           HG2      GLN  15 -12.300  -5.054  -4.424
   98    HG3  GLN  15           HG3      GLN  15 -10.559  -4.848  -4.605
   99   HE21  GLN  15          HE21      GLN  15 -13.110  -7.060  -3.737
  100   HE22  GLN  15          HE22      GLN  15 -12.178  -8.506  -3.886
  101    H    LYS  16           H        LYS  16  -7.983  -3.090  -0.954
  102    HA   LYS  16           HA       LYS  16  -9.785  -1.875   1.037
  103    HB2  LYS  16           HB2      LYS  16  -8.499  -3.541   2.155
  104    HB3  LYS  16           HB3      LYS  16  -7.016  -3.024   1.363
  105    HG2  LYS  16           HG2      LYS  16  -6.749  -1.209   2.740
  106    HG3  LYS  16           HG3      LYS  16  -8.472  -1.099   3.108
  107    HD2  LYS  16           HD2      LYS  16  -8.070  -3.429   4.236
  108    HD3  LYS  16           HD3      LYS  16  -6.388  -2.894   4.272
  109    HE2  LYS  16           HE2      LYS  16  -7.003  -1.986   6.243
  110    HE3  LYS  16           HE3      LYS  16  -7.607  -0.686   5.217
  111    HZ1  LYS  16           HZ1      LYS  16  -9.712  -2.277   5.212
  112    HZ2  LYS  16           HZ2      LYS  16  -9.475  -1.090   6.393
  113    HZ3  LYS  16           HZ3      LYS  16  -9.078  -2.701   6.722
  114    H    GLU  17           H        GLU  17  -9.492   0.253   1.571
  115    HA   GLU  17           HA       GLU  17  -7.734   1.770  -0.207
  116    HB2  GLU  17           HB2      GLU  17 -10.271   2.320   1.211
  117    HB3  GLU  17           HB3      GLU  17  -9.151   3.671   1.092
  118    HG2  GLU  17           HG2      GLU  17  -9.273   2.462  -1.454
  119    HG3  GLU  17           HG3      GLU  17 -10.928   2.637  -0.874
  120    H    PHE  18           H        PHE  18  -6.026   2.919   0.489
  121    HA   PHE  18           HA       PHE  18  -5.205   2.576   3.248
  122    HB2  PHE  18           HB2      PHE  18  -3.822   3.791   0.852
  123    HB3  PHE  18           HB3      PHE  18  -3.097   3.694   2.454
  124    HD1  PHE  18           HD2      PHE  18  -3.788   1.061   3.387
  125    HD2  PHE  18           HD1      PHE  18  -2.698   2.334  -0.525
  126    HE1  PHE  18           HE2      PHE  18  -2.972  -1.204   2.881
  127    HE2  PHE  18           HE1      PHE  18  -1.880   0.072  -1.038
  128    HZ   PHE  18           HZ       PHE  18  -2.017  -1.702   0.666
  129    H    ALA  19           H        ALA  19  -5.232   4.093   4.795
  130    HA   ALA  19           HA       ALA  19  -6.797   6.379   4.606
  131    HB1  ALA  19           HB1      ALA  19  -6.409   6.582   6.802
  132    HB2  ALA  19           HB2      ALA  19  -5.554   5.048   6.637
  133    HB3  ALA  19           HB3      ALA  19  -4.658   6.566   6.592
  134    HA   PRO  20           HA       PRO  20  -4.355   9.542   2.795
  135    HB2  PRO  20           HB2      PRO  20  -4.997  11.708   4.301
  136    HB3  PRO  20           HB3      PRO  20  -6.117  10.973   3.148
  137    HG2  PRO  20           HG2      PRO  20  -5.964  10.637   6.120
  138    HG3  PRO  20           HG3      PRO  20  -7.392  10.848   5.090
  139    HD2  PRO  20           HD2      PRO  20  -6.618   8.430   6.026
  140    HD3  PRO  20           HD3      PRO  20  -7.418   8.633   4.455
  141    H    ARG  21           H        ARG  21  -3.992   8.922   6.204
  142    HA   ARG  21           HA       ARG  21  -1.650  10.574   6.508
  143    HB2  ARG  21           HB2      ARG  21  -1.504   9.481   8.750
  144    HB3  ARG  21           HB3      ARG  21  -3.043  10.271   8.438
  145    HG2  ARG  21           HG2      ARG  21  -3.016   7.462   7.665
  146    HG3  ARG  21           HG3      ARG  21  -2.711   7.726   9.384
  147    HD2  ARG  21           HD2      ARG  21  -4.769   9.424   8.989
  148    HD3  ARG  21           HD3      ARG  21  -5.149   8.187   7.792
  149    HE   ARG  21           HE       ARG  21  -4.537   6.944  10.233
  150   HH11  ARG  21          HH11      ARG  21  -7.000   8.924   8.774
  151   HH12  ARG  21          HH12      ARG  21  -8.274   8.305   9.773
  152   HH21  ARG  21          HH21      ARG  21  -6.204   6.121  11.555
  153   HH22  ARG  21          HH22      ARG  21  -7.820   6.711  11.355
  154    H    LEU  22           H        LEU  22  -2.350   7.305   5.615
  155    HA   LEU  22           HA       LEU  22   0.066   6.054   6.254
  156    HB2  LEU  22           HB2      LEU  22  -2.007   5.576   4.147
  157    HB3  LEU  22           HB3      LEU  22  -0.540   4.602   4.201
  158    HG   LEU  22           HG       LEU  22  -2.603   4.817   6.394
  159   HD11  LEU  22          HD11      LEU  22  -3.381   3.575   4.428
  160   HD12  LEU  22          HD12      LEU  22  -3.151   2.525   5.825
  161   HD13  LEU  22          HD13      LEU  22  -1.957   2.539   4.527
  162   HD21  LEU  22          HD21      LEU  22   0.121   4.074   6.504
  163   HD22  LEU  22          HD22      LEU  22  -0.832   2.596   6.646
  164   HD23  LEU  22          HD23      LEU  22  -1.102   3.933   7.767
  165    H    THR  23           H        THR  23   1.974   5.735   5.141
  166    HA   THR  23           HA       THR  23   2.476   7.643   2.955
  167    HB   THR  23           HB       THR  23   4.945   7.179   3.618
  168    HG1  THR  23           HG1      THR  23   5.212   6.505   5.745
  169   HG21  THR  23          HG21      THR  23   3.052   8.771   5.347
  170   HG22  THR  23          HG22      THR  23   3.947   9.340   3.938
  171   HG23  THR  23          HG23      THR  23   4.807   8.910   5.416
  172    H    GLN  24           H        GLN  24   4.440   6.876   1.568
  173    HA   GLN  24           HA       GLN  24   3.638   4.681   0.062
  174    HB2  GLN  24           HB2      GLN  24   5.908   4.808  -0.969
  175    HB3  GLN  24           HB3      GLN  24   5.067   6.350  -0.906
  176    HG2  GLN  24           HG2      GLN  24   6.367   6.934   1.112
  177    HG3  GLN  24           HG3      GLN  24   7.262   5.426   0.931
  178   HE21  GLN  24          HE21      GLN  24   8.719   7.630   0.985
  179   HE22  GLN  24          HE22      GLN  24   9.308   8.047  -0.584
  180    H    LEU  25           H        LEU  25   5.994   4.897   2.680
  181    HA   LEU  25           HA       LEU  25   7.014   2.276   2.440
  182    HB2  LEU  25           HB2      LEU  25   7.994   2.613   4.580
  183    HB3  LEU  25           HB3      LEU  25   8.075   4.139   3.702
  184    HG   LEU  25           HG       LEU  25   5.826   4.582   5.062
  185   HD11  LEU  25          HD11      LEU  25   5.425   2.942   6.520
  186   HD12  LEU  25          HD12      LEU  25   6.768   3.610   7.447
  187   HD13  LEU  25          HD13      LEU  25   7.043   2.264   6.341
  188   HD21  LEU  25          HD21      LEU  25   7.471   6.172   5.284
  189   HD22  LEU  25          HD22      LEU  25   8.695   4.998   5.767
  190   HD23  LEU  25          HD23      LEU  25   7.443   5.487   6.909
  191    H    ASP  26           H        ASP  26   4.279   3.629   4.194
  192    HA   ASP  26           HA       ASP  26   3.673   1.328   5.722
  193    HB2  ASP  26           HB2      ASP  26   2.159   3.788   4.924
  194    HB3  ASP  26           HB3      ASP  26   1.304   2.452   5.694
  195    H    VAL  27           H        VAL  27   2.582   2.464   2.556
  196    HA   VAL  27           HA       VAL  27   0.585   0.588   2.070
  197    HB   VAL  27           HB       VAL  27   2.480   1.834   0.074
  198   HG11  VAL  27          HG11      VAL  27   1.533   0.454  -1.397
  199   HG12  VAL  27          HG12      VAL  27   0.333  -0.092  -0.224
  200   HG13  VAL  27          HG13      VAL  27   0.048   1.375  -1.163
  201   HG21  VAL  27          HG21      VAL  27   0.265   3.220  -0.276
  202   HG22  VAL  27          HG22      VAL  27  -0.020   2.758   1.401
  203   HG23  VAL  27          HG23      VAL  27   1.432   3.663   0.971
  204    H    ASP  28           H        ASP  28   4.018   0.435   1.120
  205    HA   ASP  28           HA       ASP  28   3.984  -2.088  -0.042
  206    HB2  ASP  28           HB2      ASP  28   6.035  -0.290   1.067
  207    HB3  ASP  28           HB3      ASP  28   6.480  -1.995   1.070
  208    H    SER  29           H        SER  29   4.188  -1.157   3.334
  209    HA   SER  29           HA       SER  29   5.003  -3.577   4.451
  210    HB2  SER  29           HB2      SER  29   4.505  -1.197   5.512
  211    HB3  SER  29           HB3      SER  29   2.949  -1.943   5.879
  212    HG   SER  29           HG       SER  29   3.888  -3.259   7.266
  213    H    HIS  30           H        HIS  30   1.697  -2.384   3.881
  214    HA   HIS  30           HA       HIS  30   0.422  -4.755   4.767
  215    HB2  HIS  30           HB2      HIS  30  -0.731  -2.581   4.672
  216    HB3  HIS  30           HB3      HIS  30  -0.615  -2.598   2.915
  217    HD1  HIS  30           HD1      HIS  30  -2.899  -3.369   5.540
  218    HD2  HIS  30           HD2      HIS  30  -2.025  -5.040   1.837
  219    HE1  HIS  30           HE1      HIS  30  -4.902  -4.768   4.943
  220    H    LEU  31           H        LEU  31   1.499  -3.614   1.612
  221    HA   LEU  31           HA       LEU  31   0.265  -5.522  -0.004
  222    HB2  LEU  31           HB2      LEU  31   2.884  -4.070  -0.301
  223    HB3  LEU  31           HB3      LEU  31   2.211  -5.106  -1.557
  224    HG   LEU  31           HG       LEU  31   0.997  -2.559  -0.488
  225   HD11  LEU  31          HD11      LEU  31   2.584  -3.270  -2.901
  226   HD12  LEU  31          HD12      LEU  31   2.622  -1.811  -1.910
  227   HD13  LEU  31          HD13      LEU  31   1.304  -2.066  -3.053
  228   HD21  LEU  31          HD21      LEU  31  -0.003  -4.478  -2.589
  229   HD22  LEU  31          HD22      LEU  31  -0.682  -2.882  -2.264
  230   HD23  LEU  31          HD23      LEU  31  -0.753  -4.139  -1.027
  231    H    ALA  32           H        ALA  32   2.946  -5.804   2.158
  232    HA   ALA  32           HA       ALA  32   3.980  -8.234   1.008
  233    HB1  ALA  32           HB1      ALA  32   5.290  -6.495   2.350
  234    HB2  ALA  32           HB2      ALA  32   4.573  -7.242   3.778
  235    HB3  ALA  32           HB3      ALA  32   5.593  -8.198   2.702
  236    H    GLN  33           H        GLN  33   2.091  -7.383   3.896
  237    HA   GLN  33           HA       GLN  33   1.799 -10.076   4.775
  238    HB2  GLN  33           HB2      GLN  33   0.254  -7.576   5.477
  239    HB3  GLN  33           HB3      GLN  33   0.055  -9.124   6.288
  240    HG2  GLN  33           HG2      GLN  33   2.594  -8.959   6.722
  241    HG3  GLN  33           HG3      GLN  33   2.381  -7.250   6.346
  242   HE21  GLN  33          HE21      GLN  33   0.900  -6.027   7.647
  243   HE22  GLN  33          HE22      GLN  33   0.608  -6.489   9.286
  244    H    CYS  34           H        CYS  34  -0.016  -7.969   2.552
  245    HA   CYS  34           HA       CYS  34  -2.364  -9.530   2.607
  246    HB2  CYS  34           HB2      CYS  34  -1.917  -7.073   1.742
  247    HB3  CYS  34           HB3      CYS  34  -1.596  -7.877   0.219
  248    H    LEU  35           H        LEU  35   0.624  -9.470   0.755
  249    HA   LEU  35           HA       LEU  35  -0.023 -11.237  -1.308
  250    HB2  LEU  35           HB2      LEU  35   2.494 -10.359   0.005
  251    HB3  LEU  35           HB3      LEU  35   2.560 -11.769  -1.048
  252    HG   LEU  35           HG       LEU  35   1.563  -9.051  -1.894
  253   HD11  LEU  35          HD11      LEU  35   3.819  -9.374  -3.281
  254   HD12  LEU  35          HD12      LEU  35   4.267 -10.243  -1.814
  255   HD13  LEU  35          HD13      LEU  35   3.764  -8.557  -1.719
  256   HD21  LEU  35          HD21      LEU  35   1.075  -9.942  -3.891
  257   HD22  LEU  35          HD22      LEU  35   1.041 -11.477  -3.022
  258   HD23  LEU  35          HD23      LEU  35   2.498 -10.984  -3.885
  259    H    ALA  36           H        ALA  36   1.340 -11.880   1.905
  260    HA   ALA  36           HA       ALA  36   1.696 -14.641   1.624
  261    HB1  ALA  36           HB1      ALA  36   2.491 -14.452   3.688
  262    HB2  ALA  36           HB2      ALA  36   2.019 -12.752   3.657
  263    HB3  ALA  36           HB3      ALA  36   0.914 -13.963   4.308
  264    H    GLU  37           H        GLU  37  -1.114 -12.773   2.698
  265    HA   GLU  37           HA       GLU  37  -2.715 -14.977   3.429
  266    HB2  GLU  37           HB2      GLU  37  -3.357 -12.144   2.641
  267    HB3  GLU  37           HB3      GLU  37  -4.621 -13.301   3.031
  268    HG2  GLU  37           HG2      GLU  37  -3.293 -13.660   5.216
  269    HG3  GLU  37           HG3      GLU  37  -2.529 -12.124   4.808
  270    H    SER  38           H        SER  38  -1.985 -13.505   0.370
  271    HA   SER  38           HA       SER  38  -4.088 -15.036  -0.971
  272    HB2  SER  38           HB2      SER  38  -3.457 -13.723  -2.978
  273    HB3  SER  38           HB3      SER  38  -3.901 -12.692  -1.618
  274    HG   SER  38           HG       SER  38  -1.333 -13.243  -2.655
  275    H    THR  39           H        THR  39  -2.962 -17.058  -0.458
  276    HA   THR  39           HA       THR  39  -0.480 -17.556  -1.894
  277    HB   THR  39           HB       THR  39  -2.042 -19.638  -0.387
  278    HG1  THR  39           HG1      THR  39  -0.532 -17.481   0.614
  279   HG21  THR  39          HG21      THR  39   0.729 -19.821   0.045
  280   HG22  THR  39          HG22      THR  39   0.524 -19.481  -1.674
  281   HG23  THR  39          HG23      THR  39  -0.275 -20.876  -0.949
  282    H    GLU  40           H        GLU  40  -1.283 -17.337  -4.043
  283    HA   GLU  40           HA       GLU  40  -3.325 -19.172  -4.965
  284    HB2  GLU  40           HB2      GLU  40  -1.698 -17.004  -6.254
  285    HB3  GLU  40           HB3      GLU  40  -2.595 -18.148  -7.242
  286    HG2  GLU  40           HG2      GLU  40  -3.910 -16.582  -5.049
  287    HG3  GLU  40           HG3      GLU  40  -3.716 -15.934  -6.678
  288    H    ASP  41           H        ASP  41  -2.026 -21.064  -4.247
  289    HA   ASP  41           HA       ASP  41   0.034 -21.787  -6.224
  290    HB2  ASP  41           HB2      ASP  41  -0.400 -22.678  -3.375
  291    HB3  ASP  41           HB3      ASP  41   0.655 -23.551  -4.483
  292    H    VAL  42           H        VAL  42  -2.595 -21.994  -7.011
  293    HA   VAL  42           HA       VAL  42  -2.933 -24.914  -7.142
  294    HB   VAL  42           HB       VAL  42  -4.645 -24.104  -5.632
  295   HG11  VAL  42          HG11      VAL  42  -6.222 -22.532  -7.453
  296   HG12  VAL  42          HG12      VAL  42  -5.628 -22.122  -5.842
  297   HG13  VAL  42          HG13      VAL  42  -4.618 -21.827  -7.257
  298   HG21  VAL  42          HG21      VAL  42  -6.094 -24.541  -8.214
  299   HG22  VAL  42          HG22      VAL  42  -5.109 -25.824  -7.511
  300   HG23  VAL  42          HG23      VAL  42  -6.468 -25.159  -6.606
  301    H    THR  43           H        THR  43  -2.908 -25.640  -9.157
  302    HA   THR  43           HA       THR  43  -3.237 -23.742 -11.356
  303    HB   THR  43           HB       THR  43  -1.226 -25.057 -11.489
  304    HG1  THR  43           HG1      THR  43  -1.523 -25.854 -13.555
  305   HG21  THR  43          HG21      THR  43  -1.365 -27.543 -11.740
  306   HG22  THR  43          HG22      THR  43  -3.058 -27.443 -11.257
  307   HG23  THR  43          HG23      THR  43  -1.790 -26.954 -10.134
  308    H    TRP  44           H        TRP  44  -4.743 -26.523  -9.912
  309    HA   TRP  44           HA       TRP  44  -6.616 -26.775 -12.147
  310    HB2  TRP  44           HB2      TRP  44  -6.379 -28.484  -9.661
  311    HB3  TRP  44           HB3      TRP  44  -7.355 -28.833 -11.086
  312    HD1  TRP  44           HD1      TRP  44  -4.381 -30.069  -9.631
  313    HE1  TRP  44           HE1      TRP  44  -2.710 -30.975 -11.366
  314    HE3  TRP  44           HE3      TRP  44  -6.322 -27.904 -13.835
  315    HZ2  TRP  44           HZ2      TRP  44  -2.272 -30.794 -14.149
  316    HZ3  TRP  44           HZ3      TRP  44  -5.217 -28.319 -15.994
  317    HH2  TRP  44           HH2      TRP  44  -3.234 -29.735 -16.145
  Start of MODEL    7
    1    H1   SER   1           H        SER   1  -1.914  17.137 -10.763
    2    HA   SER   1           HA       SER   1  -1.676  14.699 -12.090
    3    HB2  SER   1           HB2      SER   1  -0.513  17.416 -12.712
    4    HB3  SER   1           HB3      SER   1  -0.378  16.043 -13.809
    5    HG   SER   1           HG       SER   1  -2.312  17.689 -13.802
    6    H    HIS   2           H        HIS   2  -0.391  13.192 -11.120
    7    HA   HIS   2           HA       HIS   2   2.473  13.854 -10.892
    8    HB2  HIS   2           HB2      HIS   2   1.016  13.185  -8.791
    9    HB3  HIS   2           HB3      HIS   2   1.284  11.553  -9.398
   10    HD1  HIS   2           HD1      HIS   2   2.850  14.199  -7.438
   11    HD2  HIS   2           HD2      HIS   2   4.111  10.852  -9.554
   12    HE1  HIS   2           HE1      HIS   2   5.188  13.733  -6.631
   13    H    MET   3           H        MET   3   3.202  13.184 -12.860
   14    HA   MET   3           HA       MET   3   2.622  10.406 -13.639
   15    HB2  MET   3           HB2      MET   3   3.502  12.772 -15.298
   16    HB3  MET   3           HB3      MET   3   3.402  11.128 -15.914
   17    HG2  MET   3           HG2      MET   3   1.059  12.567 -14.706
   18    HG3  MET   3           HG3      MET   3   1.452  12.633 -16.423
   19    HE1  MET   3           HE1      MET   3   0.437   9.770 -13.524
   20    HE2  MET   3           HE2      MET   3  -0.420  11.285 -13.809
   21    HE3  MET   3           HE3      MET   3  -1.119   9.760 -14.355
   22    H    GLY   4           H        GLY   4   4.277   8.987 -14.071
   23    HA2  GLY   4           HA2      GLY   4   6.924   9.456 -14.561
   24    HA3  GLY   4           HA3      GLY   4   6.794   9.562 -12.812
   25    H    ALA   5           H        ALA   5   6.560   7.721 -11.610
   26    HA   ALA   5           HA       ALA   5   6.898   5.207 -13.084
   27    HB1  ALA   5           HB1      ALA   5   8.574   4.976 -11.632
   28    HB2  ALA   5           HB2      ALA   5   7.966   6.268 -10.596
   29    HB3  ALA   5           HB3      ALA   5   7.333   4.630 -10.426
   30    H    ALA   6           H        ALA   6   5.513   3.515 -12.868
   31    HA   ALA   6           HA       ALA   6   2.853   3.970 -12.158
   32    HB1  ALA   6           HB1      ALA   6   2.446   1.774 -12.734
   33    HB2  ALA   6           HB2      ALA   6   3.937   2.108 -13.618
   34    HB3  ALA   6           HB3      ALA   6   3.994   1.210 -12.102
   35    H    ALA   7           H        ALA   7   1.946   4.205 -10.232
   36    HA   ALA   7           HA       ALA   7   2.938   2.612  -7.978
   37    HB1  ALA   7           HB1      ALA   7   2.642   5.594  -8.059
   38    HB2  ALA   7           HB2      ALA   7   2.538   4.703  -6.540
   39    HB3  ALA   7           HB3      ALA   7   4.011   4.627  -7.507
   40    H    LEU   8           H        LEU   8   1.385   2.660  -6.113
   41    HA   LEU   8           HA       LEU   8  -1.391   2.994  -7.030
   42    HB2  LEU   8           HB2      LEU   8  -1.800   0.961  -5.449
   43    HB3  LEU   8           HB3      LEU   8  -1.259   0.711  -7.108
   44    HG   LEU   8           HG       LEU   8   1.019   0.340  -6.325
   45   HD11  LEU   8          HD11      LEU   8   1.213   1.702  -4.420
   46   HD12  LEU   8          HD12      LEU   8   1.326   0.045  -3.822
   47   HD13  LEU   8          HD13      LEU   8  -0.178   0.949  -3.638
   48   HD21  LEU   8          HD21      LEU   8  -0.359  -1.605  -6.519
   49   HD22  LEU   8          HD22      LEU   8  -1.101  -1.302  -4.947
   50   HD23  LEU   8          HD23      LEU   8   0.600  -1.761  -5.047
   51    H    ARG   9           H        ARG   9  -2.959   3.295  -5.319
   52    HA   ARG   9           HA       ARG   9  -1.773   4.336  -2.831
   53    HB2  ARG   9           HB2      ARG   9  -2.838   5.949  -4.693
   54    HB3  ARG   9           HB3      ARG   9  -4.305   5.534  -3.815
   55    HG2  ARG   9           HG2      ARG   9  -3.383   7.581  -2.947
   56    HG3  ARG   9           HG3      ARG   9  -3.249   6.307  -1.732
   57    HD2  ARG   9           HD2      ARG   9  -1.051   6.600  -1.626
   58    HD3  ARG   9           HD3      ARG   9  -0.903   6.293  -3.356
   59    HE   ARG   9           HE       ARG   9  -0.915   8.860  -2.035
   60   HH11  ARG   9          HH11      ARG   9  -1.343   7.139  -5.031
   61   HH12  ARG   9          HH12      ARG   9  -1.010   8.521  -6.022
   62   HH21  ARG   9          HH21      ARG   9  -0.474  10.685  -3.330
   63   HH22  ARG   9          HH22      ARG   9  -0.514  10.537  -5.054
   64    H    SER  10           H        SER  10  -3.329   1.818  -3.854
   65    HA   SER  10           HA       SER  10  -4.842   1.498  -1.401
   66    HB2  SER  10           HB2      SER  10  -6.747   0.506  -2.992
   67    HB3  SER  10           HB3      SER  10  -6.731   2.199  -2.498
   68    HG   SER  10           HG       SER  10  -5.826   1.090  -4.944
   69    H    CYS  11           H        CYS  11  -5.878  -0.806  -1.427
   70    HA   CYS  11           HA       CYS  11  -3.822  -2.640  -2.460
   71    HB2  CYS  11           HB2      CYS  11  -4.362  -2.387   0.081
   72    HB3  CYS  11           HB3      CYS  11  -5.772  -3.372  -0.299
   73    HA   PRO  12           HA       PRO  12  -7.394  -3.705  -5.091
   74    HB2  PRO  12           HB2      PRO  12  -5.869  -4.673  -7.118
   75    HB3  PRO  12           HB3      PRO  12  -6.216  -2.952  -6.914
   76    HG2  PRO  12           HG2      PRO  12  -3.772  -4.498  -6.137
   77    HG3  PRO  12           HG3      PRO  12  -3.891  -2.902  -6.902
   78    HD2  PRO  12           HD2      PRO  12  -3.411  -3.219  -4.255
   79    HD3  PRO  12           HD3      PRO  12  -4.321  -1.838  -4.903
   80    H    MET  13           H        MET  13  -4.986  -5.470  -3.502
   81    HA   MET  13           HA       MET  13  -5.621  -8.065  -4.544
   82    HB2  MET  13           HB2      MET  13  -3.945  -7.024  -2.297
   83    HB3  MET  13           HB3      MET  13  -4.369  -8.730  -2.327
   84    HG2  MET  13           HG2      MET  13  -2.410  -8.824  -3.454
   85    HG3  MET  13           HG3      MET  13  -3.498  -8.535  -4.811
   86    HE1  MET  13           HE1      MET  13  -1.235  -6.254  -2.164
   87    HE2  MET  13           HE2      MET  13  -0.563  -7.692  -2.929
   88    HE3  MET  13           HE3      MET  13  -0.024  -6.091  -3.435
   89    H    CYS  14           H        CYS  14  -6.572  -6.160  -1.736
   90    HA   CYS  14           HA       CYS  14  -8.628  -8.189  -1.150
   91    HB2  CYS  14           HB2      CYS  14  -8.454  -7.657   1.207
   92    HB3  CYS  14           HB3      CYS  14  -6.863  -8.096   0.596
   93    H    GLN  15           H        GLN  15  -8.320  -5.392  -2.590
   94    HA   GLN  15           HA       GLN  15  -9.663  -3.608  -3.020
   95    HB2  GLN  15           HB2      GLN  15 -11.585  -5.586  -1.849
   96    HB3  GLN  15           HB3      GLN  15 -12.130  -3.957  -2.226
   97    HG2  GLN  15           HG2      GLN  15 -11.030  -4.461  -4.549
   98    HG3  GLN  15           HG3      GLN  15 -11.261  -6.137  -4.051
   99   HE21  GLN  15          HE21      GLN  15 -13.065  -3.078  -4.083
  100   HE22  GLN  15          HE22      GLN  15 -14.553  -3.765  -4.627
  101    H    LYS  16           H        LYS  16  -8.053  -3.109  -0.969
  102    HA   LYS  16           HA       LYS  16  -9.759  -1.854   1.080
  103    HB2  LYS  16           HB2      LYS  16  -8.290  -3.488   2.076
  104    HB3  LYS  16           HB3      LYS  16  -6.898  -2.811   1.241
  105    HG2  LYS  16           HG2      LYS  16  -7.168  -0.730   2.533
  106    HG3  LYS  16           HG3      LYS  16  -8.507  -1.477   3.409
  107    HD2  LYS  16           HD2      LYS  16  -6.902  -3.298   4.083
  108    HD3  LYS  16           HD3      LYS  16  -5.609  -2.303   3.410
  109    HE2  LYS  16           HE2      LYS  16  -5.537  -1.635   5.597
  110    HE3  LYS  16           HE3      LYS  16  -6.678  -0.457   4.950
  111    HZ1  LYS  16           HZ1      LYS  16  -7.342  -2.935   6.445
  112    HZ2  LYS  16           HZ2      LYS  16  -8.488  -1.930   5.713
  113    HZ3  LYS  16           HZ3      LYS  16  -7.536  -1.343   6.983
  114    H    GLU  17           H        GLU  17  -9.324   0.275   1.716
  115    HA   GLU  17           HA       GLU  17  -7.778   1.816  -0.257
  116    HB2  GLU  17           HB2      GLU  17 -10.259   2.376   1.298
  117    HB3  GLU  17           HB3      GLU  17  -9.210   3.730   0.904
  118    HG2  GLU  17           HG2      GLU  17  -9.338   3.024  -1.491
  119    HG3  GLU  17           HG3      GLU  17 -10.561   1.848  -1.012
  120    H    PHE  18           H        PHE  18  -5.994   2.837   0.367
  121    HA   PHE  18           HA       PHE  18  -5.183   2.721   3.138
  122    HB2  PHE  18           HB2      PHE  18  -3.784   3.794   0.680
  123    HB3  PHE  18           HB3      PHE  18  -3.058   3.713   2.282
  124    HD1  PHE  18           HD2      PHE  18  -3.931   1.101   3.242
  125    HD2  PHE  18           HD1      PHE  18  -2.612   2.292  -0.626
  126    HE1  PHE  18           HE2      PHE  18  -3.189  -1.200   2.789
  127    HE2  PHE  18           HE1      PHE  18  -1.868  -0.007  -1.085
  128    HZ   PHE  18           HZ       PHE  18  -2.157  -1.758   0.624
  129    H    ALA  19           H        ALA  19  -5.266   4.325   4.580
  130    HA   ALA  19           HA       ALA  19  -6.727   6.674   4.102
  131    HB1  ALA  19           HB1      ALA  19  -5.806   5.353   6.328
  132    HB2  ALA  19           HB2      ALA  19  -4.888   6.860   6.352
  133    HB3  ALA  19           HB3      ALA  19  -6.650   6.902   6.321
  134    HA   PRO  20           HA       PRO  20  -3.854   9.593   2.527
  135    HB2  PRO  20           HB2      PRO  20  -4.548  11.861   3.849
  136    HB3  PRO  20           HB3      PRO  20  -5.549  11.144   2.581
  137    HG2  PRO  20           HG2      PRO  20  -5.823  10.935   5.554
  138    HG3  PRO  20           HG3      PRO  20  -7.081  11.188   4.329
  139    HD2  PRO  20           HD2      PRO  20  -6.604   8.769   5.453
  140    HD3  PRO  20           HD3      PRO  20  -7.170   8.950   3.780
  141    H    ARG  21           H        ARG  21  -3.956   9.005   5.939
  142    HA   ARG  21           HA       ARG  21  -1.635  10.587   6.569
  143    HB2  ARG  21           HB2      ARG  21  -2.684   8.383   8.314
  144    HB3  ARG  21           HB3      ARG  21  -1.936   9.905   8.781
  145    HG2  ARG  21           HG2      ARG  21  -4.039  10.982   7.723
  146    HG3  ARG  21           HG3      ARG  21  -4.737   9.371   7.896
  147    HD2  ARG  21           HD2      ARG  21  -5.309  10.644   9.839
  148    HD3  ARG  21           HD3      ARG  21  -4.114   9.435  10.307
  149    HE   ARG  21           HE       ARG  21  -2.720  11.749   9.683
  150   HH11  ARG  21          HH11      ARG  21  -5.093  10.709  12.007
  151   HH12  ARG  21          HH12      ARG  21  -4.562  11.808  13.237
  152   HH21  ARG  21          HH21      ARG  21  -2.011  13.200  11.293
  153   HH22  ARG  21          HH22      ARG  21  -2.808  13.225  12.829
  154    H    LEU  22           H        LEU  22  -2.297   7.299   5.634
  155    HA   LEU  22           HA       LEU  22  -0.016   5.991   6.507
  156    HB2  LEU  22           HB2      LEU  22  -1.741   5.639   4.080
  157    HB3  LEU  22           HB3      LEU  22  -0.345   4.603   4.368
  158    HG   LEU  22           HG       LEU  22  -2.740   4.879   6.184
  159   HD11  LEU  22          HD11      LEU  22  -3.078   2.477   5.490
  160   HD12  LEU  22          HD12      LEU  22  -1.918   2.778   4.197
  161   HD13  LEU  22          HD13      LEU  22  -3.425   3.692   4.260
  162   HD21  LEU  22          HD21      LEU  22  -1.170   2.568   6.691
  163   HD22  LEU  22          HD22      LEU  22  -1.511   3.924   7.765
  164   HD23  LEU  22          HD23      LEU  22  -0.102   3.971   6.703
  165    H    THR  23           H        THR  23   1.910   5.355   5.330
  166    HA   THR  23           HA       THR  23   2.838   7.462   3.487
  167    HB   THR  23           HB       THR  23   5.174   6.706   4.358
  168    HG1  THR  23           HG1      THR  23   3.586   6.029   6.621
  169   HG21  THR  23          HG21      THR  23   3.977   8.910   4.749
  170   HG22  THR  23          HG22      THR  23   5.164   8.445   5.967
  171   HG23  THR  23          HG23      THR  23   3.443   8.238   6.288
  172    H    GLN  24           H        GLN  24   4.684   6.735   2.075
  173    HA   GLN  24           HA       GLN  24   3.919   4.689   0.392
  174    HB2  GLN  24           HB2      GLN  24   5.498   6.374  -0.317
  175    HB3  GLN  24           HB3      GLN  24   6.676   5.827   0.870
  176    HG2  GLN  24           HG2      GLN  24   7.314   5.044  -1.304
  177    HG3  GLN  24           HG3      GLN  24   6.823   3.672  -0.311
  178   HE21  GLN  24          HE21      GLN  24   4.765   2.721  -0.698
  179   HE22  GLN  24          HE22      GLN  24   4.014   2.853  -2.247
  180    H    LEU  25           H        LEU  25   5.915   4.552   3.265
  181    HA   LEU  25           HA       LEU  25   6.868   1.896   2.838
  182    HB2  LEU  25           HB2      LEU  25   7.775   2.027   5.016
  183    HB3  LEU  25           HB3      LEU  25   7.943   3.628   4.298
  184    HG   LEU  25           HG       LEU  25   5.650   4.013   5.604
  185   HD11  LEU  25          HD11      LEU  25   6.584   2.720   7.894
  186   HD12  LEU  25          HD12      LEU  25   6.633   1.505   6.617
  187   HD13  LEU  25          HD13      LEU  25   5.126   2.349   6.974
  188   HD21  LEU  25          HD21      LEU  25   7.999   5.105   5.776
  189   HD22  LEU  25          HD22      LEU  25   8.178   4.085   7.203
  190   HD23  LEU  25          HD23      LEU  25   6.868   5.264   7.120
  191    H    ASP  26           H        ASP  26   4.098   3.310   4.464
  192    HA   ASP  26           HA       ASP  26   3.254   1.007   5.858
  193    HB2  ASP  26           HB2      ASP  26   1.783   3.457   4.890
  194    HB3  ASP  26           HB3      ASP  26   0.985   2.177   5.801
  195    H    VAL  27           H        VAL  27   2.378   2.293   2.668
  196    HA   VAL  27           HA       VAL  27   0.420   0.451   1.973
  197    HB   VAL  27           HB       VAL  27   2.447   1.753   0.148
  198   HG11  VAL  27          HG11      VAL  27   1.527   0.612  -1.517
  199   HG12  VAL  27          HG12      VAL  27   0.453  -0.209  -0.383
  200   HG13  VAL  27          HG13      VAL  27  -0.043   1.312  -1.125
  201   HG21  VAL  27          HG21      VAL  27   1.357   3.534   1.135
  202   HG22  VAL  27          HG22      VAL  27   0.348   3.234  -0.280
  203   HG23  VAL  27          HG23      VAL  27  -0.160   2.649   1.304
  204    H    ASP  28           H        ASP  28   3.906   0.306   1.235
  205    HA   ASP  28           HA       ASP  28   3.885  -2.205   0.004
  206    HB2  ASP  28           HB2      ASP  28   5.777  -0.332   0.356
  207    HB3  ASP  28           HB3      ASP  28   6.274  -1.467   1.607
  208    H    SER  29           H        SER  29   4.133  -1.292   3.393
  209    HA   SER  29           HA       SER  29   4.920  -3.723   4.489
  210    HB2  SER  29           HB2      SER  29   4.460  -1.355   5.573
  211    HB3  SER  29           HB3      SER  29   2.886  -2.066   5.926
  212    HG   SER  29           HG       SER  29   4.215  -3.885   6.803
  213    H    HIS  30           H        HIS  30   1.611  -2.500   3.988
  214    HA   HIS  30           HA       HIS  30   0.370  -4.927   4.812
  215    HB2  HIS  30           HB2      HIS  30  -0.803  -2.784   4.946
  216    HB3  HIS  30           HB3      HIS  30  -0.734  -2.619   3.195
  217    HD1  HIS  30           HD1      HIS  30  -2.958  -3.642   5.777
  218    HD2  HIS  30           HD2      HIS  30  -2.163  -4.960   1.918
  219    HE1  HIS  30           HE1      HIS  30  -4.974  -4.981   5.095
  220    H    LEU  31           H        LEU  31   1.348  -3.586   1.712
  221    HA   LEU  31           HA       LEU  31   0.017  -5.391   0.032
  222    HB2  LEU  31           HB2      LEU  31   2.531  -3.781  -0.278
  223    HB3  LEU  31           HB3      LEU  31   1.950  -4.842  -1.560
  224    HG   LEU  31           HG       LEU  31   0.347  -2.566  -0.404
  225   HD11  LEU  31          HD11      LEU  31   2.411  -1.773  -1.503
  226   HD12  LEU  31          HD12      LEU  31   0.947  -1.296  -2.361
  227   HD13  LEU  31          HD13      LEU  31   1.929  -2.628  -2.969
  228   HD21  LEU  31          HD21      LEU  31  -0.925  -4.407  -1.458
  229   HD22  LEU  31          HD22      LEU  31  -0.007  -4.154  -2.943
  230   HD23  LEU  31          HD23      LEU  31  -1.065  -2.882  -2.333
  231    H    ALA  32           H        ALA  32   2.809  -5.765   2.024
  232    HA   ALA  32           HA       ALA  32   3.802  -8.101   0.647
  233    HB1  ALA  32           HB1      ALA  32   4.627  -7.331   3.416
  234    HB2  ALA  32           HB2      ALA  32   5.577  -8.076   2.131
  235    HB3  ALA  32           HB3      ALA  32   5.146  -6.370   2.032
  236    H    GLN  33           H        GLN  33   2.095  -7.421   3.684
  237    HA   GLN  33           HA       GLN  33   1.928 -10.164   4.456
  238    HB2  GLN  33           HB2      GLN  33   0.506  -7.681   5.407
  239    HB3  GLN  33           HB3      GLN  33   0.214  -9.270   6.100
  240    HG2  GLN  33           HG2      GLN  33   2.799  -9.298   6.415
  241    HG3  GLN  33           HG3      GLN  33   2.640  -7.549   6.264
  242   HE21  GLN  33          HE21      GLN  33   3.505  -9.022   8.561
  243   HE22  GLN  33          HE22      GLN  33   2.389  -8.681   9.834
  244    H    CYS  34           H        CYS  34  -0.079  -7.982   2.486
  245    HA   CYS  34           HA       CYS  34  -2.425  -9.499   2.655
  246    HB2  CYS  34           HB2      CYS  34  -2.006  -7.076   1.748
  247    HB3  CYS  34           HB3      CYS  34  -1.706  -7.879   0.219
  248    H    LEU  35           H        LEU  35   0.159  -9.297   0.209
  249    HA   LEU  35           HA       LEU  35  -0.758 -11.452  -1.379
  250    HB2  LEU  35           HB2      LEU  35   1.102 -11.108  -2.682
  251    HB3  LEU  35           HB3      LEU  35   0.897  -9.530  -1.926
  252    HG   LEU  35           HG       LEU  35   2.612 -10.572  -0.182
  253   HD11  LEU  35          HD11      LEU  35   2.633 -12.426  -2.397
  254   HD12  LEU  35          HD12      LEU  35   3.419 -12.540  -0.823
  255   HD13  LEU  35          HD13      LEU  35   4.220 -11.697  -2.147
  256   HD21  LEU  35          HD21      LEU  35   3.897  -9.694  -2.697
  257   HD22  LEU  35          HD22      LEU  35   4.105  -9.105  -1.047
  258   HD23  LEU  35          HD23      LEU  35   2.702  -8.605  -1.993
  259    H    ALA  36           H        ALA  36   1.242 -11.258   1.457
  260    HA   ALA  36           HA       ALA  36   2.395 -13.865   1.209
  261    HB1  ALA  36           HB1      ALA  36   2.282 -11.803   3.367
  262    HB2  ALA  36           HB2      ALA  36   2.831 -13.438   3.740
  263    HB3  ALA  36           HB3      ALA  36   3.680 -12.476   2.529
  264    H    GLU  37           H        GLU  37  -0.488 -12.532   2.689
  265    HA   GLU  37           HA       GLU  37  -1.198 -15.214   3.675
  266    HB2  GLU  37           HB2      GLU  37  -2.081 -12.467   4.551
  267    HB3  GLU  37           HB3      GLU  37  -2.917 -13.932   5.048
  268    HG2  GLU  37           HG2      GLU  37  -0.663 -14.731   5.916
  269    HG3  GLU  37           HG3      GLU  37  -0.123 -13.067   5.703
  270    H    SER  38           H        SER  38  -1.468 -14.218   0.914
  271    HA   SER  38           HA       SER  38  -4.324 -13.861   0.545
  272    HB2  SER  38           HB2      SER  38  -3.748 -13.706  -1.864
  273    HB3  SER  38           HB3      SER  38  -2.815 -12.579  -0.878
  274    HG   SER  38           HG       SER  38  -1.184 -13.472  -1.867
  275    H    THR  39           H        THR  39  -4.093 -16.194   1.765
  276    HA   THR  39           HA       THR  39  -4.136 -18.276  -0.307
  277    HB   THR  39           HB       THR  39  -4.241 -19.810   1.786
  278    HG1  THR  39           HG1      THR  39  -3.864 -18.886   3.671
  279   HG21  THR  39          HG21      THR  39  -2.239 -20.144   0.815
  280   HG22  THR  39          HG22      THR  39  -1.620 -19.104   2.098
  281   HG23  THR  39          HG23      THR  39  -1.991 -18.424   0.514
  282    H    GLU  40           H        GLU  40  -6.102 -16.589   2.001
  283    HA   GLU  40           HA       GLU  40  -8.314 -18.459   1.716
  284    HB2  GLU  40           HB2      GLU  40  -8.056 -15.887   3.282
  285    HB3  GLU  40           HB3      GLU  40  -9.483 -16.914   3.283
  286    HG2  GLU  40           HG2      GLU  40  -7.844 -18.770   4.034
  287    HG3  GLU  40           HG3      GLU  40  -6.789 -17.425   4.462
  288    H    ASP  41           H        ASP  41  -7.991 -17.749  -0.720
  289    HA   ASP  41           HA       ASP  41  -9.514 -15.332  -1.327
  290    HB2  ASP  41           HB2      ASP  41  -7.976 -17.251  -3.084
  291    HB3  ASP  41           HB3      ASP  41  -8.890 -15.878  -3.701
  292    H    VAL  42           H        VAL  42 -11.156 -17.049  -0.112
  293    HA   VAL  42           HA       VAL  42 -12.804 -18.105  -2.314
  294    HB   VAL  42           HB       VAL  42 -12.647 -19.328   0.441
  295   HG11  VAL  42          HG11      VAL  42 -13.614 -21.030  -1.665
  296   HG12  VAL  42          HG12      VAL  42 -14.400 -20.555  -0.158
  297   HG13  VAL  42          HG13      VAL  42 -14.556 -19.541  -1.593
  298   HG21  VAL  42          HG21      VAL  42 -10.653 -20.097  -0.265
  299   HG22  VAL  42          HG22      VAL  42 -11.630 -21.214  -1.218
  300   HG23  VAL  42          HG23      VAL  42 -10.998 -19.743  -1.958
  301    H    THR  43           H        THR  43 -13.531 -15.748  -1.976
  302    HA   THR  43           HA       THR  43 -15.748 -15.760  -0.035
  303    HB   THR  43           HB       THR  43 -14.439 -13.184  -0.825
  304    HG1  THR  43           HG1      THR  43 -12.948 -13.410   0.808
  305   HG21  THR  43          HG21      THR  43 -15.160 -13.065   1.817
  306   HG22  THR  43          HG22      THR  43 -16.389 -14.134   1.141
  307   HG23  THR  43          HG23      THR  43 -16.154 -12.521   0.465
  308    H    TRP  44           H        TRP  44 -15.557 -16.417  -2.944
  309    HA   TRP  44           HA       TRP  44 -17.787 -14.740  -3.791
  310    HB2  TRP  44           HB2      TRP  44 -15.180 -14.985  -5.280
  311    HB3  TRP  44           HB3      TRP  44 -16.681 -14.574  -6.104
  312    HD1  TRP  44           HD1      TRP  44 -17.984 -12.450  -4.358
  313    HE1  TRP  44           HE1      TRP  44 -16.863 -10.183  -3.878
  314    HE3  TRP  44           HE3      TRP  44 -13.127 -13.726  -5.320
  315    HZ2  TRP  44           HZ2      TRP  44 -14.265  -9.082  -3.906
  316    HZ3  TRP  44           HZ3      TRP  44 -11.385 -12.007  -5.069
  317    HH2  TRP  44           HH2      TRP  44 -11.943  -9.734  -4.377
  Start of MODEL    8
    1    H1   SER   1           H        SER   1   0.149  16.216  -5.687
    2    HA   SER   1           HA       SER   1  -0.135  15.818  -8.582
    3    HB2  SER   1           HB2      SER   1   1.733  17.496  -6.919
    4    HB3  SER   1           HB3      SER   1   2.077  17.140  -8.610
    5    HG   SER   1           HG       SER   1   0.864  19.134  -8.142
    6    H    HIS   2           H        HIS   2   0.435  13.819  -9.159
    7    HA   HIS   2           HA       HIS   2   2.931  12.716  -8.043
    8    HB2  HIS   2           HB2      HIS   2   0.565  11.145  -9.084
    9    HB3  HIS   2           HB3      HIS   2   2.017  10.487  -8.335
   10    HD1  HIS   2           HD1      HIS   2  -1.202  12.201  -7.528
   11    HD2  HIS   2           HD2      HIS   2   2.103  10.656  -5.540
   12    HE1  HIS   2           HE1      HIS   2  -1.851  12.131  -5.099
   13    H    MET   3           H        MET   3   4.200  13.645  -9.686
   14    HA   MET   3           HA       MET   3   3.698  13.464 -12.432
   15    HB2  MET   3           HB2      MET   3   6.002  14.052 -12.754
   16    HB3  MET   3           HB3      MET   3   5.409  14.931 -11.350
   17    HG2  MET   3           HG2      MET   3   6.438  13.178  -9.909
   18    HG3  MET   3           HG3      MET   3   7.153  12.483 -11.362
   19    HE1  MET   3           HE1      MET   3   9.715  13.989  -9.026
   20    HE2  MET   3           HE2      MET   3   8.543  15.199  -8.506
   21    HE3  MET   3           HE3      MET   3   8.066  13.505  -8.627
   22    H    GLY   4           H        GLY   4   5.026  11.156 -10.176
   23    HA2  GLY   4           HA2      GLY   4   5.173   9.201 -12.378
   24    HA3  GLY   4           HA3      GLY   4   6.473   9.319 -11.202
   25    H    ALA   5           H        ALA   5   5.329   6.914 -11.510
   26    HA   ALA   5           HA       ALA   5   3.687   6.637  -9.078
   27    HB1  ALA   5           HB1      ALA   5   2.292   6.247 -11.028
   28    HB2  ALA   5           HB2      ALA   5   3.431   5.038 -11.623
   29    HB3  ALA   5           HB3      ALA   5   2.533   4.747 -10.133
   30    H    ALA   6           H        ALA   6   4.635   5.463  -7.556
   31    HA   ALA   6           HA       ALA   6   6.534   3.362  -8.362
   32    HB1  ALA   6           HB1      ALA   6   6.882   5.284  -6.063
   33    HB2  ALA   6           HB2      ALA   6   7.952   3.936  -6.453
   34    HB3  ALA   6           HB3      ALA   6   7.795   5.290  -7.572
   35    H    ALA   7           H        ALA   7   3.628   3.781  -7.153
   36    HA   ALA   7           HA       ALA   7   3.497   1.279  -5.868
   37    HB1  ALA   7           HB1      ALA   7   2.943   3.389  -3.849
   38    HB2  ALA   7           HB2      ALA   7   3.465   1.718  -3.628
   39    HB3  ALA   7           HB3      ALA   7   4.624   2.941  -4.149
   40    H    LEU   8           H        LEU   8   1.301   1.166  -4.549
   41    HA   LEU   8           HA       LEU   8  -0.708   2.480  -6.247
   42    HB2  LEU   8           HB2      LEU   8  -1.279   0.132  -4.485
   43    HB3  LEU   8           HB3      LEU   8  -2.105   0.648  -5.954
   44    HG   LEU   8           HG       LEU   8   0.293   0.023  -6.988
   45   HD11  LEU   8          HD11      LEU   8   0.118  -2.307  -5.246
   46   HD12  LEU   8          HD12      LEU   8   0.616  -0.839  -4.407
   47   HD13  LEU   8          HD13      LEU   8   1.530  -1.408  -5.804
   48   HD21  LEU   8          HD21      LEU   8  -0.707  -1.999  -7.766
   49   HD22  LEU   8          HD22      LEU   8  -1.984  -0.790  -7.630
   50   HD23  LEU   8          HD23      LEU   8  -1.820  -2.043  -6.398
   51    H    ARG   9           H        ARG   9  -2.422   3.578  -5.367
   52    HA   ARG   9           HA       ARG   9  -2.052   4.543  -2.669
   53    HB2  ARG   9           HB2      ARG   9  -2.930   5.759  -4.897
   54    HB3  ARG   9           HB3      ARG   9  -4.477   5.278  -4.214
   55    HG2  ARG   9           HG2      ARG   9  -4.008   7.491  -3.482
   56    HG3  ARG   9           HG3      ARG   9  -3.817   6.413  -2.097
   57    HD2  ARG   9           HD2      ARG   9  -1.394   6.416  -2.428
   58    HD3  ARG   9           HD3      ARG   9  -1.584   7.482  -3.820
   59    HE   ARG   9           HE       ARG   9  -2.748   8.582  -1.460
   60   HH11  ARG   9          HH11      ARG   9   0.261   8.103  -3.145
   61   HH12  ARG   9          HH12      ARG   9   1.036   9.471  -2.418
   62   HH21  ARG   9          HH21      ARG   9  -1.738  10.385  -0.497
   63   HH22  ARG   9          HH22      ARG   9  -0.102  10.769  -0.911
   64    H    SER  10           H        SER  10  -3.427   1.838  -3.871
   65    HA   SER  10           HA       SER  10  -5.050   1.466  -1.497
   66    HB2  SER  10           HB2      SER  10  -6.885   0.501  -3.169
   67    HB3  SER  10           HB3      SER  10  -6.883   2.195  -2.677
   68    HG   SER  10           HG       SER  10  -6.892   1.415  -5.086
   69    H    CYS  11           H        CYS  11  -5.989  -0.829  -1.499
   70    HA   CYS  11           HA       CYS  11  -3.932  -2.638  -2.571
   71    HB2  CYS  11           HB2      CYS  11  -4.423  -2.394  -0.021
   72    HB3  CYS  11           HB3      CYS  11  -5.836  -3.385  -0.373
   73    HA   PRO  12           HA       PRO  12  -7.529  -3.754  -5.143
   74    HB2  PRO  12           HB2      PRO  12  -6.022  -4.726  -7.183
   75    HB3  PRO  12           HB3      PRO  12  -6.378  -3.005  -6.986
   76    HG2  PRO  12           HG2      PRO  12  -3.914  -4.530  -6.229
   77    HG3  PRO  12           HG3      PRO  12  -4.053  -2.940  -7.003
   78    HD2  PRO  12           HD2      PRO  12  -3.539  -3.234  -4.362
   79    HD3  PRO  12           HD3      PRO  12  -4.466  -1.864  -5.007
   80    H    MET  13           H        MET  13  -5.088  -5.492  -3.573
   81    HA   MET  13           HA       MET  13  -5.719  -8.098  -4.589
   82    HB2  MET  13           HB2      MET  13  -3.966  -6.990  -2.460
   83    HB3  MET  13           HB3      MET  13  -4.457  -8.671  -2.303
   84    HG2  MET  13           HG2      MET  13  -2.557  -8.973  -3.489
   85    HG3  MET  13           HG3      MET  13  -3.679  -8.749  -4.830
   86    HE1  MET  13           HE1      MET  13  -0.035  -6.401  -3.797
   87    HE2  MET  13           HE2      MET  13  -1.209  -6.326  -2.484
   88    HE3  MET  13           HE3      MET  13  -0.666  -7.890  -3.093
   89    H    CYS  14           H        CYS  14  -6.633  -6.186  -1.771
   90    HA   CYS  14           HA       CYS  14  -8.674  -8.219  -1.146
   91    HB2  CYS  14           HB2      CYS  14  -8.467  -7.674   1.205
   92    HB3  CYS  14           HB3      CYS  14  -6.884  -8.112   0.571
   93    H    GLN  15           H        GLN  15  -8.401  -5.429  -2.604
   94    HA   GLN  15           HA       GLN  15  -9.758  -3.651  -3.020
   95    HB2  GLN  15           HB2      GLN  15 -11.656  -5.632  -1.812
   96    HB3  GLN  15           HB3      GLN  15 -12.212  -4.007  -2.195
   97    HG2  GLN  15           HG2      GLN  15 -11.466  -4.348  -4.528
   98    HG3  GLN  15           HG3      GLN  15 -11.050  -6.011  -4.114
   99   HE21  GLN  15          HE21      GLN  15 -12.529  -6.756  -5.669
  100   HE22  GLN  15          HE22      GLN  15 -14.230  -6.747  -5.369
  101    H    LYS  16           H        LYS  16  -8.121  -3.135  -0.994
  102    HA   LYS  16           HA       LYS  16  -9.804  -1.888   1.079
  103    HB2  LYS  16           HB2      LYS  16  -8.303  -3.504   2.054
  104    HB3  LYS  16           HB3      LYS  16  -6.932  -2.820   1.191
  105    HG2  LYS  16           HG2      LYS  16  -6.947  -0.866   2.522
  106    HG3  LYS  16           HG3      LYS  16  -8.522  -1.265   3.211
  107    HD2  LYS  16           HD2      LYS  16  -7.426  -3.338   4.168
  108    HD3  LYS  16           HD3      LYS  16  -5.882  -2.626   3.700
  109    HE2  LYS  16           HE2      LYS  16  -6.095  -0.869   5.210
  110    HE3  LYS  16           HE3      LYS  16  -7.841  -1.073   5.349
  111    HZ1  LYS  16           HZ1      LYS  16  -5.754  -2.873   6.453
  112    HZ2  LYS  16           HZ2      LYS  16  -7.413  -3.198   6.494
  113    HZ3  LYS  16           HZ3      LYS  16  -6.792  -1.867   7.333
  114    H    GLU  17           H        GLU  17  -9.356   0.244   1.718
  115    HA   GLU  17           HA       GLU  17  -7.885   1.797  -0.301
  116    HB2  GLU  17           HB2      GLU  17 -10.230   2.454   1.461
  117    HB3  GLU  17           HB3      GLU  17  -9.257   3.728   0.741
  118    HG2  GLU  17           HG2      GLU  17  -9.712   2.675  -1.491
  119    HG3  GLU  17           HG3      GLU  17 -10.874   1.629  -0.675
  120    H    PHE  18           H        PHE  18  -6.083   2.824   0.262
  121    HA   PHE  18           HA       PHE  18  -5.172   2.701   3.002
  122    HB2  PHE  18           HB2      PHE  18  -3.873   3.783   0.494
  123    HB3  PHE  18           HB3      PHE  18  -3.087   3.721   2.068
  124    HD1  PHE  18           HD2      PHE  18  -3.989   1.083   3.037
  125    HD2  PHE  18           HD1      PHE  18  -2.641   2.310  -0.808
  126    HE1  PHE  18           HE2      PHE  18  -3.239  -1.213   2.571
  127    HE2  PHE  18           HE1      PHE  18  -1.889   0.015  -1.281
  128    HZ   PHE  18           HZ       PHE  18  -2.188  -1.750   0.410
  129    H    ALA  19           H        ALA  19  -5.123   4.319   4.444
  130    HA   ALA  19           HA       ALA  19  -6.626   6.675   4.001
  131    HB1  ALA  19           HB1      ALA  19  -5.296   7.279   6.250
  132    HB2  ALA  19           HB2      ALA  19  -6.689   6.197   6.210
  133    HB3  ALA  19           HB3      ALA  19  -5.056   5.532   6.226
  134    HA   PRO  20           HA       PRO  20  -3.722   9.580   2.462
  135    HB2  PRO  20           HB2      PRO  20  -4.376  11.837   3.822
  136    HB3  PRO  20           HB3      PRO  20  -5.394  11.154   2.548
  137    HG2  PRO  20           HG2      PRO  20  -5.654  10.903   5.520
  138    HG3  PRO  20           HG3      PRO  20  -6.915  11.192   4.307
  139    HD2  PRO  20           HD2      PRO  20  -6.467   8.751   5.390
  140    HD3  PRO  20           HD3      PRO  20  -7.039   8.965   3.723
  141    H    ARG  21           H        ARG  21  -3.916   9.217   5.948
  142    HA   ARG  21           HA       ARG  21  -1.528  10.657   6.538
  143    HB2  ARG  21           HB2      ARG  21  -1.748   9.748   8.775
  144    HB3  ARG  21           HB3      ARG  21  -3.322  10.277   8.197
  145    HG2  ARG  21           HG2      ARG  21  -3.918   8.276   9.076
  146    HG3  ARG  21           HG3      ARG  21  -3.485   7.740   7.451
  147    HD2  ARG  21           HD2      ARG  21  -1.469   6.832   8.149
  148    HD3  ARG  21           HD3      ARG  21  -1.415   7.822   9.606
  149    HE   ARG  21           HE       ARG  21  -2.705   5.275   9.288
  150   HH11  ARG  21          HH11      ARG  21  -2.664   8.254  11.091
  151   HH12  ARG  21          HH12      ARG  21  -3.414   7.567  12.493
  152   HH21  ARG  21          HH21      ARG  21  -3.693   4.360  11.129
  153   HH22  ARG  21          HH22      ARG  21  -3.999   5.352  12.514
  154    H    LEU  22           H        LEU  22  -2.231   7.429   5.516
  155    HA   LEU  22           HA       LEU  22   0.034   6.078   6.449
  156    HB2  LEU  22           HB2      LEU  22  -1.733   5.689   4.056
  157    HB3  LEU  22           HB3      LEU  22  -0.359   4.630   4.369
  158    HG   LEU  22           HG       LEU  22  -2.694   5.034   6.238
  159   HD11  LEU  22          HD11      LEU  22  -2.080   2.617   4.556
  160   HD12  LEU  22          HD12      LEU  22  -3.205   3.879   4.058
  161   HD13  LEU  22          HD13      LEU  22  -3.525   2.941   5.516
  162   HD21  LEU  22          HD21      LEU  22  -0.086   3.907   6.596
  163   HD22  LEU  22          HD22      LEU  22  -1.303   2.639   6.734
  164   HD23  LEU  22          HD23      LEU  22  -1.400   4.069   7.761
  165    H    THR  23           H        THR  23   2.023   5.594   5.487
  166    HA   THR  23           HA       THR  23   2.920   7.592   3.524
  167    HB   THR  23           HB       THR  23   5.250   6.683   4.364
  168    HG1  THR  23           HG1      THR  23   4.986   6.215   6.689
  169   HG21  THR  23          HG21      THR  23   4.326   8.992   4.618
  170   HG22  THR  23          HG22      THR  23   5.348   8.477   5.959
  171   HG23  THR  23          HG23      THR  23   3.593   8.477   6.136
  172    H    GLN  24           H        GLN  24   4.888   6.747   2.214
  173    HA   GLN  24           HA       GLN  24   3.993   4.769   0.464
  174    HB2  GLN  24           HB2      GLN  24   6.297   4.801  -0.454
  175    HB3  GLN  24           HB3      GLN  24   5.621   6.411  -0.237
  176    HG2  GLN  24           HG2      GLN  24   6.863   6.516   1.948
  177    HG3  GLN  24           HG3      GLN  24   7.684   5.035   1.458
  178   HE21  GLN  24          HE21      GLN  24   8.393   8.020   1.830
  179   HE22  GLN  24          HE22      GLN  24   9.345   8.368   0.431
  180    H    LEU  25           H        LEU  25   6.116   4.561   3.263
  181    HA   LEU  25           HA       LEU  25   6.940   1.878   2.834
  182    HB2  LEU  25           HB2      LEU  25   7.908   1.976   4.971
  183    HB3  LEU  25           HB3      LEU  25   8.058   3.599   4.300
  184    HG   LEU  25           HG       LEU  25   5.800   3.946   5.670
  185   HD11  LEU  25          HD11      LEU  25   5.364   1.994   6.739
  186   HD12  LEU  25          HD12      LEU  25   6.445   2.711   7.934
  187   HD13  LEU  25          HD13      LEU  25   7.059   1.512   6.795
  188   HD21  LEU  25          HD21      LEU  25   8.628   4.043   6.699
  189   HD22  LEU  25          HD22      LEU  25   7.255   4.726   7.571
  190   HD23  LEU  25          HD23      LEU  25   7.689   5.350   5.978
  191    H    ASP  26           H        ASP  26   4.246   3.362   4.534
  192    HA   ASP  26           HA       ASP  26   3.353   1.054   5.894
  193    HB2  ASP  26           HB2      ASP  26   2.128   3.677   5.146
  194    HB3  ASP  26           HB3      ASP  26   1.081   2.387   5.731
  195    H    VAL  27           H        VAL  27   2.494   2.445   2.749
  196    HA   VAL  27           HA       VAL  27   0.430   0.707   2.064
  197    HB   VAL  27           HB       VAL  27   2.455   1.973   0.213
  198   HG11  VAL  27          HG11      VAL  27  -0.132   1.672  -0.941
  199   HG12  VAL  27          HG12      VAL  27   1.402   0.977  -1.469
  200   HG13  VAL  27          HG13      VAL  27   0.391   0.110  -0.313
  201   HG21  VAL  27          HG21      VAL  27  -0.293   2.987   0.892
  202   HG22  VAL  27          HG22      VAL  27   1.154   3.501   1.760
  203   HG23  VAL  27          HG23      VAL  27   0.998   3.825   0.033
  204    H    ASP  28           H        ASP  28   3.889   0.457   1.231
  205    HA   ASP  28           HA       ASP  28   3.721  -2.033  -0.052
  206    HB2  ASP  28           HB2      ASP  28   5.889  -0.350   1.064
  207    HB3  ASP  28           HB3      ASP  28   6.260  -2.059   0.865
  208    H    SER  29           H        SER  29   4.102  -1.164   3.326
  209    HA   SER  29           HA       SER  29   4.927  -3.590   4.390
  210    HB2  SER  29           HB2      SER  29   4.427  -1.231   5.495
  211    HB3  SER  29           HB3      SER  29   2.886  -1.996   5.880
  212    HG   SER  29           HG       SER  29   5.419  -2.506   6.869
  213    H    HIS  30           H        HIS  30   1.595  -2.423   3.920
  214    HA   HIS  30           HA       HIS  30   0.394  -4.860   4.765
  215    HB2  HIS  30           HB2      HIS  30  -0.823  -2.747   4.882
  216    HB3  HIS  30           HB3      HIS  30  -0.737  -2.578   3.131
  217    HD1  HIS  30           HD1      HIS  30  -2.948  -3.690   5.707
  218    HD2  HIS  30           HD2      HIS  30  -2.142  -4.886   1.811
  219    HE1  HIS  30           HE1      HIS  30  -4.942  -5.045   4.994
  220    H    LEU  31           H        LEU  31   1.260  -3.506   1.625
  221    HA   LEU  31           HA       LEU  31  -0.015  -5.355  -0.025
  222    HB2  LEU  31           HB2      LEU  31   2.505  -3.756  -0.364
  223    HB3  LEU  31           HB3      LEU  31   1.883  -4.804  -1.637
  224    HG   LEU  31           HG       LEU  31   0.313  -2.526  -0.441
  225   HD11  LEU  31          HD11      LEU  31   1.049  -1.102  -2.101
  226   HD12  LEU  31          HD12      LEU  31   1.629  -2.418  -3.121
  227   HD13  LEU  31          HD13      LEU  31   2.527  -1.966  -1.673
  228   HD21  LEU  31          HD21      LEU  31  -0.041  -4.218  -2.911
  229   HD22  LEU  31          HD22      LEU  31  -0.993  -2.782  -2.535
  230   HD23  LEU  31          HD23      LEU  31  -1.074  -4.194  -1.482
  231    H    ALA  32           H        ALA  32   2.767  -5.696   1.981
  232    HA   ALA  32           HA       ALA  32   3.791  -8.030   0.622
  233    HB1  ALA  32           HB1      ALA  32   5.624  -7.334   1.665
  234    HB2  ALA  32           HB2      ALA  32   4.696  -6.247   2.698
  235    HB3  ALA  32           HB3      ALA  32   4.922  -7.931   3.169
  236    H    GLN  33           H        GLN  33   2.036  -7.351   3.631
  237    HA   GLN  33           HA       GLN  33   1.891 -10.091   4.421
  238    HB2  GLN  33           HB2      GLN  33   0.282  -7.699   5.329
  239    HB3  GLN  33           HB3      GLN  33   0.272  -9.276   6.107
  240    HG2  GLN  33           HG2      GLN  33   2.889  -7.935   5.744
  241    HG3  GLN  33           HG3      GLN  33   1.790  -7.286   6.959
  242   HE21  GLN  33          HE21      GLN  33   4.400  -8.790   7.068
  243   HE22  GLN  33          HE22      GLN  33   4.099 -10.084   8.173
  244    H    CYS  34           H        CYS  34  -0.111  -7.948   2.404
  245    HA   CYS  34           HA       CYS  34  -2.441  -9.492   2.550
  246    HB2  CYS  34           HB2      CYS  34  -2.012  -7.068   1.617
  247    HB3  CYS  34           HB3      CYS  34  -1.727  -7.898   0.100
  248    H    LEU  35           H        LEU  35   0.177  -9.276   0.142
  249    HA   LEU  35           HA       LEU  35  -0.691 -11.457  -1.440
  250    HB2  LEU  35           HB2      LEU  35   1.184 -11.103  -2.721
  251    HB3  LEU  35           HB3      LEU  35   0.938  -9.518  -1.990
  252    HG   LEU  35           HG       LEU  35   2.646 -10.505  -0.206
  253   HD11  LEU  35          HD11      LEU  35   3.464 -12.481  -0.819
  254   HD12  LEU  35          HD12      LEU  35   4.323 -11.621  -2.097
  255   HD13  LEU  35          HD13      LEU  35   2.758 -12.362  -2.431
  256   HD21  LEU  35          HD21      LEU  35   2.723  -8.551  -2.023
  257   HD22  LEU  35          HD22      LEU  35   3.938  -9.624  -2.720
  258   HD23  LEU  35          HD23      LEU  35   4.130  -9.026  -1.071
  259    H    ALA  36           H        ALA  36   1.266 -11.209   1.419
  260    HA   ALA  36           HA       ALA  36   2.494 -13.777   1.217
  261    HB1  ALA  36           HB1      ALA  36   3.602 -12.198   2.570
  262    HB2  ALA  36           HB2      ALA  36   2.141 -11.846   3.495
  263    HB3  ALA  36           HB3      ALA  36   2.950 -13.402   3.682
  264    H    GLU  37           H        GLU  37  -0.491 -12.560   2.596
  265    HA   GLU  37           HA       GLU  37  -1.114 -15.220   3.663
  266    HB2  GLU  37           HB2      GLU  37  -2.268 -12.486   4.161
  267    HB3  GLU  37           HB3      GLU  37  -3.118 -13.946   4.651
  268    HG2  GLU  37           HG2      GLU  37  -1.022 -14.582   5.914
  269    HG3  GLU  37           HG3      GLU  37  -0.461 -12.938   5.614
  270    H    SER  38           H        SER  38  -1.145 -14.512   0.795
  271    HA   SER  38           HA       SER  38  -4.010 -14.851   0.216
  272    HB2  SER  38           HB2      SER  38  -3.591 -13.959  -1.976
  273    HB3  SER  38           HB3      SER  38  -2.820 -12.881  -0.813
  274    HG   SER  38           HG       SER  38  -1.579 -14.863  -2.420
  275    H    THR  39           H        THR  39  -2.293 -16.994   1.108
  276    HA   THR  39           HA       THR  39  -2.073 -18.640  -1.320
  277    HB   THR  39           HB       THR  39  -0.974 -19.503   1.330
  278    HG1  THR  39           HG1      THR  39   0.955 -18.373   0.813
  279   HG21  THR  39          HG21      THR  39  -0.572 -21.211  -0.115
  280   HG22  THR  39          HG22      THR  39   0.831 -20.222  -0.520
  281   HG23  THR  39          HG23      THR  39  -0.611 -20.164  -1.532
  282    H    GLU  40           H        GLU  40  -4.573 -18.553  -0.927
  283    HA   GLU  40           HA       GLU  40  -5.401 -20.615   0.982
  284    HB2  GLU  40           HB2      GLU  40  -6.872 -18.482  -0.539
  285    HB3  GLU  40           HB3      GLU  40  -7.738 -19.842   0.163
  286    HG2  GLU  40           HG2      GLU  40  -5.876 -18.322   1.902
  287    HG3  GLU  40           HG3      GLU  40  -7.412 -17.576   1.465
  288    H    ASP  41           H        ASP  41  -3.933 -21.456  -1.273
  289    HA   ASP  41           HA       ASP  41  -3.964 -22.944  -3.000
  290    HB2  ASP  41           HB2      ASP  41  -6.530 -23.856  -1.684
  291    HB3  ASP  41           HB3      ASP  41  -5.531 -24.800  -2.787
  292    H    VAL  42           H        VAL  42  -5.088 -20.410  -3.580
  293    HA   VAL  42           HA       VAL  42  -7.315 -21.063  -5.384
  294    HB   VAL  42           HB       VAL  42  -6.344 -18.321  -4.573
  295   HG11  VAL  42          HG11      VAL  42  -9.093 -18.500  -5.385
  296   HG12  VAL  42          HG12      VAL  42  -7.791 -17.515  -6.055
  297   HG13  VAL  42          HG13      VAL  42  -8.043 -19.162  -6.638
  298   HG21  VAL  42          HG21      VAL  42  -7.212 -18.879  -2.573
  299   HG22  VAL  42          HG22      VAL  42  -8.757 -18.597  -3.376
  300   HG23  VAL  42          HG23      VAL  42  -8.125 -20.238  -3.230
  301    H    THR  43           H        THR  43  -6.179 -21.942  -7.105
  302    HA   THR  43           HA       THR  43  -4.297 -20.134  -8.472
  303    HB   THR  43           HB       THR  43  -3.271 -22.263  -7.820
  304    HG1  THR  43           HG1      THR  43  -2.480 -22.768  -9.898
  305   HG21  THR  43          HG21      THR  43  -4.024 -24.370  -8.621
  306   HG22  THR  43          HG22      THR  43  -5.208 -23.618  -9.690
  307   HG23  THR  43          HG23      THR  43  -5.437 -23.564  -7.943
  308    H    TRP  44           H        TRP  44  -7.255 -21.913  -8.731
  309    HA   TRP  44           HA       TRP  44  -7.477 -21.833 -11.572
  310    HB2  TRP  44           HB2      TRP  44  -9.677 -22.108  -9.512
  311    HB3  TRP  44           HB3      TRP  44  -9.787 -22.522 -11.220
  312    HD1  TRP  44           HD1      TRP  44  -8.539 -23.851  -7.897
  313    HE1  TRP  44           HE1      TRP  44  -7.770 -26.289  -8.198
  314    HE3  TRP  44           HE3      TRP  44  -8.741 -24.141 -12.997
  315    HZ2  TRP  44           HZ2      TRP  44  -7.310 -28.096 -10.317
  316    HZ3  TRP  44           HZ3      TRP  44  -8.119 -26.260 -14.083
  317    HH2  TRP  44           HH2      TRP  44  -7.419 -28.195 -12.769
  Start of MODEL    9
    1    H1   SER   1           H        SER   1   2.115  19.045 -12.175
    2    HA   SER   1           HA       SER   1   4.528  19.157 -13.865
    3    HB2  SER   1           HB2      SER   1   3.723  21.287 -12.520
    4    HB3  SER   1           HB3      SER   1   4.494  20.455 -11.170
    5    HG   SER   1           HG       SER   1   6.345  21.033 -11.954
    6    H    HIS   2           H        HIS   2   3.654  16.725 -13.084
    7    HA   HIS   2           HA       HIS   2   5.828  15.810 -11.441
    8    HB2  HIS   2           HB2      HIS   2   3.934  16.522  -9.846
    9    HB3  HIS   2           HB3      HIS   2   3.072  15.110 -10.452
   10    HD1  HIS   2           HD1      HIS   2   3.954  12.788  -9.748
   11    HD2  HIS   2           HD2      HIS   2   6.094  15.971  -8.152
   12    HE1  HIS   2           HE1      HIS   2   5.395  11.792  -7.945
   13    H    MET   3           H        MET   3   6.543  14.292 -12.799
   14    HA   MET   3           HA       MET   3   4.741  12.103 -13.489
   15    HB2  MET   3           HB2      MET   3   5.431  12.098 -15.830
   16    HB3  MET   3           HB3      MET   3   4.653  13.619 -15.417
   17    HG2  MET   3           HG2      MET   3   7.612  13.454 -15.230
   18    HG3  MET   3           HG3      MET   3   6.871  13.535 -16.826
   19    HE1  MET   3           HE1      MET   3   8.362  15.440 -17.161
   20    HE2  MET   3           HE2      MET   3   6.930  16.183 -17.873
   21    HE3  MET   3           HE3      MET   3   7.945  17.108 -16.766
   22    H    GLY   4           H        GLY   4   5.836  10.142 -14.068
   23    HA2  GLY   4           HA2      GLY   4   7.805   8.831 -14.346
   24    HA3  GLY   4           HA3      GLY   4   8.732  10.114 -13.585
   25    H    ALA   5           H        ALA   5   5.983   7.996 -12.753
   26    HA   ALA   5           HA       ALA   5   7.389   6.851 -10.540
   27    HB1  ALA   5           HB1      ALA   5   6.751   9.087  -9.640
   28    HB2  ALA   5           HB2      ALA   5   5.059   8.632  -9.848
   29    HB3  ALA   5           HB3      ALA   5   6.086   7.726  -8.736
   30    H    ALA   6           H        ALA   6   6.541   4.910 -10.020
   31    HA   ALA   6           HA       ALA   6   3.842   4.283 -11.026
   32    HB1  ALA   6           HB1      ALA   6   4.941   1.879 -11.192
   33    HB2  ALA   6           HB2      ALA   6   5.052   3.046 -12.510
   34    HB3  ALA   6           HB3      ALA   6   6.408   2.836 -11.402
   35    H    ALA   7           H        ALA   7   2.501   3.776  -9.435
   36    HA   ALA   7           HA       ALA   7   3.037   1.830  -7.476
   37    HB1  ALA   7           HB1      ALA   7   3.934   4.477  -6.814
   38    HB2  ALA   7           HB2      ALA   7   2.655   3.969  -5.709
   39    HB3  ALA   7           HB3      ALA   7   4.100   2.977  -5.901
   40    H    LEU   8           H        LEU   8   1.276   1.798  -5.761
   41    HA   LEU   8           HA       LEU   8  -1.228   2.832  -6.922
   42    HB2  LEU   8           HB2      LEU   8  -2.246   0.843  -5.649
   43    HB3  LEU   8           HB3      LEU   8  -1.403   0.541  -7.166
   44    HG   LEU   8           HG       LEU   8   0.614  -0.089  -5.779
   45   HD11  LEU   8          HD11      LEU   8   0.499   0.467  -3.621
   46   HD12  LEU   8          HD12      LEU   8  -0.537  -0.949  -3.440
   47   HD13  LEU   8          HD13      LEU   8  -1.255   0.647  -3.667
   48   HD21  LEU   8          HD21      LEU   8  -0.316  -2.326  -5.207
   49   HD22  LEU   8          HD22      LEU   8  -0.698  -1.789  -6.843
   50   HD23  LEU   8          HD23      LEU   8  -1.924  -1.703  -5.578
   51    H    ARG   9           H        ARG   9  -2.849   3.557  -5.506
   52    HA   ARG   9           HA       ARG   9  -1.832   4.362  -2.871
   53    HB2  ARG   9           HB2      ARG   9  -2.790   5.985  -4.733
   54    HB3  ARG   9           HB3      ARG   9  -4.331   5.506  -4.034
   55    HG2  ARG   9           HG2      ARG   9  -3.704   7.497  -2.949
   56    HG3  ARG   9           HG3      ARG   9  -3.394   6.196  -1.797
   57    HD2  ARG   9           HD2      ARG   9  -1.098   6.358  -2.033
   58    HD3  ARG   9           HD3      ARG   9  -1.214   7.126  -3.616
   59    HE   ARG   9           HE       ARG   9  -1.233   9.143  -2.561
   60   HH11  ARG   9          HH11      ARG   9  -2.257   6.706  -0.296
   61   HH12  ARG   9          HH12      ARG   9  -2.345   7.802   1.044
   62   HH21  ARG   9          HH21      ARG   9  -1.345  10.595  -0.807
   63   HH22  ARG   9          HH22      ARG   9  -1.826  10.014   0.751
   64    H    SER  10           H        SER  10  -3.336   1.819  -3.920
   65    HA   SER  10           HA       SER  10  -4.905   1.497  -1.505
   66    HB2  SER  10           HB2      SER  10  -6.801   0.521  -3.062
   67    HB3  SER  10           HB3      SER  10  -6.741   2.245  -2.696
   68    HG   SER  10           HG       SER  10  -6.490   2.589  -4.742
   69    H    CYS  11           H        CYS  11  -5.883  -0.802  -1.485
   70    HA   CYS  11           HA       CYS  11  -3.831  -2.633  -2.532
   71    HB2  CYS  11           HB2      CYS  11  -4.263  -2.377   0.003
   72    HB3  CYS  11           HB3      CYS  11  -5.739  -3.287  -0.299
   73    HA   PRO  12           HA       PRO  12  -7.447  -3.757  -5.080
   74    HB2  PRO  12           HB2      PRO  12  -5.954  -4.729  -7.129
   75    HB3  PRO  12           HB3      PRO  12  -6.314  -3.010  -6.933
   76    HG2  PRO  12           HG2      PRO  12  -3.839  -4.522  -6.194
   77    HG3  PRO  12           HG3      PRO  12  -3.990  -2.935  -6.970
   78    HD2  PRO  12           HD2      PRO  12  -3.453  -3.220  -4.332
   79    HD3  PRO  12           HD3      PRO  12  -4.390  -1.856  -4.974
   80    H    MET  13           H        MET  13  -4.991  -5.480  -3.519
   81    HA   MET  13           HA       MET  13  -5.586  -8.092  -4.527
   82    HB2  MET  13           HB2      MET  13  -3.853  -6.937  -2.427
   83    HB3  MET  13           HB3      MET  13  -4.389  -8.590  -2.152
   84    HG2  MET  13           HG2      MET  13  -2.542  -9.085  -3.325
   85    HG3  MET  13           HG3      MET  13  -3.600  -8.796  -4.703
   86    HE1  MET  13           HE1      MET  13  -0.947  -7.699  -2.400
   87    HE2  MET  13           HE2      MET  13  -0.044  -6.440  -3.242
   88    HE3  MET  13           HE3      MET  13  -1.492  -6.023  -2.323
   89    H    CYS  14           H        CYS  14  -6.602  -6.176  -1.749
   90    HA   CYS  14           HA       CYS  14  -8.620  -8.241  -1.156
   91    HB2  CYS  14           HB2      CYS  14  -8.491  -7.650   1.196
   92    HB3  CYS  14           HB3      CYS  14  -6.890  -8.092   0.610
   93    H    GLN  15           H        GLN  15  -8.259  -5.346  -2.517
   94    HA   GLN  15           HA       GLN  15  -9.661  -3.627  -3.017
   95    HB2  GLN  15           HB2      GLN  15 -11.281  -5.776  -2.884
   96    HB3  GLN  15           HB3      GLN  15 -11.981  -4.802  -1.597
   97    HG2  GLN  15           HG2      GLN  15 -12.950  -3.419  -3.037
   98    HG3  GLN  15           HG3      GLN  15 -11.476  -3.250  -3.990
   99   HE21  GLN  15          HE21      GLN  15 -12.638  -3.308  -5.917
  100   HE22  GLN  15          HE22      GLN  15 -13.312  -4.774  -6.537
  101    H    LYS  16           H        LYS  16  -8.104  -3.100  -0.931
  102    HA   LYS  16           HA       LYS  16  -9.889  -1.806   1.026
  103    HB2  LYS  16           HB2      LYS  16  -8.630  -3.456   2.193
  104    HB3  LYS  16           HB3      LYS  16  -7.139  -2.991   1.384
  105    HG2  LYS  16           HG2      LYS  16  -6.810  -1.175   2.728
  106    HG3  LYS  16           HG3      LYS  16  -8.534  -0.956   3.040
  107    HD2  LYS  16           HD2      LYS  16  -8.300  -3.250   4.275
  108    HD3  LYS  16           HD3      LYS  16  -6.589  -2.822   4.332
  109    HE2  LYS  16           HE2      LYS  16  -7.135  -0.731   5.452
  110    HE3  LYS  16           HE3      LYS  16  -8.855  -1.109   5.350
  111    HZ1  LYS  16           HZ1      LYS  16  -7.574  -3.272   6.561
  112    HZ2  LYS  16           HZ2      LYS  16  -8.678  -2.194   7.254
  113    HZ3  LYS  16           HZ3      LYS  16  -7.019  -1.870   7.330
  114    H    GLU  17           H        GLU  17  -9.584   0.334   1.477
  115    HA   GLU  17           HA       GLU  17  -7.805   1.776  -0.340
  116    HB2  GLU  17           HB2      GLU  17 -10.322   2.400   1.083
  117    HB3  GLU  17           HB3      GLU  17  -9.182   3.729   0.929
  118    HG2  GLU  17           HG2      GLU  17  -9.357   2.445  -1.589
  119    HG3  GLU  17           HG3      GLU  17 -10.996   2.710  -0.996
  120    H    PHE  18           H        PHE  18  -6.076   2.920   0.312
  121    HA   PHE  18           HA       PHE  18  -5.217   2.620   3.061
  122    HB2  PHE  18           HB2      PHE  18  -3.872   3.804   0.628
  123    HB3  PHE  18           HB3      PHE  18  -3.122   3.731   2.219
  124    HD1  PHE  18           HD2      PHE  18  -3.825   1.102   3.191
  125    HD2  PHE  18           HD1      PHE  18  -2.745   2.335  -0.738
  126    HE1  PHE  18           HE2      PHE  18  -3.015  -1.170   2.704
  127    HE2  PHE  18           HE1      PHE  18  -1.935   0.065  -1.231
  128    HZ   PHE  18           HZ       PHE  18  -2.068  -1.690   0.491
  129    H    ALA  19           H        ALA  19  -5.155   4.171   4.584
  130    HA   ALA  19           HA       ALA  19  -6.714   6.494   4.323
  131    HB1  ALA  19           HB1      ALA  19  -5.195   7.056   6.488
  132    HB2  ALA  19           HB2      ALA  19  -6.608   6.000   6.516
  133    HB3  ALA  19           HB3      ALA  19  -4.991   5.307   6.390
  134    HA   PRO  20           HA       PRO  20  -4.042   9.564   2.684
  135    HB2  PRO  20           HB2      PRO  20  -4.690  11.748   4.162
  136    HB3  PRO  20           HB3      PRO  20  -5.765  11.062   2.938
  137    HG2  PRO  20           HG2      PRO  20  -5.809  10.709   5.911
  138    HG3  PRO  20           HG3      PRO  20  -7.161  10.981   4.796
  139    HD2  PRO  20           HD2      PRO  20  -6.541   8.529   5.763
  140    HD3  PRO  20           HD3      PRO  20  -7.236   8.771   4.148
  141    H    ARG  21           H        ARG  21  -3.916   8.921   6.106
  142    HA   ARG  21           HA       ARG  21  -1.548  10.485   6.579
  143    HB2  ARG  21           HB2      ARG  21  -2.958  10.234   8.456
  144    HB3  ARG  21           HB3      ARG  21  -3.105   8.498   8.216
  145    HG2  ARG  21           HG2      ARG  21  -1.035   8.058   9.133
  146    HG3  ARG  21           HG3      ARG  21  -0.438   9.690   8.824
  147    HD2  ARG  21           HD2      ARG  21  -2.734   9.325  10.687
  148    HD3  ARG  21           HD3      ARG  21  -1.111   8.921  11.249
  149    HE   ARG  21           HE       ARG  21  -2.185  11.530  10.865
  150   HH11  ARG  21          HH11      ARG  21   0.750   9.667  10.696
  151   HH12  ARG  21          HH12      ARG  21   1.784  11.028  10.979
  152   HH21  ARG  21          HH21      ARG  21  -0.835  13.330  11.240
  153   HH22  ARG  21          HH22      ARG  21   0.882  13.111  11.288
  154    H    LEU  22           H        LEU  22  -2.279   7.245   5.593
  155    HA   LEU  22           HA       LEU  22   0.055   5.913   6.337
  156    HB2  LEU  22           HB2      LEU  22  -1.879   5.559   4.078
  157    HB3  LEU  22           HB3      LEU  22  -0.449   4.537   4.207
  158    HG   LEU  22           HG       LEU  22  -2.652   4.759   6.259
  159   HD11  LEU  22          HD11      LEU  22  -3.329   3.599   4.203
  160   HD12  LEU  22          HD12      LEU  22  -3.236   2.505   5.583
  161   HD13  LEU  22          HD13      LEU  22  -1.951   2.512   4.375
  162   HD21  LEU  22          HD21      LEU  22  -1.281   3.784   7.702
  163   HD22  LEU  22          HD22      LEU  22   0.032   3.923   6.532
  164   HD23  LEU  22          HD23      LEU  22  -0.973   2.474   6.561
  165    H    THR  23           H        THR  23   2.026   5.570   5.349
  166    HA   THR  23           HA       THR  23   2.733   7.530   3.269
  167    HB   THR  23           HB       THR  23   5.129   7.003   4.058
  168    HG1  THR  23           HG1      THR  23   3.882   6.304   6.491
  169   HG21  THR  23          HG21      THR  23   4.467   8.396   6.306
  170   HG22  THR  23          HG22      THR  23   3.060   8.686   5.284
  171   HG23  THR  23          HG23      THR  23   4.671   9.109   4.707
  172    H    GLN  24           H        GLN  24   4.698   6.769   1.931
  173    HA   GLN  24           HA       GLN  24   3.933   4.641   0.323
  174    HB2  GLN  24           HB2      GLN  24   6.176   4.780  -0.666
  175    HB3  GLN  24           HB3      GLN  24   5.473   6.375  -0.434
  176    HG2  GLN  24           HG2      GLN  24   6.795   6.574   1.666
  177    HG3  GLN  24           HG3      GLN  24   7.589   5.057   1.249
  178   HE21  GLN  24          HE21      GLN  24   8.946   4.989  -0.575
  179   HE22  GLN  24          HE22      GLN  24   9.642   6.427  -1.229
  180    H    LEU  25           H        LEU  25   6.122   4.707   3.084
  181    HA   LEU  25           HA       LEU  25   7.088   2.059   2.790
  182    HB2  LEU  25           HB2      LEU  25   8.049   2.319   4.927
  183    HB3  LEU  25           HB3      LEU  25   8.133   3.896   4.145
  184    HG   LEU  25           HG       LEU  25   5.857   4.231   5.502
  185   HD11  LEU  25          HD11      LEU  25   7.243   1.952   6.780
  186   HD12  LEU  25          HD12      LEU  25   5.528   2.361   6.737
  187   HD13  LEU  25          HD13      LEU  25   6.608   3.206   7.846
  188   HD21  LEU  25          HD21      LEU  25   7.699   5.739   5.660
  189   HD22  LEU  25          HD22      LEU  25   8.674   4.549   6.522
  190   HD23  LEU  25          HD23      LEU  25   7.259   5.260   7.299
  191    H    ASP  26           H        ASP  26   4.336   3.467   4.466
  192    HA   ASP  26           HA       ASP  26   3.599   1.151   5.919
  193    HB2  ASP  26           HB2      ASP  26   2.126   3.642   5.095
  194    HB3  ASP  26           HB3      ASP  26   1.303   2.333   5.941
  195    H    VAL  27           H        VAL  27   2.544   2.460   2.795
  196    HA   VAL  27           HA       VAL  27   0.546   0.627   2.199
  197    HB   VAL  27           HB       VAL  27   2.471   1.938   0.275
  198   HG11  VAL  27          HG11      VAL  27   1.511   0.622  -1.250
  199   HG12  VAL  27          HG12      VAL  27   0.273   0.079  -0.118
  200   HG13  VAL  27          HG13      VAL  27   0.055   1.586  -1.008
  201   HG21  VAL  27          HG21      VAL  27   1.444   3.727   1.289
  202   HG22  VAL  27          HG22      VAL  27   0.314   3.398  -0.026
  203   HG23  VAL  27          HG23      VAL  27  -0.043   2.832   1.606
  204    H    ASP  28           H        ASP  28   4.019   0.447   1.454
  205    HA   ASP  28           HA       ASP  28   3.965  -2.007   0.107
  206    HB2  ASP  28           HB2      ASP  28   6.038  -0.344   1.419
  207    HB3  ASP  28           HB3      ASP  28   6.438  -2.044   1.182
  208    H    SER  29           H        SER  29   4.106  -1.234   3.525
  209    HA   SER  29           HA       SER  29   4.865  -3.717   4.543
  210    HB2  SER  29           HB2      SER  29   4.395  -1.382   5.706
  211    HB3  SER  29           HB3      SER  29   2.815  -2.107   6.006
  212    HG   SER  29           HG       SER  29   3.903  -3.852   7.017
  213    H    HIS  30           H        HIS  30   1.583  -2.436   4.017
  214    HA   HIS  30           HA       HIS  30   0.268  -4.841   4.745
  215    HB2  HIS  30           HB2      HIS  30  -0.835  -2.630   4.780
  216    HB3  HIS  30           HB3      HIS  30  -0.746  -2.569   3.022
  217    HD1  HIS  30           HD1      HIS  30  -3.034  -3.359   5.611
  218    HD2  HIS  30           HD2      HIS  30  -2.180  -4.999   1.891
  219    HE1  HIS  30           HE1      HIS  30  -5.060  -4.713   4.992
  220    H    LEU  31           H        LEU  31   1.395  -3.521   1.682
  221    HA   LEU  31           HA       LEU  31   0.129  -5.306  -0.057
  222    HB2  LEU  31           HB2      LEU  31   2.705  -3.775  -0.236
  223    HB3  LEU  31           HB3      LEU  31   2.153  -4.818  -1.546
  224    HG   LEU  31           HG       LEU  31   0.647  -2.434  -0.469
  225   HD11  LEU  31          HD11      LEU  31   1.291  -1.304  -2.496
  226   HD12  LEU  31          HD12      LEU  31   2.167  -2.728  -3.056
  227   HD13  LEU  31          HD13      LEU  31   2.739  -1.841  -1.644
  228   HD21  LEU  31          HD21      LEU  31  -0.710  -2.757  -2.526
  229   HD22  LEU  31          HD22      LEU  31  -0.868  -4.068  -1.357
  230   HD23  LEU  31          HD23      LEU  31   0.133  -4.284  -2.794
  231    H    ALA  32           H        ALA  32   2.829  -5.731   2.062
  232    HA   ALA  32           HA       ALA  32   3.795  -8.121   0.757
  233    HB1  ALA  32           HB1      ALA  32   5.608  -7.920   2.065
  234    HB2  ALA  32           HB2      ALA  32   4.977  -6.305   2.389
  235    HB3  ALA  32           HB3      ALA  32   4.652  -7.622   3.517
  236    H    GLN  33           H        GLN  33   2.101  -7.350   3.787
  237    HA   GLN  33           HA       GLN  33   1.816 -10.046   4.614
  238    HB2  GLN  33           HB2      GLN  33   0.203  -7.611   5.393
  239    HB3  GLN  33           HB3      GLN  33   0.183  -9.156   6.232
  240    HG2  GLN  33           HG2      GLN  33   2.631  -8.862   6.651
  241    HG3  GLN  33           HG3      GLN  33   2.478  -7.230   6.000
  242   HE21  GLN  33          HE21      GLN  33   2.361  -5.759   7.521
  243   HE22  GLN  33          HE22      GLN  33   1.585  -5.930   9.055
  244    H    CYS  34           H        CYS  34  -0.080  -7.926   2.473
  245    HA   CYS  34           HA       CYS  34  -2.405  -9.531   2.579
  246    HB2  CYS  34           HB2      CYS  34  -2.037  -7.035   1.777
  247    HB3  CYS  34           HB3      CYS  34  -1.769  -7.788   0.217
  248    H    LEU  35           H        LEU  35   0.412  -9.224   0.456
  249    HA   LEU  35           HA       LEU  35  -0.331 -11.090  -1.505
  250    HB2  LEU  35           HB2      LEU  35   2.258  -9.927  -0.585
  251    HB3  LEU  35           HB3      LEU  35   2.274 -11.277  -1.718
  252    HG   LEU  35           HG       LEU  35   0.897  -8.634  -2.199
  253   HD11  LEU  35          HD11      LEU  35   3.132  -9.277  -3.918
  254   HD12  LEU  35          HD12      LEU  35   3.620  -9.160  -2.227
  255   HD13  LEU  35          HD13      LEU  35   2.797  -7.808  -3.002
  256   HD21  LEU  35          HD21      LEU  35   1.188  -9.711  -4.618
  257   HD22  LEU  35          HD22      LEU  35  -0.233 -10.003  -3.615
  258   HD23  LEU  35          HD23      LEU  35   1.065 -11.197  -3.677
  259    H    ALA  36           H        ALA  36   1.479 -11.463   1.514
  260    HA   ALA  36           HA       ALA  36   2.067 -14.222   1.136
  261    HB1  ALA  36           HB1      ALA  36   3.451 -13.717   2.795
  262    HB2  ALA  36           HB2      ALA  36   2.597 -12.205   3.108
  263    HB3  ALA  36           HB3      ALA  36   2.068 -13.696   3.889
  264    H    GLU  37           H        GLU  37  -0.528 -12.461   2.757
  265    HA   GLU  37           HA       GLU  37  -1.725 -14.692   4.008
  266    HB2  GLU  37           HB2      GLU  37  -2.597 -11.919   3.332
  267    HB3  GLU  37           HB3      GLU  37  -3.821 -13.090   3.800
  268    HG2  GLU  37           HG2      GLU  37  -2.466 -13.528   5.867
  269    HG3  GLU  37           HG3      GLU  37  -1.470 -12.145   5.414
  270    H    SER  38           H        SER  38  -1.894 -13.407   0.780
  271    HA   SER  38           HA       SER  38  -4.276 -14.736  -0.019
  272    HB2  SER  38           HB2      SER  38  -2.049 -13.321  -1.415
  273    HB3  SER  38           HB3      SER  38  -3.095 -14.372  -2.372
  274    HG   SER  38           HG       SER  38  -4.840 -13.133  -1.815
  275    H    THR  39           H        THR  39  -1.057 -15.776   0.476
  276    HA   THR  39           HA       THR  39   0.039 -17.742   0.122
  277    HB   THR  39           HB       THR  39  -2.611 -19.110  -0.221
  278    HG1  THR  39           HG1      THR  39  -1.510 -18.226   2.257
  279   HG21  THR  39          HG21      THR  39  -1.456 -20.964   0.252
  280   HG22  THR  39          HG22      THR  39  -0.706 -20.216   1.663
  281   HG23  THR  39          HG23      THR  39   0.006 -19.996   0.065
  282    H    GLU  40           H        GLU  40  -0.114 -16.243  -2.151
  283    HA   GLU  40           HA       GLU  40  -1.067 -17.889  -4.335
  284    HB2  GLU  40           HB2      GLU  40  -1.361 -15.551  -4.644
  285    HB3  GLU  40           HB3      GLU  40   0.308 -15.211  -4.208
  286    HG2  GLU  40           HG2      GLU  40  -0.003 -14.967  -6.586
  287    HG3  GLU  40           HG3      GLU  40   1.067 -16.326  -6.248
  288    H    ASP  41           H        ASP  41   0.153 -19.718  -4.468
  289    HA   ASP  41           HA       ASP  41   2.998 -19.329  -5.109
  290    HB2  ASP  41           HB2      ASP  41   2.622 -20.299  -2.803
  291    HB3  ASP  41           HB3      ASP  41   1.926 -21.711  -3.593
  292    H    VAL  42           H        VAL  42   1.473 -19.292  -7.197
  293    HA   VAL  42           HA       VAL  42   1.145 -22.023  -8.211
  294    HB   VAL  42           HB       VAL  42   0.200 -19.402  -9.382
  295   HG11  VAL  42          HG11      VAL  42   0.440 -20.783 -11.229
  296   HG12  VAL  42          HG12      VAL  42   0.015 -22.237 -10.324
  297   HG13  VAL  42          HG13      VAL  42  -1.234 -21.067 -10.753
  298   HG21  VAL  42          HG21      VAL  42  -1.811 -21.346  -8.586
  299   HG22  VAL  42          HG22      VAL  42  -0.828 -20.790  -7.230
  300   HG23  VAL  42          HG23      VAL  42  -1.699 -19.624  -8.226
  301    H    THR  43           H        THR  43   2.958 -22.796  -9.090
  302    HA   THR  43           HA       THR  43   4.569 -21.010 -10.788
  303    HB   THR  43           HB       THR  43   6.364 -22.795 -10.491
  304    HG1  THR  43           HG1      THR  43   5.842 -24.481  -9.336
  305   HG21  THR  43          HG21      THR  43   5.424 -21.276  -8.053
  306   HG22  THR  43          HG22      THR  43   6.458 -20.647  -9.335
  307   HG23  THR  43          HG23      THR  43   7.039 -21.940  -8.287
  308    H    TRP  44           H        TRP  44   2.838 -24.036 -10.646
  309    HA   TRP  44           HA       TRP  44   3.235 -24.334 -13.544
  310    HB2  TRP  44           HB2      TRP  44   4.636 -25.990 -12.365
  311    HB3  TRP  44           HB3      TRP  44   3.206 -26.598 -11.536
  312    HD1  TRP  44           HD1      TRP  44   1.348 -27.860 -13.114
  313    HE1  TRP  44           HE1      TRP  44   1.672 -29.222 -15.274
  314    HE3  TRP  44           HE3      TRP  44   6.001 -26.200 -14.429
  315    HZ2  TRP  44           HZ2      TRP  44   3.641 -29.550 -17.271
  316    HZ3  TRP  44           HZ3      TRP  44   7.035 -27.088 -16.477
  317    HH2  TRP  44           HH2      TRP  44   5.878 -28.729 -17.867
  Start of MODEL   10
    1    H1   SER   1           H        SER   1  10.508   3.468 -21.844
    2    HA   SER   1           HA       SER   1   8.262   5.225 -22.119
    3    HB2  SER   1           HB2      SER   1   8.322   4.162 -24.370
    4    HB3  SER   1           HB3      SER   1   8.153   2.585 -23.599
    5    HG   SER   1           HG       SER   1   6.097   2.942 -23.372
    6    H    HIS   2           H        HIS   2   6.756   4.833 -20.579
    7    HA   HIS   2           HA       HIS   2   6.799   2.253 -19.189
    8    HB2  HIS   2           HB2      HIS   2   6.815   3.335 -17.003
    9    HB3  HIS   2           HB3      HIS   2   8.254   3.786 -17.914
   10    HD1  HIS   2           HD1      HIS   2   5.799   5.241 -15.826
   11    HD2  HIS   2           HD2      HIS   2   7.704   6.436 -19.320
   12    HE1  HIS   2           HE1      HIS   2   5.524   7.740 -15.921
   13    H    MET   3           H        MET   3   4.909   2.039 -17.676
   14    HA   MET   3           HA       MET   3   2.571   3.459 -18.772
   15    HB2  MET   3           HB2      MET   3   1.259   1.430 -18.350
   16    HB3  MET   3           HB3      MET   3   2.588   1.115 -19.457
   17    HG2  MET   3           HG2      MET   3   3.843   0.400 -17.283
   18    HG3  MET   3           HG3      MET   3   2.211   0.221 -16.643
   19    HE1  MET   3           HE1      MET   3   3.418  -3.276 -17.091
   20    HE2  MET   3           HE2      MET   3   4.742  -2.515 -17.974
   21    HE3  MET   3           HE3      MET   3   4.131  -1.778 -16.492
   22    H    GLY   4           H        GLY   4   4.087   2.075 -15.911
   23    HA2  GLY   4           HA2      GLY   4   3.680   3.763 -13.987
   24    HA3  GLY   4           HA3      GLY   4   2.006   3.286 -14.224
   25    H    ALA   5           H        ALA   5   1.451   2.072 -12.537
   26    HA   ALA   5           HA       ALA   5   1.453   0.425 -10.965
   27    HB1  ALA   5           HB1      ALA   5   1.321  -1.133 -12.709
   28    HB2  ALA   5           HB2      ALA   5   3.000  -0.873 -13.185
   29    HB3  ALA   5           HB3      ALA   5   2.630  -1.724 -11.685
   30    H    ALA   6           H        ALA   6   3.386   2.485 -10.637
   31    HA   ALA   6           HA       ALA   6   5.526   0.997  -9.259
   32    HB1  ALA   6           HB1      ALA   6   7.091   2.675  -9.768
   33    HB2  ALA   6           HB2      ALA   6   6.220   2.382 -11.274
   34    HB3  ALA   6           HB3      ALA   6   5.838   3.799 -10.296
   35    H    ALA   7           H        ALA   7   2.766   2.441  -8.631
   36    HA   ALA   7           HA       ALA   7   3.341   2.974  -5.925
   37    HB1  ALA   7           HB1      ALA   7   4.307   5.013  -7.245
   38    HB2  ALA   7           HB2      ALA   7   2.620   5.521  -7.299
   39    HB3  ALA   7           HB3      ALA   7   3.414   5.263  -5.746
   40    H    LEU   8           H        LEU   8   1.530   2.118  -5.139
   41    HA   LEU   8           HA       LEU   8  -1.036   2.888  -6.361
   42    HB2  LEU   8           HB2      LEU   8  -1.891   0.810  -5.187
   43    HB3  LEU   8           HB3      LEU   8  -0.828   0.568  -6.572
   44    HG   LEU   8           HG       LEU   8   0.364   0.562  -3.840
   45   HD11  LEU   8          HD11      LEU   8  -1.720  -1.241  -4.703
   46   HD12  LEU   8          HD12      LEU   8  -0.925  -1.103  -3.135
   47   HD13  LEU   8          HD13      LEU   8  -0.207  -2.097  -4.402
   48   HD21  LEU   8          HD21      LEU   8   1.520  -1.431  -5.190
   49   HD22  LEU   8          HD22      LEU   8   2.049   0.246  -5.324
   50   HD23  LEU   8          HD23      LEU   8   0.989  -0.445  -6.552
   51    H    ARG   9           H        ARG   9  -2.577   3.838  -5.144
   52    HA   ARG   9           HA       ARG   9  -1.842   4.567  -2.411
   53    HB2  ARG   9           HB2      ARG   9  -3.501   5.756  -4.537
   54    HB3  ARG   9           HB3      ARG   9  -4.161   5.913  -2.914
   55    HG2  ARG   9           HG2      ARG   9  -2.855   7.857  -3.434
   56    HG3  ARG   9           HG3      ARG   9  -2.029   6.924  -2.185
   57    HD2  ARG   9           HD2      ARG   9  -0.367   6.217  -3.630
   58    HD3  ARG   9           HD3      ARG   9  -1.362   6.476  -5.062
   59    HE   ARG   9           HE       ARG   9  -0.855   8.939  -3.779
   60   HH11  ARG   9          HH11      ARG   9   0.717   6.493  -5.694
   61   HH12  ARG   9          HH12      ARG   9   1.869   7.588  -6.384
   62   HH21  ARG   9          HH21      ARG   9   0.655  10.391  -4.680
   63   HH22  ARG   9          HH22      ARG   9   1.834   9.805  -5.805
   64    H    SER  10           H        SER  10  -3.262   2.012  -3.651
   65    HA   SER  10           HA       SER  10  -4.915   1.575  -1.310
   66    HB2  SER  10           HB2      SER  10  -6.721   0.637  -3.028
   67    HB3  SER  10           HB3      SER  10  -6.735   2.320  -2.501
   68    HG   SER  10           HG       SER  10  -5.389   1.421  -4.828
   69    H    CYS  11           H        CYS  11  -5.867  -0.730  -1.418
   70    HA   CYS  11           HA       CYS  11  -3.763  -2.499  -2.462
   71    HB2  CYS  11           HB2      CYS  11  -4.328  -2.347   0.066
   72    HB3  CYS  11           HB3      CYS  11  -5.753  -3.291  -0.354
   73    HA   PRO  12           HA       PRO  12  -7.244  -3.548  -5.213
   74    HB2  PRO  12           HB2      PRO  12  -5.651  -4.462  -7.213
   75    HB3  PRO  12           HB3      PRO  12  -6.017  -2.748  -6.983
   76    HG2  PRO  12           HG2      PRO  12  -3.586  -4.291  -6.167
   77    HG3  PRO  12           HG3      PRO  12  -3.694  -2.681  -6.901
   78    HD2  PRO  12           HD2      PRO  12  -3.292  -3.049  -4.248
   79    HD3  PRO  12           HD3      PRO  12  -4.192  -1.662  -4.894
   80    H    MET  13           H        MET  13  -4.865  -5.328  -3.593
   81    HA   MET  13           HA       MET  13  -5.441  -7.906  -4.707
   82    HB2  MET  13           HB2      MET  13  -3.373  -6.956  -3.271
   83    HB3  MET  13           HB3      MET  13  -4.298  -7.707  -1.978
   84    HG2  MET  13           HG2      MET  13  -4.320  -9.809  -3.329
   85    HG3  MET  13           HG3      MET  13  -3.206  -9.026  -4.447
   86    HE1  MET  13           HE1      MET  13  -0.919  -7.778  -3.371
   87    HE2  MET  13           HE2      MET  13  -1.786  -7.246  -1.931
   88    HE3  MET  13           HE3      MET  13  -0.302  -8.187  -1.771
   89    H    CYS  14           H        CYS  14  -6.490  -6.087  -1.869
   90    HA   CYS  14           HA       CYS  14  -8.557  -8.139  -1.414
   91    HB2  CYS  14           HB2      CYS  14  -8.469  -7.663   0.960
   92    HB3  CYS  14           HB3      CYS  14  -6.856  -8.080   0.394
   93    H    GLN  15           H        GLN  15  -8.222  -5.305  -2.773
   94    HA   GLN  15           HA       GLN  15  -9.562  -3.518  -3.201
   95    HB2  GLN  15           HB2      GLN  15 -11.510  -5.537  -2.150
   96    HB3  GLN  15           HB3      GLN  15 -12.053  -3.904  -2.508
   97    HG2  GLN  15           HG2      GLN  15 -11.477  -4.117  -4.796
   98    HG3  GLN  15           HG3      GLN  15 -10.612  -5.625  -4.502
   99   HE21  GLN  15          HE21      GLN  15 -12.627  -5.320  -6.418
  100   HE22  GLN  15          HE22      GLN  15 -13.970  -6.308  -5.962
  101    H    LYS  16           H        LYS  16  -8.029  -3.059  -1.084
  102    HA   LYS  16           HA       LYS  16  -9.816  -1.877   0.940
  103    HB2  LYS  16           HB2      LYS  16  -8.364  -3.519   1.940
  104    HB3  LYS  16           HB3      LYS  16  -6.952  -2.809   1.169
  105    HG2  LYS  16           HG2      LYS  16  -7.036  -0.899   2.556
  106    HG3  LYS  16           HG3      LYS  16  -8.646  -1.314   3.149
  107    HD2  LYS  16           HD2      LYS  16  -7.701  -3.330   4.213
  108    HD3  LYS  16           HD3      LYS  16  -6.095  -2.841   3.671
  109    HE2  LYS  16           HE2      LYS  16  -6.128  -2.029   5.828
  110    HE3  LYS  16           HE3      LYS  16  -6.654  -0.619   4.909
  111    HZ1  LYS  16           HZ1      LYS  16  -8.665  -2.485   5.967
  112    HZ2  LYS  16           HZ2      LYS  16  -8.804  -0.831   5.638
  113    HZ3  LYS  16           HZ3      LYS  16  -7.958  -1.352   7.007
  114    H    GLU  17           H        GLU  17  -9.406   0.236   1.663
  115    HA   GLU  17           HA       GLU  17  -7.822   1.846  -0.222
  116    HB2  GLU  17           HB2      GLU  17 -10.250   2.504   1.438
  117    HB3  GLU  17           HB3      GLU  17  -9.262   3.751   0.689
  118    HG2  GLU  17           HG2      GLU  17  -9.693   2.735  -1.511
  119    HG3  GLU  17           HG3      GLU  17 -10.743   1.551  -0.734
  120    H    PHE  18           H        PHE  18  -6.074   2.876   0.487
  121    HA   PHE  18           HA       PHE  18  -5.334   2.675   3.271
  122    HB2  PHE  18           HB2      PHE  18  -3.900   3.896   0.904
  123    HB3  PHE  18           HB3      PHE  18  -3.212   3.741   2.517
  124    HD1  PHE  18           HD2      PHE  18  -4.083   1.057   3.296
  125    HD2  PHE  18           HD1      PHE  18  -2.641   2.500  -0.440
  126    HE1  PHE  18           HE2      PHE  18  -3.284  -1.201   2.735
  127    HE2  PHE  18           HE1      PHE  18  -1.841   0.244  -1.007
  128    HZ   PHE  18           HZ       PHE  18  -2.161  -1.611   0.583
  129    H    ALA  19           H        ALA  19  -5.067   4.337   4.719
  130    HA   ALA  19           HA       ALA  19  -6.735   6.620   4.373
  131    HB1  ALA  19           HB1      ALA  19  -5.315   7.219   6.591
  132    HB2  ALA  19           HB2      ALA  19  -6.725   6.160   6.576
  133    HB3  ALA  19           HB3      ALA  19  -5.103   5.469   6.533
  134    HA   PRO  20           HA       PRO  20  -3.987   9.658   2.804
  135    HB2  PRO  20           HB2      PRO  20  -4.677  11.864   4.227
  136    HB3  PRO  20           HB3      PRO  20  -5.709  11.169   2.973
  137    HG2  PRO  20           HG2      PRO  20  -5.867  10.855   5.946
  138    HG3  PRO  20           HG3      PRO  20  -7.174  11.120   4.778
  139    HD2  PRO  20           HD2      PRO  20  -6.606   8.678   5.799
  140    HD3  PRO  20           HD3      PRO  20  -7.237   8.901   4.155
  141    H    ARG  21           H        ARG  21  -3.821   8.719   6.075
  142    HA   ARG  21           HA       ARG  21  -1.554  10.408   6.725
  143    HB2  ARG  21           HB2      ARG  21  -1.591   9.197   8.892
  144    HB3  ARG  21           HB3      ARG  21  -3.130   9.952   8.496
  145    HG2  ARG  21           HG2      ARG  21  -4.170   7.928   8.093
  146    HG3  ARG  21           HG3      ARG  21  -2.646   7.086   7.809
  147    HD2  ARG  21           HD2      ARG  21  -3.666   6.461   9.954
  148    HD3  ARG  21           HD3      ARG  21  -2.094   7.231  10.163
  149    HE   ARG  21           HE       ARG  21  -3.128   8.888  11.337
  150   HH11  ARG  21          HH11      ARG  21  -5.507   7.256   9.390
  151   HH12  ARG  21          HH12      ARG  21  -6.845   8.135  10.055
  152   HH21  ARG  21          HH21      ARG  21  -4.879  10.051  12.221
  153   HH22  ARG  21          HH22      ARG  21  -6.486   9.724  11.665
  154    H    LEU  22           H        LEU  22  -2.188   7.188   5.598
  155    HA   LEU  22           HA       LEU  22   0.285   6.006   6.294
  156    HB2  LEU  22           HB2      LEU  22  -1.732   5.370   4.154
  157    HB3  LEU  22           HB3      LEU  22  -0.295   4.392   4.440
  158    HG   LEU  22           HG       LEU  22  -2.439   4.890   6.501
  159   HD11  LEU  22          HD11      LEU  22  -2.021   2.424   4.824
  160   HD12  LEU  22          HD12      LEU  22  -3.259   3.639   4.510
  161   HD13  LEU  22          HD13      LEU  22  -3.294   2.713   6.010
  162   HD21  LEU  22          HD21      LEU  22  -1.226   3.652   7.927
  163   HD22  LEU  22          HD22      LEU  22   0.128   4.096   6.889
  164   HD23  LEU  22          HD23      LEU  22  -0.683   2.545   6.666
  165    H    THR  23           H        THR  23   2.088   5.525   4.959
  166    HA   THR  23           HA       THR  23   2.455   7.413   2.724
  167    HB   THR  23           HB       THR  23   4.957   7.180   3.332
  168    HG1  THR  23           HG1      THR  23   5.068   6.887   5.744
  169   HG21  THR  23          HG21      THR  23   4.429   8.819   5.404
  170   HG22  THR  23          HG22      THR  23   2.852   8.811   4.613
  171   HG23  THR  23          HG23      THR  23   4.285   9.311   3.716
  172    H    GLN  24           H        GLN  24   4.492   6.654   1.388
  173    HA   GLN  24           HA       GLN  24   3.792   4.399  -0.039
  174    HB2  GLN  24           HB2      GLN  24   5.374   6.182  -0.788
  175    HB3  GLN  24           HB3      GLN  24   6.599   5.476   0.260
  176    HG2  GLN  24           HG2      GLN  24   7.083   4.635  -1.855
  177    HG3  GLN  24           HG3      GLN  24   6.234   3.320  -1.043
  178   HE21  GLN  24          HE21      GLN  24   5.356   2.303  -2.750
  179   HE22  GLN  24          HE22      GLN  24   4.227   3.020  -3.843
  180    H    LEU  25           H        LEU  25   5.936   4.681   2.739
  181    HA   LEU  25           HA       LEU  25   6.956   2.042   2.642
  182    HB2  LEU  25           HB2      LEU  25   7.888   2.466   4.747
  183    HB3  LEU  25           HB3      LEU  25   7.888   4.021   3.917
  184    HG   LEU  25           HG       LEU  25   5.583   4.261   5.244
  185   HD11  LEU  25          HD11      LEU  25   6.701   3.255   7.598
  186   HD12  LEU  25          HD12      LEU  25   6.847   1.958   6.412
  187   HD13  LEU  25          HD13      LEU  25   5.269   2.667   6.753
  188   HD21  LEU  25          HD21      LEU  25   8.389   4.813   6.163
  189   HD22  LEU  25          HD22      LEU  25   6.979   5.353   7.075
  190   HD23  LEU  25          HD23      LEU  25   7.233   5.922   5.425
  191    H    ASP  26           H        ASP  26   4.098   3.476   4.079
  192    HA   ASP  26           HA       ASP  26   3.381   1.215   5.660
  193    HB2  ASP  26           HB2      ASP  26   1.825   3.611   4.684
  194    HB3  ASP  26           HB3      ASP  26   1.107   2.357   5.690
  195    H    VAL  27           H        VAL  27   2.424   2.377   2.453
  196    HA   VAL  27           HA       VAL  27   0.424   0.538   1.883
  197    HB   VAL  27           HB       VAL  27   2.430   1.731  -0.036
  198   HG11  VAL  27          HG11      VAL  27   0.210  -0.117  -0.411
  199   HG12  VAL  27          HG12      VAL  27   0.076   1.337  -1.403
  200   HG13  VAL  27          HG13      VAL  27   1.515   0.323  -1.510
  201   HG21  VAL  27          HG21      VAL  27  -0.216   2.852  -0.132
  202   HG22  VAL  27          HG22      VAL  27   0.441   2.966   1.501
  203   HG23  VAL  27          HG23      VAL  27   1.330   3.656   0.144
  204    H    ASP  28           H        ASP  28   3.890   0.302   1.085
  205    HA   ASP  28           HA       ASP  28   3.819  -2.248  -0.046
  206    HB2  ASP  28           HB2      ASP  28   5.750  -0.399   0.262
  207    HB3  ASP  28           HB3      ASP  28   6.229  -1.526   1.528
  208    H    SER  29           H        SER  29   4.058  -1.230   3.308
  209    HA   SER  29           HA       SER  29   4.824  -3.614   4.505
  210    HB2  SER  29           HB2      SER  29   4.310  -1.209   5.492
  211    HB3  SER  29           HB3      SER  29   2.743  -1.938   5.845
  212    HG   SER  29           HG       SER  29   5.193  -3.150   6.578
  213    H    HIS  30           H        HIS  30   1.516  -2.441   3.890
  214    HA   HIS  30           HA       HIS  30   0.279  -4.849   4.771
  215    HB2  HIS  30           HB2      HIS  30  -0.910  -2.707   4.799
  216    HB3  HIS  30           HB3      HIS  30  -0.814  -2.618   3.043
  217    HD1  HIS  30           HD1      HIS  30  -3.061  -3.564   5.640
  218    HD2  HIS  30           HD2      HIS  30  -2.210  -5.009   1.839
  219    HE1  HIS  30           HE1      HIS  30  -5.057  -4.948   4.984
  220    H    LEU  31           H        LEU  31   1.380  -3.638   1.670
  221    HA   LEU  31           HA       LEU  31   0.081  -5.480   0.001
  222    HB2  LEU  31           HB2      LEU  31   2.626  -3.915  -0.267
  223    HB3  LEU  31           HB3      LEU  31   2.083  -5.016  -1.532
  224    HG   LEU  31           HG       LEU  31   0.551  -2.617  -0.529
  225   HD11  LEU  31          HD11      LEU  31   1.203  -1.486  -2.484
  226   HD12  LEU  31          HD12      LEU  31   1.883  -2.946  -3.201
  227   HD13  LEU  31          HD13      LEU  31   2.685  -2.183  -1.828
  228   HD21  LEU  31          HD21      LEU  31  -1.205  -3.386  -1.648
  229   HD22  LEU  31          HD22      LEU  31  -0.341  -4.908  -1.871
  230   HD23  LEU  31          HD23      LEU  31  -0.231  -3.642  -3.095
  231    H    ALA  32           H        ALA  32   2.804  -5.813   2.099
  232    HA   ALA  32           HA       ALA  32   3.812  -8.211   0.848
  233    HB1  ALA  32           HB1      ALA  32   5.606  -7.374   1.888
  234    HB2  ALA  32           HB2      ALA  32   4.630  -6.441   3.025
  235    HB3  ALA  32           HB3      ALA  32   4.952  -8.148   3.331
  236    H    GLN  33           H        GLN  33   1.963  -7.401   3.763
  237    HA   GLN  33           HA       GLN  33   1.736 -10.119   4.625
  238    HB2  GLN  33           HB2      GLN  33   0.177  -7.662   5.442
  239    HB3  GLN  33           HB3      GLN  33   0.105  -9.219   6.255
  240    HG2  GLN  33           HG2      GLN  33   2.718  -8.858   6.399
  241    HG3  GLN  33           HG3      GLN  33   2.242  -7.166   6.266
  242   HE21  GLN  33          HE21      GLN  33   0.918 -10.011   7.928
  243   HE22  GLN  33          HE22      GLN  33   0.817  -9.267   9.484
  244    H    CYS  34           H        CYS  34  -0.155  -7.967   2.514
  245    HA   CYS  34           HA       CYS  34  -2.534  -9.434   2.640
  246    HB2  CYS  34           HB2      CYS  34  -2.044  -7.054   1.675
  247    HB3  CYS  34           HB3      CYS  34  -1.680  -7.906   0.188
  248    H    LEU  35           H        LEU  35   0.228  -9.423   0.400
  249    HA   LEU  35           HA       LEU  35  -0.699 -11.622  -1.166
  250    HB2  LEU  35           HB2      LEU  35   1.193 -11.340  -2.438
  251    HB3  LEU  35           HB3      LEU  35   0.970  -9.727  -1.765
  252    HG   LEU  35           HG       LEU  35   2.642 -10.687   0.070
  253   HD11  LEU  35          HD11      LEU  35   2.904 -12.484  -2.269
  254   HD12  LEU  35          HD12      LEU  35   3.190 -12.797  -0.557
  255   HD13  LEU  35          HD13      LEU  35   4.392 -11.923  -1.507
  256   HD21  LEU  35          HD21      LEU  35   4.151  -9.254  -0.820
  257   HD22  LEU  35          HD22      LEU  35   2.771  -8.797  -1.818
  258   HD23  LEU  35          HD23      LEU  35   3.985  -9.912  -2.448
  259    H    ALA  36           H        ALA  36   1.226 -11.288   1.708
  260    HA   ALA  36           HA       ALA  36   2.501 -13.811   1.654
  261    HB1  ALA  36           HB1      ALA  36   3.336 -12.075   3.088
  262    HB2  ALA  36           HB2      ALA  36   1.808 -12.006   3.966
  263    HB3  ALA  36           HB3      ALA  36   2.829 -13.438   4.087
  264    H    GLU  37           H        GLU  37  -0.650 -12.738   2.756
  265    HA   GLU  37           HA       GLU  37  -1.272 -15.207   4.094
  266    HB2  GLU  37           HB2      GLU  37  -2.724 -12.672   3.495
  267    HB3  GLU  37           HB3      GLU  37  -3.675 -14.102   3.870
  268    HG2  GLU  37           HG2      GLU  37  -2.090 -14.284   5.925
  269    HG3  GLU  37           HG3      GLU  37  -1.788 -12.577   5.601
  270    H    SER  38           H        SER  38  -1.728 -13.848   0.914
  271    HA   SER  38           HA       SER  38  -2.621 -14.669  -1.014
  272    HB2  SER  38           HB2      SER  38  -1.363 -16.958   0.347
  273    HB3  SER  38           HB3      SER  38  -2.557 -17.399  -0.874
  274    HG   SER  38           HG       SER  38  -1.022 -17.018  -2.247
  275    H    THR  39           H        THR  39  -4.383 -14.264   1.336
  276    HA   THR  39           HA       THR  39  -6.328 -16.191   1.663
  277    HB   THR  39           HB       THR  39  -7.234 -13.358   1.450
  278    HG1  THR  39           HG1      THR  39  -5.796 -12.664   2.833
  279   HG21  THR  39          HG21      THR  39  -7.766 -15.745   3.156
  280   HG22  THR  39          HG22      THR  39  -8.900 -14.648   2.368
  281   HG23  THR  39          HG23      THR  39  -8.054 -14.141   3.829
  282    H    GLU  40           H        GLU  40  -5.799 -14.046  -1.034
  283    HA   GLU  40           HA       GLU  40  -8.324 -14.246  -2.259
  284    HB2  GLU  40           HB2      GLU  40  -5.580 -13.522  -3.170
  285    HB3  GLU  40           HB3      GLU  40  -6.793 -13.864  -4.394
  286    HG2  GLU  40           HG2      GLU  40  -8.242 -12.183  -3.039
  287    HG3  GLU  40           HG3      GLU  40  -6.688 -11.651  -2.402
  288    H    ASP  41           H        ASP  41  -9.100 -16.329  -2.284
  289    HA   ASP  41           HA       ASP  41  -7.515 -18.420  -3.555
  290    HB2  ASP  41           HB2      ASP  41  -9.456 -19.883  -2.904
  291    HB3  ASP  41           HB3      ASP  41  -8.636 -19.106  -1.553
  292    H    VAL  42           H        VAL  42  -7.616 -17.241  -5.636
  293    HA   VAL  42           HA       VAL  42 -10.187 -17.601  -7.020
  294    HB   VAL  42           HB       VAL  42  -7.821 -15.922  -7.863
  295   HG11  VAL  42          HG11      VAL  42  -9.867 -14.960  -9.285
  296   HG12  VAL  42          HG12      VAL  42  -8.831 -16.266  -9.865
  297   HG13  VAL  42          HG13      VAL  42 -10.395 -16.636  -9.138
  298   HG21  VAL  42          HG21      VAL  42  -8.742 -14.864  -5.970
  299   HG22  VAL  42          HG22      VAL  42  -9.440 -14.028  -7.357
  300   HG23  VAL  42          HG23      VAL  42 -10.394 -15.220  -6.474
  301    H    THR  43           H        THR  43 -10.316 -19.430  -8.130
  302    HA   THR  43           HA       THR  43  -7.916 -20.380  -9.556
  303    HB   THR  43           HB       THR  43  -9.208 -22.668  -9.390
  304    HG1  THR  43           HG1      THR  43 -10.963 -22.372  -8.219
  305   HG21  THR  43          HG21      THR  43  -7.472 -21.328  -7.355
  306   HG22  THR  43          HG22      THR  43  -7.088 -22.646  -8.462
  307   HG23  THR  43          HG23      THR  43  -8.093 -22.949  -7.046
  308    H    TRP  44           H        TRP  44  -8.797 -18.930 -11.264
  309    HA   TRP  44           HA       TRP  44 -10.968 -20.242 -12.763
  310    HB2  TRP  44           HB2      TRP  44 -11.388 -17.881 -11.988
  311    HB3  TRP  44           HB3      TRP  44 -10.071 -17.370 -13.040
  312    HD1  TRP  44           HD1      TRP  44 -12.458 -20.067 -14.275
  313    HE1  TRP  44           HE1      TRP  44 -13.875 -19.109 -16.199
  314    HE3  TRP  44           HE3      TRP  44 -11.067 -15.159 -13.940
  315    HZ2  TRP  44           HZ2      TRP  44 -14.341 -16.605 -17.413
  316    HZ3  TRP  44           HZ3      TRP  44 -12.045 -13.547 -15.521
  317    HH2  TRP  44           HH2      TRP  44 -13.647 -14.256 -17.221