*HEADER    HYDROLASE                               03-APR-09   2KHE              
*TITLE     SOLUTION STRUCTURE OF THE BACTERIAL TOXIN RELE FROM THERMUS           
*TITLE    2 THERMOPHILUS HB8                                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TOXIN-LIKE PROTEIN;                                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: TOXIN RELE;                                                 
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS;                           
*SOURCE   3 ORGANISM_TAXID: 300852;                                              
*SOURCE   4 STRAIN: HB8;                                                         
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET11A                                     
*KEYWDS    RELE, TOXIN-ANTITOXIN, RNASE, PLASMID, HYDROLASE, STRUCTURAL          
*KEYWDS   2 GENOMICS, NPPSFA, NATIONAL PROJECT ON PROTEIN STRUCTURAL             
*KEYWDS   3 AND FUNCTIONAL ANALYSES, RIKEN STRUCTURAL                            
*KEYWDS   4 GENOMICS/PROTEOMICS INITIATIVE, RSGI                                 
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    S.SUZUKI, M.KAWAZOE, T.KAMINISHI, C.TAKEMOTO, Y.MUTO,                 
*AUTHOR   2 M.SHIROUZU, S.YOKOYAMA, RIKEN STRUCTURAL                             
*AUTHOR   3 GENOMICS/PROTEOMICS INITIATIVE (RSGI)                                
*REVDAT   1   31-MAR-10 2KHE    0                                                

 76 VAL  QG1    77 LEU  HN      3.88 #SUP  0.94  #QF  0.94
  8 ASP  HN     78 VAL  HN      4.20 #SUP  0.96  #QF  0.96
 77 LEU  HN     78 VAL  HN      4.79 #SUP  0.97  #QF  0.97
 77 LEU  HA     78 VAL  HN      2.96 #SUP  0.96  #QF  0.96
 63 TYR  HA     84 ALA  HN      3.80 #SUP  0.83  #QF  0.83
 83 HIST HA     84 ALA  HN      3.16 #SUP  0.95  #QF  0.95
 83 HIST QB     84 ALA  HN      4.09 #SUP  0.91  #QF  0.91
 77 LEU  HB3    78 VAL  HN      4.71 #SUP  1.00
 77 LEU  HN     77 LEU  HB3     3.60 #SUP  0.99  #QF  0.99
 78 VAL  HN     78 VAL  HB      3.33 #SUP  0.99  #QF  0.99
 77 LEU  HG     78 VAL  HN      4.93 #SUP  0.97  #QF  0.97
 77 LEU  QD1    78 VAL  HN      4.79 #SUP  0.92  #QF  0.92
 70 GLN  HN     75 THR  HN      4.55 #SUP  0.99  #QF  0.99
 69 ILE  HA     70 GLN  HN      2.99 #SUP  0.94  #QF  0.94
 70 GLN  HN     75 THR  HB      4.80 #SUP  0.93  #QF  0.93
 70 GLN  HN     70 GLN  HB2     3.51 #SUP  0.66  #QF  0.66
 70 GLN  HN     70 GLN  HG2     4.41 #SUP  1.00
 70 GLN  HN     70 GLN  HG3     4.41 #SUP  0.95  #QF  0.95
 69 ILE  HG12   70 GLN  HN      4.49 #SUP  0.54  #QF  0.54
  3 TYR  HB3    76 VAL  HN      4.26 #SUP  0.97  #QF  0.97
  6 GLU  HN     76 VAL  HN      4.42 #SUP  0.97  #QF  0.97
  6 GLU  HN     78 VAL  HN      4.47 #SUP  0.92  #QF  0.92
  5 ILE  HN      6 GLU  HN      4.60 #SUP  0.81  #QF  0.81
 68 HIST HD2    69 ILE  HN      4.21 #SUP  0.55  #QF  0.55
  6 GLU  HN     77 LEU  HA      3.71 #SUP  0.83  #QF  0.83
  6 GLU  HN      6 GLU  HB3     3.81 #SUP  1.00
  6 GLU  HN      6 GLU  HB2     3.81 #SUP  1.00
  6 GLU  HN     76 VAL  QG1     4.74 #SUP  1.00  #QF  0.25
  5 ILE  QG2     6 GLU  HN      3.43 #SUP  0.82  #QF  0.82
 68 HIST HN     79 LEU  HN      4.64 #SUP  0.96  #QF  0.96
 79 LEU  HN     79 LEU  HB2     4.11 #SUP  0.99  #QF  0.99
 88 TYR  QD     89 ARG  HN      4.67 #SUP  0.98  #QF  0.98
 88 TYR  HA     89 ARG  HN      3.21 #SUP  0.98  #QF  0.98
 88 TYR  HB2    89 ARG  HN      4.59 #SUP  0.98  #QF  0.98
 88 TYR  HB3    89 ARG  HN      4.59 #SUP  1.00
 89 ARG  HN     89 ARG  QG      4.02 #SUP  0.99  #QF  0.99
  8 ASP  HN     79 LEU  HA      4.25 #SUP  1.00
 71 ASP  HA     74 ALA  HN      4.03 #SUP  0.98  #QF  0.98
 56 TRP  HN     56 TRP  HB2     4.13 #SUP  0.86  #QF  0.86
 74 ALA  HN     74 ALA  HA      2.94 #SUP  0.99  #QF  0.99
 73 GLU  HB2    74 ALA  HN      4.46 #SUP  0.95  #QF  0.95
 73 GLU  HB3    74 ALA  HN      4.46 #SUP  0.97  #QF  0.97
  8 ASP  HN     11 ALA  QB      3.54 #SUP  0.55  #QF  0.55
 56 TRP  HN     66 ILE  QG2     4.76 #SUP  0.80  #QF  0.80
  3 TYR  QE     74 ALA  HN      4.70 #SUP  0.82  #QF  0.82
 72 ARG  HA     74 ALA  HN      4.81 #SUP  0.60  #QF  0.60
  3 TYR  HN     35 ALA  HA      4.60 #SUP  0.93  #QF  0.93
  3 TYR  HN      3 TYR  HB2     3.62 #SUP  0.99  #QF  0.99
  3 TYR  HN      3 TYR  HB3     4.19 #SUP  1.00
 20 ARG  HN     21 GLU  HN      3.89 #SUP  0.78  #QF  0.78
 19 ASP  HN     20 ARG  HN      5.12 #SUP  0.99  #QF  0.95
 20 ARG  HN     23 ALA  HN      5.50 #SUP  0.99  #QF  0.95
 19 ASP  HA     20 ARG  HN      2.89 #SUP  0.96  #QF  0.96
 19 ASP  HB2    20 ARG  HN      4.54 #SUP  0.96  #QF  0.96
 19 ASP  HB3    20 ARG  HN      4.54 #SUP  0.96  #QF  0.96
 20 ARG  HN     20 ARG  HB2     3.84 #SUP  0.61  #QF  0.61
 66 ILE  HN     79 LEU  HN      5.15 #SUP  0.93  #QF  0.93
 66 ILE  HN     66 ILE  HB      3.40 #SUP  0.97  #QF  0.97
 65 LEU  HB3    66 ILE  HN      3.99 #SUP  0.91  #QF  0.91
 66 ILE  HN     66 ILE  HG12    4.21 #SUP  0.82  #QF  0.82
 65 LEU  QD2    66 ILE  HN      4.48 #SUP  0.86  #QF  0.82
 67 CYS  HN     68 HIST HN      4.65 #SUP  0.84  #QF  0.84
 68 HIST HN     77 LEU  HN      4.28 #SUP  0.96  #QF  0.96
 68 HIST HN     76 VAL  HA      5.05 #SUP  0.99  #QF  0.57
 68 HIST HN     68 HIST HB3     3.79 #SUP  0.98  #QF  0.98
 68 HIST HN     68 HIST HB2     3.94 #SUP  0.99  #QF  0.99
 68 HIST HN     79 LEU  HG      4.55 #SUP  0.99  #QF  0.99
 68 HIST HN     76 VAL  QG1     4.47 #SUP  0.92  #QF  0.92
 66 ILE  HA     67 CYS  HN      2.97 #SUP  0.96  #QF  0.96
 34 VAL  HA     37 LEU  HN      4.30 #SUP  0.97  #QF  0.97
 67 CYS  HN     67 CYS  HB2     3.75 #SUP  0.87  #QF  0.87
 37 LEU  HN     37 LEU  HG      3.23 #SUP  0.99  #QF  0.99
 67 CYS  HN     67 CYS  HG      3.87 #SUP  0.82  #QF  0.82
 37 LEU  HN     37 LEU  HB2     4.07 #SUP  1.00
 36 THR  QG2    37 LEU  HN      3.86 #SUP  0.98  #QF  0.31
 37 LEU  HN     37 LEU  QD1     3.89 #SUP  0.84  #QF  0.84
 87 VAL  HN     88 TYR  HN      4.80 #SUP  0.98  #QF  0.98
 60 VAL  HN     64 ARG  HA      4.12 #SUP  0.95  #QF  0.95
 87 VAL  HB     88 TYR  HN      4.50 #SUP  0.96  #QF  0.96
 59 ARG  QB     60 VAL  HN      3.94 #SUP  0.96  #QF  0.96
 60 VAL  HN     60 VAL  HB      3.59 #SUP  0.98  #QF  0.98
 60 VAL  HN     65 LEU  QD1     4.72 #SUP  0.87  #QF  0.87
 60 VAL  HN     60 VAL  QG1     4.13 #SUP  0.99  #QF  0.99
 60 VAL  HN     60 VAL  QG2     3.85 #SUP  0.99  #QF  0.99
 88 TYR  HN     89 ARG  HN      4.73 #SUP  1.00
 37 LEU  HA     38 GLU  HN      3.03 #SUP  0.97  #QF  0.97
 88 TYR  HN     88 TYR  HB2     4.20 #SUP  1.00
 83 HIST HN     83 HIST QB      3.65 #SUP  0.84  #QF  0.84
 88 TYR  HN     88 TYR  HB3     4.20 #SUP  0.98  #QF  0.98
 38 GLU  HN     38 GLU  HG2     4.61 #SUP  0.62  #QF  0.62
 38 GLU  HN     38 GLU  QB      3.13 #SUP  0.94  #QF  0.94
 37 LEU  HB2    38 GLU  HN      4.71 #SUP  0.99  #QF  0.99
 37 LEU  QD2    38 GLU  HN      4.10 #SUP  1.00
 81 VAL  HN     82 GLY  HN      4.79 #SUP  0.96  #QF  0.96
 80 ARG  HA     81 VAL  HN      2.95 #SUP  0.99  #QF  0.99
 11 ALA  HA     81 VAL  HN      4.30 #SUP  0.97  #QF  0.97
 14 GLU  HB2    81 VAL  HN      4.58 #SUP  0.93  #QF  0.93
 81 VAL  HN     81 VAL  HB      3.59 #SUP  1.00
  5 ILE  HN      5 ILE  HB      3.20 #SUP  0.92  #QF  0.92
 80 ARG  HB2    81 VAL  HN      4.18 #SUP  0.99  #QF  0.99
  4 ARG  QG      5 ILE  HN      3.43 #SUP  0.99  #QF  0.46
 80 ARG  HB3    81 VAL  HN      4.18 #SUP  0.94  #QF  0.94
 80 ARG  HG3    81 VAL  HN      4.94 #SUP  0.85  #QF  0.85
  5 ILE  HN      5 ILE  HG13    4.01 #SUP  0.92  #QF  0.92
 81 VAL  HN     81 VAL  QG2     4.13 #SUP  0.84  #QF  0.84
 78 VAL  QG1    81 VAL  HN      4.80 #SUP  0.89  #QF  0.89
 24 ARG  HN     26 ILE  HN      4.40 #SUP  0.69  #QF  0.69
 57 LYS  HA     65 LEU  HN      5.21 #SUP  0.92  #QF  0.92
 64 ARG  HA     65 LEU  HN      3.06 #SUP  0.99  #QF  0.99
 58 TYR  HB2    65 LEU  HN      4.63 #SUP  0.99  #QF  0.99
 65 LEU  HN     65 LEU  HB2     3.73 #SUP  0.99  #QF  0.99
 26 ILE  HN     26 ILE  HB      2.90 #SUP  0.91  #QF  0.91
 65 LEU  HN     65 LEU  HG      3.88 #SUP  0.98  #QF  0.98
 26 ILE  HN     26 ILE  HG13    3.22 #SUP  1.00
 64 ARG  HB3    65 LEU  HN      4.39 #SUP  0.95  #QF  0.93
 64 ARG  HG3    65 LEU  HN      5.50 #SUP  0.95  #QF  0.93
 64 ARG  HB2    65 LEU  HN      4.39 #SUP  0.81  #QF  0.81
 64 ARG  HG2    65 LEU  HN      5.50 #SUP  0.81  #QF  0.21
 26 ILE  HN     26 ILE  QG2     3.81 #SUP  1.00
 26 ILE  HN     26 ILE  HG12    3.87 #SUP  1.00
 10 ARG  HN     11 ALA  HN      3.24 #SUP  0.99  #QF  0.99
  8 ASP  HN     11 ALA  HN      4.59 #SUP  0.94  #QF  0.94
 64 ARG  HN     65 LEU  HN      4.72 #SUP  0.97  #QF  0.97
 64 ARG  HN     82 GLY  HN      3.89 #SUP  0.96  #QF  0.96
 64 ARG  HN     84 ALA  HN      4.48 #SUP  0.96  #QF  0.69
 11 ALA  HN     12 GLU  HN      3.14 #SUP  0.97  #QF  0.97
 58 TYR  HN     58 TYR  QD      4.31 #SUP  1.00
  7 PHE  QD     11 ALA  HN      5.50 #SUP  0.69  #QF  0.69
 63 TYR  QD     64 ARG  HN      4.28 #SUP  0.86  #QF  0.86
 58 TYR  HN     66 ILE  HA      4.75 #SUP  0.83  #QF  0.83
 63 TYR  HA     64 ARG  HN      3.12 #SUP  0.97  #QF  0.97
 64 ARG  HN     83 HIST HA      4.20 #SUP  0.98  #QF  0.98
  8 ASP  HB2    11 ALA  HN      4.84 #SUP  1.00
 58 TYR  HN     58 TYR  HB2     3.89 #SUP  0.99  #QF  0.99
 63 TYR  HB3    64 ARG  HN      3.57 #SUP  0.99  #QF  0.99
 10 ARG  HB3    11 ALA  HN      4.04 #SUP  0.63  #QF  0.63
 58 TYR  HN     65 LEU  HB2     4.19 #SUP  0.99  #QF  0.99
 64 ARG  HN     64 ARG  HB3     4.06 #SUP  0.98  #QF  0.98
 57 LYS  HB2    58 TYR  HN      4.63 #SUP  0.80  #QF  0.70
 58 TYR  HN     65 LEU  HB3     5.23 #SUP  0.80  #QF  0.70
 64 ARG  HN     64 ARG  HB2     4.06 #SUP  1.00
 64 ARG  HN     64 ARG  HG2     4.65 #SUP  1.00
 57 LYS  HB3    58 TYR  HN      4.63 #SUP  0.78  #QF  0.61
 64 ARG  HN     65 LEU  QD2     4.56 #SUP  0.67  #QF  0.67
 22 VAL  HN     23 ALA  HN      3.07 #SUP  1.00
 22 VAL  HN     24 ARG  HN      4.54 #SUP  0.99  #QF  0.99
 19 ASP  HB2    22 VAL  HN      4.21 #SUP  1.00
 19 ASP  HB3    22 VAL  HN      4.21 #SUP  0.99  #QF  0.99
 21 GLU  QG     22 VAL  HN      4.54 #SUP  0.99  #QF  0.99
 21 GLU  QB     22 VAL  HN      2.98 #SUP  0.99  #QF  0.82
 22 VAL  HN     23 ALA  QB      4.48 #SUP  0.84  #QF  0.84
 22 VAL  HN     22 VAL  QG1     3.99 #SUP  0.99  #QF  0.99
 23 ALA  HN     25 ARG  HN      4.68 #SUP  0.96  #QF  0.96
 20 ARG  HA     23 ALA  HN      3.87 #SUP  0.95  #QF  0.95
 58 TYR  HB3    59 ARG  HN      4.05 #SUP  0.98  #QF  0.98
 58 TYR  HB2    59 ARG  HN      4.60 #SUP  1.00
 22 VAL  HB     23 ALA  HN      3.15 #SUP  0.94  #QF  0.94
 23 ALA  HN     25 ARG  HB3     5.50 #SUP  0.99  #QF  0.92
 59 ARG  HN     59 ARG  QB      3.64 #SUP  0.99  #QF  0.99
  7 PHE  HN      8 ASP  HN      4.64 #SUP  0.74  #QF  0.74
  7 PHE  HN      7 PHE  QD      3.78 #SUP  0.93  #QF  0.93
  7 PHE  HN      7 PHE  HB2     3.30 #SUP  0.97  #QF  0.97
  6 GLU  HG2     7 PHE  HN      5.07 #SUP  0.98  #QF  0.98
  6 GLU  HB2     7 PHE  HN      4.14 #SUP  0.99  #QF  0.99
 47 LEU  HN     47 LEU  HB2     3.73 #SUP  0.98  #QF  0.98
 47 LEU  HN     47 LEU  HB3     3.73 #SUP  0.98  #QF  0.98
 18 LEU  QD1    19 ASP  HN      4.47 #SUP  0.90  #QF  0.90
 51 GLU  HN     52 LEU  HN      4.05 #SUP  0.92  #QF  0.92
 28 ARG  HN     29 PHE  HN      3.24 #SUP  0.99  #QF  0.99
 29 PHE  HN     30 LEU  HN      3.32 #SUP  0.97  #QF  0.97
 29 PHE  HN     29 PHE  QD      4.22 #SUP  0.94  #QF  0.94
 18 LEU  HA     19 ASP  HN      2.95 #SUP  0.98  #QF  0.98
 46 PRO  HA     47 LEU  HN      3.18 #SUP  0.97  #QF  0.97
 26 ILE  HA     29 PHE  HN      3.85 #SUP  0.99  #QF  0.99
 29 PHE  HN     29 PHE  HB2     2.83 #SUP  0.45  #QF  0.45
 19 ASP  HN     19 ASP  HB2     3.28 #SUP  0.98  #QF  0.98
 19 ASP  HN     19 ASP  HB3     3.28 #SUP  0.96  #QF  0.96
 46 PRO  HB2    47 LEU  HN      4.48 #SUP  0.98  #QF  0.98
 52 LEU  HN     52 LEU  QB      3.46 #SUP  0.75  #QF  0.75
 26 ILE  QG2    29 PHE  HN      4.89 #SUP  0.92  #QF  0.92
 52 LEU  HN     52 LEU  QD1     5.16 #SUP  0.97  #QF  0.70
 52 LEU  HN     52 LEU  QD2     5.16 #SUP  0.97  #QF  0.70
 29 PHE  HN     60 VAL  QG1     5.29 #SUP  0.99  #QF  0.99
 29 PHE  HN     60 VAL  QG2     5.20 #SUP  1.00
 25 ARG  HN     27 LEU  HN      4.79 #SUP  0.99  #QF  0.99
 14 GLU  HN     15 LEU  HN      3.36 #SUP  1.00
 22 VAL  HN     25 ARG  HN      5.08 #SUP  0.96  #QF  0.96
 15 LEU  HN     17 LYS  HN      4.51 #SUP  0.85  #QF  0.85
 11 ALA  HA     15 LEU  HN      4.58 #SUP  0.99  #QF  0.99
 23 ALA  HA     25 ARG  HN      4.71 #SUP  0.56  #QF  0.56
 15 LEU  HN     16 GLU  QB      4.61 #SUP  0.87  #QF  0.87
 15 LEU  HN     15 LEU  QB      2.80 #SUP  0.92  #QF  0.92
 26 ILE  HN     27 LEU  HN      3.31 #SUP  0.87  #QF  0.80
 25 ARG  HN     26 ILE  HN      3.25 #SUP  0.98  #QF  0.98
 24 ARG  HN     25 ARG  HN      3.38 #SUP  0.98  #QF  0.98
 27 LEU  HN     29 PHE  HN      4.49 #SUP  0.93  #QF  0.93
 43 LEU  HN     58 TYR  QE      4.48 #SUP  0.81  #QF  0.81
 42 SER  HB3    43 LEU  HN      4.85 #SUP  0.95  #QF  0.93
 24 ARG  HA     27 LEU  HN      3.92 #SUP  0.98  #QF  0.98
 22 VAL  HA     25 ARG  HN      3.90 #SUP  1.00
 24 ARG  QD     25 ARG  HN      5.04 #SUP  0.98  #QF  0.95
 25 ARG  HN     25 ARG  HB2     3.12 #SUP  0.98  #QF  0.98
 27 LEU  HN     27 LEU  HB2     2.92 #SUP  0.90  #QF  0.90
 25 ARG  HN     25 ARG  HB3     3.39 #SUP  0.95  #QF  0.38
 26 ILE  QG2    27 LEU  HN      3.76 #SUP  0.98  #QF  0.98
 27 LEU  HN     27 LEU  QD1     3.76 #SUP  0.98  #QF  0.96
 13 LYS  HN     14 GLU  HN      3.26 #SUP  0.98  #QF  0.98
 11 ALA  HA     14 GLU  HN      3.72 #SUP  0.95  #QF  0.95
 83 HIST QB     86 ASP  HN      4.12 #SUP  0.36  #QF  0.36
 86 ASP  HN     86 ASP  QB      3.10 #SUP  0.42  #QF  0.42
 14 GLU  HN     14 GLU  HG2     3.59 #SUP  1.00
 14 GLU  HN     14 GLU  HB3     3.75 #SUP  0.96  #QF  0.96
 13 LYS  HB3    14 GLU  HN      4.09 #SUP  0.97  #QF  0.97
 14 GLU  HN     15 LEU  QB      4.81 #SUP  0.62  #QF  0.62
 85 ARG  QG     86 ASP  HN      4.18 #SUP  0.73  #QF  0.73
 30 LEU  HN     31 ARG  HN      3.47 #SUP  0.91  #QF  0.91
 29 PHE  QD     30 LEU  HN      3.75 #SUP  0.99  #QF  0.99
 27 LEU  HA     30 LEU  HN      3.92 #SUP  0.99  #QF  0.99
 29 PHE  HB3    30 LEU  HN      3.32 #SUP  0.68  #QF  0.68
 30 LEU  HN     30 LEU  HB2     3.19 #SUP  0.99  #QF  0.99
 30 LEU  HN     30 LEU  HG      3.11 #SUP  0.99  #QF  0.99
 30 LEU  HN     30 LEU  HB3     3.77 #SUP  1.00
  4 ARG  HN     76 VAL  HN      4.14 #SUP  0.97  #QF  0.97
 27 LEU  HN     28 ARG  HN      3.39 #SUP  0.93  #QF  0.93
 28 ARG  HN     30 LEU  HN      4.30 #SUP  0.60  #QF  0.60
 33 ARG  HN     35 ALA  HN      4.64 #SUP  0.97  #QF  0.97
  3 TYR  QD      4 ARG  HN      4.39 #SUP  0.99  #QF  0.99
  4 ARG  HN     75 THR  HA      3.41 #SUP  0.99  #QF  0.99
  3 TYR  HA      4 ARG  HN      3.03 #SUP  0.98  #QF  0.98
 31 ARG  HA     35 ALA  HN      4.42 #SUP  0.72  #QF  0.72
 30 LEU  HA     35 ALA  HN      4.19 #SUP  0.95  #QF  0.95
 28 ARG  HN     31 ARG  QD      5.50 #SUP  0.99  #QF  0.98
  3 TYR  HB2     4 ARG  HN      4.11 #SUP  1.00
  3 TYR  HB3     4 ARG  HN      3.62 #SUP  0.99  #QF  0.99
  4 ARG  HN      4 ARG  QB      3.25 #SUP  0.86  #QF  0.86
 27 LEU  HB2    28 ARG  HN      3.04 #SUP  0.97  #QF  0.84
  4 ARG  HN      4 ARG  QG      4.14 #SUP  0.97  #QF  0.97
 27 LEU  HB3    28 ARG  HN      3.64 #SUP  0.83  #QF  0.83
  4 ARG  HN     75 THR  QG2     4.18 #SUP  0.81  #QF  0.66
 27 LEU  QD1    28 ARG  HN      4.99 #SUP  1.00  #QF  0.99
 27 LEU  QD2    28 ARG  HN      5.48 #SUP  1.00  #QF  0.99
 34 VAL  QG1    35 ALA  HN      3.79 #SUP  0.71  #QF  0.71
 18 LEU  HN     19 ASP  HN      4.62 #SUP  1.00
 16 GLU  HN     18 LEU  HN      4.72 #SUP  0.91  #QF  0.91
 16 GLU  HA     18 LEU  HN      4.40 #SUP  0.80  #QF  0.80
 18 LEU  HN     18 LEU  HG      2.96 #SUP  0.98  #QF  0.98
 34 VAL  HB     35 ALA  HN      3.37 #SUP  0.99  #QF  0.99
 18 LEU  HN     18 LEU  HB2     3.02 #SUP  0.98  #QF  0.98
 18 LEU  HN     18 LEU  HB3     3.69 #SUP  0.99  #QF  0.99
 35 ALA  HN     36 THR  QG2     4.51 #SUP  0.89  #QF  0.89
 18 LEU  HN     18 LEU  QD2     3.77 #SUP  1.00
 54 ARG  HN     55 PHE  HN      4.12 #SUP  0.97  #QF  0.97
 55 PHE  HN     55 PHE  QD      4.14 #SUP  0.94  #QF  0.94
 55 PHE  HN     55 PHE  HB2     4.09 #SUP  0.99  #QF  0.99
 55 PHE  HN     55 PHE  HB3     4.09 #SUP  0.92  #QF  0.92
 45 GLU  HN     56 TRP  HE1     4.62 #SUP  0.93  #QF  0.93
 44 GLY  HN     45 GLU  HN      4.72 #SUP  0.91  #QF  0.91
 45 GLU  HN     57 LYS  HN      4.09 #SUP  0.90  #QF  0.90
 21 GLU  HN     23 ALA  HN      4.55 #SUP  0.98  #QF  0.98
 86 ASP  HN     87 VAL  HN      3.38 #SUP  0.91  #QF  0.91
 21 GLU  HN     22 VAL  HN      3.13 #SUP  1.00
 19 ASP  HA     21 GLU  HN      4.74 #SUP  0.99  #QF  0.99
  9 PRO  HD3    10 ARG  HN      4.15 #SUP  1.00
  8 ASP  HB2    10 ARG  HN      4.65 #SUP  0.99  #QF  0.99
  8 ASP  HB3    10 ARG  HN      4.65 #SUP  0.98  #QF  0.98
 86 ASP  QB     87 VAL  HN      3.56 #SUP  0.97  #QF  0.97
 21 GLU  HN     21 GLU  QB      2.92 #SUP  0.92  #QF  0.92
 10 ARG  HN     10 ARG  HB2     3.70 #SUP  0.81  #QF  0.81
 20 ARG  HB2    21 GLU  HN      3.81 #SUP  0.87  #QF  0.87
 87 VAL  HN     87 VAL  HB      3.32 #SUP  0.96  #QF  0.96
 21 GLU  HN     22 VAL  QG2     4.50 #SUP  0.99  #QF  0.99
 87 VAL  HN     87 VAL  QG2     4.08 #SUP  0.88  #QF  0.88
 12 GLU  HN     13 LYS  HN      3.33 #SUP  0.99  #QF  0.99
  9 PRO  HA     13 LYS  HN      5.24 #SUP  1.00
 13 LYS  HN     13 LYS  HG2     3.87 #SUP  0.65  #QF  0.65
 34 VAL  HN     35 ALA  HN      3.32 #SUP  0.99  #QF  0.99
 33 ARG  HN     34 VAL  HN      3.15 #SUP  0.99  #QF  0.99
 34 VAL  HN     36 THR  HN      4.58 #SUP  0.90  #QF  0.90
 29 PHE  HA     34 VAL  HN      5.39 #SUP  0.97  #QF  0.97
 30 LEU  HA     34 VAL  HN      3.67 #SUP  0.99  #QF  0.99
  7 PHE  HB2    12 GLU  HN      5.50 #SUP  0.97  #QF  0.83
 34 VAL  HN     34 VAL  HB      3.19 #SUP  0.98  #QF  0.98
 33 ARG  QB     34 VAL  HN      3.23 #SUP  0.96  #QF  0.96
 34 VAL  HN     34 VAL  QG1     3.95 #SUP  0.98  #QF  0.98
 34 VAL  HN     34 VAL  QG2     3.11 #SUP  0.99  #QF  0.99
 10 ARG  HN     12 GLU  HN      4.77 #SUP  0.99  #QF  0.99
  7 PHE  QD     12 GLU  HN      4.81 #SUP  0.99  #QF  0.99
 10 ARG  HA     12 GLU  HN      5.01 #SUP  0.99  #QF  0.99
  7 PHE  HB3    12 GLU  HN      4.13 #SUP  0.99  #QF  0.99
 51 GLU  HN     51 GLU  QG      4.41 #SUP  0.95  #QF  0.95
 12 GLU  HN     12 GLU  QB      3.03 #SUP  0.99  #QF  0.99
 50 PRO  QG     51 GLU  HN      3.83 #SUP  0.99  #QF  0.71
 62 ASP  HN     63 TYR  HN      4.32 #SUP  0.91  #QF  0.91
 60 VAL  HN     63 TYR  HN      4.01 #SUP  0.99  #QF  0.99
 63 TYR  HN     63 TYR  QD      3.28 #SUP  0.92  #QF  0.92
 63 TYR  HN     83 HIST HA      5.50 #SUP  1.00  #QF  0.92
 63 TYR  HN     63 TYR  HB2     3.26 #SUP  0.96  #QF  0.96
 63 TYR  HN     63 TYR  HB3     3.95 #SUP  1.00
 60 VAL  HB     63 TYR  HN      4.75 #SUP  0.97  #QF  0.97
 60 VAL  QG1    63 TYR  HN      4.68 #SUP  0.98  #QF  0.98
 41 ARG  HN     42 SER  HN      3.41 #SUP  0.70  #QF  0.70
 41 ARG  HN     41 ARG  HB2     3.74 #SUP  0.95  #QF  0.95
 41 ARG  HN     41 ARG  HB3     3.74 #SUP  0.99  #QF  0.99
 41 ARG  HN     41 ARG  HG2     4.18 #SUP  0.98  #QF  0.98
 41 ARG  HN     41 ARG  HG3     4.18 #SUP  0.99  #QF  0.99
 15 LEU  HN     16 GLU  HN      3.33 #SUP  1.00
 16 GLU  HN     17 LYS  HN      3.21 #SUP  1.00
 29 PHE  HA     33 ARG  HN      3.94 #SUP  1.00  #QF  0.98
 16 GLU  HN     16 GLU  HG3     3.96 #SUP  1.00
 16 GLU  HN     16 GLU  HG2     3.96 #SUP  1.00
 16 GLU  HN     16 GLU  QB      2.89 #SUP  0.94  #QF  0.94
 32 GLU  HB2    33 ARG  HN      3.65 #SUP  0.69  #QF  0.69
 15 LEU  QB     16 GLU  HN      3.19 #SUP  0.96  #QF  0.96
 33 ARG  HN     33 ARG  HG2     4.10 #SUP  0.99  #QF  0.99
 33 ARG  HN     33 ARG  QB      3.25 #SUP  0.98  #QF  0.97
 33 ARG  HN     34 VAL  QG2     4.63 #SUP  0.95  #QF  0.95
 42 SER  HN     43 LEU  HN      3.54 #SUP  0.98  #QF  0.98
 30 LEU  QD1    31 ARG  HN      4.72 #SUP  1.00
 30 LEU  QD2    31 ARG  HN      5.06 #SUP  0.86  #QF  0.86
 23 ALA  HN     24 ARG  HN      3.29 #SUP  0.99  #QF  0.99
 29 PHE  HN     31 ARG  HN      4.39 #SUP  0.52  #QF  0.52
 31 ARG  HN     33 ARG  HN      4.70 #SUP  0.84  #QF  0.84
 27 LEU  HA     31 ARG  HN      4.63 #SUP  0.97  #QF  0.97
 22 VAL  HA     24 ARG  HN      4.77 #SUP  1.00
 24 ARG  HN     24 ARG  QD      4.46 #SUP  1.00
 31 ARG  HN     31 ARG  QD      4.37 #SUP  0.99  #QF  0.99
 30 LEU  HB2    31 ARG  HN      3.52 #SUP  0.98  #QF  0.98
 24 ARG  HN     24 ARG  HB3     3.55 #SUP  0.86  #QF  0.25
 31 ARG  HN     31 ARG  HB2     3.69 #SUP  0.67  #QF  0.67
 73 GLU  HN     73 GLU  HB3     4.09 #SUP  0.83  #QF  0.83
 31 ARG  HN     31 ARG  HG3     4.27 #SUP  1.00
 23 ALA  QB     24 ARG  HN      3.22 #SUP  1.00
 30 LEU  HB3    31 ARG  HN      3.89 #SUP  1.00
 38 GLU  HN     39 ASP  HN      3.56 #SUP  1.00
 37 LEU  HA     39 ASP  HN      4.00 #SUP  0.99  #QF  0.99
 39 ASP  HN     39 ASP  HB2     3.87 #SUP  0.93  #QF  0.93
 39 ASP  HN     39 ASP  HB3     3.87 #SUP  0.98  #QF  0.98
 17 LYS  HN     17 LYS  HB2     3.73 #SUP  0.93  #QF  0.93
 38 GLU  QB     39 ASP  HN      3.36 #SUP  0.96  #QF  0.96
 17 LYS  HN     17 LYS  HB3     3.73 #SUP  0.95  #QF  0.95
 17 LYS  HN     17 LYS  HG2     4.42 #SUP  0.78  #QF  0.78
 79 LEU  HN     80 ARG  HN      3.17 #SUP  0.98  #QF  0.98
 66 ILE  HN     80 ARG  HN      3.77 #SUP  0.98  #QF  0.98
 67 CYS  HA     80 ARG  HN      4.77 #SUP  0.97  #QF  0.97
 78 VAL  HA     80 ARG  HN      4.38 #SUP  0.99  #QF  0.99
 66 ILE  HB     80 ARG  HN      3.65 #SUP  0.73  #QF  0.61
 79 LEU  HB2    80 ARG  HN      3.88 #SUP  0.93  #QF  0.93
 78 VAL  QG1    80 ARG  HN      3.69 #SUP  0.98  #QF  0.98
 31 ARG  HN     32 GLU  HN      3.30 #SUP  0.99  #QF  0.99
 30 LEU  HN     32 GLU  HN      4.48 #SUP  0.92  #QF  0.92
 32 GLU  HN     33 ARG  HN      3.10 #SUP  1.00
 32 GLU  HN     34 VAL  HN      4.47 #SUP  1.00
  3 TYR  QD     75 THR  HN      4.15 #SUP  0.99  #QF  0.99
 70 GLN  HA     75 THR  HN      5.29 #SUP  1.00  #QF  0.90
 71 ASP  HA     75 THR  HN      5.50 #SUP  1.00  #QF  0.90
 75 THR  HN     75 THR  HB      3.54 #SUP  1.00
 31 ARG  QD     32 GLU  HN      5.50 #SUP  0.89  #QF  0.89
 74 ALA  HA     75 THR  HN      3.41 #SUP  0.95  #QF  0.95
 70 GLN  HB2    75 THR  HN      3.73 #SUP  0.71  #QF  0.46
 32 GLU  HN     32 GLU  HB2     3.14 #SUP  0.58  #QF  0.58
 32 GLU  HN     33 ARG  QB      4.39 #SUP  0.74  #QF  0.74
 74 ALA  QB     75 THR  HN      4.21 #SUP  0.96  #QF  0.91
 75 THR  HN     75 THR  QG2     4.59 #SUP  0.96  #QF  0.91
 63 TYR  QD     82 GLY  HN      5.04 #SUP  0.93  #QF  0.93
 65 LEU  HA     82 GLY  HN      4.52 #SUP  0.88  #QF  0.88
 81 VAL  HA     82 GLY  HN      3.00 #SUP  0.91  #QF  0.91
 63 TYR  HA     82 GLY  HN      5.50 #SUP  0.94  #QF  0.94
 48 ARG  HA     49 GLY  HN      3.40 #SUP  0.75  #QF  0.75
 81 VAL  HB     82 GLY  HN      4.67 #SUP  0.98  #QF  0.98
 65 LEU  QD2    82 GLY  HN      4.13 #SUP  0.85  #QF  0.41
 82 GLY  HN     87 VAL  QG1     5.21 #SUP  0.80  #QF  0.21
 82 GLY  HN     87 VAL  QG2     5.21 #SUP  0.80  #QF  0.21
 43 LEU  HB3    44 GLY  HN      4.57 #SUP  0.99  #QF  0.99
 43 LEU  HB2    44 GLY  HN      4.57 #SUP  0.65  #QF  0.65
 35 ALA  HN     36 THR  HN      3.64 #SUP  0.99  #QF  0.99
 36 THR  HN     37 LEU  HN      3.13 #SUP  0.98  #QF  0.98
 33 ARG  HA     36 THR  HN      4.69 #SUP  0.88  #QF  0.88
 34 VAL  HA     36 THR  HN      4.94 #SUP  1.00
 35 ALA  QB     36 THR  HN      3.82 #SUP  0.98  #QF  0.98
 36 THR  HN     36 THR  QG2     3.33 #SUP  1.00
 14 GLU  HB2    15 LEU  HN      3.59 #SUP  0.95  #QF  0.95
 20 ARG  HA     22 VAL  HN      4.82 #SUP  0.97  #QF  0.97
 22 VAL  HA     26 ILE  HN      4.92 #SUP  0.96  #QF  0.96
 26 ILE  QD1    27 LEU  HN      4.86 #SUP  0.98  #QF  0.98
 58 TYR  QD     59 ARG  HN      4.81 #SUP  0.96  #QF  0.96
 60 VAL  HN     61 GLY  HN      5.03 #SUP  0.99  #QF  0.93
 60 VAL  HN     65 LEU  HN      5.50 #SUP  0.99  #QF  0.93
 63 TYR  HN     64 ARG  HN      4.87 #SUP  1.00
 68 HIST HB3    77 LEU  HN      4.86 #SUP  0.93  #QF  0.93
 77 LEU  HB2    78 VAL  HN      4.38 #SUP  0.98  #QF  0.98
  5 ILE  HN      5 ILE  QG2     4.08 #SUP  0.99  #QF  0.99
 20 ARG  HB3    21 GLU  HN      3.81 #SUP  0.90  #QF  0.90
 59 ARG  HA     65 LEU  HN      4.75 #SUP  0.88  #QF  0.88
 58 TYR  HN     65 LEU  HN      3.72 #SUP  0.96  #QF  0.96
 45 GLU  HN     58 TYR  HA      4.81 #SUP  0.87  #QF  0.87
 47 LEU  HN     56 TRP  HA      4.17 #SUP  0.92  #QF  0.92
 79 LEU  HB3    80 ARG  HN      3.88 #SUP  0.95  #QF  0.95
 43 LEU  HB3    58 TYR  QD      4.32 #SUP  0.87  #QF  0.87
 43 LEU  HB2    58 TYR  QD      4.32 #SUP  0.88  #QF  0.88
 43 LEU  HB2    43 LEU  QD1     4.13 #SUP  0.99  #QF  0.99
 52 LEU  HA     53 GLY  HA2     5.17 #SUP  0.94  #QF  0.85
 53 GLY  HA2    54 ARG  HA      5.50 #SUP  0.94  #QF  0.85
 52 LEU  HA     53 GLY  HA1     5.17 #SUP  0.90  #QF  0.71
 53 GLY  HA1    54 ARG  HA      5.50 #SUP  0.90  #QF  0.71
 44 GLY  HA2    56 TRP  HE1     4.44 #SUP  0.95  #QF  0.95
 26 ILE  HN     26 ILE  QD1     3.83 #SUP  1.00
 26 ILE  QD1    63 TYR  QD      4.05 #SUP  0.99  #QF  0.99
 23 ALA  HA     26 ILE  QD1     3.49 #SUP  0.96  #QF  0.96
 26 ILE  QD1    63 TYR  HB2     3.81 #SUP  0.98  #QF  0.98
 26 ILE  QD1    63 TYR  HB3     3.75 #SUP  0.99  #QF  0.99
 26 ILE  HB     26 ILE  QD1     3.22 #SUP  1.00
 23 ALA  QB     26 ILE  QD1     4.07 #SUP  0.88  #QF  0.88
 26 ILE  QG2    26 ILE  QD1     2.69 #SUP  0.97  #QF  0.90
 26 ILE  QD1    81 VAL  QG1     4.43 #SUP  0.97  #QF  0.90
 69 ILE  HN     69 ILE  QD1     4.61 #SUP  0.97  #QF  0.97
  8 ASP  HN      8 ASP  HB2     3.49 #SUP  0.99  #QF  0.99
  8 ASP  HN      8 ASP  HB3     3.49 #SUP  0.98  #QF  0.98
 58 TYR  HH     69 ILE  QD1     4.17 #SUP  0.79  #QF  0.79
  8 ASP  HB3    11 ALA  HN      4.84 #SUP  0.98  #QF  0.98
 58 TYR  QE     69 ILE  QD1     4.13 #SUP  0.76  #QF  0.76
  8 ASP  HB2    79 LEU  HA      4.04 #SUP  1.00
  8 ASP  HB3    79 LEU  HA      4.04 #SUP  0.99  #QF  0.99
 69 ILE  HA     69 ILE  QD1     3.93 #SUP  1.00
 41 ARG  HA     69 ILE  QD1     4.52 #SUP  0.94  #QF  0.94
 56 TRP  HB2    69 ILE  QD1     3.79 #SUP  0.99  #QF  0.99
 56 TRP  HB3    69 ILE  QD1     3.79 #SUP  1.00  #QF  0.38
 69 ILE  HB     69 ILE  QD1     3.37 #SUP  0.98  #QF  0.98
 41 ARG  HG2    69 ILE  QD1     3.70 #SUP  0.99  #QF  0.44
 41 ARG  HG3    69 ILE  QD1     3.70 #SUP  0.95  #QF  0.95
 49 GLY  HA1    50 PRO  QG      4.69 #SUP  0.98  #QF  0.98
 49 GLY  HA2    50 PRO  QG      4.69 #SUP  0.98  #QF  0.98
 65 LEU  HN     65 LEU  HB3     3.92 #SUP  0.62  #QF  0.62
 58 TYR  HB2    65 LEU  HB3     4.30 #SUP  1.00
 65 LEU  HB2    78 VAL  QG1     4.84 #SUP  0.55  #QF  0.55
 65 LEU  HB3    78 VAL  QG1     3.88 #SUP  0.43  #QF  0.43
 68 HIST HN     77 LEU  HB3     4.27 #SUP  0.99  #QF  0.99
 79 LEU  HN     79 LEU  HB3     4.11 #SUP  1.00
 77 LEU  HN     77 LEU  HB2     3.82 #SUP  0.99  #QF  0.99
 68 HIST HB3    77 LEU  HB2     4.71 #SUP  0.94  #QF  0.94
 68 HIST HB3    77 LEU  HB3     3.64 #SUP  0.98  #QF  0.98
 28 ARG  HB3    28 ARG  QD      3.67 #SUP  0.90  #QF  0.58
 77 LEU  HB2    77 LEU  QD1     3.60 #SUP  0.95  #QF  0.95
 79 LEU  HB2    79 LEU  QD1     3.85 #SUP  0.96  #QF  0.96
 79 LEU  HB3    79 LEU  QD1     3.85 #SUP  0.98  #QF  0.98
 77 LEU  HB2    77 LEU  QD2     3.60 #SUP  0.99  #QF  0.99
 10 ARG  HN     10 ARG  QD      4.70 #SUP  0.99  #QF  0.99
 28 ARG  HN     28 ARG  QD      4.49 #SUP  0.91  #QF  0.32
 28 ARG  QD     29 PHE  HN      5.37 #SUP  0.71  #QF  0.54
 10 ARG  HA     10 ARG  QD      4.32 #SUP  0.54  #QF  0.54
 68 HIST HB2    77 LEU  HB3     4.47 #SUP  0.94  #QF  0.94
  2 GLY  QA      3 TYR  HN      3.08 #SUP  0.90  #QF  0.90
  2 GLY  QA      3 TYR  QD      4.01 #SUP  0.96  #QF  0.96
 64 ARG  HA     64 ARG  HD2     4.08 #SUP  1.00
 54 ARG  HA     54 ARG  QD      4.16 #SUP  0.83  #QF  0.83
  2 GLY  QA      3 TYR  HB2     4.59 #SUP  0.81  #QF  0.81
 85 ARG  QB     85 ARG  QD      3.58 #SUP  0.90  #QF  0.90
 59 ARG  QB     59 ARG  QD      3.26 #SUP  0.72  #QF  0.22
 27 LEU  QD2    31 ARG  QD      3.98 #SUP  0.41  #QF  0.41
 66 ILE  QD1    67 CYS  HN      5.40 #SUP  0.99  #QF  0.99
 66 ILE  HN     66 ILE  QD1     4.19 #SUP  0.99  #QF  0.99
 66 ILE  HA     66 ILE  QD1     3.82 #SUP  1.00
 48 ARG  HA     48 ARG  QD      4.02 #SUP  0.92  #QF  0.92
 20 ARG  HA     20 ARG  QD      4.05 #SUP  0.88  #QF  0.88
 57 LYS  HE3    66 ILE  QD1     4.47 #SUP  0.76  #QF  0.76
 66 ILE  HB     66 ILE  QD1     3.53 #SUP  0.95  #QF  0.95
 18 LEU  HB2    19 ASP  HN      3.81 #SUP  0.98  #QF  0.98
 18 LEU  HB3    19 ASP  HN      3.54 #SUP  0.97  #QF  0.97
 41 ARG  HD2    56 TRP  HZ3     4.53 #SUP  0.68  #QF  0.45
 41 ARG  HD3    56 TRP  HZ3     4.53 #SUP  0.85  #QF  0.85
 15 LEU  HA     18 LEU  HB2     4.46 #SUP  0.96  #QF  0.96
 18 LEU  HB2    18 LEU  QD2     3.75 #SUP  1.00
 18 LEU  HB2    22 VAL  QG1     4.30 #SUP  0.99  #QF  0.99
 29 PHE  QE     58 TYR  HB3     3.78 #SUP  0.95  #QF  0.95
 29 PHE  QE     58 TYR  HB2     4.40 #SUP  0.96  #QF  0.96
 19 ASP  HB3    22 VAL  HB      4.03 #SUP  1.00  #QF  0.36
 58 TYR  HB2    65 LEU  HB2     3.72 #SUP  0.91  #QF  0.91
 58 TYR  HB3    65 LEU  HB2     4.05 #SUP  0.87  #QF  0.87
 37 LEU  HB3    38 GLU  HN      4.71 #SUP  0.96  #QF  0.96
 33 ARG  HN     33 ARG  QD      4.48 #SUP  0.99  #QF  0.99
 37 LEU  HN     37 LEU  HB3     4.07 #SUP  1.00
 29 PHE  QD     33 ARG  QD      3.68 #SUP  0.76  #QF  0.76
 80 ARG  HA     80 ARG  HD2     4.32 #SUP  0.98  #QF  0.98
 33 ARG  HA     33 ARG  QD      3.40 #SUP  0.84  #QF  0.84
 29 PHE  HA     33 ARG  QD      4.80 #SUP  0.91  #QF  0.91
 27 LEU  HA     30 LEU  HB2     3.95 #SUP  0.97  #QF  0.97
 27 LEU  HA     30 LEU  HB3     4.71 #SUP  0.99  #QF  0.99
 19 ASP  HB2    22 VAL  HB      4.03 #SUP  0.90  #QF  0.90
 32 GLU  HB2    33 ARG  QD      5.46 #SUP  0.72  #QF  0.50
 32 GLU  HB3    33 ARG  QD      5.50 #SUP  0.72  #QF  0.50
  5 ILE  HG13   30 LEU  HB3     3.98 #SUP  0.81  #QF  0.81
 33 ARG  QD     43 LEU  QD2     5.23 #SUP  0.85  #QF  0.85
 30 LEU  HB3    30 LEU  QD2     3.47 #SUP  0.90  #QF  0.90
 52 LEU  QB     53 GLY  HN      3.67 #SUP  0.99  #QF  0.99
 80 ARG  HA     80 ARG  HD3     4.32 #SUP  1.00
 13 LYS  HA     13 LYS  QE      4.39 #SUP  0.51  #QF  0.51
 15 LEU  QB     23 ALA  QB      4.63 #SUP  0.87  #QF  0.87
 52 LEU  QB     55 PHE  QD      4.26 #SUP  0.77  #QF  0.77
 86 ASP  QB     87 VAL  HA      4.66 #SUP  0.57  #QF  0.57
 52 LEU  QB     52 LEU  QD2     3.42 #SUP  0.89  #QF  0.80
 75 THR  HB     76 VAL  HN      4.59 #SUP  0.81  #QF  0.81
 70 GLN  HB2    75 THR  HB      3.93 #SUP  0.77  #QF  0.35
 73 GLU  HB2    75 THR  HB      4.26 #SUP  0.77  #QF  0.35
 73 GLU  HB3    75 THR  HB      4.26 #SUP  0.91  #QF  0.91
 83 HIST HE1    84 ALA  QB      4.29 #SUP  0.46  #QF  0.46
 27 LEU  HN     27 LEU  HB3     3.69 #SUP  0.99  #QF  0.99
 24 ARG  HA     27 LEU  HB2     3.69 #SUP  0.85  #QF  0.85
 24 ARG  HA     27 LEU  HB3     4.89 #SUP  0.99  #QF  0.99
 27 LEU  HB3    31 ARG  QD      4.64 #SUP  0.66  #QF  0.66
 83 HIST HE1    85 ARG  QB      4.19 #SUP  0.60  #QF  0.60
 83 HIST HE1    85 ARG  QG      4.22 #SUP  0.72  #QF  0.72
 27 LEU  HB2    27 LEU  QD1     3.21 #SUP  0.99  #QF  0.90
 27 LEU  HB3    27 LEU  QD1     3.47 #SUP  0.99  #QF  0.86
  5 ILE  QD1    76 VAL  HN      4.18 #SUP  0.91  #QF  0.91
  5 ILE  QD1     6 GLU  HN      4.19 #SUP  0.70  #QF  0.70
  5 ILE  HN      5 ILE  QD1     4.00 #SUP  0.99  #QF  0.99
  5 ILE  QD1    35 ALA  HN      4.34 #SUP  0.98  #QF  0.98
  5 ILE  QD1    35 ALA  HA      3.69 #SUP  0.92  #QF  0.92
  5 ILE  QD1    30 LEU  HA      4.30 #SUP  0.96  #QF  0.96
  3 TYR  HB3     5 ILE  QD1     4.67 #SUP  0.74  #QF  0.74
  5 ILE  QD1    76 VAL  HB      3.19 #SUP  0.94  #QF  0.94
  5 ILE  QD1    35 ALA  QB      3.60 #SUP  0.52  #QF  0.52
  5 ILE  QD1    30 LEU  HB3     3.64 #SUP  0.83  #QF  0.83
  5 ILE  QD1    30 LEU  QD1     4.14 #SUP  0.50  #QF  0.50
  5 ILE  QD1    76 VAL  QG2     3.64 #SUP  0.82  #QF  0.74
  5 ILE  QD1    76 VAL  QG1     4.10 #SUP  0.82  #QF  0.74
  5 ILE  QD1    34 VAL  QG2     4.30 #SUP  0.69  #QF  0.69
  7 PHE  HN      7 PHE  HB3     3.86 #SUP  0.99  #QF  0.99
  7 PHE  HB2     8 ASP  HN      4.66 #SUP  0.80  #QF  0.80
  7 PHE  HB3     8 ASP  HN      4.38 #SUP  0.92  #QF  0.92
  7 PHE  HB2    12 GLU  QB      4.80 #SUP  0.82  #QF  0.82
  7 PHE  HB3    11 ALA  QB      3.96 #SUP  0.95  #QF  0.95
 55 PHE  HB2    66 ILE  QG2     4.08 #SUP  0.97  #QF  0.97
 63 TYR  HB2    64 ARG  HN      4.29 #SUP  1.00
 63 TYR  HB2    65 LEU  QD2     4.34 #SUP  0.51  #QF  0.51
 63 TYR  HB3    65 LEU  QD2     4.16 #SUP  0.86  #QF  0.56
 60 VAL  QG1    63 TYR  HB3     4.52 #SUP  1.00
 29 PHE  HB2    30 LEU  HN      4.27 #SUP  0.99  #QF  0.99
 29 PHE  HN     29 PHE  HB3     3.51 #SUP  0.99  #QF  0.99
 26 ILE  HA     29 PHE  HB2     3.96 #SUP  0.94  #QF  0.94
 29 PHE  HB3    30 LEU  HG      5.20 #SUP  0.90  #QF  0.42
 29 PHE  HB3    30 LEU  QD1     5.50 #SUP  0.96  #QF  0.46
 26 ILE  QG2    29 PHE  HB2     5.50 #SUP  0.90  #QF  0.73
 29 PHE  HB2    65 LEU  QD1     5.50 #SUP  0.90  #QF  0.73
 29 PHE  HB3    60 VAL  QG1     4.36 #SUP  0.89  #QF  0.89
 29 PHE  HB2    60 VAL  QG1     4.40 #SUP  0.88  #QF  0.88
 29 PHE  HB3    60 VAL  QG2     4.12 #SUP  0.97  #QF  0.97
  3 TYR  HB2    76 VAL  QG2     3.60 #SUP  0.99  #QF  0.99
 26 ILE  HB     27 LEU  HN      3.56 #SUP  0.96  #QF  0.96
 14 GLU  HN     14 GLU  HG3     3.59 #SUP  0.94  #QF  0.94
 36 THR  HN     36 THR  HB      4.13 #SUP  0.99  #QF  0.99
 11 ALA  HA     14 GLU  HG3     4.62 #SUP  0.99  #QF  0.99
 11 ALA  HA     14 GLU  HG2     4.62 #SUP  0.98  #QF  0.98
 88 TYR  HN     88 TYR  QD      4.39 #SUP  0.97  #QF  0.97
 69 ILE  HN     69 ILE  HB      3.66 #SUP  0.99  #QF  0.99
 12 GLU  HN     12 GLU  HG3     4.47 #SUP  0.94  #QF  0.94
 12 GLU  HN     12 GLU  HG2     4.47 #SUP  0.97  #QF  0.97
 12 GLU  HA     12 GLU  HG3     3.91 #SUP  0.99  #QF  0.99
 12 GLU  HA     12 GLU  HG2     3.91 #SUP  0.99  #QF  0.99
  7 PHE  HB2    12 GLU  HG3     4.41 #SUP  0.99  #QF  0.99
  7 PHE  HB2    12 GLU  HG2     4.41 #SUP  1.00
  7 PHE  HB3    12 GLU  HG3     4.34 #SUP  0.99  #QF  0.99
  7 PHE  HB3    12 GLU  HG2     4.34 #SUP  1.00
 44 GLY  HA1    58 TYR  QD      4.30 #SUP  0.97  #QF  0.97
  4 ARG  HA      5 ILE  HB      4.91 #SUP  0.97  #QF  0.97
 44 GLY  HA2    58 TYR  QD      4.30 #SUP  0.99  #QF  0.99
 73 GLU  HA     73 GLU  HG3     3.72 #SUP  0.98  #QF  0.98
 58 TYR  QD     65 LEU  HB2     3.85 #SUP  0.94  #QF  0.94
 58 TYR  QD     65 LEU  HB3     4.59 #SUP  0.99  #QF  0.99
 58 TYR  QD     65 LEU  QD1     4.99 #SUP  0.99  #QF  0.64
 58 TYR  QD     76 VAL  QG1     4.64 #SUP  0.52  #QF  0.52
 34 VAL  QG2    58 TYR  QD      4.39 #SUP  0.53  #QF  0.53
 38 GLU  HN     38 GLU  HG3     4.61 #SUP  0.99  #QF  0.99
 63 TYR  QD     65 LEU  QD2     4.71 #SUP  0.94  #QF  0.46
 18 LEU  QD1    63 TYR  QD      4.33 #SUP  1.00  #QF  0.99
 22 VAL  QG1    63 TYR  QD      4.20 #SUP  0.86  #QF  0.86
 56 TRP  HN     56 TRP  HB3     4.13 #SUP  0.93  #QF  0.93
  6 GLU  HG3     7 PHE  HN      5.07 #SUP  0.97  #QF  0.97
  6 GLU  HG2    75 THR  QG2     3.89 #SUP  1.00
 56 TRP  HB2    69 ILE  HG12    4.78 #SUP  0.97  #QF  0.97
 21 GLU  HN     21 GLU  QG      3.90 #SUP  0.97  #QF  0.97
 21 GLU  QG     24 ARG  QD      4.62 #SUP  0.35  #QF  0.35
 29 PHE  QD     34 VAL  QG2     4.28 #SUP  0.96  #QF  0.96
  3 TYR  HN      3 TYR  QD      3.75 #SUP  0.99  #QF  0.99
  3 TYR  QD     74 ALA  HA      4.29 #SUP  0.99  #QF  0.99
  7 PHE  QD     12 GLU  QB      5.47 #SUP  0.97  #QF  0.95
  7 PHE  QD     81 VAL  HB      5.50 #SUP  0.97  #QF  0.95
 29 PHE  QE     33 ARG  QB      4.61 #SUP  0.79  #QF  0.79
 29 PHE  QE     43 LEU  QD2     4.50 #SUP  0.93  #QF  0.78
 29 PHE  QE     30 LEU  QD2     4.58 #SUP  0.85  #QF  0.85
 29 PHE  QE     60 VAL  QG2     4.57 #SUP  0.95  #QF  0.95
  7 PHE  QE     78 VAL  QG1     3.98 #SUP  0.88  #QF  0.88
 54 ARG  HA     55 PHE  QD      5.19 #SUP  0.94  #QF  0.92
  7 PHE  QE     30 LEU  QD1     4.16 #SUP  0.92  #QF  0.72
  6 GLU  HB3     7 PHE  HN      4.14 #SUP  1.00
  6 GLU  HB3    77 LEU  HA      4.13 #SUP  0.99  #QF  0.99
  6 GLU  HB2    77 LEU  HA      4.13 #SUP  0.94  #QF  0.94
 34 VAL  HA     40 PRO  HA      4.57 #SUP  0.86  #QF  0.86
 14 GLU  HB2    81 VAL  HB      4.16 #SUP  0.90  #QF  0.90
 22 VAL  HA     25 ARG  HB3     3.43 #SUP  0.81  #QF  0.81
 33 ARG  QB     34 VAL  HA      4.75 #SUP  0.86  #QF  0.62
  6 GLU  HB3    75 THR  QG2     4.22 #SUP  0.98  #QF  0.98
  6 GLU  HB2    75 THR  QG2     4.22 #SUP  0.95  #QF  0.95
 34 VAL  HA     37 LEU  QD1     3.13 #SUP  0.98  #QF  0.98
 34 VAL  HA     34 VAL  QG1     3.23 #SUP  1.00
 22 VAL  HA     22 VAL  QG1     3.17 #SUP  0.99  #QF  0.99
 34 VAL  HA     34 VAL  QG2     3.14 #SUP  0.99  #QF  0.99
  9 PRO  HA     12 GLU  HN      4.38 #SUP  0.99  #QF  0.99
 55 PHE  QD     68 HIST HB2     4.45 #SUP  0.63  #QF  0.63
 26 ILE  HA     29 PHE  QD      4.56 #SUP  0.98  #QF  0.98
 26 ILE  HA     29 PHE  HB3     3.58 #SUP  0.82  #QF  0.82
  9 PRO  HA     12 GLU  QB      3.24 #SUP  0.74  #QF  0.74
 26 ILE  HA     26 ILE  HG13    3.52 #SUP  1.00
 26 ILE  HA     26 ILE  QG2     3.22 #SUP  0.98  #QF  0.98
 68 HIST HB2    79 LEU  QD1     4.68 #SUP  0.90  #QF  0.90
 26 ILE  HA     26 ILE  HG12    3.33 #SUP  0.99  #QF  0.99
 26 ILE  HA     26 ILE  QD1     4.10 #SUP  1.00
 29 PHE  HZ     58 TYR  HB3     4.34 #SUP  0.94  #QF  0.94
 29 PHE  HZ     43 LEU  QD2     4.28 #SUP  0.75  #QF  0.75
 29 PHE  HZ     34 VAL  QG2     4.20 #SUP  0.96  #QF  0.96
 67 CYS  HB2    68 HIST HN      4.00 #SUP  0.98  #QF  0.98
 67 CYS  HB3    68 HIST HN      3.79 #SUP  0.99  #QF  0.99
 67 CYS  HN     67 CYS  HB3     4.06 #SUP  0.99  #QF  0.99
 17 LYS  HB2    18 LEU  HN      4.37 #SUP  1.00
 17 LYS  HB3    18 LEU  HN      4.37 #SUP  1.00
 58 TYR  QE     67 CYS  HB3     4.70 #SUP  0.92  #QF  0.92
 67 CYS  HB2    78 VAL  HA      4.49 #SUP  0.91  #QF  0.91
 67 CYS  HB3    78 VAL  HA      4.44 #SUP  0.99  #QF  0.66
  7 PHE  HZ     30 LEU  QD1     3.53 #SUP  0.51  #QF  0.51
 67 CYS  HB2    76 VAL  QG1     3.53 #SUP  0.94  #QF  0.94
  7 PHE  HZ     78 VAL  QG1     4.61 #SUP  0.60  #QF  0.60
  5 ILE  QG2     7 PHE  HZ      4.39 #SUP  0.83  #QF  0.83
 67 CYS  HB2    69 ILE  QD1     5.21 #SUP  0.86  #QF  0.86
 76 VAL  HN     76 VAL  HB      3.51 #SUP  1.00
 60 VAL  HB     63 TYR  HB2     4.09 #SUP  0.99  #QF  0.99
 60 VAL  HB     63 TYR  HB3     4.59 #SUP  0.92  #QF  0.92
 60 VAL  HB     65 LEU  QD1     4.28 #SUP  0.93  #QF  0.44
 26 ILE  HG12   60 VAL  HB      4.00 #SUP  0.98  #QF  0.98
 26 ILE  QD1    60 VAL  HB      4.57 #SUP  0.98  #QF  0.98
  9 PRO  HB2    10 ARG  HN      4.62 #SUP  1.00
  9 PRO  HB3    10 ARG  HN      4.62 #SUP  0.98  #QF  0.98
 40 PRO  HA     42 SER  HN      4.47 #SUP  0.92  #QF  0.92
 40 PRO  HA     58 TYR  HH      4.22 #SUP  0.43  #QF  0.43
 46 PRO  HB3    47 LEU  HN      4.48 #SUP  0.99  #QF  0.99
 46 PRO  HB3    56 TRP  HZ3     4.54 #SUP  0.97  #QF  0.97
 46 PRO  HB2    56 TRP  HZ3     4.54 #SUP  1.00
 83 HIST QB     85 ARG  QG      4.56 #SUP  0.66  #QF  0.66
 37 LEU  QD1    40 PRO  HA      3.63 #SUP  0.99  #QF  0.99
  8 ASP  HN     78 VAL  HB      4.38 #SUP  0.86  #QF  0.86
 42 SER  HN     42 SER  HB3     3.88 #SUP  0.96  #QF  0.96
 42 SER  HN     42 SER  HB2     3.88 #SUP  0.98  #QF  0.98
 13 LYS  HB2    14 GLU  HN      4.09 #SUP  0.98  #QF  0.98
 89 ARG  HB2    89 ARG  QD      3.83 #SUP  0.90  #QF  0.90
 89 ARG  HB3    89 ARG  QD      3.83 #SUP  0.97  #QF  0.69
 42 SER  HB2    43 LEU  HN      4.85 #SUP  0.70  #QF  0.70
 22 VAL  HN     22 VAL  HB      3.22 #SUP  0.98  #QF  0.98
  7 PHE  QD     78 VAL  HB      4.05 #SUP  0.79  #QF  0.54
  4 ARG  QB      4 ARG  QD      3.66 #SUP  0.79  #QF  0.79
 18 LEU  HB3    22 VAL  HB      3.84 #SUP  0.71  #QF  0.71
 68 HIST HN     78 VAL  HA      4.36 #SUP  0.91  #QF  0.91
 78 VAL  HA     79 LEU  HN      2.97 #SUP  0.95  #QF  0.95
 31 ARG  HB3    32 GLU  HN      4.26 #SUP  0.91  #QF  0.91
 31 ARG  HB2    31 ARG  QD      3.74 #SUP  0.89  #QF  0.89
 31 ARG  HB2    32 GLU  HN      4.26 #SUP  0.98  #QF  0.98
 31 ARG  HN     31 ARG  HB3     3.69 #SUP  0.99  #QF  0.99
 31 ARG  HB3    31 ARG  QD      3.74 #SUP  0.93  #QF  0.93
 30 LEU  HB3    34 VAL  HB      4.45 #SUP  0.96  #QF  0.96
 76 VAL  HA     77 LEU  HN      2.98 #SUP  0.92  #QF  0.92
 40 PRO  HB2    58 TYR  HH      4.19 #SUP  0.89  #QF  0.89
 40 PRO  HB3    58 TYR  HH      4.19 #SUP  0.76  #QF  0.76
 76 VAL  HA     76 VAL  QG2     3.17 #SUP  0.95  #QF  0.74
 40 PRO  HB2    69 ILE  QD1     4.49 #SUP  1.00
 40 PRO  HB3    69 ILE  QD1     4.49 #SUP  0.99  #QF  0.99
 56 TRP  HD1    58 TYR  QE      4.31 #SUP  0.96  #QF  0.96
 54 ARG  HB2    54 ARG  QD      4.01 #SUP  0.99  #QF  0.99
 54 ARG  HB3    54 ARG  QD      4.01 #SUP  0.99  #QF  0.99
 69 ILE  HA     69 ILE  HG13    3.94 #SUP  1.00
 87 VAL  HA     87 VAL  QG1     3.33 #SUP  0.85  #QF  0.72
 56 TRP  HD1    69 ILE  QD1     4.54 #SUP  0.96  #QF  0.96
 32 GLU  HN     32 GLU  HB3     3.74 #SUP  1.00
 20 ARG  HN     20 ARG  HB3     3.84 #SUP  0.99  #QF  0.99
 25 ARG  HB2    26 ILE  HN      4.24 #SUP  0.91  #QF  0.91
 24 ARG  HN     24 ARG  HB2     3.55 #SUP  0.99  #QF  0.99
 22 VAL  HA     25 ARG  HB2     3.89 #SUP  0.96  #QF  0.96
 28 ARG  HB2    28 ARG  QD      3.67 #SUP  0.97  #QF  0.81
 25 ARG  HB3    60 VAL  QG1     4.49 #SUP  0.96  #QF  0.96
 75 THR  HA     76 VAL  HN      2.97 #SUP  0.98  #QF  0.98
 10 ARG  HN     10 ARG  HB3     3.70 #SUP  0.99  #QF  0.99
 12 GLU  QB     13 LYS  HN      3.42 #SUP  0.86  #QF  0.86
 46 PRO  HA     56 TRP  HE3     4.07 #SUP  0.98  #QF  0.98
 10 ARG  HB2    11 ALA  HN      4.04 #SUP  0.98  #QF  0.98
 16 GLU  QB     17 LYS  HN      3.92 #SUP  0.94  #QF  0.94
  3 TYR  QD     75 THR  HA      4.46 #SUP  1.00
  3 TYR  HA     75 THR  HA      4.67 #SUP  0.99  #QF  0.99
  7 PHE  HB3    12 GLU  QB      4.05 #SUP  1.00
  3 TYR  HB3    75 THR  HA      3.99 #SUP  0.99  #QF  0.99
 70 GLN  HB2    75 THR  HA      5.30 #SUP  0.89  #QF  0.30
 75 THR  HA     76 VAL  HB      5.50 #SUP  0.89  #QF  0.30
  4 ARG  QB     75 THR  HA      3.75 #SUP  0.97  #QF  0.97
  4 ARG  QG     75 THR  HA      4.40 #SUP  0.99  #QF  0.99
 75 THR  HA     75 THR  QG2     3.31 #SUP  0.99  #QF  0.99
 75 THR  HA     76 VAL  QG2     4.45 #SUP  0.98  #QF  0.98
 46 PRO  HA     57 LYS  HN      4.71 #SUP  0.75  #QF  0.75
 14 GLU  HB3    15 LEU  HN      4.11 #SUP  0.99  #QF  0.99
 14 GLU  HN     14 GLU  HB2     3.58 #SUP  0.99  #QF  0.99
 14 GLU  HB2    81 VAL  QG1     4.50 #SUP  0.89  #QF  0.89
 29 PHE  HA     32 GLU  HN      4.62 #SUP  0.89  #QF  0.89
 29 PHE  HA     29 PHE  QD      3.51 #SUP  0.99  #QF  0.99
 29 PHE  HA     33 ARG  HG2     4.06 #SUP  0.97  #QF  0.97
 29 PHE  HA     33 ARG  HG3     4.06 #SUP  0.80  #QF  0.80
 26 ILE  HG12   65 LEU  QD1     4.01 #SUP  0.98  #QF  0.96
 29 PHE  QD     33 ARG  QB      4.24 #SUP  0.84  #QF  0.84
 29 PHE  HA     33 ARG  QB      4.11 #SUP  0.99  #QF  0.99
 33 ARG  QB     33 ARG  QD      3.79 #SUP  0.98  #QF  0.98
 72 ARG  QB     73 GLU  HN      4.04 #SUP  0.66  #QF  0.66
 17 LYS  HN     17 LYS  QD      4.63 #SUP  0.88  #QF  0.85
 17 LYS  QD     18 LEU  HN      5.10 #SUP  0.88  #QF  0.85
 17 LYS  HA     17 LYS  QD      3.97 #SUP  0.99  #QF  0.99
 14 GLU  HA     17 LYS  QD      4.64 #SUP  0.68  #QF  0.68
 21 GLU  QB     22 VAL  HA      4.64 #SUP  0.75  #QF  0.75
 72 ARG  QB     72 ARG  QD      3.90 #SUP  0.82  #QF  0.82
 21 GLU  QB     22 VAL  QG2     4.13 #SUP  0.94  #QF  0.94
 73 GLU  HN     73 GLU  HB2     4.09 #SUP  0.98  #QF  0.95
 35 ALA  QB     36 THR  HA      4.60 #SUP  0.90  #QF  0.90
 36 THR  HA     36 THR  QG2     3.37 #SUP  0.87  #QF  0.87
 65 LEU  QD2    81 VAL  HA      3.52 #SUP  0.96  #QF  0.76
 60 VAL  HA     60 VAL  QG1     3.20 #SUP  1.00
 60 VAL  HA     60 VAL  QG2     3.26 #SUP  0.97  #QF  0.97
 66 ILE  HN     81 VAL  HA      4.71 #SUP  0.71  #QF  0.71
 31 ARG  HN     31 ARG  HG2     4.27 #SUP  0.99  #QF  0.99
 31 ARG  HA     31 ARG  HG2     3.85 #SUP  0.99  #QF  0.99
 31 ARG  HA     31 ARG  HG3     3.85 #SUP  0.99  #QF  0.99
 69 ILE  HN     69 ILE  HG13    4.06 #SUP  0.99  #QF  0.99
 69 ILE  HN     69 ILE  HG12    4.63 #SUP  0.99  #QF  0.99
 28 ARG  HA     32 GLU  HN      4.19 #SUP  0.25  #QF  0.25
 24 ARG  HA     28 ARG  HN      4.14 #SUP  0.62  #QF  0.62
 12 GLU  HA     15 LEU  HN      4.05 #SUP  0.80  #QF  0.80
 24 ARG  HN     24 ARG  HG3     4.64 #SUP  0.95  #QF  0.95
 24 ARG  HN     24 ARG  HG2     4.64 #SUP  1.00
 25 ARG  HA     29 PHE  HN      4.48 #SUP  0.97  #QF  0.39
  7 PHE  QD     12 GLU  HA      4.19 #SUP  0.93  #QF  0.93
 69 ILE  HA     69 ILE  HG12    3.84 #SUP  1.00
 25 ARG  HA     25 ARG  HG3     3.54 #SUP  0.87  #QF  0.87
 24 ARG  HA     24 ARG  HG3     4.05 #SUP  0.96  #QF  0.96
 24 ARG  HA     24 ARG  HG2     4.05 #SUP  0.59  #QF  0.59
 28 ARG  HA     28 ARG  QD      4.37 #SUP  0.91  #QF  0.85
 28 ARG  HA     31 ARG  QD      4.63 #SUP  0.91  #QF  0.85
 24 ARG  HA     24 ARG  QD      4.32 #SUP  0.97  #QF  0.97
 56 TRP  HB2    69 ILE  HG13    4.45 #SUP  0.99  #QF  0.99
  7 PHE  HB3    12 GLU  HA      4.62 #SUP  0.99  #QF  0.99
 58 TYR  HB2    65 LEU  HG      4.68 #SUP  0.99  #QF  0.99
 56 TRP  HB3    69 ILE  HG13    4.45 #SUP  0.97  #QF  0.97
 12 GLU  HA     15 LEU  QB      3.31 #SUP  0.89  #QF  0.89
 25 ARG  HA     25 ARG  HG2     3.54 #SUP  0.99  #QF  0.95
 28 ARG  HA     28 ARG  HG2     3.81 #SUP  0.99  #QF  0.95
 11 ALA  QB     12 GLU  HA      4.55 #SUP  0.88  #QF  0.88
 23 ALA  QB     24 ARG  HA      4.32 #SUP  0.96  #QF  0.96
 24 ARG  HA     27 LEU  QD1     3.52 #SUP  0.98  #QF  0.98
 69 ILE  QG2    69 ILE  HG12    3.69 #SUP  0.99  #QF  0.99
 70 GLN  HN     70 GLN  HB3     4.14 #SUP  0.99  #QF  0.99
 28 ARG  HN     28 ARG  HG3     4.82 #SUP  0.96  #QF  0.96
 28 ARG  HN     28 ARG  HG2     4.82 #SUP  0.95  #QF  0.95
 70 GLN  HB3    75 THR  HN      4.35 #SUP  0.75  #QF  0.75
 47 LEU  HN     47 LEU  HG      4.59 #SUP  1.00
 10 ARG  HA     13 LYS  HN      4.27 #SUP  0.57  #QF  0.57
  8 ASP  HA      9 PRO  HG2     4.85 #SUP  0.97  #QF  0.97
  8 ASP  HA      9 PRO  HG3     4.85 #SUP  0.91  #QF  0.91
 47 LEU  HA     47 LEU  HG      4.00 #SUP  0.99  #QF  0.99
 28 ARG  HA     28 ARG  HG3     3.81 #SUP  0.97  #QF  0.97
 67 CYS  HB2    69 ILE  HG13    5.28 #SUP  0.94  #QF  0.92
 10 ARG  HA     10 ARG  HG2     4.04 #SUP  0.92  #QF  0.82
 25 ARG  HG2    60 VAL  QG1     3.95 #SUP  0.97  #QF  0.97
 20 ARG  HA     24 ARG  HN      4.45 #SUP  0.91  #QF  0.91
 14 GLU  HA     17 LYS  HN      4.33 #SUP  0.85  #QF  0.85
 30 LEU  HA     30 LEU  HG      4.09 #SUP  0.98  #QF  0.98
 14 GLU  HA     14 GLU  HG3     3.86 #SUP  0.95  #QF  0.95
 14 GLU  HA     14 GLU  HG2     3.86 #SUP  0.98  #QF  0.98
 10 ARG  HN     10 ARG  HG2     4.33 #SUP  0.98  #QF  0.98
 10 ARG  HN     10 ARG  HG3     4.33 #SUP  0.87  #QF  0.87
 66 ILE  HN     66 ILE  HG13    4.21 #SUP  0.94  #QF  0.94
 27 LEU  HN     27 LEU  HG      3.27 #SUP  0.96  #QF  0.96
 30 LEU  HN     30 LEU  QD1     3.54 #SUP  1.00
 43 LEU  HN     43 LEU  HG      4.66 #SUP  1.00
 29 PHE  QD     30 LEU  HG      3.97 #SUP  0.98  #QF  0.98
 29 PHE  QD     30 LEU  QD1     3.36 #SUP  0.57  #QF  0.57
 43 LEU  HA     43 LEU  HG      4.23 #SUP  1.00
 27 LEU  HA     27 LEU  HG      3.56 #SUP  0.73  #QF  0.73
 10 ARG  HA     10 ARG  HG3     4.04 #SUP  0.89  #QF  0.89
 30 LEU  HB2    30 LEU  QD1     3.18 #SUP  0.98  #QF  0.98
 31 ARG  HA     35 ALA  QB      3.03 #SUP  0.78  #QF  0.68
 30 LEU  HB3    30 LEU  QD1     3.13 #SUP  0.67  #QF  0.67
  5 ILE  HG13   31 ARG  HA      4.23 #SUP  0.83  #QF  0.83
  5 ILE  QG2    31 ARG  HA      4.79 #SUP  0.32  #QF  0.32
 64 ARG  HN     64 ARG  HG3     4.65 #SUP  0.91  #QF  0.91
 59 ARG  HN     59 ARG  HG3     4.58 #SUP  0.89  #QF  0.89
 59 ARG  HN     59 ARG  HG2     4.58 #SUP  0.95  #QF  0.95
  5 ILE  HN      5 ILE  HG12    3.60 #SUP  0.99  #QF  0.99
 15 LEU  HN     15 LEU  HG      4.59 #SUP  0.93  #QF  0.93
 52 LEU  HN     52 LEU  HG      4.33 #SUP  0.95  #QF  0.95
 37 LEU  QD1    42 SER  HN      4.39 #SUP  0.96  #QF  0.96
 21 GLU  HA     24 ARG  HN      4.05 #SUP  0.96  #QF  0.96
 21 GLU  HA     25 ARG  HN      4.56 #SUP  0.92  #QF  0.92
 37 LEU  QD1    43 LEU  HN      4.29 #SUP  0.99  #QF  0.99
  4 ARG  HA      5 ILE  HG12    4.51 #SUP  0.76  #QF  0.76
 15 LEU  HA     15 LEU  HG      3.98 #SUP  0.92  #QF  0.92
 64 ARG  HG3    84 ALA  HA      4.18 #SUP  0.84  #QF  0.84
 64 ARG  HG2    84 ALA  HA      4.18 #SUP  0.87  #QF  0.87
 21 GLU  HA     24 ARG  QD      3.99 #SUP  0.78  #QF  0.78
 21 GLU  HA     21 GLU  QG      3.54 #SUP  0.97  #QF  0.97
 37 LEU  HB2    37 LEU  QD1     3.34 #SUP  0.97  #QF  0.97
 37 LEU  HB3    37 LEU  QD1     3.34 #SUP  0.98  #QF  0.98
 34 VAL  QG2    37 LEU  QD1     4.09 #SUP  0.74  #QF  0.74
 79 LEU  HN     79 LEU  HG      3.96 #SUP  0.96  #QF  0.96
  3 TYR  QE     71 ASP  HA      3.29 #SUP  0.97  #QF  0.97
 67 CYS  HA     79 LEU  HG      4.36 #SUP  0.99  #QF  0.99
 20 ARG  HA     20 ARG  HG2     3.97 #SUP  0.99  #QF  0.99
 20 ARG  HA     20 ARG  HG3     3.97 #SUP  0.98  #QF  0.98
 71 ASP  HA     74 ALA  HA      4.05 #SUP  0.96  #QF  0.96
 77 LEU  HB3    77 LEU  QD1     3.48 #SUP  0.99  #QF  0.99
 71 ASP  HA     74 ALA  QB      4.65 #SUP  0.96  #QF  0.96
 69 ILE  QG2    71 ASP  HA      4.47 #SUP  0.94  #QF  0.94
 79 LEU  HN     79 LEU  QD2     4.30 #SUP  0.96  #QF  0.96
 15 LEU  HN     18 LEU  QD1     5.13 #SUP  1.00  #QF  0.74
  3 TYR  QD     71 ASP  HA      5.19 #SUP  0.95  #QF  0.95
 79 LEU  HA     79 LEU  QD2     4.45 #SUP  0.98  #QF  0.98
 68 HIST HB3    79 LEU  QD2     4.88 #SUP  0.97  #QF  0.97
 68 HIST HB2    79 LEU  QD2     4.68 #SUP  0.98  #QF  0.98
 16 GLU  HA     16 GLU  HG2     3.90 #SUP  0.86  #QF  0.86
 13 LYS  HA     16 GLU  QB      3.28 #SUP  0.51  #QF  0.51
 18 LEU  HB2    18 LEU  QD1     3.11 #SUP  0.93  #QF  0.93
 13 LYS  HA     13 LYS  QD      3.59 #SUP  0.94  #QF  0.94
 79 LEU  HB2    79 LEU  QD2     3.85 #SUP  1.00
 79 LEU  HB3    79 LEU  QD2     3.85 #SUP  1.00
 18 LEU  HB3    18 LEU  QD1     3.18 #SUP  0.91  #QF  0.91
 27 LEU  HA     30 LEU  QD1     3.39 #SUP  0.96  #QF  0.96
 27 LEU  HA     30 LEU  QD2     5.45 #SUP  0.96  #QF  0.96
 18 LEU  QD1    26 ILE  QD1     3.48 #SUP  0.83  #QF  0.83
 80 ARG  HG2    81 VAL  HN      4.94 #SUP  0.96  #QF  0.96
 65 LEU  HN     65 LEU  QD2     4.20 #SUP  0.71  #QF  0.71
 33 ARG  HN     33 ARG  HG3     4.10 #SUP  1.00
 18 LEU  HN     18 LEU  QD1     3.75 #SUP  0.97  #QF  0.97
 29 PHE  QD     33 ARG  HG2     4.49 #SUP  0.88  #QF  0.88
 29 PHE  QD     33 ARG  HG3     4.49 #SUP  0.92  #QF  0.92
 63 TYR  HA     63 TYR  QD      4.08 #SUP  0.94  #QF  0.94
 80 ARG  HA     80 ARG  HG2     4.25 #SUP  1.00
 33 ARG  HA     33 ARG  HG3     3.98 #SUP  1.00
 16 GLU  HA     16 GLU  HG3     3.90 #SUP  0.98  #QF  0.98
 65 LEU  HB2    65 LEU  QD2     3.54 #SUP  0.70  #QF  0.70
 32 GLU  HB2    33 ARG  HG3     4.75 #SUP  0.74  #QF  0.74
 15 LEU  QB     16 GLU  HA      4.33 #SUP  0.95  #QF  0.95
 65 LEU  HB3    65 LEU  QD2     3.36 #SUP  0.82  #QF  0.82
 40 PRO  HG2    69 ILE  QD1     4.65 #SUP  0.88  #QF  0.88
 40 PRO  HG3    69 ILE  QD1     4.65 #SUP  0.98  #QF  0.98
 65 LEU  HN     65 LEU  QD1     4.05 #SUP  0.98  #QF  0.98
 15 LEU  HA     18 LEU  HN      3.90 #SUP  0.99  #QF  0.99
 29 PHE  QD     30 LEU  HA      4.28 #SUP  0.96  #QF  0.96
 29 PHE  QD     65 LEU  QD1     3.80 #SUP  0.66  #QF  0.66
 63 TYR  QD     83 HIST HA      3.97 #SUP  0.84  #QF  0.84
 63 TYR  HA     83 HIST HA      3.40 #SUP  0.96  #QF  0.96
 26 ILE  HA     65 LEU  QD1     4.31 #SUP  0.74  #QF  0.74
 58 TYR  HB3    65 LEU  QD1     3.85 #SUP  0.99  #QF  0.99
 47 LEU  QD2    55 PHE  HB2     4.97 #SUP  0.96  #QF  0.96
 47 LEU  QD2    55 PHE  HB3     4.97 #SUP  0.94  #QF  0.94
 47 LEU  QD2    57 LYS  HE2     6.09 #SUP  0.33  #QF  0.33
 58 TYR  HB2    65 LEU  QD1     3.62 #SUP  0.97  #QF  0.97
 15 LEU  HA     18 LEU  HG      3.39 #SUP  0.95  #QF  0.95
 30 LEU  HA     34 VAL  HB      3.12 #SUP  0.99  #QF  0.99
 65 LEU  HB2    65 LEU  QD1     3.31 #SUP  0.96  #QF  0.96
 65 LEU  HB3    65 LEU  QD1     3.33 #SUP  0.96  #QF  0.96
 15 LEU  HA     23 ALA  QB      4.83 #SUP  0.66  #QF  0.66
 30 LEU  HA     30 LEU  QD1     4.07 #SUP  0.99  #QF  0.99
 15 LEU  HA     81 VAL  QG1     4.59 #SUP  0.89  #QF  0.89
 15 LEU  HA     15 LEU  QD2     3.82 #SUP  0.90  #QF  0.90
 15 LEU  HA     18 LEU  QD1     3.29 #SUP  0.99  #QF  0.99
 30 LEU  HA     34 VAL  QG2     3.47 #SUP  0.99  #QF  0.99
 88 TYR  HA     88 TYR  QD      3.47 #SUP  0.94  #QF  0.94
 43 LEU  HA     43 LEU  QD2     4.02 #SUP  1.00
 43 LEU  HB3    43 LEU  QD2     4.13 #SUP  0.96  #QF  0.96
 43 LEU  HB2    43 LEU  QD2     4.13 #SUP  0.75  #QF  0.75
 34 VAL  QG2    43 LEU  QD2     4.97 #SUP  0.88  #QF  0.88
 15 LEU  HN     15 LEU  QD2     4.71 #SUP  0.94  #QF  0.94
 15 LEU  HN     15 LEU  QD1     4.71 #SUP  0.98  #QF  0.96
 36 THR  HN     37 LEU  HG      4.66 #SUP  0.98  #QF  0.98
 34 VAL  HA     37 LEU  HG      3.67 #SUP  0.99  #QF  0.99
 89 ARG  HA     89 ARG  QD      4.21 #SUP  0.95  #QF  0.95
 89 ARG  HA     89 ARG  QG      3.62 #SUP  0.97  #QF  0.97
 52 LEU  HA     52 LEU  QD1     4.27 #SUP  0.89  #QF  0.89
 46 PRO  HA     56 TRP  HZ3     4.42 #SUP  0.97  #QF  0.97
 15 LEU  HA     15 LEU  QD1     3.82 #SUP  0.94  #QF  0.94
 15 LEU  QD1    23 ALA  HA      3.71 #SUP  0.78  #QF  0.78
 47 LEU  QD1    55 PHE  HB2     4.97 #SUP  0.97  #QF  0.97
 47 LEU  QD1    55 PHE  HB3     4.97 #SUP  0.89  #QF  0.89
 47 LEU  QD1    57 LYS  HE2     6.09 #SUP  0.39  #QF  0.39
 32 GLU  HA     32 GLU  HG2     3.66 #SUP  1.00
 32 GLU  HA     32 GLU  HG3     3.66 #SUP  1.00
 52 LEU  QB     52 LEU  QD1     3.42 #SUP  0.68  #QF  0.68
 85 ARG  HA     85 ARG  QG      3.66 #SUP  0.83  #QF  0.83
 32 GLU  HA     35 ALA  QB      4.49 #SUP  0.41  #QF  0.41
 15 LEU  QD1    23 ALA  QB      3.66 #SUP  0.75  #QF  0.75
 32 GLU  HA     36 THR  QG2     3.96 #SUP  0.50  #QF  0.50
 67 CYS  HA     68 HIST HN      3.12 #SUP  0.98  #QF  0.98
 67 CYS  HA     79 LEU  HN      3.40 #SUP  0.97  #QF  0.97
 13 LYS  HN     13 LYS  HG3     3.87 #SUP  0.95  #QF  0.95
 17 LYS  HN     17 LYS  HG3     4.42 #SUP  0.97  #QF  0.95
 17 LYS  HA     17 LYS  HG2     4.25 #SUP  1.00
 27 LEU  HA     27 LEU  QD1     4.06 #SUP  0.95  #QF  0.95
 67 CYS  HA     78 VAL  HA      3.39 #SUP  1.00
 13 LYS  HA     13 LYS  HG2     3.84 #SUP  0.99  #QF  0.99
 13 LYS  HA     13 LYS  HG3     3.84 #SUP  0.99  #QF  0.99
 51 GLU  HA     51 GLU  QG      3.42 #SUP  0.78  #QF  0.78
 54 ARG  HA     54 ARG  HG3     3.80 #SUP  0.99  #QF  0.99
 58 TYR  HA     59 ARG  HN      3.35 #SUP  0.99  #QF  0.99
 58 TYR  HA     58 TYR  QD      3.52 #SUP  0.99  #QF  0.99
 44 GLY  HA1    58 TYR  HA      4.14 #SUP  0.98  #QF  0.98
 44 GLY  HA2    58 TYR  HA      4.14 #SUP  0.98  #QF  0.98
 73 GLU  HA     73 GLU  HG2     3.72 #SUP  0.99  #QF  0.99
 58 TYR  HA     59 ARG  QB      4.60 #SUP  0.56  #QF  0.56
 73 GLU  HA     74 ALA  QB      4.53 #SUP  0.97  #QF  0.97
 41 ARG  HA     56 TRP  HE1     4.30 #SUP  0.94  #QF  0.94
  3 TYR  HA      3 TYR  QD      3.62 #SUP  1.00
 57 LYS  HA     57 LYS  HG2     4.11 #SUP  0.94  #QF  0.94
 17 LYS  HA     17 LYS  HG3     4.25 #SUP  1.00
 55 PHE  HA     56 TRP  HN      3.28 #SUP  0.95  #QF  0.95
 23 ALA  HA     27 LEU  HN      4.63 #SUP  0.96  #QF  0.96
 41 ARG  HA     43 LEU  HN      4.43 #SUP  0.82  #QF  0.82
 55 PHE  HA     55 PHE  QD      3.50 #SUP  0.97  #QF  0.97
 29 PHE  HZ     43 LEU  QD1     4.28 #SUP  0.93  #QF  0.93
 29 PHE  QE     43 LEU  QD1     4.50 #SUP  0.89  #QF  0.89
 43 LEU  HA     43 LEU  QD1     4.02 #SUP  0.98  #QF  0.98
 33 ARG  QD     43 LEU  QD1     5.23 #SUP  0.63  #QF  0.63
 23 ALA  HA     26 ILE  HB      3.36 #SUP  0.97  #QF  0.97
 43 LEU  HB3    43 LEU  QD1     4.13 #SUP  0.98  #QF  0.98
 23 ALA  HA     26 ILE  HG13    4.12 #SUP  0.84  #QF  0.84
 23 ALA  HA     26 ILE  QG2     4.71 #SUP  0.99  #QF  0.99
 55 PHE  HA     66 ILE  QG2     4.83 #SUP  0.91  #QF  0.91
 15 LEU  QD2    23 ALA  HA      3.71 #SUP  1.00
 18 LEU  QD1    23 ALA  HA      3.95 #SUP  0.89  #QF  0.89
 34 VAL  QG2    43 LEU  QD1     4.97 #SUP  0.97  #QF  0.97
 77 LEU  QD2    78 VAL  HN      4.79 #SUP  0.99  #QF  0.99
 77 LEU  HB3    77 LEU  QD2     3.48 #SUP  0.94  #QF  0.94
 33 ARG  HA     33 ARG  HG2     3.98 #SUP  1.00
 33 ARG  HA     36 THR  QG2     4.35 #SUP  0.51  #QF  0.51
  4 ARG  HA      5 ILE  HN      2.81 #SUP  0.96  #QF  0.96
 52 LEU  HA     55 PHE  QD      4.38 #SUP  0.87  #QF  0.87
  4 ARG  HA      4 ARG  QG      3.45 #SUP  0.96  #QF  0.89
 52 LEU  HA     52 LEU  QD2     4.27 #SUP  0.75  #QF  0.50
 27 LEU  HN     27 LEU  QD2     3.96 #SUP  0.96  #QF  0.96
  7 PHE  QE     27 LEU  QD2     3.59 #SUP  0.58  #QF  0.31
  7 PHE  HZ     27 LEU  QD2     3.36 #SUP  0.92  #QF  0.81
 27 LEU  HA     27 LEU  QD2     2.87 #SUP  0.98  #QF  0.98
 19 ASP  HA     22 VAL  HB      5.50 #SUP  0.99  #QF  0.98
 27 LEU  HB3    27 LEU  QD2     3.05 #SUP  0.89  #QF  0.89
 79 LEU  HN     79 LEU  QD1     4.30 #SUP  0.95  #QF  0.95
 18 LEU  QD2    19 ASP  HN      3.72 #SUP  0.99  #QF  0.99
 34 VAL  QG2    35 ALA  HN      4.23 #SUP  0.97  #QF  0.97
 29 PHE  QE     34 VAL  QG2     3.40 #SUP  0.73  #QF  0.73
 18 LEU  QD2    63 TYR  QD      3.27 #SUP  0.61  #QF  0.61
 79 LEU  HA     79 LEU  QD1     4.45 #SUP  0.99  #QF  0.99
 18 LEU  HA     18 LEU  QD2     2.86 #SUP  0.99  #QF  0.99
 19 ASP  HA     20 ARG  HA      4.54 #SUP  0.94  #QF  0.94
 68 HIST HB3    79 LEU  QD1     4.88 #SUP  0.92  #QF  0.92
 33 ARG  QB     34 VAL  QG2     3.71 #SUP  0.97  #QF  0.97
 18 LEU  HB3    18 LEU  QD2     3.07 #SUP  0.97  #QF  0.97
 62 ASP  HA     84 ALA  QB      4.00 #SUP  0.90  #QF  0.90
 84 ALA  HA     87 VAL  HB      4.61 #SUP  0.71  #QF  0.71
 64 ARG  HB3    84 ALA  HA      4.52 #SUP  0.98  #QF  0.85
 64 ARG  HB2    84 ALA  HA      4.52 #SUP  0.94  #QF  0.94
 56 TRP  HE1    58 TYR  QE      4.23 #SUP  0.94  #QF  0.94
 19 ASP  HN     22 VAL  QG2     3.91 #SUP  0.98  #QF  0.83
 22 VAL  QG2    23 ALA  HN      4.40 #SUP  0.98  #QF  0.83
 63 TYR  HN     63 TYR  QE      5.14 #SUP  0.96  #QF  0.96
 58 TYR  QE     58 TYR  HH      3.33 #SUP  0.71  #QF  0.71
 22 VAL  HN     22 VAL  QG2     3.09 #SUP  1.00
 22 VAL  QG2    63 TYR  QE      3.77 #SUP  0.91  #QF  0.91
 63 TYR  QE     83 HIST HA      4.58 #SUP  0.81  #QF  0.81
 22 VAL  HA     22 VAL  QG2     3.00 #SUP  0.99  #QF  0.99
 63 TYR  QE     83 HIST QB      4.10 #SUP  0.82  #QF  0.82
 58 TYR  QE     67 CYS  HB2     4.63 #SUP  1.00
 19 ASP  HB2    22 VAL  QG2     3.58 #SUP  0.99  #QF  0.99
 19 ASP  HB3    22 VAL  QG2     3.58 #SUP  0.99  #QF  0.99
 21 GLU  QG     22 VAL  QG2     5.02 #SUP  0.86  #QF  0.86
 37 LEU  HA     37 LEU  HG      3.59 #SUP  0.84  #QF  0.84
 18 LEU  QD2    63 TYR  QE      3.40 #SUP  0.59  #QF  0.59
 47 LEU  HA     47 LEU  QD2     4.05 #SUP  0.96  #QF  0.96
 34 VAL  QG1    58 TYR  QE      3.96 #SUP  0.89  #QF  0.89
 18 LEU  QD1    63 TYR  QE      4.09 #SUP  0.87  #QF  0.87
 34 VAL  QG2    58 TYR  QE      4.23 #SUP  0.69  #QF  0.69
 37 LEU  QD2    39 ASP  HN      4.45 #SUP  0.95  #QF  0.95
 37 LEU  HN     37 LEU  QD2     4.03 #SUP  0.94  #QF  0.94
 37 LEU  HA     37 LEU  QD2     2.86 #SUP  0.98  #QF  0.98
 34 VAL  HA     37 LEU  QD2     4.57 #SUP  0.95  #QF  0.95
 11 ALA  HA     14 GLU  HB2     3.61 #SUP  1.00
 11 ALA  HA     14 GLU  HB3     3.97 #SUP  0.96  #QF  0.96
 57 LYS  HA     67 CYS  HN      4.32 #SUP  0.80  #QF  0.80
 78 VAL  QG1    79 LEU  HN      3.72 #SUP  0.97  #QF  0.97
 66 ILE  HN     78 VAL  QG1     4.38 #SUP  0.83  #QF  0.83
 57 LYS  HA     58 TYR  HN      3.01 #SUP  0.98  #QF  0.98
  7 PHE  QD     78 VAL  QG1     3.91 #SUP  0.98  #QF  0.83
 57 LYS  HA     66 ILE  HA      3.73 #SUP  0.99  #QF  0.99
 11 ALA  HA     80 ARG  HA      4.08 #SUP  0.90  #QF  0.90
  3 TYR  HA      3 TYR  QE      4.71 #SUP  0.86  #QF  0.86
 78 VAL  HA     78 VAL  QG1     3.23 #SUP  0.93  #QF  0.93
 83 HIST QB     83 HIST HD2     3.71 #SUP  0.70  #QF  0.70
 57 LYS  HA     58 TYR  HB2     5.39 #SUP  0.91  #QF  0.24
  3 TYR  QE     74 ALA  HA      4.02 #SUP  0.97  #QF  0.97
 18 LEU  HA     18 LEU  HG      3.66 #SUP  0.99  #QF  0.99
 57 LYS  HA     57 LYS  HG3     4.11 #SUP  0.99  #QF  0.99
 57 LYS  HA     66 ILE  QD1     4.60 #SUP  1.00
 18 LEU  HA     18 LEU  QD1     4.16 #SUP  1.00
 78 VAL  HN     78 VAL  QG1     4.13 #SUP  0.98  #QF  0.98
 81 VAL  HN     81 VAL  QG1     4.13 #SUP  0.98  #QF  0.98
 81 VAL  QG1    82 GLY  HN      4.14 #SUP  0.92  #QF  0.92
 15 LEU  HN     81 VAL  QG1     4.76 #SUP  0.90  #QF  0.90
 30 LEU  HN     30 LEU  QD2     4.41 #SUP  0.98  #QF  0.98
 70 GLN  HA     71 ASP  HN      3.48 #SUP  0.95  #QF  0.95
  3 TYR  QE     75 THR  HN      4.43 #SUP  0.86  #QF  0.86
 30 LEU  QD2    58 TYR  QD      4.29 #SUP  0.80  #QF  0.67
 29 PHE  QD     30 LEU  QD2     3.63 #SUP  0.89  #QF  0.89
 81 VAL  HA     81 VAL  QG1     3.41 #SUP  0.94  #QF  0.94
 78 VAL  QG1    81 VAL  HA      4.64 #SUP  0.98  #QF  0.98
 30 LEU  HA     30 LEU  QD2     2.99 #SUP  0.99  #QF  0.99
 30 LEU  HB2    30 LEU  QD2     3.48 #SUP  0.99  #QF  0.99
 78 VAL  QG1    81 VAL  HB      4.03 #SUP  0.98  #QF  0.98
 32 GLU  HB3    36 THR  QG2     4.85 #SUP  0.71  #QF  0.71
 30 LEU  QD2    34 VAL  HB      3.35 #SUP  0.85  #QF  0.85
 70 GLN  HA     70 GLN  HG2     3.83 #SUP  0.99  #QF  0.99
 15 LEU  QB     81 VAL  QG1     3.34 #SUP  0.65  #QF  0.65
 35 ALA  QB     36 THR  QG2     3.69 #SUP  0.52  #QF  0.52
 80 ARG  HA     80 ARG  HG3     4.25 #SUP  1.00
 70 GLN  HA     70 GLN  HG3     3.83 #SUP  0.99  #QF  0.99
  3 TYR  QE     74 ALA  QB      4.13 #SUP  0.91  #QF  0.91
  3 TYR  QE     69 ILE  QG2     3.08 #SUP  0.93  #QF  0.93
 30 LEU  QD2    34 VAL  QG2     3.25 #SUP  0.88  #QF  0.88
 76 VAL  HN     76 VAL  QG1     4.47 #SUP  0.99  #QF  0.99
 68 HIST HA     69 ILE  HN      3.26 #SUP  0.92  #QF  0.92
 55 PHE  QD     68 HIST HA      3.93 #SUP  0.94  #QF  0.94
 68 HIST HA     68 HIST HD2     4.13 #SUP  0.61  #QF  0.61
 58 TYR  QE     76 VAL  QG1     3.55 #SUP  0.99  #QF  0.99
 67 CYS  HA     76 VAL  QG1     4.59 #SUP  0.98  #QF  0.98
 55 PHE  HA     68 HIST HA      3.76 #SUP  0.97  #QF  0.97
 76 VAL  HA     76 VAL  QG1     3.24 #SUP  0.90  #QF  0.90
 67 CYS  HB3    76 VAL  QG1     3.34 #SUP  0.91  #QF  0.91
 68 HIST HA     69 ILE  HG13    4.60 #SUP  0.71  #QF  0.71
 69 ILE  QD1    76 VAL  QG1     4.03 #SUP  0.68  #QF  0.68
 65 LEU  HA     66 ILE  HN      2.97 #SUP  0.95  #QF  0.95
 81 VAL  QG2    82 GLY  HN      4.14 #SUP  0.96  #QF  0.96
 15 LEU  HN     81 VAL  QG2     4.76 #SUP  0.99  #QF  0.99
 22 VAL  QG1    23 ALA  HN      3.70 #SUP  0.98  #QF  0.98
 34 VAL  QG1    58 TYR  HH      4.02 #SUP  0.67  #QF  0.67
 22 VAL  QG1    63 TYR  QE      3.62 #SUP  0.75  #QF  0.75
 65 LEU  HA     81 VAL  HA      3.70 #SUP  0.99  #QF  0.99
 81 VAL  HA     81 VAL  QG2     3.41 #SUP  0.96  #QF  0.96
 34 VAL  QG1    40 PRO  HA      3.88 #SUP  0.95  #QF  0.55
 15 LEU  HA     81 VAL  QG2     4.59 #SUP  0.90  #QF  0.90
 22 VAL  QG1    23 ALA  HA      4.14 #SUP  1.00
 30 LEU  HA     34 VAL  QG1     4.10 #SUP  0.97  #QF  0.97
 22 VAL  QG1    63 TYR  HB3     5.13 #SUP  0.96  #QF  0.89
 14 GLU  HB2    81 VAL  QG2     4.50 #SUP  0.95  #QF  0.95
 34 VAL  QG1    40 PRO  HB2     3.79 #SUP  0.78  #QF  0.78
 65 LEU  HA     65 LEU  HG      3.88 #SUP  0.98  #QF  0.98
 15 LEU  QB     81 VAL  QG2     3.34 #SUP  0.60  #QF  0.60
 22 VAL  QG1    26 ILE  HG13    3.75 #SUP  0.61  #QF  0.61
 34 VAL  QG1    40 PRO  HB3     3.79 #SUP  0.91  #QF  0.91
 18 LEU  HB3    22 VAL  QG1     3.60 #SUP  0.92  #QF  0.92
 65 LEU  HA     65 LEU  QD2     3.40 #SUP  1.00  #QF  0.99
 18 LEU  QD2    22 VAL  QG1     3.52 #SUP  0.81  #QF  0.81
 18 LEU  QD1    22 VAL  QG1     3.11 #SUP  0.95  #QF  0.95
 26 ILE  QD1    81 VAL  QG2     4.43 #SUP  0.26  #QF  0.26
 76 VAL  QG2    77 LEU  HN      4.53 #SUP  0.84  #QF  0.84
 87 VAL  HN     87 VAL  QG1     4.08 #SUP  0.96  #QF  0.96
 64 ARG  HA     64 ARG  HD3     4.08 #SUP  1.00
 67 CYS  HB3    76 VAL  QG2     5.50 #SUP  0.88  #QF  0.65
 86 ASP  QB     87 VAL  QG1     5.20 #SUP  0.93  #QF  0.93
 40 PRO  HB2    76 VAL  QG2     3.74 #SUP  0.83  #QF  0.83
 64 ARG  HA     65 LEU  HG      4.42 #SUP  0.93  #QF  0.21
 40 PRO  HB3    76 VAL  QG2     3.74 #SUP  0.84  #QF  0.84
 64 ARG  HA     65 LEU  QD2     4.41 #SUP  0.90  #QF  0.90
 76 VAL  HN     76 VAL  QG2     3.61 #SUP  0.98  #QF  0.98
  3 TYR  QD     76 VAL  QG2     3.31 #SUP  0.98  #QF  0.98
  3 TYR  QE     76 VAL  QG2     4.47 #SUP  0.88  #QF  0.88
 69 ILE  HA     76 VAL  QG2     3.75 #SUP  0.94  #QF  0.33
 45 GLU  HA     46 PRO  HD3     3.35 #SUP  1.00
  3 TYR  HB3    76 VAL  QG2     3.48 #SUP  0.99  #QF  0.99
 69 ILE  QD1    76 VAL  QG2     3.80 #SUP  0.78  #QF  0.78
 75 THR  QG2    76 VAL  HN      3.40 #SUP  0.98  #QF  0.98
  6 GLU  HN     75 THR  QG2     3.88 #SUP  0.97  #QF  0.97
 75 THR  QG2    77 LEU  HN      4.41 #SUP  0.98  #QF  0.98
 26 ILE  HN     60 VAL  QG1     4.79 #SUP  0.66  #QF  0.37
 60 VAL  QG1    63 TYR  QD      4.06 #SUP  0.50  #QF  0.50
 29 PHE  QD     60 VAL  QG2     3.52 #SUP  0.90  #QF  0.90
 75 THR  QG2    77 LEU  HA      4.40 #SUP  0.98  #QF  0.98
 75 THR  QG2    76 VAL  HA      4.31 #SUP  0.97  #QF  0.97
 60 VAL  QG1    61 GLY  HA1     4.58 #SUP  0.43  #QF  0.43
 26 ILE  HA     60 VAL  QG1     3.45 #SUP  0.99  #QF  0.98
 60 VAL  QG1    61 GLY  HA2     4.58 #SUP  0.99  #QF  0.98
 26 ILE  HA     60 VAL  QG2     3.60 #SUP  1.00
 29 PHE  HB2    60 VAL  QG2     4.04 #SUP  0.92  #QF  0.39
 58 TYR  HB3    60 VAL  QG2     4.26 #SUP  0.92  #QF  0.39
  4 ARG  QD     75 THR  QG2     4.73 #SUP  0.86  #QF  0.86
 60 VAL  QG1    63 TYR  HB2     4.28 #SUP  1.00
 58 TYR  HB2    60 VAL  QG2     4.61 #SUP  0.77  #QF  0.77
  6 GLU  HG3    75 THR  QG2     3.89 #SUP  0.97  #QF  0.97
 25 ARG  HG3    60 VAL  QG1     3.95 #SUP  0.82  #QF  0.82
  4 ARG  QB     75 THR  QG2     3.37 #SUP  0.76  #QF  0.76
 60 VAL  QG2    65 LEU  HG      3.79 #SUP  0.69  #QF  0.69
 26 ILE  HG13   60 VAL  QG1     3.60 #SUP  0.87  #QF  0.87
  4 ARG  QG     75 THR  QG2     3.36 #SUP  0.80  #QF  0.65
 26 ILE  QG2    60 VAL  QG1     4.39 #SUP  0.86  #QF  0.71
 60 VAL  QG1    65 LEU  QD1     4.58 #SUP  0.86  #QF  0.71
 60 VAL  QG2    65 LEU  QD1     3.09 #SUP  0.98  #QF  0.26
 26 ILE  HG12   60 VAL  QG2     3.65 #SUP  0.90  #QF  0.90
 78 VAL  HN     78 VAL  QG2     3.13 #SUP  0.97  #QF  0.97
 78 VAL  QG2    79 LEU  HN      4.31 #SUP  0.94  #QF  0.94
  6 GLU  HN     78 VAL  QG2     4.30 #SUP  0.73  #QF  0.73
  7 PHE  QD     78 VAL  QG2     4.32 #SUP  0.65  #QF  0.29
  7 PHE  QE     78 VAL  QG2     4.49 #SUP  0.65  #QF  0.29
 77 LEU  HA     78 VAL  QG2     4.03 #SUP  0.95  #QF  0.95
 78 VAL  HA     78 VAL  QG2     3.27 #SUP  0.99  #QF  0.99
 87 VAL  HA     87 VAL  QG2     3.33 #SUP  0.88  #QF  0.88
 86 ASP  QB     87 VAL  QG2     5.20 #SUP  0.92  #QF  0.92
 11 ALA  QB     81 VAL  HN      3.95 #SUP  0.97  #QF  0.97
 10 ARG  HN     11 ALA  QB      4.68 #SUP  0.98  #QF  0.98
 11 ALA  QB     12 GLU  HN      3.44 #SUP  0.99  #QF  0.99
 11 ALA  QB     80 ARG  HN      4.32 #SUP  0.99  #QF  0.99
 11 ALA  HN     11 ALA  QB      3.02 #SUP  0.99  #QF  0.99
  7 PHE  QD     11 ALA  QB      3.27 #SUP  0.89  #QF  0.89
 11 ALA  QB     80 ARG  HA      3.65 #SUP  0.90  #QF  0.90
 11 ALA  QB     79 LEU  HA      3.91 #SUP  0.87  #QF  0.87
  8 ASP  HB2    11 ALA  QB      4.27 #SUP  0.92  #QF  0.92
  8 ASP  HB3    11 ALA  QB      4.27 #SUP  0.98  #QF  0.95
 11 ALA  QB     14 GLU  HB2     4.21 #SUP  0.64  #QF  0.64
 11 ALA  QB     81 VAL  HB      3.55 #SUP  0.79  #QF  0.79
 11 ALA  QB     78 VAL  QG1     3.00 #SUP  0.69  #QF  0.69
  9 PRO  HD2    10 ARG  HN      4.45 #SUP  0.98  #QF  0.98
 69 ILE  QG2    70 GLN  HN      3.83 #SUP  0.99  #QF  0.99
 35 ALA  HN     35 ALA  QB      2.94 #SUP  0.96  #QF  0.96
  3 TYR  QD     69 ILE  QG2     3.62 #SUP  0.81  #QF  0.81
  8 ASP  HA      9 PRO  HD2     2.93 #SUP  0.99  #QF  0.99
  8 ASP  HA      9 PRO  HD3     3.06 #SUP  0.98  #QF  0.98
 69 ILE  QG2    70 GLN  HA      4.55 #SUP  0.99  #QF  0.83
 69 ILE  HA     69 ILE  QG2     3.26 #SUP  0.98  #QF  0.98
 69 ILE  QG2    69 ILE  HG13    3.64 #SUP  0.64  #QF  0.64
  5 ILE  HG13   35 ALA  QB      4.03 #SUP  0.77  #QF  0.21
 69 ILE  QG2    69 ILE  QD1     3.08 #SUP  0.98  #QF  0.98
 45 GLU  HA     56 TRP  HZ2     4.30 #SUP  0.83  #QF  0.83
 41 ARG  HA     56 TRP  HZ2     4.18 #SUP  0.98  #QF  0.98
 84 ALA  HN     84 ALA  QB      3.24 #SUP  0.97  #QF  0.97
 83 HIST HA     84 ALA  QB      4.35 #SUP  0.97  #QF  0.97
 23 ALA  HN     23 ALA  QB      2.86 #SUP  0.96  #QF  0.96
 18 LEU  HN     23 ALA  QB      4.99 #SUP  0.51  #QF  0.51
  5 ILE  QG2     7 PHE  QE      3.75 #SUP  0.89  #QF  0.38
 20 ARG  HA     23 ALA  QB      3.08 #SUP  1.00
 23 ALA  QB     24 ARG  HB2     5.23 #SUP  0.79  #QF  0.20
 23 ALA  QB     24 ARG  HB3     5.23 #SUP  0.79  #QF  0.20
  5 ILE  QG2    30 LEU  HG      5.50 #SUP  0.92  #QF  0.27
  5 ILE  QG2     5 ILE  HG12    3.48 #SUP  0.92  #QF  0.92
  5 ILE  QG2    30 LEU  HB3     3.42 #SUP  0.75  #QF  0.75
  5 ILE  QG2     5 ILE  HG13    3.25 #SUP  0.98  #QF  0.98
  5 ILE  QG2    30 LEU  QD1     3.19 #SUP  0.66  #QF  0.66
 15 LEU  QD2    23 ALA  QB      3.66 #SUP  0.49  #QF  0.31
 23 ALA  QB     27 LEU  QD1     3.91 #SUP  0.49  #QF  0.31
 18 LEU  QD1    23 ALA  QB      4.08 #SUP  0.85  #QF  0.85
 26 ILE  QG2    29 PHE  QD      3.95 #SUP  0.81  #QF  0.81
 26 ILE  QG2    27 LEU  HA      4.04 #SUP  0.80  #QF  0.80
 26 ILE  QG2    29 PHE  HB3     4.33 #SUP  0.92  #QF  0.92
 26 ILE  QG2    26 ILE  HG13    3.23 #SUP  0.61  #QF  0.61
 26 ILE  QG2    26 ILE  HG12    3.02 #SUP  0.89  #QF  0.89
 26 ILE  QG2    60 VAL  QG2     3.93 #SUP  0.93  #QF  0.93
 49 GLY  HA1    50 PRO  HD3     3.63 #SUP  1.00
 49 GLY  HA1    50 PRO  HD2     3.63 #SUP  0.99  #QF  0.99
 49 GLY  HA2    50 PRO  HD3     3.63 #SUP  0.99  #QF  0.99
 49 GLY  HA2    50 PRO  HD2     3.63 #SUP  1.00
 66 ILE  QG2    67 CYS  HN      3.53 #SUP  0.98  #QF  0.98
 66 ILE  HN     66 ILE  QG2     4.32 #SUP  0.82  #QF  0.82
 46 PRO  HD2    56 TRP  HH2     4.61 #SUP  0.96  #QF  0.96
 46 PRO  HD3    56 TRP  HH2     4.61 #SUP  0.88  #QF  0.88
 55 PHE  QD     66 ILE  QG2     4.11 #SUP  0.85  #QF  0.85
 66 ILE  HA     66 ILE  QG2     3.31 #SUP  0.98  #QF  0.98
 45 GLU  HA     46 PRO  HD2     3.35 #SUP  1.00
 55 PHE  HB3    66 ILE  QG2     4.08 #SUP  0.86  #QF  0.86
  4 ARG  HN     74 ALA  QB      4.23 #SUP  0.91  #QF  0.91
 74 ALA  HN     74 ALA  QB      3.33 #SUP  0.96  #QF  0.96
  3 TYR  QD     74 ALA  QB      3.87 #SUP  0.93  #QF  0.93
  3 TYR  HA     74 ALA  QB      3.52 #SUP  0.99  #QF  0.99
  7 PHE  HA     78 VAL  HB      3.63 #SUP  0.36  #QF  0.36
 56 TRP  HA     56 TRP  HE3     4.36 #SUP  0.93  #QF  0.93
 59 ARG  HA     60 VAL  HN      3.45 #SUP  0.94  #QF  0.94
 31 ARG  HA     31 ARG  QD      4.61 #SUP  0.98  #QF  0.95
 72 ARG  HA     72 ARG  QD      4.85 #SUP  0.98  #QF  0.95
 32 GLU  HB2    33 ARG  HG2     4.75 #SUP  0.82  #QF  0.61
 39 ASP  HA     40 PRO  HD3     3.64 #SUP  0.97  #QF  0.97
 39 ASP  HA     40 PRO  HD2     3.64 #SUP  0.91  #QF  0.91
 44 GLY  HA1    56 TRP  HE1     4.44 #SUP  0.96  #QF  0.96
 57 LYS  HD2    66 ILE  QD1     5.13 #SUP  0.86  #QF  0.67
 57 LYS  HD3    66 ILE  QD1     5.13 #SUP  0.86  #QF  0.67
 59 ARG  HA     64 ARG  HA      3.85 #SUP  0.79  #QF  0.79
 56 TRP  HN     68 HIST HA      4.75 #SUP  0.74  #QF  0.74
 46 PRO  HA     56 TRP  HA      3.62 #SUP  0.90  #QF  0.90
  7 PHE  HA     78 VAL  QG2     4.43 #SUP  0.37  #QF  0.37
 56 TRP  HD1    58 TYR  QD      4.75 #SUP  0.48  #QF  0.48
  4 ARG  HA      5 ILE  HG13    5.35 #SUP  0.96  #QF  0.96
 56 TRP  HB3    69 ILE  HG12    4.78 #SUP  0.96  #QF  0.96
 57 LYS  HE2    66 ILE  QD1     4.47 #SUP  0.54  #QF  0.54
 54 ARG  HA     54 ARG  HG2     3.80 #SUP  0.98  #QF  0.98
 47 LEU  HA     47 LEU  QD1     4.05 #SUP  0.86  #QF  0.86
  3 TYR  QD     40 PRO  QG      3.60 
  3 TYR  QE     40 PRO  QG      4.04 
  3 TYR  QE     40 PRO  QD      4.34 
  4 ARG  QG      6 GLU  QG      4.45 
  5 ILE  QG2     6 GLU  QB      5.34 
  6 GLU  HN      6 GLU  QB      3.27 
  6 GLU  HN      6 GLU  QG      3.93 
  6 GLU  HN     77 LEU  QQD     5.05 
  6 GLU  QB      7 PHE  HN      3.47 
  6 GLU  QB     75 THR  QG2     3.38 
  6 GLU  QB     77 LEU  HA      3.63 
  6 GLU  QB     77 LEU  QQD     3.00 
  6 GLU  QG      7 PHE  HN      4.23 
  6 GLU  QG     75 THR  QG2     3.24 
  6 GLU  QG     77 LEU  QQD     4.29 
  7 PHE  HN     77 LEU  QQD     4.52 
  7 PHE  HB2    12 GLU  QG      3.85 
  7 PHE  HB3    12 GLU  QG      3.75 
  7 PHE  QD     15 LEU  QQD     3.76 
  7 PHE  QD     81 VAL  QQG     4.61 
  7 PHE  QE     81 VAL  QQG     4.50 
  8 ASP  HN     77 LEU  QQD     3.71 
  8 ASP  HA      9 PRO  QG      4.25 
  8 ASP  HA     77 LEU  QQD     3.32 
  8 ASP  QB      9 PRO  HD2     4.27 
  8 ASP  QB      9 PRO  HD3     4.60 
  8 ASP  QB     10 ARG  HN      3.96 
  8 ASP  QB     11 ALA  HN      3.97 
  8 ASP  QB     11 ALA  QB      3.69 
  8 ASP  QB     12 GLU  HN      5.34 
  8 ASP  QB     77 LEU  HG      4.51 
  8 ASP  QB     77 LEU  QQD     3.32 
  8 ASP  QB     79 LEU  HA      3.51 
  8 ASP  QB     79 LEU  QQD     3.44 
  9 PRO  HA     12 GLU  QG      4.29 
  9 PRO  QB     10 ARG  HN      3.74 
  9 PRO  QG     10 ARG  HN      4.50 
  9 PRO  HD2    10 ARG  QB      4.81 
 10 ARG  HN     10 ARG  QB      2.91 
 10 ARG  HA     10 ARG  QG      3.49 
 10 ARG  QB     10 ARG  QD      3.31 
 10 ARG  QB     11 ALA  HN      3.23 
 10 ARG  QG     11 ALA  HN      4.69 
 11 ALA  HA     81 VAL  QQG     4.08 
 11 ALA  QB     81 VAL  QQG     3.13 
 12 GLU  HN     12 GLU  QG      3.67 
 12 GLU  HA     15 LEU  QQD     4.47 
 12 GLU  QG     13 LYS  HN      5.09 
 13 LYS  HN     13 LYS  QB      2.81 
 13 LYS  HN     13 LYS  QG      3.40 
 13 LYS  HA     13 LYS  QG      3.34 
 13 LYS  HA     16 GLU  QG      3.98 
 13 LYS  QB     14 GLU  HN      3.36 
 14 GLU  HA     14 GLU  QG      3.08 
 14 GLU  HA     17 LYS  QB      4.16 
 14 GLU  HB2    81 VAL  QQG     3.93 
 14 GLU  HB3    81 VAL  QQG     4.45 
 14 GLU  QG     15 LEU  HN      4.64 
 15 LEU  HN     15 LEU  QQD     4.02 
 15 LEU  HN     81 VAL  QQG     4.15 
 15 LEU  HA     15 LEU  QQD     3.28 
 15 LEU  HA     81 VAL  QQG     3.69 
 15 LEU  QB     16 GLU  QG      4.73 
 15 LEU  QQD    16 GLU  HN      4.72 
 15 LEU  QQD    23 ALA  HN      5.05 
 15 LEU  QQD    23 ALA  QB      3.14 
 16 GLU  HN     16 GLU  QG      3.35 
 16 GLU  HA     16 GLU  QG      3.39 
 17 LYS  HN     17 LYS  QB      2.93 
 17 LYS  HN     17 LYS  QG      3.58 
 17 LYS  HA     17 LYS  QG      3.45 
 17 LYS  QB     18 LEU  HN      3.63 
 17 LYS  QG     18 LEU  HN      4.83 
 18 LEU  QD1    81 VAL  QQG     3.21 
 19 ASP  HA     20 ARG  QB      4.82 
 19 ASP  QB     20 ARG  HN      3.99 
 19 ASP  QB     21 GLU  HN      4.14 
 19 ASP  QB     22 VAL  HN      3.53 
 19 ASP  QB     22 VAL  HB      3.36 
 19 ASP  QB     22 VAL  QG1     4.53 
 19 ASP  QB     22 VAL  QG2     3.01 
 20 ARG  HN     20 ARG  QB      3.13 
 20 ARG  HN     20 ARG  QG      3.95 
 21 GLU  HA     24 ARG  QB      3.70 
 22 VAL  HA     25 ARG  QG      4.74 
 22 VAL  HA     25 ARG  QD      4.16 
 23 ALA  HN     24 ARG  QB      5.33 
 23 ALA  QB     24 ARG  QB      4.53 
 24 ARG  HN     24 ARG  QB      2.78 
 24 ARG  HN     24 ARG  QG      3.97 
 24 ARG  HA     24 ARG  QG      3.40 
 24 ARG  QB     24 ARG  QD      3.15 
 24 ARG  QB     25 ARG  HN      3.24 
 24 ARG  QG     25 ARG  HN      4.89 
 25 ARG  HN     25 ARG  QG      4.42 
 25 ARG  HN     25 ARG  QD      5.34 
 25 ARG  HA     25 ARG  QG      3.08 
 25 ARG  HB2    25 ARG  QD      3.64 
 25 ARG  QG     29 PHE  HN      5.15 
 25 ARG  QG     29 PHE  HB2     4.76 
 25 ARG  QG     29 PHE  HB3     4.87 
 25 ARG  QG     60 VAL  QG1     3.32 
 25 ARG  QD     60 VAL  QG1     3.54 
 26 ILE  QD1    81 VAL  QQG     3.03 
 28 ARG  HN     28 ARG  QB      3.11 
 28 ARG  HN     28 ARG  QG      4.14 
 28 ARG  HA     28 ARG  QG      3.32 
 28 ARG  QB     29 PHE  HN      3.13 
 28 ARG  QB     29 PHE  HA      4.62 
 28 ARG  QB     29 PHE  HB2     5.31 
 28 ARG  QG     29 PHE  HN      5.34 
 28 ARG  QG     32 GLU  QG      3.74 
 29 PHE  HA     33 ARG  QG      3.28 
 29 PHE  QD     33 ARG  QG      3.75 
 29 PHE  QE     43 LEU  QQD     3.74 
 29 PHE  HZ     43 LEU  QQD     3.72 
 31 ARG  HN     31 ARG  QB      2.96 
 31 ARG  HN     31 ARG  QG      3.57 
 31 ARG  HA     31 ARG  QG      3.33 
 31 ARG  QB     32 GLU  QG      4.08 
 32 GLU  HN     32 GLU  QG      3.29 
 32 GLU  HN     33 ARG  QG      4.18 
 32 GLU  HB2    33 ARG  QG      4.07 
 32 GLU  HB3    33 ARG  QG      5.32 
 32 GLU  QG     33 ARG  HN      4.68 
 33 ARG  HA     43 LEU  QQD     4.84 
 33 ARG  QB     43 LEU  QQD     3.84 
 33 ARG  QG     34 VAL  HN      4.02 
 33 ARG  QD     43 LEU  QQD     3.81 
 34 VAL  HA     37 LEU  QB      4.80 
 34 VAL  HA     43 LEU  QQD     4.58 
 34 VAL  QG2    43 LEU  QQD     3.61 
 37 LEU  HN     37 LEU  QB      3.44 
 37 LEU  QB     37 LEU  QD1     2.91 
 37 LEU  QB     37 LEU  QD2     3.34 
 37 LEU  QB     38 GLU  HN      4.11 
 37 LEU  QB     39 ASP  HN      3.56 
 37 LEU  QB     40 PRO  HA      3.98 
 37 LEU  QD1    42 SER  QB      4.33 
 37 LEU  QD2    42 SER  QB      4.24 
 38 GLU  HN     38 GLU  QG      3.85 
 38 GLU  QB     39 ASP  QB      4.32 
 39 ASP  HN     39 ASP  QB      3.21 
 39 ASP  HA     40 PRO  QD      3.17 
 39 ASP  QB     40 PRO  QD      4.42 
 39 ASP  QB     41 ARG  HN      4.19 
 39 ASP  QB     41 ARG  QB      4.63 
 39 ASP  QB     42 SER  HN      4.48 
 39 ASP  QB     42 SER  QB      3.89 
 40 PRO  QB     58 TYR  QE      4.46 
 40 PRO  QB     58 TYR  HH      3.46 
 40 PRO  QB     69 ILE  QG2     3.35 
 40 PRO  QB     69 ILE  QD1     3.63 
 40 PRO  QG     41 ARG  HN      4.02 
 40 PRO  QG     69 ILE  QD1     3.85 
 40 PRO  QD     41 ARG  HN      4.05 
 40 PRO  QD     76 VAL  QG2     5.20 
 41 ARG  HN     41 ARG  QB      3.22 
 41 ARG  HN     41 ARG  QG      3.41 
 41 ARG  HA     41 ARG  QG      3.62 
 41 ARG  QB     41 ARG  QD      3.31 
 41 ARG  QB     56 TRP  HZ2     4.28 
 41 ARG  QB     56 TRP  HH2     4.30 
 41 ARG  QG     69 ILE  QD1     3.01 
 41 ARG  QD     56 TRP  QB      5.18 
 41 ARG  QD     56 TRP  HH2     4.77 
 41 ARG  QD     69 ILE  QD1     4.09 
 42 SER  QB     43 LEU  HN      4.23 
 43 LEU  HN     43 LEU  QB      3.56 
 43 LEU  HA     43 LEU  QQD     3.03 
 43 LEU  QB     43 LEU  QQD     2.66 
 43 LEU  QB     44 GLY  HN      3.78 
 43 LEU  QB     44 GLY  QA      5.18 
 43 LEU  QB     58 TYR  QE      3.53 
 43 LEU  QQD    44 GLY  HN      4.77 
 43 LEU  QQD    58 TYR  QD      4.62 
 44 GLY  QA     45 GLU  QB      5.18 
 44 GLY  QA     56 TRP  HE1     3.83 
 44 GLY  QA     58 TYR  QD      3.73 
 45 GLU  HN     45 GLU  QG      3.70 
 45 GLU  HN     57 LYS  QB      4.48 
 45 GLU  QB     46 PRO  QD      3.10 
 45 GLU  QG     57 LYS  QB      3.83 
 45 GLU  QG     57 LYS  QE      4.02 
 46 PRO  HA     56 TRP  QB      4.88 
 46 PRO  QB     47 LEU  HN      3.75 
 46 PRO  QB     56 TRP  HE3     4.69 
 46 PRO  QB     56 TRP  HZ3     3.77 
 46 PRO  QG     56 TRP  HZ3     4.49 
 46 PRO  QG     56 TRP  HH2     4.55 
 46 PRO  QD     56 TRP  HZ3     4.63 
 46 PRO  QD     56 TRP  HH2     3.88 
 47 LEU  HN     47 LEU  QB      3.25 
 47 LEU  HN     47 LEU  QQD     4.63 
 47 LEU  HA     47 LEU  QQD     3.26 
 47 LEU  QB     55 PHE  QB      3.61 
 47 LEU  QQD    55 PHE  HN      5.00 
 47 LEU  QQD    55 PHE  QB      3.25 
 47 LEU  QQD    55 PHE  QD      4.22 
 47 LEU  QQD    57 LYS  QE      3.75 
 47 LEU  QD1    57 LYS  HE3     6.09 
 47 LEU  QD2    57 LYS  HE3     6.09 
 47 LEU  QQD    88 TYR  QD      5.03 
 47 LEU  QQD    88 TYR  QE      4.87 
 48 ARG  HN     48 ARG  QG      5.24 
 48 ARG  HA     48 ARG  QG      3.69 
 48 ARG  QB     49 GLY  HN      4.36 
 49 GLY  QA     50 PRO  QG      4.02 
 49 GLY  QA     50 PRO  QD      2.65 
 51 GLU  QB     52 LEU  HN      4.17 
 52 LEU  HN     52 LEU  QQD     4.25 
 52 LEU  HA     52 LEU  QQD     3.51 
 52 LEU  HA     53 GLY  QA      4.50 
 52 LEU  QB     52 LEU  QQD     2.76 
 52 LEU  QQD    55 PHE  QD      3.69 
 53 GLY  QA     54 ARG  HA      4.81 
 54 ARG  HN     54 ARG  QG      4.57 
 54 ARG  HA     54 ARG  QG      3.31 
 54 ARG  QB     54 ARG  QD      3.50 
 54 ARG  QB     55 PHE  HN      3.99 
 54 ARG  QG     55 PHE  HN      4.60 
 55 PHE  HN     55 PHE  QB      3.31 
 55 PHE  QB     56 TRP  HN      3.68 
 55 PHE  QB     66 ILE  QG2     3.36 
 55 PHE  QD     79 LEU  QQD     3.79 
 56 TRP  QB     67 CYS  HB2     5.34 
 56 TRP  QB     69 ILE  QG2     5.06 
 56 TRP  QB     69 ILE  HG12    4.19 
 56 TRP  QB     69 ILE  HG13    3.86 
 57 LYS  HN     57 LYS  QB      3.66 
 57 LYS  HN     57 LYS  QG      4.81 
 57 LYS  HA     57 LYS  QE      5.04 
 57 LYS  QB     57 LYS  QE      3.44 
 57 LYS  QB     66 ILE  HA      4.37 
 57 LYS  QB     66 ILE  QG2     4.02 
 57 LYS  QB     66 ILE  QD1     4.39 
 57 LYS  QG     58 TYR  HN      4.30 
 57 LYS  QG     65 LEU  HN      5.34 
 57 LYS  QG     66 ILE  QD1     4.15 
 57 LYS  QD     66 ILE  QG2     4.82 
 57 LYS  QD     66 ILE  QD1     4.50 
 57 LYS  QE     66 ILE  QG2     4.14 
 57 LYS  QE     66 ILE  QD1     3.91 
 59 ARG  HN     59 ARG  QG      4.00 
 59 ARG  HA     64 ARG  QD      4.24 
 59 ARG  QG     60 VAL  HN      4.62 
 60 VAL  HN     64 ARG  QD      4.35 
 60 VAL  QG1    61 GLY  QA      3.74 
 61 GLY  QA     63 TYR  HN      5.07 
 62 ASP  QB     63 TYR  HN      4.43 
 62 ASP  QB     83 HIST HE1     4.68 
 62 ASP  QB     84 ALA  QB      4.37 
 63 TYR  HB3    81 VAL  QQG     4.11 
 63 TYR  QD     81 VAL  QQG     4.12 
 63 TYR  QD     82 GLY  QA      4.35 
 64 ARG  HN     64 ARG  QB      3.34 
 64 ARG  HN     64 ARG  QG      3.81 
 64 ARG  HA     64 ARG  QD      3.49 
 64 ARG  QB     64 ARG  QD      3.25 
 64 ARG  QB     65 LEU  HN      3.62 
 64 ARG  QB     82 GLY  HN      4.32 
 64 ARG  QB     84 ALA  HA      3.77 
 64 ARG  QB     87 VAL  QQG     3.38 
 64 ARG  QG     65 LEU  HN      4.63 
 64 ARG  QG     84 ALA  HA      3.65 
 64 ARG  QD     65 LEU  HN      4.30 
 65 LEU  HN     66 ILE  QG1     5.34 
 65 LEU  HA     81 VAL  QQG     5.08 
 65 LEU  HA     87 VAL  QQG     5.02 
 66 ILE  HN     66 ILE  QG1     3.58 
 66 ILE  HN     80 ARG  QG      5.34 
 66 ILE  HN     81 VAL  QQG     4.79 
 66 ILE  HN     87 VAL  QQG     4.67 
 66 ILE  HB     80 ARG  QB      3.42 
 66 ILE  QG2    66 ILE  QG1     3.39 
 67 CYS  HN     79 LEU  QQD     5.44 
 67 CYS  HA     79 LEU  QB      4.41 
 67 CYS  HA     79 LEU  QQD     4.51 
 68 HIST HN     79 LEU  QQD     4.60 
 68 HIST HA     79 LEU  QQD     4.45 
 68 HIST HB2    77 LEU  QQD     4.34 
 68 HIST HB2    79 LEU  QQD     3.57 
 68 HIST HB3    77 LEU  QQD     3.94 
 68 HIST HB3    79 LEU  QQD     3.96 
 68 HIST HE1    70 GLN  QG      4.43 
 68 HIST HE1    70 GLN  QE2     4.52 
 69 ILE  QG2    71 ASP  QB      5.34 
 70 GLN  HN     70 GLN  QG      3.60 
 70 GLN  QE2    77 LEU  QQD     4.08 
 71 ASP  HN     71 ASP  QB      3.59 
 72 ARG  HA     72 ARG  QG      3.52 
 73 GLU  HN     73 GLU  QB      3.24 
 73 GLU  HN     73 GLU  QG      3.32 
 73 GLU  HA     73 GLU  QG      3.25 
 73 GLU  QB     74 ALA  HN      3.88 
 73 GLU  QB     75 THR  HN      4.27 
 73 GLU  QB     75 THR  HB      3.51 
 77 LEU  HN     77 LEU  QQD     4.55 
 77 LEU  HA     77 LEU  QQD     3.35 
 77 LEU  QQD    78 VAL  HN      3.40 
 78 VAL  HB     81 VAL  QQG     5.11 
 78 VAL  QG1    81 VAL  QQG     3.18 
 79 LEU  HN     79 LEU  QB      3.46 
 79 LEU  HA     79 LEU  QQD     2.96 
 79 LEU  QB     79 LEU  QQD     2.87 
 79 LEU  QB     80 ARG  HN      3.16 
 79 LEU  QQD    80 ARG  HN      4.66 
 80 ARG  HA     80 ARG  QG      3.72 
 80 ARG  HA     80 ARG  QD      3.53 
 80 ARG  HA     81 VAL  QQG     4.43 
 80 ARG  QB     80 ARG  QD      3.29 
 80 ARG  QB     81 VAL  HN      3.65 
 80 ARG  QG     81 VAL  HN      4.21 
 80 ARG  QD     81 VAL  HN      4.56 
 81 VAL  HN     81 VAL  QQG     3.45 
 81 VAL  QQG    82 GLY  HN      3.55 
 81 VAL  QQG    82 GLY  QA      4.42 
 82 GLY  HN     87 VAL  QQG     4.56 
 82 GLY  QA     86 ASP  QB      4.60 
 82 GLY  QA     87 VAL  QQG     3.94 
 84 ALA  HA     87 VAL  QQG     4.00 
 86 ASP  QB     87 VAL  QQG     3.95 
 87 VAL  HN     87 VAL  QQG     3.13 
 87 VAL  HA     87 VAL  QQG     2.86 
 87 VAL  QQG    88 TYR  HN      4.22 
 87 VAL  QQG    88 TYR  HA      4.25 
 87 VAL  QQG    88 TYR  QD      4.10 
 87 VAL  QQG    89 ARG  HN      5.17 
 88 TYR  HN     88 TYR  QB      3.60 
 88 TYR  QB     89 ARG  HN      3.93 
 89 ARG  HN     89 ARG  QB      3.50 
 89 ARG  QB     89 ARG  QD      3.36 
      4   ARG  PHI  -142.00     -82.00
      4   ARG  PSI   101.00     161.00
      5   ILE  PHI  -134.00     -74.00
      5   ILE  PSI   101.00     161.00
      6   GLU  PHI  -168.00    -108.00
      6   GLU  PSI   126.00     186.00
      7   PHE  PHI  -137.00     -77.00
      7   PHE  PSI    99.00     159.00
     10   ARG  PHI   -96.00     -36.00
     10   ARG  PSI   -68.00      -8.00
     11   ALA  PHI   -91.00     -31.00
     11   ALA  PSI   -74.00     -14.00
     12   GLU  PHI   -96.00     -36.00
     12   GLU  PSI   -74.00     -14.00
     13   LYS  PHI   -91.00     -31.00
     13   LYS  PSI   -75.00     -15.00
     14   GLU  PHI   -96.00     -36.00
     14   GLU  PSI   -73.00     -13.00
     15   LEU  PHI   -92.00     -32.00
     15   LEU  PSI   -66.00      -6.00
     16   GLU  PHI   -91.00     -31.00
     16   GLU  PSI   -61.00      -1.00
     17   LYS  PHI  -120.00     -60.00
     17   LYS  PSI   -43.00      17.00
     21   GLU  PHI  -100.00     -40.00
     21   GLU  PSI   -67.00      -7.00
     22   VAL  PHI   -95.00     -35.00
     22   VAL  PSI   -75.00     -15.00
     23   ALA  PHI   -90.00     -30.00
     23   ALA  PSI   -72.00     -12.00
     24   ARG  PHI   -93.00     -33.00
     24   ARG  PSI   -71.00     -11.00
     25   ARG  PHI   -94.00     -34.00
     25   ARG  PSI   -72.00     -12.00
     26   ILE  PHI   -98.00     -38.00
     26   ILE  PSI   -72.00     -12.00
     27   LEU  PHI   -92.00     -32.00
     27   LEU  PSI   -66.00      -6.00
     28   ARG  PHI   -95.00     -35.00
     28   ARG  PSI   -69.00      -9.00
     29   PHE  PHI   -95.00     -35.00
     29   PHE  PSI   -74.00     -14.00
     30   LEU  PHI   -90.00     -30.00
     30   LEU  PSI   -76.00     -16.00
     31   ARG  PHI   -95.00     -35.00
     31   ARG  PSI   -67.00      -7.00
     45   GLU  PHI  -141.00     -81.00
     45   GLU  PSI    93.00     153.00
     48   ARG  PHI  -180.00     -20.00  #lol
     51   GLU  PHI  -180.00     -20.00  #lol
     52   LEU  PHI  -180.00     -20.00  #lol
     54   ARG  PHI  -180.00     -20.00  #lol
     55   PHE  PHI  -180.00     -20.00  #lol
     57   LYS  PHI  -147.00     -87.00
     57   LYS  PSI   109.00     169.00
     58   TYR  PHI  -151.00     -91.00
     58   TYR  PSI   108.00     168.00
     59   ARG  PHI  -164.00    -104.00
     59   ARG  PSI   117.00     177.00
     62   ASP  PHI  -180.00     -20.00  #lol
     64   ARG  PHI  -161.00    -101.00
     64   ARG  PSI   118.00     178.00
     65   LEU  PHI  -153.00     -93.00
     65   LEU  PSI    99.00     159.00
     66   ILE  PHI  -142.00     -82.00
     66   ILE  PSI   100.00     160.00
     67   CYS  PHI  -153.00     -93.00
     67   CYS  PSI   110.00     170.00
     68   HIST PHI  -152.00     -92.00
     68   HIST PSI    96.00     156.00
     69   ILE  PHI  -126.00     -66.00
     69   ILE  PSI    87.00     147.00
     70   GLN  PHI  -123.00     -63.00
     70   GLN  PSI    86.00     146.00
     75   THR  PHI  -155.00     -95.00
     75   THR  PSI   121.00     181.00
     76   VAL  PHI  -145.00     -85.00
     76   VAL  PSI    95.00     155.00
     77   LEU  PHI  -133.00     -73.00
     77   LEU  PSI    93.00     153.00
     78   VAL  PHI  -115.00     -55.00
     78   VAL  PSI    99.00     159.00
     79   LEU  PHI  -131.00     -71.00
     79   LEU  PSI   -58.00       2.00
     80   ARG  PHI  -168.00    -108.00
     80   ARG  PSI   112.00     172.00
     81   VAL  PHI  -151.00     -91.00
     81   VAL  PSI   115.00     175.00
     82   GLY  PHI  -160.00    -100.00
     82   GLY  PSI    98.00     158.00
     83   HIST PHI  -107.00     -47.00
     83   HIST PSI   104.00     164.00
     88   TYR  PHI  -180.00     -20.00  #lol

##### chi angle #####

   3 TYR   CHI1    -80.0   -40.0
   5 ILE   CHI1    -80.0   -40.0
   5 ILE   CHI21   -80.0   -40.0
   7 PHE   CHI1    -80.0   -40.0
  18 LEU   CHI1    -80.0   -40.0
  18 LEU   CHI2    160.0   200.0
  22 VAL   CHI1    160.0   200.0
  26 ILE   CHI1    -80.0   -40.0
  26 ILE   CHI21   160.0   200.0
  27 LEU   CHI1    -80.0   -40.0
  27 LEU   CHI2    160.0   200.0
  29 PHE   CHI1    160.0   200.0
  30 LEU   CHI1    -80.0   -40.0
  34 VAL   CHI1    160.0   200.0
  37 LEU   CHI1    -80.0   -40.0
  43 LEU   CHI1    -80.0   -40.0
  55 PHE   CHI1    -80.0   -40.0
  58 TYR   CHI1    -80.0   -40.0
  60 VAL   CHI1    160.0   200.0
  63 TYR   CHI1    -80.0   -40.0
  65 LEU   CHI1    -80.0   -40.0
  65 LEU   CHI2    160.0   200.0
  66 ILE   CHI1    -80.0   -40.0
  67 CYS   CHI1    -80.0   -40.0
  68 HIST  CHI1    160.0   200.0
  69 ILE   CHI1    -80.0   -40.0
  76 VAL   CHI1    160.0   200.0
  77 LEU   CHI1    160.0   200.0
  78 VAL   CHI1    160.0   200.0
      4   ARG  PHI  -142.00     -82.00
      4   ARG  PSI   101.00     161.00
      5   ILE  PHI  -134.00     -74.00
      5   ILE  PSI   101.00     161.00
      6   GLU  PHI  -168.00    -108.00
      6   GLU  PSI   126.00     186.00
      7   PHE  PHI  -137.00     -77.00
      7   PHE  PSI    99.00     159.00
     10   ARG  PHI   -96.00     -36.00
     10   ARG  PSI   -68.00      -8.00
     11   ALA  PHI   -91.00     -31.00
     11   ALA  PSI   -74.00     -14.00
     12   GLU  PHI   -96.00     -36.00
     12   GLU  PSI   -74.00     -14.00
     13   LYS  PHI   -91.00     -31.00
     13   LYS  PSI   -75.00     -15.00
     14   GLU  PHI   -96.00     -36.00
     14   GLU  PSI   -73.00     -13.00
     15   LEU  PHI   -92.00     -32.00
     15   LEU  PSI   -66.00      -6.00
     16   GLU  PHI   -91.00     -31.00
     16   GLU  PSI   -61.00      -1.00
     17   LYS  PHI  -120.00     -60.00
     17   LYS  PSI   -43.00      17.00
     21   GLU  PHI  -100.00     -40.00
     21   GLU  PSI   -67.00      -7.00
     22   VAL  PHI   -95.00     -35.00
     22   VAL  PSI   -75.00     -15.00
     23   ALA  PHI   -90.00     -30.00
     23   ALA  PSI   -72.00     -12.00
     24   ARG  PHI   -93.00     -33.00
     24   ARG  PSI   -71.00     -11.00
     25   ARG  PHI   -94.00     -34.00
     25   ARG  PSI   -72.00     -12.00
     26   ILE  PHI   -98.00     -38.00
     26   ILE  PSI   -72.00     -12.00
     27   LEU  PHI   -92.00     -32.00
     27   LEU  PSI   -66.00      -6.00
     28   ARG  PHI   -95.00     -35.00
     28   ARG  PSI   -69.00      -9.00
     29   PHE  PHI   -95.00     -35.00
     29   PHE  PSI   -74.00     -14.00
     30   LEU  PHI   -90.00     -30.00
     30   LEU  PSI   -76.00     -16.00
     31   ARG  PHI   -95.00     -35.00
     31   ARG  PSI   -67.00      -7.00
     45   GLU  PHI  -141.00     -81.00
     45   GLU  PSI    93.00     153.00
     48   ARG  PHI  -180.00     -20.00  #lol
     51   GLU  PHI  -180.00     -20.00  #lol
     52   LEU  PHI  -180.00     -20.00  #lol
     54   ARG  PHI  -180.00     -20.00  #lol
     55   PHE  PHI  -180.00     -20.00  #lol
     57   LYS  PHI  -147.00     -87.00
     57   LYS  PSI   109.00     169.00
     58   TYR  PHI  -151.00     -91.00
     58   TYR  PSI   108.00     168.00
     59   ARG  PHI  -164.00    -104.00
     59   ARG  PSI   117.00     177.00
     62   ASP  PHI  -180.00     -20.00  #lol
     64   ARG  PHI  -161.00    -101.00
     64   ARG  PSI   118.00     178.00
     65   LEU  PHI  -153.00     -93.00
     65   LEU  PSI    99.00     159.00
     66   ILE  PHI  -142.00     -82.00
     66   ILE  PSI   100.00     160.00
     67   CYS  PHI  -153.00     -93.00
     67   CYS  PSI   110.00     170.00
     68   HIST PHI  -152.00     -92.00
     68   HIST PSI    96.00     156.00
     69   ILE  PHI  -126.00     -66.00
     69   ILE  PSI    87.00     147.00
     70   GLN  PHI  -123.00     -63.00
     70   GLN  PSI    86.00     146.00
     75   THR  PHI  -155.00     -95.00
     75   THR  PSI   121.00     181.00
     76   VAL  PHI  -145.00     -85.00
     76   VAL  PSI    95.00     155.00
     77   LEU  PHI  -133.00     -73.00
     77   LEU  PSI    93.00     153.00
     78   VAL  PHI  -115.00     -55.00
     78   VAL  PSI    99.00     159.00
     79   LEU  PHI  -131.00     -71.00
     79   LEU  PSI   -58.00       2.00
     80   ARG  PHI  -168.00    -108.00
     80   ARG  PSI   112.00     172.00
     81   VAL  PHI  -151.00     -91.00
     81   VAL  PSI   115.00     175.00
     82   GLY  PHI  -160.00    -100.00
     82   GLY  PSI    98.00     158.00
     83   HIST PHI  -107.00     -47.00
     83   HIST PSI   104.00     164.00
     88   TYR  PHI  -180.00     -20.00  #lol

##### chi angle #####

   3 TYR   CHI1    -80.0   -40.0
   5 ILE   CHI1    -80.0   -40.0
   5 ILE   CHI21   -80.0   -40.0
   7 PHE   CHI1    -80.0   -40.0
  18 LEU   CHI1    -80.0   -40.0
  18 LEU   CHI2    160.0   200.0
  22 VAL   CHI1    160.0   200.0
  26 ILE   CHI1    -80.0   -40.0
  26 ILE   CHI21   160.0   200.0
  27 LEU   CHI1    -80.0   -40.0
  27 LEU   CHI2    160.0   200.0
  29 PHE   CHI1    160.0   200.0
  30 LEU   CHI1    -80.0   -40.0
  34 VAL   CHI1    160.0   200.0
  37 LEU   CHI1    -80.0   -40.0
  43 LEU   CHI1    -80.0   -40.0
  55 PHE   CHI1    -80.0   -40.0
  58 TYR   CHI1    -80.0   -40.0
  60 VAL   CHI1    160.0   200.0
  63 TYR   CHI1    -80.0   -40.0
  65 LEU   CHI1    -80.0   -40.0
  65 LEU   CHI2    160.0   200.0
  66 ILE   CHI1    -80.0   -40.0
  67 CYS   CHI1    -80.0   -40.0
  68 HIST  CHI1    160.0   200.0
  69 ILE   CHI1    -80.0   -40.0
  76 VAL   CHI1    160.0   200.0
  77 LEU   CHI1    160.0   200.0
  78 VAL   CHI1    160.0   200.0



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HN       MET   1 -18.396   1.458   6.717
    2    HA   MET   1           HA       MET   1 -18.662   1.908   3.903
    3    HB2  MET   1           2HB      MET   1 -18.125   4.202   5.751
    4    HB3  MET   1           3HB      MET   1 -17.381   4.179   4.158
    5    HG2  MET   1           2HG      MET   1 -20.310   3.716   4.375
    6    HG3  MET   1           3HG      MET   1 -19.687   5.352   4.573
    7    HE1  MET   1           3HE      MET   1 -21.123   3.996   0.812
    8    HE2  MET   1           1HE      MET   1 -21.416   3.306   2.409
    9    HE3  MET   1           2HE      MET   1 -21.717   5.020   2.120
   10    H    GLY   2           HN       GLY   2 -16.775   1.501   2.824
   11    HA2  GLY   2           1HA      GLY   2 -14.218   1.603   4.138
   12    HA3  GLY   2           2HA      GLY   2 -14.804  -0.038   3.910
   13    H    TYR   3           HN       TYR   3 -12.736   2.053   2.656
   14    HA   TYR   3           HA       TYR   3 -13.320   2.147  -0.094
   15    HB2  TYR   3           2HB      TYR   3 -10.777   2.387   1.491
   16    HB3  TYR   3           3HB      TYR   3 -10.750   2.415  -0.269
   17    HD1  TYR   3           2HD      TYR   3 -13.036   3.945   2.266
   18    HD2  TYR   3           1HD      TYR   3 -10.393   4.570  -1.009
   19    HE1  TYR   3           2HE      TYR   3 -13.569   6.346   2.301
   20    HE2  TYR   3           1HE      TYR   3 -10.917   6.973  -0.982
   21    HH   TYR   3           HH       TYR   3 -13.496   8.276   0.456
   22    H    ARG   4           HN       ARG   4 -12.054   1.038  -1.808
   23    HA   ARG   4           HA       ARG   4 -12.146  -1.818  -1.368
   24    HB2  ARG   4           2HB      ARG   4 -13.035  -0.739  -3.438
   25    HB3  ARG   4           3HB      ARG   4 -11.387  -0.308  -3.872
   26    HG2  ARG   4           2HG      ARG   4 -10.826  -2.441  -4.436
   27    HG3  ARG   4           3HG      ARG   4 -11.966  -3.159  -3.296
   28    HD2  ARG   4           2HD      ARG   4 -13.049  -3.623  -5.247
   29    HD3  ARG   4           3HD      ARG   4 -13.731  -2.032  -4.910
   30    HE   ARG   4           HE       ARG   4 -11.550  -1.470  -6.411
   31   HH11  ARG   4          2HH1      ARG   4 -14.265  -3.609  -6.829
   32   HH12  ARG   4          1HH1      ARG   4 -14.257  -3.492  -8.557
   33   HH21  ARG   4          2HH2      ARG   4 -11.530  -1.308  -8.686
   34   HH22  ARG   4          1HH2      ARG   4 -12.701  -2.184  -9.613
   35    H    ILE   5           HN       ILE   5 -10.420  -3.264  -1.746
   36    HA   ILE   5           HA       ILE   5  -7.757  -2.042  -1.426
   37    HB   ILE   5           HB       ILE   5  -8.486  -4.830  -0.555
   38   HG12  ILE   5          2HG1      ILE   5  -9.925  -3.272   0.662
   39   HG13  ILE   5          3HG1      ILE   5  -8.697  -3.937   1.733
   40   HG21  ILE   5          1HG2      ILE   5  -6.335  -5.001  -0.040
   41   HG22  ILE   5          2HG2      ILE   5  -6.062  -3.414  -0.759
   42   HG23  ILE   5          3HG2      ILE   5  -6.427  -3.552   0.961
   43   HD11  ILE   5          3HD1      ILE   5  -7.403  -1.889   1.538
   44   HD12  ILE   5          1HD1      ILE   5  -8.608  -1.224   0.436
   45   HD13  ILE   5          2HD1      ILE   5  -9.037  -1.558   2.114
   46    H    GLU   6           HN       GLU   6  -6.877  -2.035  -3.414
   47    HA   GLU   6           HA       GLU   6  -6.917  -4.561  -4.932
   48    HB2  GLU   6           2HB      GLU   6  -7.040  -1.705  -5.822
   49    HB3  GLU   6           3HB      GLU   6  -6.331  -2.911  -6.886
   50    HG2  GLU   6           2HG      GLU   6  -9.141  -2.792  -5.838
   51    HG3  GLU   6           3HG      GLU   6  -8.595  -2.687  -7.511
   52    H    PHE   7           HN       PHE   7  -4.996  -5.022  -6.209
   53    HA   PHE   7           HA       PHE   7  -2.555  -3.697  -5.267
   54    HB2  PHE   7           2HB      PHE   7  -3.221  -6.617  -5.065
   55    HB3  PHE   7           3HB      PHE   7  -1.547  -6.100  -5.235
   56    HD1  PHE   7           1HD      PHE   7  -4.575  -5.514  -3.156
   57    HD2  PHE   7           2HD      PHE   7  -0.324  -5.545  -3.356
   58    HE1  PHE   7           1HE      PHE   7  -4.462  -5.107  -0.731
   59    HE2  PHE   7           2HE      PHE   7  -0.203  -5.139  -0.932
   60    HZ   PHE   7           HZ       PHE   7  -2.274  -4.921   0.383
   61    H    ASP   8           HN       ASP   8  -1.292  -3.143  -6.908
   62    HA   ASP   8           HA       ASP   8  -1.901  -3.694  -9.582
   63    HB2  ASP   8           2HB      ASP   8   0.381  -2.451  -8.140
   64    HB3  ASP   8           3HB      ASP   8   0.671  -2.970  -9.798
   65    HA   PRO   9           HA       PRO   9  -0.036  -7.543 -10.548
   66    HB2  PRO   9           2HB      PRO   9   1.093  -7.074 -12.971
   67    HB3  PRO   9           3HB      PRO   9  -0.655  -7.196 -12.733
   68    HG2  PRO   9           2HG      PRO   9   1.060  -4.753 -12.967
   69    HG3  PRO   9           3HG      PRO   9  -0.523  -5.083 -13.696
   70    HD2  PRO   9           2HD      PRO   9  -0.230  -3.556 -11.479
   71    HD3  PRO   9           3HD      PRO   9  -1.662  -4.567 -11.760
   72    H    ARG  10           HN       ARG  10   1.899  -4.772 -10.122
   73    HA   ARG  10           HA       ARG  10   4.405  -6.257 -10.372
   74    HB2  ARG  10           2HB      ARG  10   3.857  -3.330  -9.854
   75    HB3  ARG  10           3HB      ARG  10   5.464  -4.037  -9.955
   76    HG2  ARG  10           2HG      ARG  10   3.453  -4.162 -12.187
   77    HG3  ARG  10           3HG      ARG  10   4.667  -2.891 -12.029
   78    HD2  ARG  10           2HD      ARG  10   6.438  -4.385 -12.363
   79    HD3  ARG  10           3HD      ARG  10   5.429  -5.792 -12.029
   80    HE   ARG  10           HE       ARG  10   4.389  -4.522 -14.279
   81   HH11  ARG  10          2HH1      ARG  10   7.288  -6.196 -13.322
   82   HH12  ARG  10          1HH1      ARG  10   7.634  -6.779 -14.917
   83   HH21  ARG  10          2HH2      ARG  10   4.834  -5.284 -16.383
   84   HH22  ARG  10          1HH2      ARG  10   6.238  -6.259 -16.657
   85    H    ALA  11           HN       ALA  11   2.565  -4.401  -7.971
   86    HA   ALA  11           HA       ALA  11   4.349  -4.797  -5.823
   87    HB1  ALA  11           1HB      ALA  11   1.443  -4.074  -5.977
   88    HB2  ALA  11           2HB      ALA  11   2.256  -4.301  -4.428
   89    HB3  ALA  11           3HB      ALA  11   2.818  -3.057  -5.545
   90    H    GLU  12           HN       GLU  12   1.422  -6.553  -6.813
   91    HA   GLU  12           HA       GLU  12   1.028  -8.321  -4.821
   92    HB2  GLU  12           2HB      GLU  12   0.863  -8.585  -7.783
   93    HB3  GLU  12           3HB      GLU  12   0.717 -10.051  -6.824
   94    HG2  GLU  12           2HG      GLU  12  -0.976  -7.595  -6.435
   95    HG3  GLU  12           3HG      GLU  12  -1.448  -8.993  -7.400
   96    H    LYS  13           HN       LYS  13   3.567  -8.579  -7.280
   97    HA   LYS  13           HA       LYS  13   4.628 -11.013  -6.179
   98    HB2  LYS  13           2HB      LYS  13   5.437  -9.137  -8.370
   99    HB3  LYS  13           3HB      LYS  13   6.593 -10.321  -7.774
  100    HG2  LYS  13           2HG      LYS  13   3.844 -11.076  -8.721
  101    HG3  LYS  13           3HG      LYS  13   5.239 -10.983  -9.799
  102    HD2  LYS  13           2HD      LYS  13   6.343 -12.739  -8.701
  103    HD3  LYS  13           3HD      LYS  13   5.300 -12.623  -7.282
  104    HE2  LYS  13           2HE      LYS  13   3.451 -13.538  -8.475
  105    HE3  LYS  13           3HE      LYS  13   4.306 -13.420 -10.012
  106    HZ1  LYS  13           3HZ      LYS  13   5.377 -15.331  -9.644
  107    HZ2  LYS  13           1HZ      LYS  13   4.186 -15.631  -8.481
  108    HZ3  LYS  13           2HZ      LYS  13   5.677 -14.984  -8.016
  109    H    GLU  14           HN       GLU  14   5.603  -7.600  -6.198
  110    HA   GLU  14           HA       GLU  14   8.016  -7.863  -4.828
  111    HB2  GLU  14           2HB      GLU  14   6.036  -5.581  -4.823
  112    HB3  GLU  14           3HB      GLU  14   7.663  -5.479  -4.167
  113    HG2  GLU  14           2HG      GLU  14   7.342  -6.389  -6.973
  114    HG3  GLU  14           3HG      GLU  14   7.093  -4.682  -6.612
  115    H    LEU  15           HN       LEU  15   4.753  -8.040  -3.693
  116    HA   LEU  15           HA       LEU  15   5.526  -7.739  -0.904
  117    HB2  LEU  15           2HB      LEU  15   3.470  -6.736  -1.340
  118    HB3  LEU  15           3HB      LEU  15   2.926  -8.074  -2.351
  119    HG   LEU  15           HG       LEU  15   3.355  -8.523   0.571
  120   HD11  LEU  15          1HD1      LEU  15   0.842  -7.347  -0.606
  121   HD12  LEU  15          2HD1      LEU  15   2.011  -6.455   0.367
  122   HD13  LEU  15          3HD1      LEU  15   1.117  -7.801   1.076
  123   HD21  LEU  15          3HD2      LEU  15   1.153  -9.878  -0.104
  124   HD22  LEU  15          1HD2      LEU  15   2.779 -10.523  -0.324
  125   HD23  LEU  15          2HD2      LEU  15   1.927  -9.795  -1.687
  126    H    GLU  16           HN       GLU  16   4.058 -10.233  -2.979
  127    HA   GLU  16           HA       GLU  16   3.895 -12.281  -1.119
  128    HB2  GLU  16           2HB      GLU  16   4.207 -12.217  -4.094
  129    HB3  GLU  16           3HB      GLU  16   4.313 -13.757  -3.253
  130    HG2  GLU  16           2HG      GLU  16   1.985 -11.859  -3.308
  131    HG3  GLU  16           3HG      GLU  16   2.075 -13.476  -4.003
  132    H    LYS  17           HN       LYS  17   6.657 -11.077  -2.884
  133    HA   LYS  17           HA       LYS  17   8.404 -13.248  -2.452
  134    HB2  LYS  17           2HB      LYS  17  10.108 -11.862  -3.251
  135    HB3  LYS  17           3HB      LYS  17   8.666 -11.228  -4.033
  136    HG2  LYS  17           2HG      LYS  17   9.593  -9.279  -3.340
  137    HG3  LYS  17           3HG      LYS  17   8.642  -9.660  -1.902
  138    HD2  LYS  17           2HD      LYS  17  10.745  -9.101  -1.054
  139    HD3  LYS  17           3HD      LYS  17  10.753 -10.866  -1.072
  140    HE2  LYS  17           2HE      LYS  17  11.760  -9.423  -3.470
  141    HE3  LYS  17           3HE      LYS  17  12.774  -9.453  -2.028
  142    HZ1  LYS  17           3HZ      LYS  17  13.466 -11.348  -3.047
  143    HZ2  LYS  17           1HZ      LYS  17  11.975 -11.652  -3.785
  144    HZ3  LYS  17           2HZ      LYS  17  12.191 -11.996  -2.144
  145    H    LEU  18           HN       LEU  18   7.346 -10.646  -0.418
  146    HA   LEU  18           HA       LEU  18   9.468 -10.735   1.466
  147    HB2  LEU  18           2HB      LEU  18   6.615  -9.820   1.794
  148    HB3  LEU  18           3HB      LEU  18   7.919  -9.517   2.940
  149    HG   LEU  18           HG       LEU  18   7.863  -8.484   0.106
  150   HD11  LEU  18          1HD1      LEU  18   6.188  -7.231   1.020
  151   HD12  LEU  18          2HD1      LEU  18   7.585  -6.276   1.517
  152   HD13  LEU  18          3HD1      LEU  18   6.818  -7.378   2.661
  153   HD21  LEU  18          3HD2      LEU  18   9.991  -7.969   0.458
  154   HD22  LEU  18          1HD2      LEU  18   9.918  -8.671   2.075
  155   HD23  LEU  18          2HD2      LEU  18   9.510  -6.972   1.833
  156    H    ASP  19           HN       ASP  19   8.967 -11.281   3.837
  157    HA   ASP  19           HA       ASP  19   8.686 -14.016   4.128
  158    HB2  ASP  19           2HB      ASP  19   9.732 -12.723   5.862
  159    HB3  ASP  19           3HB      ASP  19   8.256 -11.802   6.139
  160    H    ARG  20           HN       ARG  20   7.009 -15.184   5.410
  161    HA   ARG  20           HA       ARG  20   4.462 -14.850   4.180
  162    HB2  ARG  20           2HB      ARG  20   5.224 -17.071   4.709
  163    HB3  ARG  20           3HB      ARG  20   5.407 -16.656   6.408
  164    HG2  ARG  20           2HG      ARG  20   3.426 -17.757   6.505
  165    HG3  ARG  20           3HG      ARG  20   2.828 -16.127   6.188
  166    HD2  ARG  20           2HD      ARG  20   2.415 -16.593   3.933
  167    HD3  ARG  20           3HD      ARG  20   3.442 -18.026   3.950
  168    HE   ARG  20           HE       ARG  20   1.220 -18.280   5.719
  169   HH11  ARG  20          2HH1      ARG  20   2.185 -18.492   2.381
  170   HH12  ARG  20          1HH1      ARG  20   0.927 -19.603   1.953
  171   HH21  ARG  20          2HH2      ARG  20  -0.441 -19.742   5.167
  172   HH22  ARG  20          1HH2      ARG  20  -0.567 -20.313   3.538
  173    H    GLU  21           HN       GLU  21   5.560 -14.561   7.559
  174    HA   GLU  21           HA       GLU  21   3.104 -13.682   8.602
  175    HB2  GLU  21           2HB      GLU  21   5.930 -13.253   9.577
  176    HB3  GLU  21           3HB      GLU  21   4.502 -12.806  10.499
  177    HG2  GLU  21           2HG      GLU  21   3.795 -15.108  10.603
  178    HG3  GLU  21           3HG      GLU  21   5.136 -15.596   9.568
  179    H    VAL  22           HN       VAL  22   5.839 -11.931   7.230
  180    HA   VAL  22           HA       VAL  22   4.986  -9.330   7.911
  181    HB   VAL  22           HB       VAL  22   6.693 -10.210   5.578
  182   HG11  VAL  22          1HG1      VAL  22   6.897  -7.513   6.812
  183   HG12  VAL  22          2HG1      VAL  22   7.227  -8.029   5.157
  184   HG13  VAL  22          3HG1      VAL  22   5.562  -7.825   5.703
  185   HG21  VAL  22          3HG2      VAL  22   7.686  -9.046   8.156
  186   HG22  VAL  22          1HG2      VAL  22   7.402 -10.778   7.986
  187   HG23  VAL  22          2HG2      VAL  22   8.570  -9.969   6.941
  188    H    ALA  23           HN       ALA  23   4.445 -11.329   5.037
  189    HA   ALA  23           HA       ALA  23   3.091  -9.399   3.506
  190    HB1  ALA  23           1HB      ALA  23   2.141 -12.109   3.063
  191    HB2  ALA  23           2HB      ALA  23   3.007 -11.020   1.978
  192    HB3  ALA  23           3HB      ALA  23   3.900 -12.010   3.132
  193    H    ARG  24           HN       ARG  24   1.829 -11.967   5.628
  194    HA   ARG  24           HA       ARG  24  -0.890 -11.386   5.278
  195    HB2  ARG  24           2HB      ARG  24  -0.297 -13.468   6.267
  196    HB3  ARG  24           3HB      ARG  24   0.620 -12.679   7.543
  197    HG2  ARG  24           2HG      ARG  24  -1.634 -11.645   8.229
  198    HG3  ARG  24           3HG      ARG  24  -2.344 -12.908   7.222
  199    HD2  ARG  24           2HD      ARG  24  -0.281 -13.669   9.230
  200    HD3  ARG  24           3HD      ARG  24  -1.906 -13.282   9.796
  201    HE   ARG  24           HE       ARG  24  -1.093 -15.665   8.504
  202   HH11  ARG  24          2HH1      ARG  24  -3.737 -13.407   8.682
  203   HH12  ARG  24          1HH1      ARG  24  -4.938 -14.578   8.246
  204   HH21  ARG  24          2HH2      ARG  24  -2.664 -17.216   7.930
  205   HH22  ARG  24          1HH2      ARG  24  -4.326 -16.745   7.820
  206    H    ARG  25           HN       ARG  25   1.521 -10.035   7.446
  207    HA   ARG  25           HA       ARG  25  -0.227  -8.627   9.146
  208    HB2  ARG  25           2HB      ARG  25   2.081  -8.988   9.771
  209    HB3  ARG  25           3HB      ARG  25   2.642  -8.076   8.376
  210    HG2  ARG  25           2HG      ARG  25   1.633  -6.047   9.306
  211    HG3  ARG  25           3HG      ARG  25   1.100  -6.968  10.713
  212    HD2  ARG  25           2HD      ARG  25   3.625  -7.603  10.894
  213    HD3  ARG  25           3HD      ARG  25   3.860  -6.166   9.901
  214    HE   ARG  25           HE       ARG  25   3.359  -4.870  11.720
  215   HH11  ARG  25          2HH1      ARG  25   2.336  -8.142  12.332
  216   HH12  ARG  25          1HH1      ARG  25   1.948  -7.848  13.994
  217   HH21  ARG  25          2HH2      ARG  25   2.851  -4.471  13.908
  218   HH22  ARG  25          1HH2      ARG  25   2.240  -5.759  14.890
  219    H    ILE  26           HN       ILE  26   1.393  -7.708   6.134
  220    HA   ILE  26           HA       ILE  26   0.530  -5.015   6.124
  221    HB   ILE  26           HB       ILE  26   1.440  -6.835   3.902
  222   HG12  ILE  26          2HG1      ILE  26   2.805  -4.397   5.031
  223   HG13  ILE  26          3HG1      ILE  26   3.025  -5.996   5.732
  224   HG21  ILE  26          1HG2      ILE  26   0.269  -5.404   2.589
  225   HG22  ILE  26          2HG2      ILE  26   0.289  -4.113   3.790
  226   HG23  ILE  26          3HG2      ILE  26   1.717  -4.420   2.801
  227   HD11  ILE  26          3HD1      ILE  26   3.988  -6.817   3.705
  228   HD12  ILE  26          1HD1      ILE  26   3.610  -5.314   2.863
  229   HD13  ILE  26          2HD1      ILE  26   4.810  -5.323   4.156
  230    H    LEU  27           HN       LEU  27  -0.630  -7.780   4.185
  231    HA   LEU  27           HA       LEU  27  -2.786  -6.584   2.972
  232    HB2  LEU  27           2HB      LEU  27  -2.364  -9.397   3.930
  233    HB3  LEU  27           3HB      LEU  27  -3.829  -8.921   3.075
  234    HG   LEU  27           HG       LEU  27  -1.056  -8.621   1.933
  235   HD11  LEU  27          1HD1      LEU  27  -2.811 -10.958   2.134
  236   HD12  LEU  27          2HD1      LEU  27  -1.081 -10.857   1.806
  237   HD13  LEU  27          3HD1      LEU  27  -2.241 -10.604   0.502
  238   HD21  LEU  27          3HD2      LEU  27  -2.260  -7.256   0.597
  239   HD22  LEU  27          1HD2      LEU  27  -3.796  -8.010   1.025
  240   HD23  LEU  27          2HD2      LEU  27  -2.737  -8.778  -0.158
  241    H    ARG  28           HN       ARG  28  -2.718  -8.189   6.141
  242    HA   ARG  28           HA       ARG  28  -5.448  -7.776   6.736
  243    HB2  ARG  28           2HB      ARG  28  -3.021  -8.546   8.274
  244    HB3  ARG  28           3HB      ARG  28  -4.408  -7.968   9.188
  245    HG2  ARG  28           2HG      ARG  28  -4.853 -10.063   7.130
  246    HG3  ARG  28           3HG      ARG  28  -4.077 -10.520   8.647
  247    HD2  ARG  28           2HD      ARG  28  -5.952  -9.636   9.904
  248    HD3  ARG  28           3HD      ARG  28  -6.712  -9.072   8.417
  249    HE   ARG  28           HE       ARG  28  -6.329 -11.783   8.095
  250   HH11  ARG  28          2HH1      ARG  28  -8.048  -9.704  10.295
  251   HH12  ARG  28          1HH1      ARG  28  -9.294 -10.862  10.621
  252   HH21  ARG  28          2HH2      ARG  28  -7.965 -13.316   8.515
  253   HH22  ARG  28          1HH2      ARG  28  -9.246 -12.916   9.609
  254    H    PHE  29           HN       PHE  29  -2.524  -5.969   7.635
  255    HA   PHE  29           HA       PHE  29  -3.629  -4.053   9.277
  256    HB2  PHE  29           2HB      PHE  29  -1.292  -4.023   9.113
  257    HB3  PHE  29           3HB      PHE  29  -1.323  -3.973   7.354
  258    HD1  PHE  29           1HD      PHE  29  -1.967  -1.983  10.402
  259    HD2  PHE  29           2HD      PHE  29  -1.307  -1.929   6.198
  260    HE1  PHE  29           1HE      PHE  29  -1.725   0.464  10.475
  261    HE2  PHE  29           2HE      PHE  29  -1.063   0.518   6.264
  262    HZ   PHE  29           HZ       PHE  29  -1.272   1.718   8.404
  263    H    LEU  30           HN       LEU  30  -3.772  -4.306   5.795
  264    HA   LEU  30           HA       LEU  30  -4.952  -1.670   5.500
  265    HB2  LEU  30           2HB      LEU  30  -4.159  -3.853   3.615
  266    HB3  LEU  30           3HB      LEU  30  -5.215  -2.550   3.075
  267    HG   LEU  30           HG       LEU  30  -2.610  -1.870   4.363
  268   HD11  LEU  30          1HD1      LEU  30  -1.487  -3.059   2.844
  269   HD12  LEU  30          2HD1      LEU  30  -2.039  -1.852   1.683
  270   HD13  LEU  30          3HD1      LEU  30  -2.932  -3.360   1.878
  271   HD21  LEU  30          3HD2      LEU  30  -4.613  -0.342   3.455
  272   HD22  LEU  30          1HD2      LEU  30  -3.676  -0.505   1.969
  273   HD23  LEU  30          2HD2      LEU  30  -2.922   0.162   3.418
  274    H    ARG  31           HN       ARG  31  -5.937  -5.031   5.538
  275    HA   ARG  31           HA       ARG  31  -8.656  -4.395   4.749
  276    HB2  ARG  31           2HB      ARG  31  -7.118  -6.892   5.288
  277    HB3  ARG  31           3HB      ARG  31  -8.868  -6.947   5.453
  278    HG2  ARG  31           2HG      ARG  31  -9.208  -6.425   3.192
  279    HG3  ARG  31           3HG      ARG  31  -7.540  -5.891   2.981
  280    HD2  ARG  31           2HD      ARG  31  -7.413  -7.963   2.026
  281    HD3  ARG  31           3HD      ARG  31  -7.016  -8.373   3.694
  282    HE   ARG  31           HE       ARG  31  -8.916  -9.625   3.769
  283   HH11  ARG  31          2HH1      ARG  31  -9.237  -7.284   1.212
  284   HH12  ARG  31          1HH1      ARG  31 -10.757  -7.904   0.659
  285   HH21  ARG  31          2HH2      ARG  31 -10.917 -10.450   3.049
  286   HH22  ARG  31          1HH2      ARG  31 -11.712  -9.704   1.705
  287    H    GLU  32           HN       GLU  32  -6.893  -4.250   7.567
  288    HA   GLU  32           HA       GLU  32  -9.271  -4.716   9.239
  289    HB2  GLU  32           2HB      GLU  32  -6.338  -4.772   9.964
  290    HB3  GLU  32           3HB      GLU  32  -7.646  -4.895  11.132
  291    HG2  GLU  32           2HG      GLU  32  -8.391  -6.869   9.535
  292    HG3  GLU  32           3HG      GLU  32  -6.669  -6.875   9.158
  293    H    ARG  33           HN       ARG  33  -6.322  -2.706   9.341
  294    HA   ARG  33           HA       ARG  33  -7.539  -0.679  10.909
  295    HB2  ARG  33           2HB      ARG  33  -5.068  -0.443   9.186
  296    HB3  ARG  33           3HB      ARG  33  -5.507   0.582  10.546
  297    HG2  ARG  33           2HG      ARG  33  -5.031  -2.366  10.848
  298    HG3  ARG  33           3HG      ARG  33  -3.732  -1.176  10.957
  299    HD2  ARG  33           2HD      ARG  33  -4.372  -1.475  13.172
  300    HD3  ARG  33           3HD      ARG  33  -5.236  -0.015  12.693
  301    HE   ARG  33           HE       ARG  33  -6.888  -2.226  12.222
  302   HH11  ARG  33          2HH1      ARG  33  -5.483  -0.470  14.880
  303   HH12  ARG  33          1HH1      ARG  33  -6.764  -0.856  15.982
  304   HH21  ARG  33          2HH2      ARG  33  -8.580  -2.741  13.664
  305   HH22  ARG  33          1HH2      ARG  33  -8.524  -2.148  15.289
  306    H    VAL  34           HN       VAL  34  -6.174  -0.267   7.647
  307    HA   VAL  34           HA       VAL  34  -7.491   2.068   7.001
  308    HB   VAL  34           HB       VAL  34  -6.810  -0.121   5.034
  309   HG11  VAL  34          1HG1      VAL  34  -8.216   1.759   4.203
  310   HG12  VAL  34          2HG1      VAL  34  -6.913   2.866   4.638
  311   HG13  VAL  34          3HG1      VAL  34  -6.648   1.631   3.406
  312   HG21  VAL  34          3HG2      VAL  34  -4.845   0.261   6.310
  313   HG22  VAL  34          1HG2      VAL  34  -4.651   1.162   4.806
  314   HG23  VAL  34          2HG2      VAL  34  -5.089   2.007   6.291
  315    H    ALA  35           HN       ALA  35  -8.553  -1.271   6.453
  316    HA   ALA  35           HA       ALA  35 -10.826  -0.856   4.963
  317    HB1  ALA  35           1HB      ALA  35 -10.825  -2.839   7.208
  318    HB2  ALA  35           2HB      ALA  35 -11.524  -2.983   5.595
  319    HB3  ALA  35           3HB      ALA  35  -9.774  -3.049   5.807
  320    H    THR  36           HN       THR  36 -10.522  -0.740   8.502
  321    HA   THR  36           HA       THR  36 -13.277   0.020   8.855
  322    HB   THR  36           HB       THR  36 -12.828   0.096  11.197
  323    HG1  THR  36           1HG      THR  36 -10.522  -0.178  11.855
  324   HG21  THR  36          3HG2      THR  36 -11.118  -2.067  11.200
  325   HG22  THR  36          1HG2      THR  36 -11.839  -2.127   9.592
  326   HG23  THR  36          2HG2      THR  36 -12.871  -2.137  11.022
  327    H    LEU  37           HN       LEU  37 -10.177   1.636   8.677
  328    HA   LEU  37           HA       LEU  37 -10.776   4.097   9.790
  329    HB2  LEU  37           2HB      LEU  37  -8.997   3.333   7.493
  330    HB3  LEU  37           3HB      LEU  37  -9.105   4.990   8.084
  331    HG   LEU  37           HG       LEU  37  -8.327   2.694   9.865
  332   HD11  LEU  37          1HD1      LEU  37  -6.022   4.089   9.325
  333   HD12  LEU  37          2HD1      LEU  37  -6.795   3.968   7.745
  334   HD13  LEU  37          3HD1      LEU  37  -6.453   2.508   8.674
  335   HD21  LEU  37          3HD2      LEU  37  -7.952   4.245  11.447
  336   HD22  LEU  37          1HD2      LEU  37  -9.051   5.233  10.483
  337   HD23  LEU  37          2HD2      LEU  37  -7.306   5.415  10.294
  338    H    GLU  38           HN       GLU  38 -12.486   5.328   9.378
  339    HA   GLU  38           HA       GLU  38 -14.236   5.261   7.313
  340    HB2  GLU  38           2HB      GLU  38 -13.286   7.700   8.822
  341    HB3  GLU  38           3HB      GLU  38 -14.699   7.683   7.776
  342    HG2  GLU  38           2HG      GLU  38 -14.434   5.762  10.055
  343    HG3  GLU  38           3HG      GLU  38 -15.037   7.400  10.299
  344    H    ASP  39           HN       ASP  39 -11.036   6.604   7.262
  345    HA   ASP  39           HA       ASP  39 -11.330   7.108   4.392
  346    HB2  ASP  39           2HB      ASP  39 -10.582   9.098   6.478
  347    HB3  ASP  39           3HB      ASP  39  -9.710   9.155   4.948
  348    HA   PRO  40           HA       PRO  40  -7.531   4.895   4.188
  349    HB2  PRO  40           2HB      PRO  40  -6.697   5.709   1.736
  350    HB3  PRO  40           3HB      PRO  40  -8.021   4.561   1.969
  351    HG2  PRO  40           2HG      PRO  40  -8.138   7.501   1.416
  352    HG3  PRO  40           3HG      PRO  40  -9.113   6.193   0.722
  353    HD2  PRO  40           2HD      PRO  40 -10.023   7.793   2.708
  354    HD3  PRO  40           3HD      PRO  40 -10.509   6.092   2.554
  355    H    ARG  41           HN       ARG  41  -7.654   8.361   3.797
  356    HA   ARG  41           HA       ARG  41  -4.772   8.653   4.003
  357    HB2  ARG  41           2HB      ARG  41  -6.973  10.724   3.896
  358    HB3  ARG  41           3HB      ARG  41  -5.251  11.078   3.875
  359    HG2  ARG  41           2HG      ARG  41  -5.073   9.743   1.779
  360    HG3  ARG  41           3HG      ARG  41  -6.833   9.610   1.780
  361    HD2  ARG  41           2HD      ARG  41  -5.432  12.265   1.901
  362    HD3  ARG  41           3HD      ARG  41  -5.788  11.467   0.370
  363    HE   ARG  41           HE       ARG  41  -8.133  11.582   1.908
  364   HH11  ARG  41          2HH1      ARG  41  -5.960  13.678   0.174
  365   HH12  ARG  41          1HH1      ARG  41  -7.177  14.856  -0.188
  366   HH21  ARG  41          2HH2      ARG  41  -9.744  13.127   1.438
  367   HH22  ARG  41          1HH2      ARG  41  -9.329  14.542   0.532
  368    H    SER  42           HN       SER  42  -5.473   7.336   6.185
  369    HA   SER  42           HA       SER  42  -5.512   9.370   8.319
  370    HB2  SER  42           2HB      SER  42  -7.544   8.117   8.490
  371    HB3  SER  42           3HB      SER  42  -6.690   6.587   8.291
  372    HG   SER  42           HG       SER  42  -7.085   8.086  10.538
  373    H    LEU  43           HN       LEU  43  -4.390   6.094   7.504
  374    HA   LEU  43           HA       LEU  43  -2.185   6.431   9.416
  375    HB2  LEU  43           2HB      LEU  43  -3.499   4.028   8.198
  376    HB3  LEU  43           3HB      LEU  43  -1.897   3.918   8.924
  377    HG   LEU  43           HG       LEU  43  -4.265   4.954  10.456
  378   HD11  LEU  43          1HD1      LEU  43  -4.773   2.802  11.237
  379   HD12  LEU  43          2HD1      LEU  43  -3.312   2.108  10.535
  380   HD13  LEU  43          3HD1      LEU  43  -4.631   2.630   9.487
  381   HD21  LEU  43          3HD2      LEU  43  -1.622   3.747  11.267
  382   HD22  LEU  43          1HD2      LEU  43  -2.906   4.231  12.375
  383   HD23  LEU  43          2HD2      LEU  43  -2.085   5.445  11.393
  384    H    GLY  44           HN       GLY  44  -2.314   7.642   6.724
  385    HA2  GLY  44           1HA      GLY  44   0.240   6.567   5.752
  386    HA3  GLY  44           2HA      GLY  44  -1.091   6.728   4.615
  387    H    GLU  45           HN       GLU  45   1.230   8.017   4.074
  388    HA   GLU  45           HA       GLU  45   0.453  10.825   4.438
  389    HB2  GLU  45           2HB      GLU  45   2.786  11.476   4.755
  390    HB3  GLU  45           3HB      GLU  45   2.274  10.359   6.012
  391    HG2  GLU  45           2HG      GLU  45   3.332   8.525   4.641
  392    HG3  GLU  45           3HG      GLU  45   4.041   9.800   3.651
  393    HA   PRO  46           HA       PRO  46   0.954  11.052   0.073
  394    HB2  PRO  46           2HB      PRO  46   1.331  13.728  -0.187
  395    HB3  PRO  46           3HB      PRO  46  -0.241  13.011   0.188
  396    HG2  PRO  46           2HG      PRO  46   1.754  14.273   2.029
  397    HG3  PRO  46           3HG      PRO  46  -0.010  14.453   1.998
  398    HD2  PRO  46           2HD      PRO  46   1.258  12.828   3.755
  399    HD3  PRO  46           3HD      PRO  46  -0.358  12.466   3.115
  400    H    LEU  47           HN       LEU  47   2.614  10.741  -1.283
  401    HA   LEU  47           HA       LEU  47   5.274  10.748  -0.450
  402    HB2  LEU  47           2HB      LEU  47   3.888  10.542  -3.069
  403    HB3  LEU  47           3HB      LEU  47   5.625  10.837  -3.077
  404    HG   LEU  47           HG       LEU  47   4.387   8.524  -1.605
  405   HD11  LEU  47          1HD1      LEU  47   4.809   8.895  -4.478
  406   HD12  LEU  47          2HD1      LEU  47   3.808   7.727  -3.616
  407   HD13  LEU  47          3HD1      LEU  47   5.535   7.431  -3.815
  408   HD21  LEU  47          3HD2      LEU  47   7.051   8.222  -2.696
  409   HD22  LEU  47          1HD2      LEU  47   6.474   7.996  -1.045
  410   HD23  LEU  47          2HD2      LEU  47   6.941   9.602  -1.603
  411    H    ARG  48           HN       ARG  48   7.043  11.972  -1.704
  412    HA   ARG  48           HA       ARG  48   6.292  14.788  -2.076
  413    HB2  ARG  48           2HB      ARG  48   8.280  13.640  -0.178
  414    HB3  ARG  48           3HB      ARG  48   8.688  15.153  -0.975
  415    HG2  ARG  48           2HG      ARG  48   6.277  15.838  -0.164
  416    HG3  ARG  48           3HG      ARG  48   6.574  14.570   1.026
  417    HD2  ARG  48           2HD      ARG  48   7.452  16.350   2.148
  418    HD3  ARG  48           3HD      ARG  48   8.885  15.829   1.262
  419    HE   ARG  48           HE       ARG  48   7.774  17.616  -0.418
  420   HH11  ARG  48          2HH1      ARG  48   8.561  17.738   2.971
  421   HH12  ARG  48          1HH1      ARG  48   8.861  19.444   2.974
  422   HH21  ARG  48          2HH2      ARG  48   8.166  19.863  -0.427
  423   HH22  ARG  48          1HH2      ARG  48   8.635  20.652   1.040
  424    H    GLY  49           HN       GLY  49   7.008  15.577  -3.943
  425    HA2  GLY  49           1HA      GLY  49   9.506  15.480  -5.025
  426    HA3  GLY  49           2HA      GLY  49   8.751  14.004  -5.608
  427    HA   PRO  50           HA       PRO  50   7.453  17.988  -7.991
  428    HB2  PRO  50           2HB      PRO  50   9.413  18.158  -9.861
  429    HB3  PRO  50           3HB      PRO  50   9.483  19.012  -8.315
  430    HG2  PRO  50           2HG      PRO  50  10.797  16.446  -9.122
  431    HG3  PRO  50           3HG      PRO  50  11.468  17.805  -8.201
  432    HD2  PRO  50           2HD      PRO  50  10.588  15.535  -7.016
  433    HD3  PRO  50           3HD      PRO  50  10.476  17.125  -6.235
  434    H    GLU  51           HN       GLU  51   8.777  14.877  -8.862
  435    HA   GLU  51           HA       GLU  51   7.428  14.831 -11.430
  436    HB2  GLU  51           2HB      GLU  51   9.659  13.785 -11.129
  437    HB3  GLU  51           3HB      GLU  51   8.941  12.633 -10.012
  438    HG2  GLU  51           2HG      GLU  51   8.266  12.935 -12.929
  439    HG3  GLU  51           3HG      GLU  51   9.233  11.650 -12.206
  440    H    LEU  52           HN       LEU  52   7.219  13.125  -8.322
  441    HA   LEU  52           HA       LEU  52   4.545  12.175  -9.112
  442    HB2  LEU  52           2HB      LEU  52   4.952  10.521  -7.184
  443    HB3  LEU  52           3HB      LEU  52   5.771  10.255  -8.721
  444    HG   LEU  52           HG       LEU  52   7.791  11.382  -7.684
  445   HD11  LEU  52          1HD1      LEU  52   5.921  11.396  -5.403
  446   HD12  LEU  52          2HD1      LEU  52   7.255  12.482  -5.788
  447   HD13  LEU  52          3HD1      LEU  52   7.581  10.913  -5.053
  448   HD21  LEU  52          3HD2      LEU  52   8.315   9.211  -7.744
  449   HD22  LEU  52          1HD2      LEU  52   6.705   8.716  -7.224
  450   HD23  LEU  52          2HD2      LEU  52   7.908   9.197  -6.027
  451    H    GLY  53           HN       GLY  53   2.816  12.480  -7.745
  452    HA2  GLY  53           1HA      GLY  53   3.285  13.810  -5.179
  453    HA3  GLY  53           2HA      GLY  53   2.324  14.667  -6.375
  454    H    ARG  54           HN       ARG  54   0.524  13.189  -7.352
  455    HA   ARG  54           HA       ARG  54  -1.285  12.615  -5.287
  456    HB2  ARG  54           2HB      ARG  54  -1.234  12.134  -8.236
  457    HB3  ARG  54           3HB      ARG  54  -2.469  11.337  -7.271
  458    HG2  ARG  54           2HG      ARG  54  -2.945  13.695  -6.342
  459    HG3  ARG  54           3HG      ARG  54  -2.049  14.256  -7.754
  460    HD2  ARG  54           2HD      ARG  54  -3.612  13.390  -9.244
  461    HD3  ARG  54           3HD      ARG  54  -4.278  12.280  -8.047
  462    HE   ARG  54           HE       ARG  54  -4.847  14.719  -7.020
  463   HH11  ARG  54          2HH1      ARG  54  -5.396  13.232 -10.120
  464   HH12  ARG  54          1HH1      ARG  54  -6.847  14.125 -10.437
  465   HH21  ARG  54          2HH2      ARG  54  -6.756  15.900  -7.426
  466   HH22  ARG  54          1HH2      ARG  54  -7.619  15.643  -8.905
  467    H    PHE  55           HN       PHE  55   0.066  11.210  -3.949
  468    HA   PHE  55           HA       PHE  55  -0.549   8.438  -4.448
  469    HB2  PHE  55           2HB      PHE  55   2.345   9.277  -4.174
  470    HB3  PHE  55           3HB      PHE  55   1.748   7.624  -4.288
  471    HD1  PHE  55           1HD      PHE  55   0.589   6.912  -6.418
  472    HD2  PHE  55           2HD      PHE  55   2.827  10.517  -6.091
  473    HE1  PHE  55           1HE      PHE  55   0.781   7.011  -8.869
  474    HE2  PHE  55           2HE      PHE  55   3.022  10.623  -8.541
  475    HZ   PHE  55           HZ       PHE  55   1.998   8.869  -9.934
  476    H    TRP  56           HN       TRP  56  -0.771   7.299  -2.587
  477    HA   TRP  56           HA       TRP  56  -0.079   8.709  -0.093
  478    HB2  TRP  56           2HB      TRP  56  -2.564   8.178  -0.792
  479    HB3  TRP  56           3HB      TRP  56  -2.172   6.573  -0.183
  480    HD1  TRP  56           1HD      TRP  56  -2.192   6.234   2.395
  481    HE1  TRP  56           1HE      TRP  56  -2.670   7.767   4.406
  482    HE3  TRP  56           3HE      TRP  56  -2.250  10.742  -0.016
  483    HZ2  TRP  56           2HZ      TRP  56  -3.025  10.523   4.905
  484    HZ3  TRP  56           3HZ      TRP  56  -2.666  12.779   1.301
  485    HH2  TRP  56           2HH      TRP  56  -3.046  12.669   3.710
  486    H    LYS  57           HN       LYS  57   1.200   7.723   1.349
  487    HA   LYS  57           HA       LYS  57   1.928   4.915   0.829
  488    HB2  LYS  57           2HB      LYS  57   3.888   6.130   0.468
  489    HB3  LYS  57           3HB      LYS  57   3.538   7.267   1.764
  490    HG2  LYS  57           2HG      LYS  57   4.363   5.892   3.385
  491    HG3  LYS  57           3HG      LYS  57   3.985   4.421   2.486
  492    HD2  LYS  57           2HD      LYS  57   6.435   4.960   2.695
  493    HD3  LYS  57           3HD      LYS  57   5.853   4.719   1.046
  494    HE2  LYS  57           2HE      LYS  57   7.384   6.669   1.321
  495    HE3  LYS  57           3HE      LYS  57   5.807   7.075   0.646
  496    HZ1  LYS  57           3HZ      LYS  57   5.118   8.018   2.658
  497    HZ2  LYS  57           1HZ      LYS  57   6.701   8.579   2.452
  498    HZ3  LYS  57           2HZ      LYS  57   6.384   7.322   3.537
  499    H    TYR  58           HN       TYR  58   1.961   3.468   2.503
  500    HA   TYR  58           HA       TYR  58   0.818   4.426   5.041
  501    HB2  TYR  58           2HB      TYR  58   0.639   1.743   3.667
  502    HB3  TYR  58           3HB      TYR  58   0.128   2.004   5.330
  503    HD1  TYR  58           1HD      TYR  58  -1.661   3.815   5.733
  504    HD2  TYR  58           2HD      TYR  58  -0.842   2.140   1.909
  505    HE1  TYR  58           1HE      TYR  58  -3.870   4.554   4.943
  506    HE2  TYR  58           2HE      TYR  58  -3.048   2.875   1.108
  507    HH   TYR  58           HH       TYR  58  -4.786   5.098   2.287
  508    H    ARG  59           HN       ARG  59   1.603   3.566   7.010
  509    HA   ARG  59           HA       ARG  59   4.389   2.641   6.837
  510    HB2  ARG  59           2HB      ARG  59   4.450   3.429   9.272
  511    HB3  ARG  59           3HB      ARG  59   4.355   4.667   8.026
  512    HG2  ARG  59           2HG      ARG  59   1.938   4.849   8.409
  513    HG3  ARG  59           3HG      ARG  59   2.064   3.638   9.686
  514    HD2  ARG  59           2HD      ARG  59   3.857   5.251  10.664
  515    HD3  ARG  59           3HD      ARG  59   3.080   6.449   9.629
  516    HE   ARG  59           HE       ARG  59   1.096   5.145  11.104
  517   HH11  ARG  59          2HH1      ARG  59   3.784   7.299  11.606
  518   HH12  ARG  59          1HH1      ARG  59   3.090   8.051  13.004
  519   HH21  ARG  59          2HH2      ARG  59   0.171   6.126  12.944
  520   HH22  ARG  59          1HH2      ARG  59   1.035   7.382  13.765
  521    H    VAL  60           HN       VAL  60   4.844   0.626   7.412
  522    HA   VAL  60           HA       VAL  60   3.035  -0.759   9.278
  523    HB   VAL  60           HB       VAL  60   4.259  -1.917   6.771
  524   HG11  VAL  60          1HG1      VAL  60   3.707  -3.219   9.183
  525   HG12  VAL  60          2HG1      VAL  60   2.371  -3.628   8.106
  526   HG13  VAL  60          3HG1      VAL  60   4.033  -3.959   7.617
  527   HG21  VAL  60          3HG2      VAL  60   2.380  -0.996   5.919
  528   HG22  VAL  60          1HG2      VAL  60   1.618  -2.428   6.612
  529   HG23  VAL  60          2HG2      VAL  60   1.586  -0.899   7.491
  530    H    GLY  61           HN       GLY  61   4.561  -0.248  10.938
  531    HA2  GLY  61           1HA      GLY  61   6.330  -0.727  12.319
  532    HA3  GLY  61           2HA      GLY  61   6.385  -2.285  11.509
  533    H    ASP  62           HN       ASP  62   7.792  -2.589   9.756
  534    HA   ASP  62           HA       ASP  62   9.777  -0.448   9.365
  535    HB2  ASP  62           2HB      ASP  62  10.479  -3.381   9.388
  536    HB3  ASP  62           3HB      ASP  62  11.573  -2.001   9.441
  537    H    TYR  63           HN       TYR  63   7.436  -1.186   7.775
  538    HA   TYR  63           HA       TYR  63   8.832  -1.723   5.250
  539    HB2  TYR  63           2HB      TYR  63   6.281  -3.030   6.200
  540    HB3  TYR  63           3HB      TYR  63   6.798  -3.038   4.518
  541    HD1  TYR  63           1HD      TYR  63   7.781  -4.112   7.931
  542    HD2  TYR  63           2HD      TYR  63   8.366  -4.615   3.747
  543    HE1  TYR  63           1HE      TYR  63   9.148  -6.110   8.368
  544    HE2  TYR  63           2HE      TYR  63   9.734  -6.615   4.172
  545    HH   TYR  63           HH       TYR  63  11.217  -7.385   6.416
  546    H    ARG  64           HN       ARG  64   8.315  -0.360   3.649
  547    HA   ARG  64           HA       ARG  64   6.184   1.588   4.165
  548    HB2  ARG  64           2HB      ARG  64   8.688   1.641   2.516
  549    HB3  ARG  64           3HB      ARG  64   7.377   2.758   2.164
  550    HG2  ARG  64           2HG      ARG  64   9.257   3.557   3.695
  551    HG3  ARG  64           3HG      ARG  64   7.594   3.851   4.208
  552    HD2  ARG  64           2HD      ARG  64   7.712   1.814   5.608
  553    HD3  ARG  64           3HD      ARG  64   9.404   1.630   5.149
  554    HE   ARG  64           HE       ARG  64   9.958   3.354   6.573
  555   HH11  ARG  64          2HH1      ARG  64   6.499   3.160   6.225
  556   HH12  ARG  64          1HH1      ARG  64   6.176   4.260   7.525
  557   HH21  ARG  64          2HH2      ARG  64   9.545   4.804   8.285
  558   HH22  ARG  64          1HH2      ARG  64   7.910   5.195   8.695
  559    H    LEU  65           HN       LEU  65   4.350   1.515   3.052
  560    HA   LEU  65           HA       LEU  65   4.283  -0.076   0.574
  561    HB2  LEU  65           2HB      LEU  65   1.893   0.560   2.272
  562    HB3  LEU  65           3HB      LEU  65   2.066  -0.693   1.045
  563    HG   LEU  65           HG       LEU  65   3.427  -0.692   3.739
  564   HD11  LEU  65          1HD1      LEU  65   1.026  -2.203   2.723
  565   HD12  LEU  65          2HD1      LEU  65   1.061  -1.010   4.020
  566   HD13  LEU  65          3HD1      LEU  65   1.877  -2.559   4.227
  567   HD21  LEU  65          3HD2      LEU  65   4.780  -1.884   2.198
  568   HD22  LEU  65          1HD2      LEU  65   3.377  -2.665   1.466
  569   HD23  LEU  65          2HD2      LEU  65   3.867  -3.090   3.107
  570    H    ILE  66           HN       ILE  66   4.110   1.099  -1.205
  571    HA   ILE  66           HA       ILE  66   2.979   3.792  -1.053
  572    HB   ILE  66           HB       ILE  66   4.465   2.449  -3.314
  573   HG12  ILE  66          2HG1      ILE  66   6.229   4.181  -2.638
  574   HG13  ILE  66          3HG1      ILE  66   5.318   4.359  -1.142
  575   HG21  ILE  66          1HG2      ILE  66   4.072   5.393  -3.121
  576   HG22  ILE  66          2HG2      ILE  66   4.299   4.375  -4.542
  577   HG23  ILE  66          3HG2      ILE  66   2.743   4.396  -3.712
  578   HD11  ILE  66          3HD1      ILE  66   5.956   1.593  -1.851
  579   HD12  ILE  66          1HD1      ILE  66   7.355   2.616  -1.525
  580   HD13  ILE  66          2HD1      ILE  66   6.091   2.436  -0.308
  581    H    CYS  67           HN       CYS  67   0.808   3.703  -1.192
  582    HA   CYS  67           HA       CYS  67  -0.354   2.165  -3.420
  583    HB2  CYS  67           2HB      CYS  67  -1.913   3.079  -1.016
  584    HB3  CYS  67           3HB      CYS  67  -2.301   1.794  -2.154
  585    HG   CYS  67           HG       CYS  67   0.463   1.463  -0.213
  586    H    HIS  68           HN       HIS  68  -2.468   3.118  -4.216
  587    HA   HIS  68           HA       HIS  68  -2.265   6.057  -4.314
  588    HB2  HIS  68           2HB      HIS  68  -1.591   4.809  -6.428
  589    HB3  HIS  68           3HB      HIS  68  -3.280   4.331  -6.572
  590    HD2  HIS  68           2HD      HIS  68  -2.364   7.990  -5.539
  591    HE1  HIS  68           1HE      HIS  68  -3.995   8.044  -9.455
  592    HE2  HIS  68           2HE      HIS  68  -3.120   9.435  -7.546
  593    H    ILE  69           HN       ILE  69  -3.988   7.081  -3.555
  594    HA   ILE  69           HA       ILE  69  -6.441   5.598  -3.064
  595    HB   ILE  69           HB       ILE  69  -5.699   8.429  -2.315
  596   HG12  ILE  69          2HG1      ILE  69  -5.897   6.017  -0.511
  597   HG13  ILE  69          3HG1      ILE  69  -4.385   6.519  -1.260
  598   HG21  ILE  69          1HG2      ILE  69  -8.199   7.633  -2.572
  599   HG22  ILE  69          2HG2      ILE  69  -7.889   6.914  -0.993
  600   HG23  ILE  69          3HG2      ILE  69  -7.695   8.651  -1.223
  601   HD11  ILE  69          3HD1      ILE  69  -4.514   8.657  -0.118
  602   HD12  ILE  69          1HD1      ILE  69  -6.054   8.191   0.604
  603   HD13  ILE  69          2HD1      ILE  69  -4.580   7.322   1.032
  604    H    GLN  70           HN       GLN  70  -8.246   5.768  -4.232
  605    HA   GLN  70           HA       GLN  70  -8.386   7.909  -6.252
  606    HB2  GLN  70           2HB      GLN  70  -9.195   5.020  -6.365
  607    HB3  GLN  70           3HB      GLN  70  -9.958   6.201  -7.421
  608    HG2  GLN  70           2HG      GLN  70  -7.795   6.787  -8.360
  609    HG3  GLN  70           3HG      GLN  70  -7.004   5.645  -7.274
  610   HE21  GLN  70          1HE2      GLN  70  -6.159   4.700  -9.230
  611   HE22  GLN  70          2HE2      GLN  70  -7.125   3.583 -10.125
  612    H    ASP  71           HN       ASP  71  -9.593   9.386  -5.133
  613    HA   ASP  71           HA       ASP  71 -11.759   8.859  -3.460
  614    HB2  ASP  71           2HB      ASP  71 -11.447  11.319  -5.186
  615    HB3  ASP  71           3HB      ASP  71 -12.312  11.190  -3.657
  616    H    ARG  72           HN       ARG  72 -11.621   9.309  -6.951
  617    HA   ARG  72           HA       ARG  72 -14.220   9.659  -7.657
  618    HB2  ARG  72           2HB      ARG  72 -12.452   9.510  -9.310
  619    HB3  ARG  72           3HB      ARG  72 -12.214   7.805  -8.949
  620    HG2  ARG  72           2HG      ARG  72 -13.433   7.906 -10.966
  621    HG3  ARG  72           3HG      ARG  72 -14.579   7.425  -9.713
  622    HD2  ARG  72           2HD      ARG  72 -15.465   9.652  -9.588
  623    HD3  ARG  72           3HD      ARG  72 -14.215  10.257 -10.674
  624    HE   ARG  72           HE       ARG  72 -16.631   8.872 -11.406
  625   HH11  ARG  72          2HH1      ARG  72 -13.403   9.741 -12.378
  626   HH12  ARG  72          1HH1      ARG  72 -13.730   9.583 -14.072
  627   HH21  ARG  72          2HH2      ARG  72 -17.074   8.660 -13.633
  628   HH22  ARG  72          1HH2      ARG  72 -15.819   8.969 -14.785
  629    H    GLU  73           HN       GLU  73 -12.700   6.505  -6.996
  630    HA   GLU  73           HA       GLU  73 -15.391   5.438  -6.448
  631    HB2  GLU  73           2HB      GLU  73 -13.130   4.234  -8.010
  632    HB3  GLU  73           3HB      GLU  73 -14.288   3.195  -7.191
  633    HG2  GLU  73           2HG      GLU  73 -16.110   4.276  -8.435
  634    HG3  GLU  73           3HG      GLU  73 -14.921   5.260  -9.287
  635    H    ALA  74           HN       ALA  74 -13.326   6.592  -4.670
  636    HA   ALA  74           HA       ALA  74 -12.048   6.057  -2.813
  637    HB1  ALA  74           1HB      ALA  74 -14.638   6.003  -2.322
  638    HB2  ALA  74           2HB      ALA  74 -14.302   4.306  -1.977
  639    HB3  ALA  74           3HB      ALA  74 -13.460   5.571  -1.083
  640    H    THR  75           HN       THR  75 -10.938   4.544  -4.667
  641    HA   THR  75           HA       THR  75 -10.788   1.841  -3.499
  642    HB   THR  75           HB       THR  75 -10.203   2.678  -6.346
  643    HG1  THR  75           1HG      THR  75 -12.317   1.182  -5.159
  644   HG21  THR  75          3HG2      THR  75  -8.965   0.663  -5.049
  645   HG22  THR  75          1HG2      THR  75  -9.347   0.625  -6.770
  646   HG23  THR  75          2HG2      THR  75 -10.412  -0.174  -5.613
  647    H    VAL  76           HN       VAL  76  -8.872   1.141  -2.759
  648    HA   VAL  76           HA       VAL  76  -6.549   2.911  -3.127
  649    HB   VAL  76           HB       VAL  76  -7.035   0.888  -0.936
  650   HG11  VAL  76          1HG1      VAL  76  -4.631   1.698  -1.780
  651   HG12  VAL  76          2HG1      VAL  76  -5.007   3.026  -0.680
  652   HG13  VAL  76          3HG1      VAL  76  -4.989   1.365  -0.086
  653   HG21  VAL  76          3HG2      VAL  76  -7.964   2.490   0.340
  654   HG22  VAL  76          1HG2      VAL  76  -6.884   3.743  -0.271
  655   HG23  VAL  76          2HG2      VAL  76  -8.306   3.274  -1.202
  656    H    LEU  77           HN       LEU  77  -5.395   2.153  -4.803
  657    HA   LEU  77           HA       LEU  77  -4.898  -0.738  -4.977
  658    HB2  LEU  77           2HB      LEU  77  -5.861   0.413  -6.953
  659    HB3  LEU  77           3HB      LEU  77  -4.401   1.395  -7.048
  660    HG   LEU  77           HG       LEU  77  -4.167  -1.579  -7.162
  661   HD11  LEU  77          1HD1      LEU  77  -5.732  -1.472  -8.829
  662   HD12  LEU  77          2HD1      LEU  77  -4.266  -1.122  -9.744
  663   HD13  LEU  77          3HD1      LEU  77  -5.332   0.194  -9.252
  664   HD21  LEU  77          3HD2      LEU  77  -2.063  -1.092  -7.672
  665   HD22  LEU  77          1HD2      LEU  77  -2.426   0.608  -7.372
  666   HD23  LEU  77          2HD2      LEU  77  -2.577  -0.051  -9.001
  667    H    VAL  78           HN       VAL  78  -2.999  -1.492  -4.337
  668    HA   VAL  78           HA       VAL  78  -0.891   0.241  -3.505
  669    HB   VAL  78           HB       VAL  78  -0.754  -2.751  -3.886
  670   HG11  VAL  78          1HG1      VAL  78   1.138  -2.739  -2.557
  671   HG12  VAL  78          2HG1      VAL  78   1.345  -1.264  -3.503
  672   HG13  VAL  78          3HG1      VAL  78   0.754  -1.173  -1.843
  673   HG21  VAL  78          3HG2      VAL  78  -2.648  -2.249  -2.479
  674   HG22  VAL  78          1HG2      VAL  78  -1.337  -2.879  -1.482
  675   HG23  VAL  78          2HG2      VAL  78  -1.676  -1.149  -1.501
  676    H    LEU  79           HN       LEU  79   0.869   0.909  -4.571
  677    HA   LEU  79           HA       LEU  79   1.191   0.056  -7.349
  678    HB2  LEU  79           2HB      LEU  79   1.941   2.453  -5.771
  679    HB3  LEU  79           3HB      LEU  79   2.980   2.015  -7.126
  680    HG   LEU  79           HG       LEU  79   0.014   2.410  -7.438
  681   HD11  LEU  79          1HD1      LEU  79   2.219   4.429  -7.383
  682   HD12  LEU  79          2HD1      LEU  79   0.605   4.512  -6.677
  683   HD13  LEU  79          3HD1      LEU  79   0.813   4.666  -8.421
  684   HD21  LEU  79          3HD2      LEU  79   0.436   2.465  -9.723
  685   HD22  LEU  79          1HD2      LEU  79   1.511   1.191  -9.147
  686   HD23  LEU  79          2HD2      LEU  79   2.155   2.795  -9.499
  687    H    ARG  80           HN       ARG  80   3.276   0.699  -4.525
  688    HA   ARG  80           HA       ARG  80   4.960  -1.557  -5.346
  689    HB2  ARG  80           2HB      ARG  80   6.089   0.414  -6.195
  690    HB3  ARG  80           3HB      ARG  80   5.956   1.205  -4.631
  691    HG2  ARG  80           2HG      ARG  80   7.372  -1.402  -4.773
  692    HG3  ARG  80           3HG      ARG  80   8.181   0.035  -5.401
  693    HD2  ARG  80           2HD      ARG  80   7.510   1.109  -3.148
  694    HD3  ARG  80           3HD      ARG  80   7.265  -0.552  -2.609
  695    HE   ARG  80           HE       ARG  80   9.527  -0.766  -2.456
  696   HH11  ARG  80          2HH1      ARG  80   8.811   1.858  -4.629
  697   HH12  ARG  80          1HH1      ARG  80  10.470   2.315  -4.832
  698   HH21  ARG  80          2HH2      ARG  80  11.714  -0.175  -2.716
  699   HH22  ARG  80          1HH2      ARG  80  12.121   1.157  -3.744
  700    H    VAL  81           HN       VAL  81   6.071  -2.590  -3.660
  701    HA   VAL  81           HA       VAL  81   5.511  -1.674  -0.933
  702    HB   VAL  81           HB       VAL  81   4.853  -4.418  -2.001
  703   HG11  VAL  81          1HG1      VAL  81   4.116  -4.657   0.522
  704   HG12  VAL  81          2HG1      VAL  81   5.760  -5.036   0.006
  705   HG13  VAL  81          3HG1      VAL  81   5.409  -3.484   0.768
  706   HG21  VAL  81          3HG2      VAL  81   3.143  -2.655  -2.285
  707   HG22  VAL  81          1HG2      VAL  81   2.621  -3.946  -1.202
  708   HG23  VAL  81          2HG2      VAL  81   3.150  -2.400  -0.540
  709    H    GLY  82           HN       GLY  82   7.416  -1.507   0.041
  710    HA2  GLY  82           1HA      GLY  82   9.249  -3.745   0.045
  711    HA3  GLY  82           2HA      GLY  82   9.865  -2.313  -0.766
  712    H    HIS  83           HN       HIS  83  10.967  -3.534   1.571
  713    HA   HIS  83           HA       HIS  83  10.247  -2.331   3.974
  714    HB2  HIS  83           2HB      HIS  83  11.905  -4.215   3.631
  715    HB3  HIS  83           3HB      HIS  83  13.083  -2.989   3.171
  716    HD2  HIS  83           2HD      HIS  83  11.647  -4.615   6.321
  717    HE1  HIS  83           1HE      HIS  83  13.997  -1.317   7.584
  718    HE2  HIS  83           2HE      HIS  83  12.825  -3.430   8.295
  719    H    ALA  84           HN       ALA  84  11.217  -0.580   5.146
  720    HA   ALA  84           HA       ALA  84  11.182   1.861   3.981
  721    HB1  ALA  84           1HB      ALA  84  12.898   2.494   5.853
  722    HB2  ALA  84           2HB      ALA  84  11.271   1.960   6.275
  723    HB3  ALA  84           3HB      ALA  84  12.623   0.834   6.381
  724    H    ARG  85           HN       ARG  85  14.017  -0.246   4.261
  725    HA   ARG  85           HA       ARG  85  15.895   1.545   3.180
  726    HB2  ARG  85           2HB      ARG  85  17.286  -0.445   2.790
  727    HB3  ARG  85           3HB      ARG  85  16.571  -0.455   4.396
  728    HG2  ARG  85           2HG      ARG  85  14.876  -2.035   3.644
  729    HG3  ARG  85           3HG      ARG  85  15.569  -2.012   2.021
  730    HD2  ARG  85           2HD      ARG  85  17.279  -2.706   4.373
  731    HD3  ARG  85           3HD      ARG  85  16.203  -3.918   3.678
  732    HE   ARG  85           HE       ARG  85  17.611  -2.853   1.562
  733   HH11  ARG  85          2HH1      ARG  85  18.358  -4.535   4.517
  734   HH12  ARG  85          1HH1      ARG  85  19.788  -5.281   3.884
  735   HH21  ARG  85          2HH2      ARG  85  19.491  -3.829   0.717
  736   HH22  ARG  85          1HH2      ARG  85  20.432  -4.878   1.723
  737    H    ASP  86           HN       ASP  86  13.909  -0.967   1.653
  738    HA   ASP  86           HA       ASP  86  14.912  -0.779  -0.935
  739    HB2  ASP  86           2HB      ASP  86  12.193  -1.523   0.127
  740    HB3  ASP  86           3HB      ASP  86  12.551  -1.550  -1.598
  741    H    VAL  87           HN       VAL  87  12.059   0.871   0.428
  742    HA   VAL  87           HA       VAL  87  11.548   2.459  -1.844
  743    HB   VAL  87           HB       VAL  87  10.841   3.399   0.910
  744   HG11  VAL  87          1HG1      VAL  87   9.978   4.858  -0.650
  745   HG12  VAL  87          2HG1      VAL  87   9.691   3.585  -1.839
  746   HG13  VAL  87          3HG1      VAL  87   8.630   3.740  -0.437
  747   HG21  VAL  87          3HG2      VAL  87  10.212   1.228   1.288
  748   HG22  VAL  87          1HG2      VAL  87   8.760   1.838   0.493
  749   HG23  VAL  87          2HG2      VAL  87   9.936   0.894  -0.422
  750    H    TYR  88           HN       TYR  88  11.794   4.774  -2.060
  751    HA   TYR  88           HA       TYR  88  14.442   5.629  -1.283
  752    HB2  TYR  88           2HB      TYR  88  12.546   7.439  -2.711
  753    HB3  TYR  88           3HB      TYR  88  14.277   7.221  -2.943
  754    HD1  TYR  88           1HD      TYR  88  15.091   5.156  -4.137
  755    HD2  TYR  88           2HD      TYR  88  10.984   6.260  -4.030
  756    HE1  TYR  88           1HE      TYR  88  14.653   3.689  -6.062
  757    HE2  TYR  88           2HE      TYR  88  10.534   4.795  -5.954
  758    HH   TYR  88           HH       TYR  88  11.718   3.775  -7.807
  759    H    ARG  89           HN       ARG  89  11.788   5.527   0.448
  760    HA   ARG  89           HA       ARG  89  12.405   8.023   1.862
  761    HB2  ARG  89           2HB      ARG  89   9.772   7.137   0.795
  762    HB3  ARG  89           3HB      ARG  89   9.788   7.918   2.370
  763    HG2  ARG  89           2HG      ARG  89  10.434   9.939   1.519
  764    HG3  ARG  89           3HG      ARG  89  11.237   9.218   0.123
  765    HD2  ARG  89           2HD      ARG  89   8.263   9.051   0.455
  766    HD3  ARG  89           3HD      ARG  89   9.020  10.486  -0.237
  767    HE   ARG  89           HE       ARG  89   8.779   7.875  -1.460
  768   HH11  ARG  89          2HH1      ARG  89  10.359  10.977  -1.496
  769   HH12  ARG  89          1HH1      ARG  89  10.829  10.864  -3.160
  770   HH21  ARG  89          2HH2      ARG  89   9.392   7.715  -3.651
  771   HH22  ARG  89          1HH2      ARG  89  10.278   9.008  -4.385
  Start of MODEL    2
    1    H1   MET   1           HN       MET   1 -16.092   7.334   2.994
    2    HA   MET   1           HA       MET   1 -18.129   5.301   3.572
    3    HB2  MET   1           2HB      MET   1 -18.463   4.870   1.205
    4    HB3  MET   1           3HB      MET   1 -18.833   6.551   1.566
    5    HG2  MET   1           2HG      MET   1 -16.426   7.030   0.821
    6    HG3  MET   1           3HG      MET   1 -16.479   5.418   0.111
    7    HE1  MET   1           3HE      MET   1 -16.034   8.344  -1.417
    8    HE2  MET   1           1HE      MET   1 -17.525   9.063  -2.027
    9    HE3  MET   1           2HE      MET   1 -17.183   9.076  -0.296
   10    H    GLY   2           HN       GLY   2 -17.538   3.139   2.714
   11    HA2  GLY   2           1HA      GLY   2 -14.963   2.392   3.533
   12    HA3  GLY   2           2HA      GLY   2 -16.065   1.384   2.607
   13    H    TYR   3           HN       TYR   3 -13.490   1.030   2.080
   14    HA   TYR   3           HA       TYR   3 -13.206   2.205  -0.588
   15    HB2  TYR   3           2HB      TYR   3 -11.153   2.258   1.610
   16    HB3  TYR   3           3HB      TYR   3 -10.673   2.304  -0.083
   17    HD1  TYR   3           2HD      TYR   3 -12.874   4.051   2.367
   18    HD2  TYR   3           1HD      TYR   3 -10.555   4.346  -1.188
   19    HE1  TYR   3           2HE      TYR   3 -13.242   6.483   2.336
   20    HE2  TYR   3           1HE      TYR   3 -10.915   6.779  -1.228
   21    HH   TYR   3           HH       TYR   3 -12.413   8.433  -0.375
   22    H    ARG   4           HN       ARG   4 -12.079   0.921  -2.080
   23    HA   ARG   4           HA       ARG   4 -12.119  -1.909  -1.443
   24    HB2  ARG   4           2HB      ARG   4 -13.106  -1.305  -3.537
   25    HB3  ARG   4           3HB      ARG   4 -11.684  -0.385  -4.010
   26    HG2  ARG   4           2HG      ARG   4 -11.381  -2.287  -5.233
   27    HG3  ARG   4           3HG      ARG   4 -10.487  -2.704  -3.770
   28    HD2  ARG   4           2HD      ARG   4 -11.907  -4.552  -4.465
   29    HD3  ARG   4           3HD      ARG   4 -12.446  -3.899  -2.918
   30    HE   ARG   4           HE       ARG   4 -14.405  -3.220  -3.913
   31   HH11  ARG   4          2HH1      ARG   4 -12.117  -4.181  -6.354
   32   HH12  ARG   4          1HH1      ARG   4 -13.277  -4.143  -7.641
   33   HH21  ARG   4          2HH2      ARG   4 -15.941  -3.166  -5.598
   34   HH22  ARG   4          1HH2      ARG   4 -15.451  -3.564  -7.210
   35    H    ILE   5           HN       ILE   5 -10.366  -3.297  -1.545
   36    HA   ILE   5           HA       ILE   5  -7.744  -1.980  -1.360
   37    HB   ILE   5           HB       ILE   5  -8.469  -4.753  -0.416
   38   HG12  ILE   5          2HG1      ILE   5  -9.764  -3.081   0.820
   39   HG13  ILE   5          3HG1      ILE   5  -8.524  -3.793   1.848
   40   HG21  ILE   5          1HG2      ILE   5  -6.297  -3.652   0.999
   41   HG22  ILE   5          2HG2      ILE   5  -6.282  -4.998  -0.140
   42   HG23  ILE   5          3HG2      ILE   5  -5.996  -3.355  -0.713
   43   HD11  ILE   5          3HD1      ILE   5  -7.132  -1.833   1.563
   44   HD12  ILE   5          1HD1      ILE   5  -8.322  -1.125   0.471
   45   HD13  ILE   5          2HD1      ILE   5  -8.725  -1.380   2.170
   46    H    GLU   6           HN       GLU   6  -6.869  -1.958  -3.353
   47    HA   GLU   6           HA       GLU   6  -6.785  -4.508  -4.829
   48    HB2  GLU   6           2HB      GLU   6  -7.044  -1.676  -5.760
   49    HB3  GLU   6           3HB      GLU   6  -6.257  -2.852  -6.802
   50    HG2  GLU   6           2HG      GLU   6  -9.083  -2.873  -5.792
   51    HG3  GLU   6           3HG      GLU   6  -8.520  -2.767  -7.459
   52    H    PHE   7           HN       PHE   7  -4.839  -4.905  -6.088
   53    HA   PHE   7           HA       PHE   7  -2.465  -3.456  -5.159
   54    HB2  PHE   7           2HB      PHE   7  -3.002  -6.399  -4.909
   55    HB3  PHE   7           3HB      PHE   7  -1.351  -5.812  -5.082
   56    HD1  PHE   7           1HD      PHE   7  -4.406  -5.070  -3.071
   57    HD2  PHE   7           2HD      PHE   7  -0.166  -5.423  -3.161
   58    HE1  PHE   7           1HE      PHE   7  -4.321  -4.616  -0.655
   59    HE2  PHE   7           2HE      PHE   7  -0.073  -4.970  -0.745
   60    HZ   PHE   7           HZ       PHE   7  -2.152  -4.567   0.512
   61    H    ASP   8           HN       ASP   8  -1.194  -2.895  -6.794
   62    HA   ASP   8           HA       ASP   8  -1.758  -3.403  -9.460
   63    HB2  ASP   8           2HB      ASP   8   0.570  -2.310  -7.976
   64    HB3  ASP   8           3HB      ASP   8   0.858  -2.823  -9.636
   65    HA   PRO   9           HA       PRO   9  -0.093  -7.323 -10.504
   66    HB2  PRO   9           2HB      PRO   9   1.100  -6.859 -12.898
   67    HB3  PRO   9           3HB      PRO   9  -0.655  -6.886 -12.689
   68    HG2  PRO   9           2HG      PRO   9   1.199  -4.540 -12.834
   69    HG3  PRO   9           3HG      PRO   9  -0.388  -4.761 -13.594
   70    HD2  PRO   9           2HD      PRO   9  -0.044  -3.310 -11.335
   71    HD3  PRO   9           3HD      PRO   9  -1.527  -4.229 -11.663
   72    H    ARG  10           HN       ARG  10   1.988  -4.681  -9.972
   73    HA   ARG  10           HA       ARG  10   4.410  -6.298 -10.228
   74    HB2  ARG  10           2HB      ARG  10   3.873  -3.366  -9.897
   75    HB3  ARG  10           3HB      ARG  10   5.456  -4.020  -9.499
   76    HG2  ARG  10           2HG      ARG  10   4.225  -4.624 -12.150
   77    HG3  ARG  10           3HG      ARG  10   5.003  -3.065 -11.868
   78    HD2  ARG  10           2HD      ARG  10   6.974  -4.491 -10.976
   79    HD3  ARG  10           3HD      ARG  10   6.200  -5.810 -11.854
   80    HE   ARG  10           HE       ARG  10   7.664  -3.619 -12.972
   81   HH11  ARG  10          2HH1      ARG  10   5.120  -5.921 -13.562
   82   HH12  ARG  10          1HH1      ARG  10   5.296  -5.872 -15.284
   83   HH21  ARG  10          2HH2      ARG  10   7.907  -3.546 -15.239
   84   HH22  ARG  10          1HH2      ARG  10   6.883  -4.521 -16.238
   85    H    ALA  11           HN       ALA  11   2.724  -4.319  -7.800
   86    HA   ALA  11           HA       ALA  11   4.420  -4.903  -5.644
   87    HB1  ALA  11           1HB      ALA  11   2.738  -3.074  -5.698
   88    HB2  ALA  11           2HB      ALA  11   1.474  -4.287  -5.488
   89    HB3  ALA  11           3HB      ALA  11   2.684  -4.046  -4.228
   90    H    GLU  12           HN       GLU  12   1.575  -6.572  -6.898
   91    HA   GLU  12           HA       GLU  12   1.061  -8.350  -4.855
   92    HB2  GLU  12           2HB      GLU  12   0.730  -8.438  -7.814
   93    HB3  GLU  12           3HB      GLU  12   0.530  -9.941  -6.924
   94    HG2  GLU  12           2HG      GLU  12  -0.970  -7.400  -6.339
   95    HG3  GLU  12           3HG      GLU  12  -1.584  -8.727  -7.323
   96    H    LYS  13           HN       LYS  13   3.432  -8.655  -7.474
   97    HA   LYS  13           HA       LYS  13   4.360 -11.223  -6.684
   98    HB2  LYS  13           2HB      LYS  13   5.299  -9.101  -8.563
   99    HB3  LYS  13           3HB      LYS  13   6.426 -10.370  -8.104
  100    HG2  LYS  13           2HG      LYS  13   3.692 -11.014  -9.147
  101    HG3  LYS  13           3HG      LYS  13   5.047 -10.690 -10.232
  102    HD2  LYS  13           2HD      LYS  13   5.183 -12.739  -8.032
  103    HD3  LYS  13           3HD      LYS  13   4.610 -13.124  -9.656
  104    HE2  LYS  13           2HE      LYS  13   6.751 -12.338 -10.576
  105    HE3  LYS  13           3HE      LYS  13   7.318 -12.001  -8.941
  106    HZ1  LYS  13           3HZ      LYS  13   6.585 -14.544  -8.695
  107    HZ2  LYS  13           1HZ      LYS  13   8.149 -14.067  -9.129
  108    HZ3  LYS  13           2HZ      LYS  13   7.048 -14.539 -10.322
  109    H    GLU  14           HN       GLU  14   5.604  -7.933  -6.182
  110    HA   GLU  14           HA       GLU  14   7.904  -8.679  -4.740
  111    HB2  GLU  14           2HB      GLU  14   6.310  -6.144  -4.944
  112    HB3  GLU  14           3HB      GLU  14   7.646  -6.267  -3.808
  113    HG2  GLU  14           2HG      GLU  14   8.134  -7.051  -6.628
  114    HG3  GLU  14           3HG      GLU  14   7.971  -5.336  -6.252
  115    H    LEU  15           HN       LEU  15   4.574  -8.363  -3.827
  116    HA   LEU  15           HA       LEU  15   5.011  -8.168  -1.012
  117    HB2  LEU  15           2HB      LEU  15   2.938  -7.469  -2.276
  118    HB3  LEU  15           3HB      LEU  15   2.535  -9.181  -2.388
  119    HG   LEU  15           HG       LEU  15   1.260  -8.286  -0.605
  120   HD11  LEU  15          1HD1      LEU  15   3.551  -9.497   0.884
  121   HD12  LEU  15          2HD1      LEU  15   2.633 -10.460  -0.273
  122   HD13  LEU  15          3HD1      LEU  15   1.817  -9.730   1.110
  123   HD21  LEU  15          3HD2      LEU  15   2.616  -6.234  -0.306
  124   HD22  LEU  15          1HD2      LEU  15   3.809  -7.189   0.576
  125   HD23  LEU  15          2HD2      LEU  15   2.176  -7.007   1.217
  126    H    GLU  16           HN       GLU  16   4.047 -10.831  -3.167
  127    HA   GLU  16           HA       GLU  16   3.913 -12.815  -1.182
  128    HB2  GLU  16           2HB      GLU  16   4.284 -12.883  -4.161
  129    HB3  GLU  16           3HB      GLU  16   4.370 -14.364  -3.218
  130    HG2  GLU  16           2HG      GLU  16   2.096 -13.690  -2.277
  131    HG3  GLU  16           3HG      GLU  16   2.037 -12.525  -3.599
  132    H    LYS  17           HN       LYS  17   6.588 -11.493  -2.995
  133    HA   LYS  17           HA       LYS  17   8.480 -13.519  -2.509
  134    HB2  LYS  17           2HB      LYS  17   8.708 -10.587  -3.134
  135    HB3  LYS  17           3HB      LYS  17  10.138 -11.563  -2.825
  136    HG2  LYS  17           2HG      LYS  17   9.217 -13.119  -4.650
  137    HG3  LYS  17           3HG      LYS  17   8.181 -11.757  -5.081
  138    HD2  LYS  17           2HD      LYS  17  10.071 -10.367  -5.527
  139    HD3  LYS  17           3HD      LYS  17  11.180 -11.562  -4.850
  140    HE2  LYS  17           2HE      LYS  17  10.786 -13.064  -6.654
  141    HE3  LYS  17           3HE      LYS  17   9.440 -12.093  -7.249
  142    HZ1  LYS  17           3HZ      LYS  17  11.430 -10.315  -7.305
  143    HZ2  LYS  17           1HZ      LYS  17  10.998 -11.283  -8.623
  144    HZ3  LYS  17           2HZ      LYS  17  12.289 -11.736  -7.630
  145    H    LEU  18           HN       LEU  18   7.509 -10.690  -0.645
  146    HA   LEU  18           HA       LEU  18   9.540 -10.717   1.274
  147    HB2  LEU  18           2HB      LEU  18   6.658  -9.868   1.475
  148    HB3  LEU  18           3HB      LEU  18   7.852  -9.582   2.739
  149    HG   LEU  18           HG       LEU  18   8.214  -8.534  -0.055
  150   HD11  LEU  18          1HD1      LEU  18   6.086  -7.826   1.512
  151   HD12  LEU  18          2HD1      LEU  18   6.822  -6.818   0.266
  152   HD13  LEU  18          3HD1      LEU  18   7.299  -6.624   1.953
  153   HD21  LEU  18          3HD2      LEU  18   9.974  -8.688   1.972
  154   HD22  LEU  18          1HD2      LEU  18   9.220  -7.136   2.340
  155   HD23  LEU  18          2HD2      LEU  18   9.980  -7.396   0.770
  156    H    ASP  19           HN       ASP  19   9.085 -11.202   3.663
  157    HA   ASP  19           HA       ASP  19   8.866 -13.952   4.022
  158    HB2  ASP  19           2HB      ASP  19   9.852 -12.130   5.584
  159    HB3  ASP  19           3HB      ASP  19   8.216 -12.016   6.228
  160    H    ARG  20           HN       ARG  20   7.241 -15.327   4.575
  161    HA   ARG  20           HA       ARG  20   4.639 -14.807   3.785
  162    HB2  ARG  20           2HB      ARG  20   5.754 -16.870   5.680
  163    HB3  ARG  20           3HB      ARG  20   4.061 -16.841   5.208
  164    HG2  ARG  20           2HG      ARG  20   4.700 -17.119   2.870
  165    HG3  ARG  20           3HG      ARG  20   6.402 -17.133   3.337
  166    HD2  ARG  20           2HD      ARG  20   4.310 -19.119   4.222
  167    HD3  ARG  20           3HD      ARG  20   5.537 -19.398   2.986
  168    HE   ARG  20           HE       ARG  20   5.886 -19.558   5.810
  169   HH11  ARG  20          2HH1      ARG  20   7.500 -18.754   2.832
  170   HH12  ARG  20          1HH1      ARG  20   9.081 -19.117   3.440
  171   HH21  ARG  20          2HH2      ARG  20   7.963 -20.039   6.621
  172   HH22  ARG  20          1HH2      ARG  20   9.343 -19.848   5.595
  173    H    GLU  21           HN       GLU  21   5.984 -14.794   7.077
  174    HA   GLU  21           HA       GLU  21   3.641 -14.206   8.460
  175    HB2  GLU  21           2HB      GLU  21   6.526 -13.558   9.040
  176    HB3  GLU  21           3HB      GLU  21   5.233 -13.144  10.157
  177    HG2  GLU  21           2HG      GLU  21   4.622 -15.489  10.346
  178    HG3  GLU  21           3HG      GLU  21   5.886 -15.920   9.196
  179    H    VAL  22           HN       VAL  22   6.084 -11.977   7.151
  180    HA   VAL  22           HA       VAL  22   4.869  -9.592   7.972
  181    HB   VAL  22           HB       VAL  22   6.559 -10.031   5.506
  182   HG11  VAL  22          1HG1      VAL  22   6.771  -7.774   5.288
  183   HG12  VAL  22          2HG1      VAL  22   5.149  -7.830   5.983
  184   HG13  VAL  22          3HG1      VAL  22   6.539  -7.474   7.010
  185   HG21  VAL  22          3HG2      VAL  22   7.560 -10.804   7.677
  186   HG22  VAL  22          1HG2      VAL  22   8.466  -9.542   6.843
  187   HG23  VAL  22          2HG2      VAL  22   7.465  -9.134   8.236
  188    H    ALA  23           HN       ALA  23   4.701 -11.223   4.806
  189    HA   ALA  23           HA       ALA  23   3.082  -9.577   3.395
  190    HB1  ALA  23           1HB      ALA  23   4.014 -11.960   2.858
  191    HB2  ALA  23           2HB      ALA  23   2.405 -12.481   3.360
  192    HB3  ALA  23           3HB      ALA  23   2.586 -11.350   2.019
  193    H    ARG  24           HN       ARG  24   1.870 -12.131   5.574
  194    HA   ARG  24           HA       ARG  24  -0.843 -11.473   5.343
  195    HB2  ARG  24           2HB      ARG  24   0.704 -12.847   7.539
  196    HB3  ARG  24           3HB      ARG  24  -1.047 -12.677   7.567
  197    HG2  ARG  24           2HG      ARG  24  -1.257 -13.980   5.557
  198    HG3  ARG  24           3HG      ARG  24   0.497 -14.048   5.377
  199    HD2  ARG  24           2HD      ARG  24   0.696 -15.341   7.405
  200    HD3  ARG  24           3HD      ARG  24  -1.031 -15.174   7.720
  201    HE   ARG  24           HE       ARG  24  -0.849 -16.359   5.249
  202   HH11  ARG  24          2HH1      ARG  24   0.239 -17.093   8.473
  203   HH12  ARG  24          1HH1      ARG  24   0.168 -18.810   8.247
  204   HH21  ARG  24          2HH2      ARG  24  -0.947 -18.617   4.939
  205   HH22  ARG  24          1HH2      ARG  24  -0.506 -19.675   6.236
  206    H    ARG  25           HN       ARG  25   1.655 -10.322   7.555
  207    HA   ARG  25           HA       ARG  25   0.020  -8.894   9.320
  208    HB2  ARG  25           2HB      ARG  25   2.284  -9.264   9.939
  209    HB3  ARG  25           3HB      ARG  25   2.885  -8.513   8.467
  210    HG2  ARG  25           2HG      ARG  25   2.509  -6.377   9.240
  211    HG3  ARG  25           3HG      ARG  25   1.278  -6.899  10.393
  212    HD2  ARG  25           2HD      ARG  25   4.241  -7.427  10.599
  213    HD3  ARG  25           3HD      ARG  25   3.337  -6.231  11.527
  214    HE   ARG  25           HE       ARG  25   3.482  -9.050  12.019
  215   HH11  ARG  25          2HH1      ARG  25   1.525  -6.197  12.405
  216   HH12  ARG  25          1HH1      ARG  25   0.667  -6.812  13.778
  217   HH21  ARG  25          2HH2      ARG  25   2.360  -9.871  13.827
  218   HH22  ARG  25          1HH2      ARG  25   1.144  -8.902  14.587
  219    H    ILE  26           HN       ILE  26   1.445  -7.982   6.224
  220    HA   ILE  26           HA       ILE  26   0.699  -5.245   6.340
  221    HB   ILE  26           HB       ILE  26   1.268  -6.959   3.919
  222   HG12  ILE  26          2HG1      ILE  26   3.122  -5.026   5.312
  223   HG13  ILE  26          3HG1      ILE  26   3.087  -6.746   5.685
  224   HG21  ILE  26          1HG2      ILE  26   0.100  -4.491   3.946
  225   HG22  ILE  26          2HG2      ILE  26   1.809  -4.090   3.781
  226   HG23  ILE  26          3HG2      ILE  26   1.037  -5.158   2.609
  227   HD11  ILE  26          3HD1      ILE  26   4.723  -5.621   3.873
  228   HD12  ILE  26          1HD1      ILE  26   4.191  -7.301   3.816
  229   HD13  ILE  26          2HD1      ILE  26   3.370  -6.083   2.839
  230    H    LEU  27           HN       LEU  27  -0.649  -7.914   4.388
  231    HA   LEU  27           HA       LEU  27  -2.820  -6.652   3.309
  232    HB2  LEU  27           2HB      LEU  27  -2.576  -9.476   4.320
  233    HB3  LEU  27           3HB      LEU  27  -3.950  -8.899   3.379
  234    HG   LEU  27           HG       LEU  27  -1.119  -8.807   2.360
  235   HD11  LEU  27          1HD1      LEU  27  -2.518 -11.124   2.914
  236   HD12  LEU  27          2HD1      LEU  27  -1.168 -10.957   1.792
  237   HD13  LEU  27          3HD1      LEU  27  -2.825 -10.844   1.200
  238   HD21  LEU  27          3HD2      LEU  27  -3.737  -8.002   1.368
  239   HD22  LEU  27          1HD2      LEU  27  -2.866  -9.056   0.254
  240   HD23  LEU  27          2HD2      LEU  27  -2.124  -7.555   0.809
  241    H    ARG  28           HN       ARG  28  -2.884  -8.512   6.355
  242    HA   ARG  28           HA       ARG  28  -5.474  -7.916   7.122
  243    HB2  ARG  28           2HB      ARG  28  -2.985  -8.611   8.631
  244    HB3  ARG  28           3HB      ARG  28  -4.422  -8.130   9.524
  245    HG2  ARG  28           2HG      ARG  28  -5.677  -9.926   8.338
  246    HG3  ARG  28           3HG      ARG  28  -4.146 -10.457   7.638
  247    HD2  ARG  28           2HD      ARG  28  -4.613 -11.806   9.565
  248    HD3  ARG  28           3HD      ARG  28  -3.259 -10.742   9.941
  249    HE   ARG  28           HE       ARG  28  -5.818  -9.696  10.734
  250   HH11  ARG  28          2HH1      ARG  28  -3.127 -11.704  11.656
  251   HH12  ARG  28          1HH1      ARG  28  -3.412 -11.530  13.356
  252   HH21  ARG  28          2HH2      ARG  28  -6.203  -9.460  12.970
  253   HH22  ARG  28          1HH2      ARG  28  -5.163 -10.254  14.102
  254    H    PHE  29           HN       PHE  29  -2.494  -6.115   7.812
  255    HA   PHE  29           HA       PHE  29  -3.527  -4.157   9.476
  256    HB2  PHE  29           2HB      PHE  29  -1.197  -4.166   9.273
  257    HB3  PHE  29           3HB      PHE  29  -1.254  -4.175   7.514
  258    HD1  PHE  29           1HD      PHE  29  -1.817  -2.070  10.500
  259    HD2  PHE  29           2HD      PHE  29  -1.211  -2.174   6.289
  260    HE1  PHE  29           1HE      PHE  29  -1.527   0.374  10.485
  261    HE2  PHE  29           2HE      PHE  29  -0.918   0.268   6.266
  262    HZ   PHE  29           HZ       PHE  29  -1.076   1.546   8.366
  263    H    LEU  30           HN       LEU  30  -3.710  -4.457   5.993
  264    HA   LEU  30           HA       LEU  30  -4.879  -1.816   5.688
  265    HB2  LEU  30           2HB      LEU  30  -4.278  -4.027   3.736
  266    HB3  LEU  30           3HB      LEU  30  -5.068  -2.519   3.281
  267    HG   LEU  30           HG       LEU  30  -2.400  -2.441   4.627
  268   HD11  LEU  30          1HD1      LEU  30  -2.841  -3.874   2.262
  269   HD12  LEU  30          2HD1      LEU  30  -1.297  -3.351   2.933
  270   HD13  LEU  30          3HD1      LEU  30  -2.145  -2.330   1.772
  271   HD21  LEU  30          3HD2      LEU  30  -3.091  -0.673   2.384
  272   HD22  LEU  30          1HD2      LEU  30  -2.362  -0.300   3.946
  273   HD23  LEU  30          2HD2      LEU  30  -4.109  -0.504   3.814
  274    H    ARG  31           HN       ARG  31  -5.868  -5.176   5.744
  275    HA   ARG  31           HA       ARG  31  -8.573  -4.576   4.914
  276    HB2  ARG  31           2HB      ARG  31  -7.066  -7.047   5.651
  277    HB3  ARG  31           3HB      ARG  31  -8.822  -7.078   5.720
  278    HG2  ARG  31           2HG      ARG  31  -8.417  -7.840   3.592
  279    HG3  ARG  31           3HG      ARG  31  -8.671  -6.117   3.312
  280    HD2  ARG  31           2HD      ARG  31  -6.362  -5.711   3.076
  281    HD3  ARG  31           3HD      ARG  31  -5.938  -7.280   3.761
  282    HE   ARG  31           HE       ARG  31  -6.724  -6.720   1.036
  283   HH11  ARG  31          2HH1      ARG  31  -6.300  -9.138   3.504
  284   HH12  ARG  31          1HH1      ARG  31  -6.160 -10.448   2.380
  285   HH21  ARG  31          2HH2      ARG  31  -6.542  -8.436  -0.455
  286   HH22  ARG  31          1HH2      ARG  31  -6.297 -10.048   0.128
  287    H    GLU  32           HN       GLU  32  -6.865  -4.275   7.752
  288    HA   GLU  32           HA       GLU  32  -9.293  -4.604   9.389
  289    HB2  GLU  32           2HB      GLU  32  -6.379  -4.829  10.141
  290    HB3  GLU  32           3HB      GLU  32  -7.672  -4.732  11.328
  291    HG2  GLU  32           2HG      GLU  32  -6.986  -6.937   9.448
  292    HG3  GLU  32           3HG      GLU  32  -7.335  -6.996  11.175
  293    H    ARG  33           HN       ARG  33  -6.243  -2.769   9.628
  294    HA   ARG  33           HA       ARG  33  -7.396  -0.622  11.046
  295    HB2  ARG  33           2HB      ARG  33  -4.887  -0.543   9.364
  296    HB3  ARG  33           3HB      ARG  33  -5.301   0.524  10.699
  297    HG2  ARG  33           2HG      ARG  33  -5.085  -2.414  11.167
  298    HG3  ARG  33           3HG      ARG  33  -3.626  -1.427  11.058
  299    HD2  ARG  33           2HD      ARG  33  -4.078  -0.301  12.994
  300    HD3  ARG  33           3HD      ARG  33  -5.824  -0.472  12.812
  301    HE   ARG  33           HE       ARG  33  -4.021  -2.303  14.121
  302   HH11  ARG  33          2HH1      ARG  33  -7.134  -1.889  12.619
  303   HH12  ARG  33          1HH1      ARG  33  -7.855  -3.234  13.440
  304   HH21  ARG  33          2HH2      ARG  33  -4.958  -4.076  15.208
  305   HH22  ARG  33          1HH2      ARG  33  -6.616  -4.477  14.913
  306    H    VAL  34           HN       VAL  34  -5.979  -0.417   7.782
  307    HA   VAL  34           HA       VAL  34  -7.174   1.970   7.048
  308    HB   VAL  34           HB       VAL  34  -6.447  -0.329   5.227
  309   HG11  VAL  34          1HG1      VAL  34  -6.517   2.571   4.469
  310   HG12  VAL  34          2HG1      VAL  34  -6.503   1.150   3.423
  311   HG13  VAL  34          3HG1      VAL  34  -7.953   1.555   4.342
  312   HG21  VAL  34          3HG2      VAL  34  -4.844   1.455   6.808
  313   HG22  VAL  34          1HG2      VAL  34  -4.341   0.107   5.788
  314   HG23  VAL  34          2HG2      VAL  34  -4.533   1.716   5.092
  315    H    ALA  35           HN       ALA  35  -8.370  -1.337   6.646
  316    HA   ALA  35           HA       ALA  35 -10.598  -0.851   5.073
  317    HB1  ALA  35           1HB      ALA  35  -9.736  -3.089   5.722
  318    HB2  ALA  35           2HB      ALA  35 -10.453  -2.857   7.317
  319    HB3  ALA  35           3HB      ALA  35 -11.485  -2.925   5.889
  320    H    THR  36           HN       THR  36 -10.410  -0.890   8.631
  321    HA   THR  36           HA       THR  36 -13.110  -0.063   8.994
  322    HB   THR  36           HB       THR  36 -12.557   0.210  11.339
  323    HG1  THR  36           1HG      THR  36 -10.599   0.766  11.895
  324   HG21  THR  36          3HG2      THR  36 -11.781  -2.176   9.827
  325   HG22  THR  36          1HG2      THR  36 -12.816  -2.022  11.247
  326   HG23  THR  36          2HG2      THR  36 -11.063  -2.079  11.435
  327    H    LEU  37           HN       LEU  37 -10.011   1.621   8.903
  328    HA   LEU  37           HA       LEU  37 -10.661   4.098   9.864
  329    HB2  LEU  37           2HB      LEU  37  -8.882   3.262   7.600
  330    HB3  LEU  37           3HB      LEU  37  -9.050   4.957   8.052
  331    HG   LEU  37           HG       LEU  37  -8.088   2.780   9.906
  332   HD11  LEU  37          1HD1      LEU  37  -6.118   2.924   8.903
  333   HD12  LEU  37          2HD1      LEU  37  -6.050   4.629   9.345
  334   HD13  LEU  37          3HD1      LEU  37  -6.730   4.149   7.791
  335   HD21  LEU  37          3HD2      LEU  37  -9.022   4.542  11.179
  336   HD22  LEU  37          1HD2      LEU  37  -8.299   5.772  10.142
  337   HD23  LEU  37          2HD2      LEU  37  -7.276   4.795  11.196
  338    H    GLU  38           HN       GLU  38 -12.267   5.437   9.409
  339    HA   GLU  38           HA       GLU  38 -14.067   5.215   7.333
  340    HB2  GLU  38           2HB      GLU  38 -13.248   7.648   8.921
  341    HB3  GLU  38           3HB      GLU  38 -14.608   7.636   7.808
  342    HG2  GLU  38           2HG      GLU  38 -15.669   7.222   9.783
  343    HG3  GLU  38           3HG      GLU  38 -15.369   5.578   9.223
  344    H    ASP  39           HN       ASP  39 -10.948   6.765   7.374
  345    HA   ASP  39           HA       ASP  39 -11.253   7.343   4.509
  346    HB2  ASP  39           2HB      ASP  39  -9.582   9.324   5.158
  347    HB3  ASP  39           3HB      ASP  39 -11.332   9.525   5.185
  348    HA   PRO  40           HA       PRO  40  -7.534   4.979   4.226
  349    HB2  PRO  40           2HB      PRO  40  -6.876   5.636   1.675
  350    HB3  PRO  40           3HB      PRO  40  -8.185   4.516   2.071
  351    HG2  PRO  40           2HG      PRO  40  -8.328   7.418   1.352
  352    HG3  PRO  40           3HG      PRO  40  -9.356   6.079   0.810
  353    HD2  PRO  40           2HD      PRO  40 -10.114   7.804   2.756
  354    HD3  PRO  40           3HD      PRO  40 -10.617   6.101   2.740
  355    H    ARG  41           HN       ARG  41  -7.722   8.354   4.210
  356    HA   ARG  41           HA       ARG  41  -4.822   8.690   3.944
  357    HB2  ARG  41           2HB      ARG  41  -7.150  10.582   3.824
  358    HB3  ARG  41           3HB      ARG  41  -5.527  11.185   4.129
  359    HG2  ARG  41           2HG      ARG  41  -4.761  10.223   2.026
  360    HG3  ARG  41           3HG      ARG  41  -6.380   9.589   1.722
  361    HD2  ARG  41           2HD      ARG  41  -6.086  12.497   2.269
  362    HD3  ARG  41           3HD      ARG  41  -5.563  11.890   0.698
  363    HE   ARG  41           HE       ARG  41  -8.086  10.853   1.125
  364   HH11  ARG  41          2HH1      ARG  41  -6.636  14.006   0.848
  365   HH12  ARG  41          1HH1      ARG  41  -8.060  14.747   0.197
  366   HH21  ARG  41          2HH2      ARG  41  -9.967  11.817   0.269
  367   HH22  ARG  41          1HH2      ARG  41  -9.955  13.501  -0.132
  368    H    SER  42           HN       SER  42  -5.579   7.344   6.216
  369    HA   SER  42           HA       SER  42  -5.277   9.366   8.339
  370    HB2  SER  42           2HB      SER  42  -7.345   7.761   8.255
  371    HB3  SER  42           3HB      SER  42  -6.212   6.568   8.889
  372    HG   SER  42           HG       SER  42  -6.012   7.701  10.721
  373    H    LEU  43           HN       LEU  43  -4.327   6.083   7.368
  374    HA   LEU  43           HA       LEU  43  -2.028   6.237   9.180
  375    HB2  LEU  43           2HB      LEU  43  -3.387   3.977   7.750
  376    HB3  LEU  43           3HB      LEU  43  -1.777   3.789   8.442
  377    HG   LEU  43           HG       LEU  43  -4.180   4.620  10.058
  378   HD11  LEU  43          1HD1      LEU  43  -4.649   2.433  10.589
  379   HD12  LEU  43          2HD1      LEU  43  -3.047   1.861  10.123
  380   HD13  LEU  43          3HD1      LEU  43  -4.225   2.290   8.883
  381   HD21  LEU  43          3HD2      LEU  43  -2.117   5.219  11.103
  382   HD22  LEU  43          1HD2      LEU  43  -1.419   3.636  10.759
  383   HD23  LEU  43          2HD2      LEU  43  -2.739   3.784  11.920
  384    H    GLY  44           HN       GLY  44  -2.111   7.801   6.751
  385    HA2  GLY  44           1HA      GLY  44   0.445   7.017   5.681
  386    HA3  GLY  44           2HA      GLY  44  -0.869   6.841   4.529
  387    H    GLU  45           HN       GLU  45   1.260   8.544   4.050
  388    HA   GLU  45           HA       GLU  45  -0.056  11.172   4.239
  389    HB2  GLU  45           2HB      GLU  45   2.044  12.261   4.537
  390    HB3  GLU  45           3HB      GLU  45   1.969  10.956   5.713
  391    HG2  GLU  45           2HG      GLU  45   3.291   9.569   4.069
  392    HG3  GLU  45           3HG      GLU  45   3.549  11.059   3.164
  393    HA   PRO  46           HA       PRO  46   0.219  11.357  -0.142
  394    HB2  PRO  46           2HB      PRO  46   0.325  14.045  -0.504
  395    HB3  PRO  46           3HB      PRO  46  -1.147  13.199  -0.013
  396    HG2  PRO  46           2HG      PRO  46   0.822  14.705   1.666
  397    HG3  PRO  46           3HG      PRO  46  -0.950  14.719   1.736
  398    HD2  PRO  46           2HD      PRO  46   0.565  13.282   3.460
  399    HD3  PRO  46           3HD      PRO  46  -1.043  12.750   2.930
  400    H    LEU  47           HN       LEU  47   1.659  11.710  -1.850
  401    HA   LEU  47           HA       LEU  47   4.426  11.842  -1.095
  402    HB2  LEU  47           2HB      LEU  47   2.902  11.320  -3.589
  403    HB3  LEU  47           3HB      LEU  47   4.578  11.840  -3.745
  404    HG   LEU  47           HG       LEU  47   4.277   9.382  -3.842
  405   HD11  LEU  47          1HD1      LEU  47   6.415   9.592  -3.240
  406   HD12  LEU  47          2HD1      LEU  47   5.870   9.152  -1.622
  407   HD13  LEU  47          3HD1      LEU  47   6.054  10.850  -2.059
  408   HD21  LEU  47          3HD2      LEU  47   3.056   9.893  -1.178
  409   HD22  LEU  47          1HD2      LEU  47   3.978   8.407  -1.412
  410   HD23  LEU  47          2HD2      LEU  47   2.586   8.752  -2.439
  411    H    ARG  48           HN       ARG  48   5.954  13.380  -1.719
  412    HA   ARG  48           HA       ARG  48   4.863  15.933  -2.702
  413    HB2  ARG  48           2HB      ARG  48   6.978  15.586  -0.568
  414    HB3  ARG  48           3HB      ARG  48   6.393  17.120  -1.199
  415    HG2  ARG  48           2HG      ARG  48   4.084  16.339  -0.396
  416    HG3  ARG  48           3HG      ARG  48   4.978  15.146   0.549
  417    HD2  ARG  48           2HD      ARG  48   5.815  18.000   0.686
  418    HD3  ARG  48           3HD      ARG  48   4.357  17.506   1.547
  419    HE   ARG  48           HE       ARG  48   5.661  16.322   3.034
  420   HH11  ARG  48          2HH1      ARG  48   7.592  17.385   0.339
  421   HH12  ARG  48          1HH1      ARG  48   9.098  16.969   1.087
  422   HH21  ARG  48          2HH2      ARG  48   7.638  15.771   4.029
  423   HH22  ARG  48          1HH2      ARG  48   9.123  16.051   3.186
  424    H    GLY  49           HN       GLY  49   5.576  15.565  -4.806
  425    HA2  GLY  49           1HA      GLY  49   8.438  16.002  -5.181
  426    HA3  GLY  49           2HA      GLY  49   7.761  14.548  -5.899
  427    HA   PRO  50           HA       PRO  50   7.189  18.473  -8.577
  428    HB2  PRO  50           2HB      PRO  50   9.294  18.175 -10.266
  429    HB3  PRO  50           3HB      PRO  50   9.386  19.116  -8.773
  430    HG2  PRO  50           2HG      PRO  50  10.295  16.314  -9.304
  431    HG3  PRO  50           3HG      PRO  50  11.115  17.605  -8.407
  432    HD2  PRO  50           2HD      PRO  50   9.762  15.607  -7.177
  433    HD3  PRO  50           3HD      PRO  50   9.866  17.246  -6.503
  434    H    GLU  51           HN       GLU  51   8.437  15.267  -9.470
  435    HA   GLU  51           HA       GLU  51   7.106  15.247 -12.007
  436    HB2  GLU  51           2HB      GLU  51   8.325  12.959 -10.450
  437    HB3  GLU  51           3HB      GLU  51   7.849  12.915 -12.142
  438    HG2  GLU  51           2HG      GLU  51   9.625  14.186 -12.823
  439    HG3  GLU  51           3HG      GLU  51   9.799  14.978 -11.258
  440    H    LEU  52           HN       LEU  52   6.733  12.954  -9.308
  441    HA   LEU  52           HA       LEU  52   4.347  11.841 -10.007
  442    HB2  LEU  52           2HB      LEU  52   3.957  11.489  -7.560
  443    HB3  LEU  52           3HB      LEU  52   5.530  10.963  -8.157
  444    HG   LEU  52           HG       LEU  52   6.228  13.384  -7.299
  445   HD11  LEU  52          1HD1      LEU  52   3.733  12.688  -5.796
  446   HD12  LEU  52          2HD1      LEU  52   4.216  14.231  -6.501
  447   HD13  LEU  52          3HD1      LEU  52   5.016  13.637  -5.046
  448   HD21  LEU  52          3HD2      LEU  52   7.009  11.042  -6.620
  449   HD22  LEU  52          1HD2      LEU  52   5.858  11.184  -5.291
  450   HD23  LEU  52          2HD2      LEU  52   7.183  12.340  -5.438
  451    H    GLY  53           HN       GLY  53   2.149  12.165  -9.291
  452    HA2  GLY  53           1HA      GLY  53   1.514  15.033  -9.029
  453    HA3  GLY  53           2HA      GLY  53   0.464  13.836  -9.772
  454    H    ARG  54           HN       ARG  54  -0.068  11.953  -8.168
  455    HA   ARG  54           HA       ARG  54  -0.408  12.904  -5.435
  456    HB2  ARG  54           2HB      ARG  54  -2.632  12.467  -7.384
  457    HB3  ARG  54           3HB      ARG  54  -2.892  12.055  -5.694
  458    HG2  ARG  54           2HG      ARG  54  -1.931  14.482  -5.315
  459    HG3  ARG  54           3HG      ARG  54  -2.513  14.708  -6.966
  460    HD2  ARG  54           2HD      ARG  54  -4.295  13.441  -4.933
  461    HD3  ARG  54           3HD      ARG  54  -4.080  15.191  -4.928
  462    HE   ARG  54           HE       ARG  54  -5.489  13.610  -6.897
  463   HH11  ARG  54          2HH1      ARG  54  -3.989  16.660  -6.145
  464   HH12  ARG  54          1HH1      ARG  54  -4.875  17.540  -7.346
  465   HH21  ARG  54          2HH2      ARG  54  -6.662  14.757  -8.481
  466   HH22  ARG  54          1HH2      ARG  54  -6.396  16.457  -8.673
  467    H    PHE  55           HN       PHE  55   0.107  11.305  -4.108
  468    HA   PHE  55           HA       PHE  55  -0.812   8.611  -4.568
  469    HB2  PHE  55           2HB      PHE  55   2.130   9.286  -4.669
  470    HB3  PHE  55           3HB      PHE  55   1.523   7.659  -4.378
  471    HD1  PHE  55           1HD      PHE  55  -0.629   7.310  -6.215
  472    HD2  PHE  55           2HD      PHE  55   3.038   9.398  -6.772
  473    HE1  PHE  55           1HE      PHE  55  -0.787   6.934  -8.641
  474    HE2  PHE  55           2HE      PHE  55   2.885   9.027  -9.199
  475    HZ   PHE  55           HZ       PHE  55   0.970   7.794 -10.137
  476    H    TRP  56           HN       TRP  56  -0.995   7.466  -2.699
  477    HA   TRP  56           HA       TRP  56  -0.193   8.867  -0.245
  478    HB2  TRP  56           2HB      TRP  56  -2.654   8.097  -0.858
  479    HB3  TRP  56           3HB      TRP  56  -2.089   6.560  -0.209
  480    HD1  TRP  56           1HD      TRP  56  -1.969   6.324   2.380
  481    HE1  TRP  56           1HE      TRP  56  -2.526   7.880   4.353
  482    HE3  TRP  56           3HE      TRP  56  -2.583  10.702  -0.188
  483    HZ2  TRP  56           2HZ      TRP  56  -3.144  10.603   4.766
  484    HZ3  TRP  56           3HZ      TRP  56  -3.156  12.737   1.071
  485    HH2  TRP  56           2HH      TRP  56  -3.431  12.686   3.497
  486    H    LYS  57           HN       LYS  57   0.836   7.772   1.440
  487    HA   LYS  57           HA       LYS  57   1.865   5.090   0.814
  488    HB2  LYS  57           2HB      LYS  57   4.064   5.654   1.222
  489    HB3  LYS  57           3HB      LYS  57   3.482   7.119   0.442
  490    HG2  LYS  57           2HG      LYS  57   3.092   8.076   2.720
  491    HG3  LYS  57           3HG      LYS  57   3.909   6.658   3.383
  492    HD2  LYS  57           2HD      LYS  57   5.535   8.387   3.226
  493    HD3  LYS  57           3HD      LYS  57   5.876   7.240   1.928
  494    HE2  LYS  57           2HE      LYS  57   5.232   8.696   0.288
  495    HE3  LYS  57           3HE      LYS  57   4.080   9.530   1.329
  496    HZ1  LYS  57           3HZ      LYS  57   6.061  10.867   0.748
  497    HZ2  LYS  57           1HZ      LYS  57   7.027   9.764   1.593
  498    HZ3  LYS  57           2HZ      LYS  57   5.857  10.667   2.415
  499    H    TYR  58           HN       TYR  58   1.755   3.674   2.450
  500    HA   TYR  58           HA       TYR  58   0.911   4.700   5.073
  501    HB2  TYR  58           2HB      TYR  58   0.568   1.938   3.888
  502    HB3  TYR  58           3HB      TYR  58  -0.017   2.454   5.466
  503    HD1  TYR  58           2HD      TYR  58  -0.461   2.843   1.827
  504    HD2  TYR  58           1HD      TYR  58  -2.022   3.739   5.682
  505    HE1  TYR  58           2HE      TYR  58  -2.563   3.593   0.795
  506    HE2  TYR  58           1HE      TYR  58  -4.129   4.491   4.661
  507    HH   TYR  58           HH       TYR  58  -5.388   4.254   2.652
  508    H    ARG  59           HN       ARG  59   1.711   3.603   6.986
  509    HA   ARG  59           HA       ARG  59   4.406   2.475   6.593
  510    HB2  ARG  59           2HB      ARG  59   4.672   4.644   7.552
  511    HB3  ARG  59           3HB      ARG  59   3.389   4.356   8.720
  512    HG2  ARG  59           2HG      ARG  59   4.718   3.062  10.069
  513    HG3  ARG  59           3HG      ARG  59   5.792   2.598   8.748
  514    HD2  ARG  59           2HD      ARG  59   6.560   4.998   8.686
  515    HD3  ARG  59           3HD      ARG  59   5.661   5.241  10.183
  516    HE   ARG  59           HE       ARG  59   8.193   3.947   9.886
  517   HH11  ARG  59          2HH1      ARG  59   5.283   4.050  11.794
  518   HH12  ARG  59          1HH1      ARG  59   6.041   3.426  13.222
  519   HH21  ARG  59          2HH2      ARG  59   9.202   3.124  11.759
  520   HH22  ARG  59          1HH2      ARG  59   8.270   2.901  13.201
  521    H    VAL  60           HN       VAL  60   4.659   0.469   7.306
  522    HA   VAL  60           HA       VAL  60   2.841  -0.517   9.408
  523    HB   VAL  60           HB       VAL  60   3.971  -2.071   7.076
  524   HG11  VAL  60          1HG1      VAL  60   1.888  -3.328   8.681
  525   HG12  VAL  60          2HG1      VAL  60   3.413  -3.986   8.086
  526   HG13  VAL  60          3HG1      VAL  60   3.379  -3.043   9.577
  527   HG21  VAL  60          3HG2      VAL  60   2.198  -1.193   6.024
  528   HG22  VAL  60          1HG2      VAL  60   1.247  -2.311   7.001
  529   HG23  VAL  60          2HG2      VAL  60   1.460  -0.642   7.528
  530    H    GLY  61           HN       GLY  61   4.252  -0.163  11.113
  531    HA2  GLY  61           1HA      GLY  61   5.979  -0.625  12.553
  532    HA3  GLY  61           2HA      GLY  61   6.046  -2.193  11.763
  533    H    ASP  62           HN       ASP  62   7.397  -2.424   9.879
  534    HA   ASP  62           HA       ASP  62   9.455  -0.344   9.605
  535    HB2  ASP  62           2HB      ASP  62  11.040  -2.428   9.286
  536    HB3  ASP  62           3HB      ASP  62  10.684  -1.807  10.896
  537    H    TYR  63           HN       TYR  63   7.147  -1.046   7.960
  538    HA   TYR  63           HA       TYR  63   8.593  -1.653   5.474
  539    HB2  TYR  63           2HB      TYR  63   5.933  -2.788   6.345
  540    HB3  TYR  63           3HB      TYR  63   6.521  -2.858   4.688
  541    HD1  TYR  63           1HD      TYR  63   7.222  -3.970   8.149
  542    HD2  TYR  63           2HD      TYR  63   8.083  -4.503   4.017
  543    HE1  TYR  63           1HE      TYR  63   8.441  -6.040   8.677
  544    HE2  TYR  63           2HE      TYR  63   9.303  -6.575   4.532
  545    HH   TYR  63           HH       TYR  63   9.305  -7.954   7.756
  546    H    ARG  64           HN       ARG  64   7.844  -0.605   3.622
  547    HA   ARG  64           HA       ARG  64   5.959   1.600   4.139
  548    HB2  ARG  64           2HB      ARG  64   8.341   1.473   2.286
  549    HB3  ARG  64           3HB      ARG  64   7.165   2.781   2.276
  550    HG2  ARG  64           2HG      ARG  64   8.688   2.025   4.748
  551    HG3  ARG  64           3HG      ARG  64   9.321   3.164   3.558
  552    HD2  ARG  64           2HD      ARG  64   7.382   4.595   3.865
  553    HD3  ARG  64           3HD      ARG  64   6.686   3.438   4.999
  554    HE   ARG  64           HE       ARG  64   9.138   4.071   6.043
  555   HH11  ARG  64          2HH1      ARG  64   6.289   5.846   5.119
  556   HH12  ARG  64          1HH1      ARG  64   6.524   7.093   6.299
  557   HH21  ARG  64          2HH2      ARG  64   9.458   5.706   7.601
  558   HH22  ARG  64          1HH2      ARG  64   8.328   7.012   7.710
  559    H    LEU  65           HN       LEU  65   4.161   1.688   2.953
  560    HA   LEU  65           HA       LEU  65   4.018   0.030   0.520
  561    HB2  LEU  65           2HB      LEU  65   1.643   0.667   2.233
  562    HB3  LEU  65           3HB      LEU  65   1.821  -0.599   1.020
  563    HG   LEU  65           HG       LEU  65   3.103  -0.547   3.751
  564   HD11  LEU  65          1HD1      LEU  65   1.107  -2.537   2.738
  565   HD12  LEU  65          2HD1      LEU  65   0.593  -1.027   3.490
  566   HD13  LEU  65          3HD1      LEU  65   1.574  -2.175   4.399
  567   HD21  LEU  65          3HD2      LEU  65   4.635  -1.867   2.797
  568   HD22  LEU  65          1HD2      LEU  65   3.672  -2.084   1.335
  569   HD23  LEU  65          2HD2      LEU  65   3.358  -3.084   2.754
  570    H    ILE  66           HN       ILE  66   3.951   1.298  -1.208
  571    HA   ILE  66           HA       ILE  66   2.756   3.958  -1.016
  572    HB   ILE  66           HB       ILE  66   4.202   2.773  -3.383
  573   HG12  ILE  66          2HG1      ILE  66   5.827   2.696  -1.683
  574   HG13  ILE  66          3HG1      ILE  66   6.123   4.232  -2.489
  575   HG21  ILE  66          1HG2      ILE  66   2.992   4.655  -4.079
  576   HG22  ILE  66          2HG2      ILE  66   3.355   5.544  -2.601
  577   HG23  ILE  66          3HG2      ILE  66   4.624   5.258  -3.791
  578   HD11  ILE  66          3HD1      ILE  66   6.274   4.709  -0.215
  579   HD12  ILE  66          1HD1      ILE  66   4.664   5.264  -0.673
  580   HD13  ILE  66          2HD1      ILE  66   4.860   3.731   0.178
  581    H    CYS  67           HN       CYS  67   0.595   3.864  -1.234
  582    HA   CYS  67           HA       CYS  67  -0.478   2.388  -3.548
  583    HB2  CYS  67           2HB      CYS  67  -2.060   3.107  -1.084
  584    HB3  CYS  67           3HB      CYS  67  -2.478   1.954  -2.345
  585    HG   CYS  67           HG       CYS  67   0.368   1.082  -0.927
  586    H    HIS  68           HN       HIS  68  -2.415   3.327  -4.536
  587    HA   HIS  68           HA       HIS  68  -2.365   6.270  -4.394
  588    HB2  HIS  68           2HB      HIS  68  -1.560   5.257  -6.540
  589    HB3  HIS  68           3HB      HIS  68  -3.168   4.576  -6.766
  590    HD2  HIS  68           2HD      HIS  68  -3.197   8.182  -5.442
  591    HE1  HIS  68           1HE      HIS  68  -3.937   8.356  -9.616
  592    HE2  HIS  68           2HE      HIS  68  -3.832   9.663  -7.466
  593    H    ILE  69           HN       ILE  69  -4.098   7.085  -3.435
  594    HA   ILE  69           HA       ILE  69  -6.527   5.556  -3.165
  595    HB   ILE  69           HB       ILE  69  -5.888   8.376  -2.294
  596   HG12  ILE  69          2HG1      ILE  69  -6.080   5.859  -0.633
  597   HG13  ILE  69          3HG1      ILE  69  -4.562   6.513  -1.237
  598   HG21  ILE  69          1HG2      ILE  69  -7.977   7.200  -0.777
  599   HG22  ILE  69          2HG2      ILE  69  -8.037   8.627  -1.810
  600   HG23  ILE  69          3HG2      ILE  69  -8.380   7.036  -2.486
  601   HD11  ILE  69          3HD1      ILE  69  -6.408   7.634   0.827
  602   HD12  ILE  69          1HD1      ILE  69  -4.679   7.305   0.935
  603   HD13  ILE  69          2HD1      ILE  69  -5.260   8.667  -0.024
  604    H    GLN  70           HN       GLN  70  -8.077   5.517  -4.640
  605    HA   GLN  70           HA       GLN  70  -8.270   7.707  -6.575
  606    HB2  GLN  70           2HB      GLN  70  -9.258   4.865  -6.572
  607    HB3  GLN  70           3HB      GLN  70  -9.866   6.047  -7.723
  608    HG2  GLN  70           2HG      GLN  70  -8.195   5.161  -8.965
  609    HG3  GLN  70           3HG      GLN  70  -7.287   6.430  -8.145
  610   HE21  GLN  70          1HE2      GLN  70  -5.322   5.594  -7.904
  611   HE22  GLN  70          2HE2      GLN  70  -4.963   4.086  -7.141
  612    H    ASP  71           HN       ASP  71  -9.344   9.229  -5.289
  613    HA   ASP  71           HA       ASP  71 -11.546   8.874  -3.682
  614    HB2  ASP  71           2HB      ASP  71 -10.912  11.216  -5.488
  615    HB3  ASP  71           3HB      ASP  71 -12.113  11.246  -4.200
  616    H    ARG  72           HN       ARG  72 -11.431   9.198  -7.191
  617    HA   ARG  72           HA       ARG  72 -13.960   9.640  -7.963
  618    HB2  ARG  72           2HB      ARG  72 -12.146   7.463  -9.015
  619    HB3  ARG  72           3HB      ARG  72 -13.599   8.021  -9.834
  620    HG2  ARG  72           2HG      ARG  72 -11.408   9.927  -9.104
  621    HG3  ARG  72           3HG      ARG  72 -11.334   8.961 -10.579
  622    HD2  ARG  72           2HD      ARG  72 -12.309  10.971 -11.260
  623    HD3  ARG  72           3HD      ARG  72 -13.674   9.872 -11.070
  624    HE   ARG  72           HE       ARG  72 -13.059  11.492  -8.754
  625   HH11  ARG  72          2HH1      ARG  72 -14.918  11.174 -11.680
  626   HH12  ARG  72          1HH1      ARG  72 -16.147  12.285 -11.174
  627   HH21  ARG  72          2HH2      ARG  72 -14.671  12.956  -8.076
  628   HH22  ARG  72          1HH2      ARG  72 -16.005  13.299  -9.125
  629    H    GLU  73           HN       GLU  73 -12.799   6.367  -7.135
  630    HA   GLU  73           HA       GLU  73 -15.574   5.680  -6.418
  631    HB2  GLU  73           2HB      GLU  73 -13.503   4.133  -7.927
  632    HB3  GLU  73           3HB      GLU  73 -14.692   3.266  -6.965
  633    HG2  GLU  73           2HG      GLU  73 -15.543   5.327  -8.958
  634    HG3  GLU  73           3HG      GLU  73 -15.163   3.679  -9.458
  635    H    ALA  74           HN       ALA  74 -13.092   6.640  -4.894
  636    HA   ALA  74           HA       ALA  74 -12.017   6.225  -2.924
  637    HB1  ALA  74           1HB      ALA  74 -13.535   6.140  -1.300
  638    HB2  ALA  74           2HB      ALA  74 -14.746   5.911  -2.561
  639    HB3  ALA  74           3HB      ALA  74 -14.036   4.511  -1.756
  640    H    THR  75           HN       THR  75 -11.114   4.536  -4.869
  641    HA   THR  75           HA       THR  75 -10.861   1.943  -3.490
  642    HB   THR  75           HB       THR  75 -10.599   2.578  -6.433
  643    HG1  THR  75           1HG      THR  75 -12.395   1.149  -6.559
  644   HG21  THR  75          3HG2      THR  75 -10.364   0.031  -6.584
  645   HG22  THR  75          1HG2      THR  75  -9.940   0.094  -4.874
  646   HG23  THR  75          2HG2      THR  75  -8.951   0.946  -6.060
  647    H    VAL  76           HN       VAL  76  -8.906   1.329  -2.802
  648    HA   VAL  76           HA       VAL  76  -6.624   3.060  -3.430
  649    HB   VAL  76           HB       VAL  76  -6.924   0.992  -1.246
  650   HG11  VAL  76          1HG1      VAL  76  -4.597   1.993  -2.344
  651   HG12  VAL  76          2HG1      VAL  76  -4.854   3.005  -0.921
  652   HG13  VAL  76          3HG1      VAL  76  -4.764   1.251  -0.753
  653   HG21  VAL  76          3HG2      VAL  76  -8.183   2.585  -0.295
  654   HG22  VAL  76          1HG2      VAL  76  -6.656   3.428  -0.035
  655   HG23  VAL  76          2HG2      VAL  76  -7.651   3.819  -1.437
  656    H    LEU  77           HN       LEU  77  -4.907   2.364  -4.553
  657    HA   LEU  77           HA       LEU  77  -4.716  -0.514  -5.152
  658    HB2  LEU  77           2HB      LEU  77  -5.526   0.517  -7.128
  659    HB3  LEU  77           3HB      LEU  77  -4.370   1.841  -6.991
  660    HG   LEU  77           HG       LEU  77  -2.640  -0.166  -7.259
  661   HD11  LEU  77          1HD1      LEU  77  -3.372  -1.956  -8.526
  662   HD12  LEU  77          2HD1      LEU  77  -4.836  -1.124  -9.047
  663   HD13  LEU  77          3HD1      LEU  77  -4.705  -1.724  -7.394
  664   HD21  LEU  77          3HD2      LEU  77  -2.631   0.332  -9.688
  665   HD22  LEU  77          1HD2      LEU  77  -2.686   1.776  -8.677
  666   HD23  LEU  77          2HD2      LEU  77  -4.149   1.207  -9.481
  667    H    VAL  78           HN       VAL  78  -2.925  -1.322  -4.302
  668    HA   VAL  78           HA       VAL  78  -0.772   0.253  -3.361
  669    HB   VAL  78           HB       VAL  78  -0.837  -2.721  -3.891
  670   HG11  VAL  78          1HG1      VAL  78   1.141  -2.942  -2.766
  671   HG12  VAL  78          2HG1      VAL  78   1.401  -1.368  -3.522
  672   HG13  VAL  78          3HG1      VAL  78   0.903  -1.465  -1.832
  673   HG21  VAL  78          3HG2      VAL  78  -2.083  -2.962  -2.064
  674   HG22  VAL  78          1HG2      VAL  78  -0.994  -1.941  -1.126
  675   HG23  VAL  78          2HG2      VAL  78  -2.307  -1.213  -2.051
  676    H    LEU  79           HN       LEU  79   0.642   1.282  -4.603
  677    HA   LEU  79           HA       LEU  79   1.182   0.448  -7.305
  678    HB2  LEU  79           2HB      LEU  79   1.952   2.738  -5.572
  679    HB3  LEU  79           3HB      LEU  79   2.959   2.380  -6.974
  680    HG   LEU  79           HG       LEU  79   1.091   4.141  -7.195
  681   HD11  LEU  79          1HD1      LEU  79   1.616   1.893  -9.107
  682   HD12  LEU  79          2HD1      LEU  79   2.242   3.541  -9.133
  683   HD13  LEU  79          3HD1      LEU  79   0.551   3.234  -9.527
  684   HD21  LEU  79          3HD2      LEU  79  -0.533   1.610  -7.441
  685   HD22  LEU  79          1HD2      LEU  79  -1.088   3.238  -7.833
  686   HD23  LEU  79          2HD2      LEU  79  -0.685   2.821  -6.167
  687    H    ARG  80           HN       ARG  80   3.251   0.969  -4.442
  688    HA   ARG  80           HA       ARG  80   4.972  -1.213  -5.407
  689    HB2  ARG  80           2HB      ARG  80   5.822   1.487  -4.361
  690    HB3  ARG  80           3HB      ARG  80   6.914   0.113  -4.455
  691    HG2  ARG  80           2HG      ARG  80   5.422   1.132  -6.850
  692    HG3  ARG  80           3HG      ARG  80   6.988   1.783  -6.360
  693    HD2  ARG  80           2HD      ARG  80   8.077  -0.261  -6.733
  694    HD3  ARG  80           3HD      ARG  80   6.560  -1.159  -6.766
  695    HE   ARG  80           HE       ARG  80   6.384  -0.684  -8.991
  696   HH11  ARG  80          2HH1      ARG  80   8.631   1.547  -7.543
  697   HH12  ARG  80          1HH1      ARG  80   9.099   2.258  -9.052
  698   HH21  ARG  80          2HH2      ARG  80   6.992   0.244 -10.984
  699   HH22  ARG  80          1HH2      ARG  80   8.165   1.517 -11.009
  700    H    VAL  81           HN       VAL  81   6.330  -2.166  -3.694
  701    HA   VAL  81           HA       VAL  81   5.427  -1.730  -0.960
  702    HB   VAL  81           HB       VAL  81   5.180  -4.420  -2.313
  703   HG11  VAL  81          1HG1      VAL  81   4.708  -5.388  -0.261
  704   HG12  VAL  81          2HG1      VAL  81   6.021  -4.278   0.135
  705   HG13  VAL  81          3HG1      VAL  81   4.353  -3.840   0.503
  706   HG21  VAL  81          3HG2      VAL  81   3.051  -2.682  -1.069
  707   HG22  VAL  81          1HG2      VAL  81   3.357  -2.815  -2.801
  708   HG23  VAL  81          2HG2      VAL  81   2.813  -4.224  -1.891
  709    H    GLY  82           HN       GLY  82   7.247  -1.518   0.159
  710    HA2  GLY  82           1HA      GLY  82   9.271  -3.578   0.051
  711    HA3  GLY  82           2HA      GLY  82   9.805  -2.021  -0.564
  712    H    HIS  83           HN       HIS  83  10.820  -3.444   1.731
  713    HA   HIS  83           HA       HIS  83   9.855  -2.510   4.171
  714    HB2  HIS  83           2HB      HIS  83  11.608  -4.291   3.812
  715    HB3  HIS  83           3HB      HIS  83  12.767  -2.995   3.529
  716    HD2  HIS  83           2HD      HIS  83  11.580  -5.089   6.386
  717    HE1  HIS  83           1HE      HIS  83  13.037  -1.515   8.148
  718    HE2  HIS  83           2HE      HIS  83  12.380  -3.914   8.547
  719    H    ALA  84           HN       ALA  84  10.642  -0.842   5.573
  720    HA   ALA  84           HA       ALA  84  10.654   1.696   4.536
  721    HB1  ALA  84           1HB      ALA  84  10.725   0.659   7.044
  722    HB2  ALA  84           2HB      ALA  84  12.314   1.417   6.939
  723    HB3  ALA  84           3HB      ALA  84  10.860   2.376   6.665
  724    H    ARG  85           HN       ARG  85  13.572   0.006   5.716
  725    HA   ARG  85           HA       ARG  85  15.501   1.779   4.995
  726    HB2  ARG  85           2HB      ARG  85  15.586  -1.231   4.756
  727    HB3  ARG  85           3HB      ARG  85  17.003  -0.196   4.638
  728    HG2  ARG  85           2HG      ARG  85  15.191  -0.334   7.038
  729    HG3  ARG  85           3HG      ARG  85  16.700  -1.232   6.864
  730    HD2  ARG  85           2HD      ARG  85  17.933   0.863   6.661
  731    HD3  ARG  85           3HD      ARG  85  16.428   1.771   6.796
  732    HE   ARG  85           HE       ARG  85  16.487   1.463   9.063
  733   HH11  ARG  85          2HH1      ARG  85  18.695  -0.764   7.551
  734   HH12  ARG  85          1HH1      ARG  85  19.380  -1.304   9.048
  735   HH21  ARG  85          2HH2      ARG  85  17.382   0.761  11.040
  736   HH22  ARG  85          1HH2      ARG  85  18.632  -0.436  11.032
  737    H    ASP  86           HN       ASP  86  13.850  -0.508   2.873
  738    HA   ASP  86           HA       ASP  86  15.429   0.069   0.573
  739    HB2  ASP  86           2HB      ASP  86  14.150  -2.033   0.840
  740    HB3  ASP  86           3HB      ASP  86  12.649  -1.117   0.728
  741    H    VAL  87           HN       VAL  87  11.933   0.636   0.889
  742    HA   VAL  87           HA       VAL  87  11.727   2.560  -1.084
  743    HB   VAL  87           HB       VAL  87  10.054   2.390   1.426
  744   HG11  VAL  87          1HG1      VAL  87   8.482   3.225  -0.707
  745   HG12  VAL  87          2HG1      VAL  87   9.060   4.218   0.633
  746   HG13  VAL  87          3HG1      VAL  87   9.978   4.144  -0.871
  747   HG21  VAL  87          3HG2      VAL  87   8.790   0.745   0.460
  748   HG22  VAL  87          1HG2      VAL  87   9.201   1.242  -1.181
  749   HG23  VAL  87          2HG2      VAL  87  10.370   0.344  -0.213
  750    H    TYR  88           HN       TYR  88  12.311   4.623  -1.263
  751    HA   TYR  88           HA       TYR  88  13.624   5.925   0.959
  752    HB2  TYR  88           2HB      TYR  88  13.889   7.785  -0.820
  753    HB3  TYR  88           3HB      TYR  88  14.760   6.273  -1.055
  754    HD1  TYR  88           2HD      TYR  88  11.157   6.396  -1.624
  755    HD2  TYR  88           1HD      TYR  88  14.986   6.721  -3.450
  756    HE1  TYR  88           2HE      TYR  88  10.116   6.144  -3.838
  757    HE2  TYR  88           1HE      TYR  88  13.955   6.471  -5.669
  758    HH   TYR  88           HH       TYR  88  10.460   5.951  -6.023
  759    H    ARG  89           HN       ARG  89  10.519   5.526   0.377
  760    HA   ARG  89           HA       ARG  89   9.808   8.200   1.376
  761    HB2  ARG  89           2HB      ARG  89   8.423   6.584  -0.758
  762    HB3  ARG  89           3HB      ARG  89   7.610   7.875   0.117
  763    HG2  ARG  89           2HG      ARG  89  10.216   8.451  -1.198
  764    HG3  ARG  89           3HG      ARG  89   8.761   8.325  -2.188
  765    HD2  ARG  89           2HD      ARG  89   8.804  10.578  -1.687
  766    HD3  ARG  89           3HD      ARG  89   7.743   9.944  -0.429
  767    HE   ARG  89           HE       ARG  89  10.342   9.912   0.568
  768   HH11  ARG  89          2HH1      ARG  89   7.968  12.235  -0.475
  769   HH12  ARG  89          1HH1      ARG  89   8.536  13.484   0.583
  770   HH21  ARG  89          2HH2      ARG  89  11.099  11.548   1.965
  771   HH22  ARG  89          1HH2      ARG  89  10.317  13.093   1.969
  Start of MODEL    3
    1    H1   MET   1           HN       MET   1 -20.065   0.723   5.450
    2    HA   MET   1           HA       MET   1 -19.262  -0.225   2.779
    3    HB2  MET   1           2HB      MET   1 -20.417   2.383   3.718
    4    HB3  MET   1           3HB      MET   1 -19.480   2.305   2.232
    5    HG2  MET   1           2HG      MET   1 -21.826   0.505   2.724
    6    HG3  MET   1           3HG      MET   1 -22.009   2.122   2.048
    7    HE1  MET   1           3HE      MET   1 -21.280   2.833  -0.343
    8    HE2  MET   1           1HE      MET   1 -21.600   1.601  -1.563
    9    HE3  MET   1           2HE      MET   1 -22.787   1.917  -0.297
   10    H    GLY   2           HN       GLY   2 -17.444   0.992   1.783
   11    HA2  GLY   2           1HA      GLY   2 -15.680   2.645   3.131
   12    HA3  GLY   2           2HA      GLY   2 -15.204   1.003   3.538
   13    H    TYR   3           HN       TYR   3 -13.245   2.105   2.390
   14    HA   TYR   3           HA       TYR   3 -13.370   2.162  -0.481
   15    HB2  TYR   3           2HB      TYR   3 -11.123   2.428   1.508
   16    HB3  TYR   3           3HB      TYR   3 -10.831   2.392  -0.227
   17    HD1  TYR   3           2HD      TYR   3 -13.127   4.144   2.156
   18    HD2  TYR   3           1HD      TYR   3 -10.586   4.440  -1.244
   19    HE1  TYR   3           2HE      TYR   3 -13.577   6.559   2.037
   20    HE2  TYR   3           1HE      TYR   3 -11.028   6.856  -1.372
   21    HH   TYR   3           HH       TYR   3 -11.782   8.689   0.487
   22    H    ARG   4           HN       ARG   4 -12.247   0.772  -1.911
   23    HA   ARG   4           HA       ARG   4 -12.210  -1.988  -1.005
   24    HB2  ARG   4           2HB      ARG   4 -13.341  -1.547  -3.090
   25    HB3  ARG   4           3HB      ARG   4 -11.917  -0.748  -3.743
   26    HG2  ARG   4           2HG      ARG   4 -12.035  -2.902  -4.722
   27    HG3  ARG   4           3HG      ARG   4 -10.712  -2.931  -3.555
   28    HD2  ARG   4           2HD      ARG   4 -12.366  -3.894  -1.902
   29    HD3  ARG   4           3HD      ARG   4 -13.472  -4.094  -3.261
   30    HE   ARG   4           HE       ARG   4 -11.202  -5.717  -2.636
   31   HH11  ARG   4          2HH1      ARG   4 -13.199  -4.536  -5.231
   32   HH12  ARG   4          1HH1      ARG   4 -12.848  -5.868  -6.282
   33   HH21  ARG   4          2HH2      ARG   4 -10.732  -7.475  -4.010
   34   HH22  ARG   4          1HH2      ARG   4 -11.445  -7.540  -5.586
   35    H    ILE   5           HN       ILE   5 -10.436  -3.372  -1.164
   36    HA   ILE   5           HA       ILE   5  -7.843  -1.999  -1.140
   37    HB   ILE   5           HB       ILE   5  -8.534  -4.768  -0.150
   38   HG12  ILE   5          2HG1      ILE   5  -9.622  -3.107   1.231
   39   HG13  ILE   5          3HG1      ILE   5  -8.236  -3.748   2.107
   40   HG21  ILE   5          1HG2      ILE   5  -6.357  -5.134   0.088
   41   HG22  ILE   5          2HG2      ILE   5  -6.055  -3.645  -0.807
   42   HG23  ILE   5          3HG2      ILE   5  -6.147  -3.612   0.954
   43   HD11  ILE   5          3HD1      ILE   5  -6.944  -1.770   1.514
   44   HD12  ILE   5          1HD1      ILE   5  -8.327  -1.129   0.627
   45   HD13  ILE   5          2HD1      ILE   5  -8.422  -1.343   2.376
   46    H    GLU   6           HN       GLU   6  -7.083  -1.928  -3.183
   47    HA   GLU   6           HA       GLU   6  -7.021  -4.452  -4.701
   48    HB2  GLU   6           2HB      GLU   6  -7.314  -1.601  -5.549
   49    HB3  GLU   6           3HB      GLU   6  -6.540  -2.737  -6.644
   50    HG2  GLU   6           2HG      GLU   6  -9.311  -2.975  -5.496
   51    HG3  GLU   6           3HG      GLU   6  -8.896  -2.528  -7.149
   52    H    PHE   7           HN       PHE   7  -5.118  -4.794  -6.063
   53    HA   PHE   7           HA       PHE   7  -2.709  -3.397  -5.146
   54    HB2  PHE   7           2HB      PHE   7  -3.250  -6.347  -5.016
   55    HB3  PHE   7           3HB      PHE   7  -1.603  -5.756  -5.213
   56    HD1  PHE   7           1HD      PHE   7  -4.596  -5.342  -3.041
   57    HD2  PHE   7           2HD      PHE   7  -0.353  -5.221  -3.348
   58    HE1  PHE   7           1HE      PHE   7  -4.433  -5.002  -0.609
   59    HE2  PHE   7           2HE      PHE   7  -0.183  -4.882  -0.917
   60    HZ   PHE   7           HZ       PHE   7  -2.224  -4.773   0.456
   61    H    ASP   8           HN       ASP   8  -1.046  -3.274  -6.639
   62    HA   ASP   8           HA       ASP   8  -1.835  -3.522  -9.384
   63    HB2  ASP   8           2HB      ASP   8   0.500  -2.423  -7.910
   64    HB3  ASP   8           3HB      ASP   8   0.765  -2.898  -9.586
   65    HA   PRO   9           HA       PRO   9  -0.131  -7.408 -10.491
   66    HB2  PRO   9           2HB      PRO   9   1.014  -6.900 -12.900
   67    HB3  PRO   9           3HB      PRO   9  -0.736  -6.958 -12.662
   68    HG2  PRO   9           2HG      PRO   9   1.078  -4.581 -12.813
   69    HG3  PRO   9           3HG      PRO   9  -0.518  -4.820 -13.549
   70    HD2  PRO   9           2HD      PRO   9  -0.159  -3.386 -11.280
   71    HD3  PRO   9           3HD      PRO   9  -1.633  -4.325 -11.593
   72    H    ARG  10           HN       ARG  10   1.931  -4.721 -10.026
   73    HA   ARG  10           HA       ARG  10   4.363  -6.322 -10.296
   74    HB2  ARG  10           2HB      ARG  10   3.903  -3.375  -9.829
   75    HB3  ARG  10           3HB      ARG  10   5.497  -4.118  -9.790
   76    HG2  ARG  10           2HG      ARG  10   5.269  -4.801 -12.102
   77    HG3  ARG  10           3HG      ARG  10   3.630  -4.147 -12.153
   78    HD2  ARG  10           2HD      ARG  10   5.936  -2.400 -11.390
   79    HD3  ARG  10           3HD      ARG  10   5.603  -2.741 -13.088
   80    HE   ARG  10           HE       ARG  10   3.203  -1.932 -12.086
   81   HH11  ARG  10          2HH1      ARG  10   6.407  -0.573 -12.160
   82   HH12  ARG  10          1HH1      ARG  10   5.851   1.068 -12.184
   83   HH21  ARG  10          2HH2      ARG  10   2.459   0.224 -12.116
   84   HH22  ARG  10          1HH2      ARG  10   3.605   1.520 -12.157
   85    H    ALA  11           HN       ALA  11   2.729  -4.287  -7.875
   86    HA   ALA  11           HA       ALA  11   4.464  -4.821  -5.743
   87    HB1  ALA  11           1HB      ALA  11   2.787  -3.913  -4.318
   88    HB2  ALA  11           2HB      ALA  11   2.726  -3.017  -5.837
   89    HB3  ALA  11           3HB      ALA  11   1.517  -4.255  -5.494
   90    H    GLU  12           HN       GLU  12   1.487  -6.458  -6.766
   91    HA   GLU  12           HA       GLU  12   1.029  -8.206  -4.744
   92    HB2  GLU  12           2HB      GLU  12   0.746  -8.401  -7.697
   93    HB3  GLU  12           3HB      GLU  12   0.586  -9.890  -6.776
   94    HG2  GLU  12           2HG      GLU  12  -0.982  -7.412  -6.134
   95    HG3  GLU  12           3HG      GLU  12  -1.544  -8.633  -7.275
   96    H    LYS  13           HN       LYS  13   3.382  -8.693  -7.367
   97    HA   LYS  13           HA       LYS  13   4.355 -11.166  -6.368
   98    HB2  LYS  13           2HB      LYS  13   5.416  -9.172  -8.358
   99    HB3  LYS  13           3HB      LYS  13   6.332 -10.607  -7.916
  100    HG2  LYS  13           2HG      LYS  13   3.508 -10.928  -8.796
  101    HG3  LYS  13           3HG      LYS  13   4.751 -10.596 -10.005
  102    HD2  LYS  13           2HD      LYS  13   6.048 -12.525  -8.932
  103    HD3  LYS  13           3HD      LYS  13   4.528 -12.938  -8.134
  104    HE2  LYS  13           2HE      LYS  13   4.513 -14.250 -10.059
  105    HE3  LYS  13           3HE      LYS  13   3.511 -12.866 -10.493
  106    HZ1  LYS  13           3HZ      LYS  13   5.530 -11.881 -11.526
  107    HZ2  LYS  13           1HZ      LYS  13   4.987 -13.292 -12.284
  108    HZ3  LYS  13           2HZ      LYS  13   6.334 -13.346 -11.264
  109    H    GLU  14           HN       GLU  14   5.653  -7.853  -6.243
  110    HA   GLU  14           HA       GLU  14   8.002  -8.297  -4.897
  111    HB2  GLU  14           2HB      GLU  14   6.053  -6.008  -4.748
  112    HB3  GLU  14           3HB      GLU  14   7.566  -5.991  -3.854
  113    HG2  GLU  14           2HG      GLU  14   7.548  -6.499  -6.798
  114    HG3  GLU  14           3HG      GLU  14   7.450  -4.857  -6.165
  115    H    LEU  15           HN       LEU  15   4.805  -7.725  -3.440
  116    HA   LEU  15           HA       LEU  15   5.728  -8.128  -0.771
  117    HB2  LEU  15           2HB      LEU  15   3.829  -6.800  -0.931
  118    HB3  LEU  15           3HB      LEU  15   3.044  -7.891  -2.070
  119    HG   LEU  15           HG       LEU  15   3.525  -8.854   0.706
  120   HD11  LEU  15          1HD1      LEU  15   2.333  -6.410   0.361
  121   HD12  LEU  15          2HD1      LEU  15   2.079  -7.495   1.727
  122   HD13  LEU  15          3HD1      LEU  15   0.958  -7.515   0.365
  123   HD21  LEU  15          3HD2      LEU  15   0.965  -9.228  -0.697
  124   HD22  LEU  15          1HD2      LEU  15   1.957 -10.385   0.190
  125   HD23  LEU  15          2HD2      LEU  15   2.372  -9.959  -1.470
  126    H    GLU  16           HN       GLU  16   4.015 -10.143  -3.128
  127    HA   GLU  16           HA       GLU  16   3.496 -12.350  -1.517
  128    HB2  GLU  16           2HB      GLU  16   3.852 -11.929  -4.445
  129    HB3  GLU  16           3HB      GLU  16   3.862 -13.582  -3.847
  130    HG2  GLU  16           2HG      GLU  16   1.671 -13.105  -2.742
  131    HG3  GLU  16           3HG      GLU  16   1.657 -11.557  -3.585
  132    H    LYS  17           HN       LYS  17   6.477 -11.149  -2.671
  133    HA   LYS  17           HA       LYS  17   7.860 -13.694  -2.329
  134    HB2  LYS  17           2HB      LYS  17   8.874 -12.708  -4.113
  135    HB3  LYS  17           3HB      LYS  17   8.496 -11.080  -3.564
  136    HG2  LYS  17           2HG      LYS  17  10.387 -10.926  -2.275
  137    HG3  LYS  17           3HG      LYS  17  10.522 -12.675  -2.073
  138    HD2  LYS  17           2HD      LYS  17  10.998 -12.728  -4.596
  139    HD3  LYS  17           3HD      LYS  17  11.268 -10.990  -4.444
  140    HE2  LYS  17           2HE      LYS  17  12.876 -11.605  -2.544
  141    HE3  LYS  17           3HE      LYS  17  12.788 -13.248  -3.177
  142    HZ1  LYS  17           3HZ      LYS  17  13.951 -12.698  -5.023
  143    HZ2  LYS  17           1HZ      LYS  17  14.588 -11.515  -3.996
  144    HZ3  LYS  17           2HZ      LYS  17  13.357 -11.115  -5.085
  145    H    LEU  18           HN       LEU  18   7.301 -10.703  -0.669
  146    HA   LEU  18           HA       LEU  18   9.464 -10.665   1.095
  147    HB2  LEU  18           2HB      LEU  18   6.628  -9.710   1.385
  148    HB3  LEU  18           3HB      LEU  18   7.853  -9.443   2.624
  149    HG   LEU  18           HG       LEU  18   8.219  -8.485  -0.201
  150   HD11  LEU  18          1HD1      LEU  18   7.405  -6.493   1.773
  151   HD12  LEU  18          2HD1      LEU  18   6.139  -7.649   1.360
  152   HD13  LEU  18          3HD1      LEU  18   6.912  -6.697   0.092
  153   HD21  LEU  18          3HD2      LEU  18   9.826  -7.006   0.773
  154   HD22  LEU  18          1HD2      LEU  18  10.170  -8.638   1.346
  155   HD23  LEU  18          2HD2      LEU  18   9.357  -7.485   2.405
  156    H    ASP  19           HN       ASP  19   9.119 -10.957   3.558
  157    HA   ASP  19           HA       ASP  19   8.983 -13.652   4.149
  158    HB2  ASP  19           2HB      ASP  19   9.955 -11.808   5.585
  159    HB3  ASP  19           3HB      ASP  19   8.311 -11.461   6.116
  160    H    ARG  20           HN       ARG  20   7.349 -15.032   4.098
  161    HA   ARG  20           HA       ARG  20   4.764 -14.641   3.521
  162    HB2  ARG  20           2HB      ARG  20   6.056 -16.663   5.317
  163    HB3  ARG  20           3HB      ARG  20   4.308 -16.663   5.120
  164    HG2  ARG  20           2HG      ARG  20   6.205 -16.774   2.794
  165    HG3  ARG  20           3HG      ARG  20   5.604 -18.215   3.617
  166    HD2  ARG  20           2HD      ARG  20   3.281 -17.392   3.162
  167    HD3  ARG  20           3HD      ARG  20   3.993 -16.125   2.164
  168    HE   ARG  20           HE       ARG  20   5.019 -18.507   1.225
  169   HH11  ARG  20          2HH1      ARG  20   1.876 -17.055   1.587
  170   HH12  ARG  20          1HH1      ARG  20   1.192 -17.884   0.228
  171   HH21  ARG  20          2HH2      ARG  20   4.130 -19.605  -0.566
  172   HH22  ARG  20          1HH2      ARG  20   2.475 -19.335  -0.995
  173    H    GLU  21           HN       GLU  21   5.967 -14.733   6.878
  174    HA   GLU  21           HA       GLU  21   3.591 -14.135   8.169
  175    HB2  GLU  21           2HB      GLU  21   6.012 -14.698   9.066
  176    HB3  GLU  21           3HB      GLU  21   6.134 -12.949   9.193
  177    HG2  GLU  21           2HG      GLU  21   4.407 -12.826  10.763
  178    HG3  GLU  21           3HG      GLU  21   3.837 -14.452  10.393
  179    H    VAL  22           HN       VAL  22   6.098 -11.876   7.039
  180    HA   VAL  22           HA       VAL  22   4.862  -9.510   7.858
  181    HB   VAL  22           HB       VAL  22   6.738 -10.039   5.556
  182   HG11  VAL  22          1HG1      VAL  22   6.863  -7.331   6.307
  183   HG12  VAL  22          2HG1      VAL  22   6.312  -8.006   4.772
  184   HG13  VAL  22          3HG1      VAL  22   5.157  -7.708   6.071
  185   HG21  VAL  22          3HG2      VAL  22   7.417 -10.323   8.029
  186   HG22  VAL  22          1HG2      VAL  22   8.456  -9.364   6.974
  187   HG23  VAL  22          2HG2      VAL  22   7.352  -8.561   8.091
  188    H    ALA  23           HN       ALA  23   4.739 -11.125   4.685
  189    HA   ALA  23           HA       ALA  23   3.177  -9.415   3.257
  190    HB1  ALA  23           1HB      ALA  23   4.128 -11.606   2.483
  191    HB2  ALA  23           2HB      ALA  23   2.740 -12.394   3.234
  192    HB3  ALA  23           3HB      ALA  23   2.497 -11.253   1.911
  193    H    ARG  24           HN       ARG  24   1.949 -11.977   5.412
  194    HA   ARG  24           HA       ARG  24  -0.773 -11.374   5.098
  195    HB2  ARG  24           2HB      ARG  24   0.803 -12.784   7.232
  196    HB3  ARG  24           3HB      ARG  24  -0.922 -12.506   7.429
  197    HG2  ARG  24           2HG      ARG  24  -1.491 -13.962   5.753
  198    HG3  ARG  24           3HG      ARG  24   0.054 -13.776   4.921
  199    HD2  ARG  24           2HD      ARG  24   1.160 -15.036   6.706
  200    HD3  ARG  24           3HD      ARG  24  -0.386 -15.220   7.533
  201    HE   ARG  24           HE       ARG  24   0.582 -16.792   5.381
  202   HH11  ARG  24          2HH1      ARG  24  -2.328 -15.393   6.683
  203   HH12  ARG  24          1HH1      ARG  24  -3.369 -16.595   5.995
  204   HH21  ARG  24          2HH2      ARG  24  -0.779 -18.380   4.469
  205   HH22  ARG  24          1HH2      ARG  24  -2.487 -18.293   4.736
  206    H    ARG  25           HN       ARG  25   1.624 -10.216   7.429
  207    HA   ARG  25           HA       ARG  25  -0.071  -8.791   9.119
  208    HB2  ARG  25           2HB      ARG  25   2.198  -9.128   9.775
  209    HB3  ARG  25           3HB      ARG  25   2.803  -8.328   8.330
  210    HG2  ARG  25           2HG      ARG  25   2.273  -6.212   9.126
  211    HG3  ARG  25           3HG      ARG  25   1.128  -6.841  10.312
  212    HD2  ARG  25           2HD      ARG  25   4.050  -7.498  10.463
  213    HD3  ARG  25           3HD      ARG  25   3.414  -5.999  11.140
  214    HE   ARG  25           HE       ARG  25   1.816  -7.906  12.214
  215   HH11  ARG  25          2HH1      ARG  25   5.266  -7.464  12.054
  216   HH12  ARG  25          1HH1      ARG  25   5.571  -8.274  13.554
  217   HH21  ARG  25          2HH2      ARG  25   2.205  -8.975  14.191
  218   HH22  ARG  25          1HH2      ARG  25   3.829  -9.134  14.769
  219    H    ILE  26           HN       ILE  26   1.471  -7.819   6.089
  220    HA   ILE  26           HA       ILE  26   0.674  -5.113   6.159
  221    HB   ILE  26           HB       ILE  26   1.447  -6.929   3.886
  222   HG12  ILE  26          2HG1      ILE  26   2.857  -4.481   4.941
  223   HG13  ILE  26          3HG1      ILE  26   3.124  -6.082   5.622
  224   HG21  ILE  26          1HG2      ILE  26   0.459  -4.108   3.812
  225   HG22  ILE  26          2HG2      ILE  26   1.636  -4.673   2.628
  226   HG23  ILE  26          3HG2      ILE  26   0.063  -5.460   2.752
  227   HD11  ILE  26          3HD1      ILE  26   3.545  -5.392   2.726
  228   HD12  ILE  26          1HD1      ILE  26   4.815  -5.377   3.950
  229   HD13  ILE  26          2HD1      ILE  26   3.993  -6.885   3.550
  230    H    LEU  27           HN       LEU  27  -0.632  -7.748   4.132
  231    HA   LEU  27           HA       LEU  27  -2.821  -6.481   3.097
  232    HB2  LEU  27           2HB      LEU  27  -2.536  -9.339   3.998
  233    HB3  LEU  27           3HB      LEU  27  -3.913  -8.747   3.070
  234    HG   LEU  27           HG       LEU  27  -1.086  -8.537   2.063
  235   HD11  LEU  27          1HD1      LEU  27  -1.610 -10.896   2.541
  236   HD12  LEU  27          2HD1      LEU  27  -1.444 -10.574   0.816
  237   HD13  LEU  27          3HD1      LEU  27  -3.047 -10.763   1.526
  238   HD21  LEU  27          3HD2      LEU  27  -3.824  -8.270   0.863
  239   HD22  LEU  27          1HD2      LEU  27  -2.400  -8.582  -0.129
  240   HD23  LEU  27          2HD2      LEU  27  -2.491  -7.115   0.845
  241    H    ARG  28           HN       ARG  28  -2.550  -8.031   6.265
  242    HA   ARG  28           HA       ARG  28  -5.244  -7.746   7.029
  243    HB2  ARG  28           2HB      ARG  28  -3.266  -9.089   8.112
  244    HB3  ARG  28           3HB      ARG  28  -3.029  -7.613   9.037
  245    HG2  ARG  28           2HG      ARG  28  -5.365  -7.757   9.811
  246    HG3  ARG  28           3HG      ARG  28  -5.530  -9.285   8.943
  247    HD2  ARG  28           2HD      ARG  28  -3.856 -10.314  10.319
  248    HD3  ARG  28           3HD      ARG  28  -3.474  -8.773  11.086
  249    HE   ARG  28           HE       ARG  28  -6.210  -9.657  11.395
  250   HH11  ARG  28          2HH1      ARG  28  -2.991  -9.632  12.720
  251   HH12  ARG  28          1HH1      ARG  28  -3.514  -9.958  14.339
  252   HH21  ARG  28          2HH2      ARG  28  -6.911 -10.086  13.523
  253   HH22  ARG  28          1HH2      ARG  28  -5.744 -10.217  14.795
  254    H    PHE  29           HN       PHE  29  -2.414  -5.674   7.576
  255    HA   PHE  29           HA       PHE  29  -3.636  -3.735   9.162
  256    HB2  PHE  29           2HB      PHE  29  -1.298  -3.612   9.035
  257    HB3  PHE  29           3HB      PHE  29  -1.299  -3.664   7.275
  258    HD1  PHE  29           1HD      PHE  29  -2.013  -1.540  10.205
  259    HD2  PHE  29           2HD      PHE  29  -1.432  -1.688   5.991
  260    HE1  PHE  29           1HE      PHE  29  -1.885   0.917  10.139
  261    HE2  PHE  29           2HE      PHE  29  -1.303   0.768   5.919
  262    HZ   PHE  29           HZ       PHE  29  -1.529   2.074   7.995
  263    H    LEU  30           HN       LEU  30  -3.664  -4.196   5.693
  264    HA   LEU  30           HA       LEU  30  -4.998  -1.656   5.231
  265    HB2  LEU  30           2HB      LEU  30  -4.227  -3.896   3.368
  266    HB3  LEU  30           3HB      LEU  30  -5.004  -2.399   2.857
  267    HG   LEU  30           HG       LEU  30  -2.424  -2.239   4.340
  268   HD11  LEU  30          1HD1      LEU  30  -2.532  -3.938   2.246
  269   HD12  LEU  30          2HD1      LEU  30  -1.112  -2.983   2.673
  270   HD13  LEU  30          3HD1      LEU  30  -2.209  -2.417   1.413
  271   HD21  LEU  30          3HD2      LEU  30  -2.559  -0.113   3.717
  272   HD22  LEU  30          1HD2      LEU  30  -4.154  -0.453   3.045
  273   HD23  LEU  30          2HD2      LEU  30  -2.722  -0.574   2.022
  274    H    ARG  31           HN       ARG  31  -5.777  -5.015   5.605
  275    HA   ARG  31           HA       ARG  31  -8.471  -4.676   4.565
  276    HB2  ARG  31           2HB      ARG  31  -6.967  -7.035   5.688
  277    HB3  ARG  31           3HB      ARG  31  -8.682  -7.108   5.307
  278    HG2  ARG  31           2HG      ARG  31  -8.328  -7.004   3.046
  279    HG3  ARG  31           3HG      ARG  31  -6.784  -6.167   3.217
  280    HD2  ARG  31           2HD      ARG  31  -6.168  -8.308   2.546
  281    HD3  ARG  31           3HD      ARG  31  -5.959  -8.350   4.296
  282    HE   ARG  31           HE       ARG  31  -8.551  -9.237   3.470
  283   HH11  ARG  31          2HH1      ARG  31  -5.232 -10.200   3.886
  284   HH12  ARG  31          1HH1      ARG  31  -5.609 -11.879   4.088
  285   HH21  ARG  31          2HH2      ARG  31  -9.060 -11.444   3.734
  286   HH22  ARG  31          1HH2      ARG  31  -7.786 -12.586   4.000
  287    H    GLU  32           HN       GLU  32  -6.894  -4.113   7.446
  288    HA   GLU  32           HA       GLU  32  -9.372  -4.480   9.000
  289    HB2  GLU  32           2HB      GLU  32  -6.480  -4.617   9.828
  290    HB3  GLU  32           3HB      GLU  32  -7.768  -4.379  11.000
  291    HG2  GLU  32           2HG      GLU  32  -7.446  -6.731   9.152
  292    HG3  GLU  32           3HG      GLU  32  -7.150  -6.708  10.889
  293    H    ARG  33           HN       ARG  33  -6.423  -2.542   9.466
  294    HA   ARG  33           HA       ARG  33  -7.688  -0.384  10.684
  295    HB2  ARG  33           2HB      ARG  33  -5.175  -0.244   9.013
  296    HB3  ARG  33           3HB      ARG  33  -5.651   0.856  10.300
  297    HG2  ARG  33           2HG      ARG  33  -5.344  -2.030  10.944
  298    HG3  ARG  33           3HG      ARG  33  -3.894  -1.053  10.706
  299    HD2  ARG  33           2HD      ARG  33  -4.278   0.219  12.564
  300    HD3  ARG  33           3HD      ARG  33  -6.029   0.032  12.461
  301    HE   ARG  33           HE       ARG  33  -5.230  -2.450  13.099
  302   HH11  ARG  33          2HH1      ARG  33  -4.460   0.669  14.441
  303   HH12  ARG  33          1HH1      ARG  33  -4.207   0.061  16.044
  304   HH21  ARG  33          2HH2      ARG  33  -4.900  -3.261  15.205
  305   HH22  ARG  33          1HH2      ARG  33  -4.457  -2.174  16.477
  306    H    VAL  34           HN       VAL  34  -6.239  -0.187   7.437
  307    HA   VAL  34           HA       VAL  34  -7.557   2.094   6.608
  308    HB   VAL  34           HB       VAL  34  -6.776  -0.205   4.812
  309   HG11  VAL  34          1HG1      VAL  34  -7.132   1.139   3.054
  310   HG12  VAL  34          2HG1      VAL  34  -8.130   2.078   4.167
  311   HG13  VAL  34          3HG1      VAL  34  -6.454   2.547   3.873
  312   HG21  VAL  34          3HG2      VAL  34  -5.108   1.111   6.542
  313   HG22  VAL  34          1HG2      VAL  34  -4.610   0.303   5.056
  314   HG23  VAL  34          2HG2      VAL  34  -4.921   2.039   5.054
  315    H    ALA  35           HN       ALA  35  -8.702  -1.196   6.718
  316    HA   ALA  35           HA       ALA  35 -10.923  -0.899   4.985
  317    HB1  ALA  35           1HB      ALA  35 -11.756  -2.962   6.050
  318    HB2  ALA  35           2HB      ALA  35 -10.071  -3.091   5.541
  319    HB3  ALA  35           3HB      ALA  35 -10.462  -2.844   7.243
  320    H    THR  36           HN       THR  36 -10.647  -0.773   8.533
  321    HA   THR  36           HA       THR  36 -13.399   0.060   8.816
  322    HB   THR  36           HB       THR  36 -12.393  -1.380  10.525
  323    HG1  THR  36           1HG      THR  36 -12.974   1.221  11.543
  324   HG21  THR  36          3HG2      THR  36 -10.255  -0.999  11.066
  325   HG22  THR  36          1HG2      THR  36 -10.854   0.307  12.089
  326   HG23  THR  36          2HG2      THR  36 -10.313   0.651  10.446
  327    H    LEU  37           HN       LEU  37 -10.407   1.581   8.282
  328    HA   LEU  37           HA       LEU  37 -10.878   4.031   9.642
  329    HB2  LEU  37           2HB      LEU  37  -9.019   3.155   7.468
  330    HB3  LEU  37           3HB      LEU  37  -9.143   4.858   7.901
  331    HG   LEU  37           HG       LEU  37  -8.445   2.703   9.886
  332   HD11  LEU  37          1HD1      LEU  37  -6.820   3.924   7.798
  333   HD12  LEU  37          2HD1      LEU  37  -6.505   2.509   8.801
  334   HD13  LEU  37          3HD1      LEU  37  -6.147   4.122   9.416
  335   HD21  LEU  37          3HD2      LEU  37  -8.712   5.645   9.930
  336   HD22  LEU  37          1HD2      LEU  37  -7.330   4.967  10.792
  337   HD23  LEU  37          2HD2      LEU  37  -8.966   4.459  11.212
  338    H    GLU  38           HN       GLU  38 -12.477   5.384   9.185
  339    HA   GLU  38           HA       GLU  38 -14.163   5.388   7.043
  340    HB2  GLU  38           2HB      GLU  38 -14.092   6.845   9.243
  341    HB3  GLU  38           3HB      GLU  38 -13.366   8.037   8.174
  342    HG2  GLU  38           2HG      GLU  38 -15.329   7.855   6.691
  343    HG3  GLU  38           3HG      GLU  38 -16.062   6.742   7.845
  344    H    ASP  39           HN       ASP  39 -11.005   6.911   7.267
  345    HA   ASP  39           HA       ASP  39 -11.117   7.412   4.373
  346    HB2  ASP  39           2HB      ASP  39  -9.885   9.287   6.403
  347    HB3  ASP  39           3HB      ASP  39  -9.926   9.521   4.658
  348    HA   PRO  40           HA       PRO  40  -7.326   5.180   4.281
  349    HB2  PRO  40           2HB      PRO  40  -6.350   6.087   1.916
  350    HB3  PRO  40           3HB      PRO  40  -7.694   4.944   2.026
  351    HG2  PRO  40           2HG      PRO  40  -7.757   7.906   1.594
  352    HG3  PRO  40           3HG      PRO  40  -8.702   6.638   0.792
  353    HD2  PRO  40           2HD      PRO  40  -9.709   8.162   2.791
  354    HD3  PRO  40           3HD      PRO  40 -10.199   6.474   2.537
  355    H    ARG  41           HN       ARG  41  -7.410   8.657   4.067
  356    HA   ARG  41           HA       ARG  41  -4.613   9.116   4.143
  357    HB2  ARG  41           2HB      ARG  41  -6.910  10.885   4.999
  358    HB3  ARG  41           3HB      ARG  41  -5.243  11.417   4.826
  359    HG2  ARG  41           2HG      ARG  41  -5.519  10.475   2.397
  360    HG3  ARG  41           3HG      ARG  41  -7.235  10.709   2.734
  361    HD2  ARG  41           2HD      ARG  41  -5.331  12.919   3.340
  362    HD3  ARG  41           3HD      ARG  41  -5.784  12.624   1.662
  363    HE   ARG  41           HE       ARG  41  -8.174  12.724   2.851
  364   HH11  ARG  41          2HH1      ARG  41  -5.397  14.810   3.095
  365   HH12  ARG  41          1HH1      ARG  41  -6.331  16.232   3.421
  366   HH21  ARG  41          2HH2      ARG  41  -9.414  14.589   3.280
  367   HH22  ARG  41          1HH2      ARG  41  -8.616  16.105   3.527
  368    H    SER  42           HN       SER  42  -7.027   8.493   6.581
  369    HA   SER  42           HA       SER  42  -6.083   9.441   8.900
  370    HB2  SER  42           2HB      SER  42  -7.925   7.616   8.382
  371    HB3  SER  42           3HB      SER  42  -6.647   6.503   8.870
  372    HG   SER  42           HG       SER  42  -6.585   8.293  10.701
  373    H    LEU  43           HN       LEU  43  -4.808   6.492   7.363
  374    HA   LEU  43           HA       LEU  43  -2.396   6.770   9.030
  375    HB2  LEU  43           2HB      LEU  43  -3.773   4.377   7.868
  376    HB3  LEU  43           3HB      LEU  43  -2.073   4.310   8.327
  377    HG   LEU  43           HG       LEU  43  -4.211   5.124  10.276
  378   HD11  LEU  43          1HD1      LEU  43  -3.250   2.405  10.561
  379   HD12  LEU  43          2HD1      LEU  43  -4.127   2.647   9.051
  380   HD13  LEU  43          3HD1      LEU  43  -4.898   3.032  10.589
  381   HD21  LEU  43          3HD2      LEU  43  -1.862   5.638  10.812
  382   HD22  LEU  43          1HD2      LEU  43  -1.468   3.927  10.647
  383   HD23  LEU  43          2HD2      LEU  43  -2.565   4.460  11.921
  384    H    GLY  44           HN       GLY  44  -0.553   7.281   8.045
  385    HA2  GLY  44           1HA      GLY  44   0.934   6.572   6.137
  386    HA3  GLY  44           2HA      GLY  44  -0.433   6.974   5.109
  387    H    GLU  45           HN       GLU  45   1.575   8.252   4.259
  388    HA   GLU  45           HA       GLU  45   1.259  10.984   5.266
  389    HB2  GLU  45           2HB      GLU  45   3.670  11.396   5.124
  390    HB3  GLU  45           3HB      GLU  45   3.307  10.139   6.299
  391    HG2  GLU  45           2HG      GLU  45   3.810   8.484   4.426
  392    HG3  GLU  45           3HG      GLU  45   4.518   9.855   3.574
  393    HA   PRO  46           HA       PRO  46   0.832  11.916   0.985
  394    HB2  PRO  46           2HB      PRO  46   1.366  14.576   1.072
  395    HB3  PRO  46           3HB      PRO  46  -0.146  13.880   1.667
  396    HG2  PRO  46           2HG      PRO  46   2.287  14.713   3.199
  397    HG3  PRO  46           3HG      PRO  46   0.577  14.977   3.585
  398    HD2  PRO  46           2HD      PRO  46   2.046  13.018   4.742
  399    HD3  PRO  46           3HD      PRO  46   0.307  12.847   4.424
  400    H    LEU  47           HN       LEU  47   2.155  11.701  -0.710
  401    HA   LEU  47           HA       LEU  47   5.011  11.899  -0.330
  402    HB2  LEU  47           2HB      LEU  47   3.325  11.105  -2.696
  403    HB3  LEU  47           3HB      LEU  47   5.087  11.107  -2.703
  404    HG   LEU  47           HG       LEU  47   3.336   9.393  -0.941
  405   HD11  LEU  47          1HD1      LEU  47   4.258   9.076  -3.645
  406   HD12  LEU  47          2HD1      LEU  47   3.197   8.040  -2.692
  407   HD13  LEU  47          3HD1      LEU  47   4.946   7.829  -2.604
  408   HD21  LEU  47          3HD2      LEU  47   6.332   9.451  -1.295
  409   HD22  LEU  47          1HD2      LEU  47   5.428   8.278  -0.337
  410   HD23  LEU  47          2HD2      LEU  47   5.443   9.977   0.136
  411    H    ARG  48           HN       ARG  48   3.858  14.387  -0.035
  412    HA   ARG  48           HA       ARG  48   3.637  16.015  -2.253
  413    HB2  ARG  48           2HB      ARG  48   3.347  16.524   0.292
  414    HB3  ARG  48           3HB      ARG  48   5.037  17.002   0.207
  415    HG2  ARG  48           2HG      ARG  48   4.532  18.682  -1.438
  416    HG3  ARG  48           3HG      ARG  48   2.854  18.142  -1.524
  417    HD2  ARG  48           2HD      ARG  48   2.669  18.692   0.925
  418    HD3  ARG  48           3HD      ARG  48   4.256  19.449   0.798
  419    HE   ARG  48           HE       ARG  48   2.830  20.645  -1.170
  420   HH11  ARG  48          2HH1      ARG  48   2.291  20.156   2.234
  421   HH12  ARG  48          1HH1      ARG  48   1.366  21.608   2.429
  422   HH21  ARG  48          2HH2      ARG  48   1.613  22.559  -0.926
  423   HH22  ARG  48          1HH2      ARG  48   0.980  22.973   0.631
  424    H    GLY  49           HN       GLY  49   5.030  15.973  -3.914
  425    HA2  GLY  49           1HA      GLY  49   7.730  16.916  -3.465
  426    HA3  GLY  49           2HA      GLY  49   7.628  15.269  -4.069
  427    HA   PRO  50           HA       PRO  50   7.155  18.647  -7.455
  428    HB2  PRO  50           2HB      PRO  50   9.739  18.929  -8.238
  429    HB3  PRO  50           3HB      PRO  50   8.991  19.953  -7.007
  430    HG2  PRO  50           2HG      PRO  50  10.768  17.568  -6.664
  431    HG3  PRO  50           3HG      PRO  50  10.793  19.116  -5.799
  432    HD2  PRO  50           2HD      PRO  50   9.680  16.880  -4.753
  433    HD3  PRO  50           3HD      PRO  50   9.062  18.507  -4.403
  434    H    GLU  51           HN       GLU  51   8.280  15.542  -6.972
  435    HA   GLU  51           HA       GLU  51   8.501  15.027  -9.863
  436    HB2  GLU  51           2HB      GLU  51   9.799  13.794  -7.480
  437    HB3  GLU  51           3HB      GLU  51   9.469  12.765  -8.866
  438    HG2  GLU  51           2HG      GLU  51  10.713  14.393 -10.282
  439    HG3  GLU  51           3HG      GLU  51  11.160  15.250  -8.808
  440    H    LEU  52           HN       LEU  52   6.950  14.053  -6.871
  441    HA   LEU  52           HA       LEU  52   5.237  12.195  -8.376
  442    HB2  LEU  52           2HB      LEU  52   5.802  12.412  -5.424
  443    HB3  LEU  52           3HB      LEU  52   4.611  11.320  -6.126
  444    HG   LEU  52           HG       LEU  52   6.726  10.493  -7.498
  445   HD11  LEU  52          1HD1      LEU  52   7.995  11.290  -4.895
  446   HD12  LEU  52          2HD1      LEU  52   8.133  12.269  -6.355
  447   HD13  LEU  52          3HD1      LEU  52   8.765  10.623  -6.334
  448   HD21  LEU  52          3HD2      LEU  52   6.870   8.667  -6.017
  449   HD22  LEU  52          1HD2      LEU  52   5.211   9.253  -5.885
  450   HD23  LEU  52          2HD2      LEU  52   6.388   9.648  -4.632
  451    H    GLY  53           HN       GLY  53   3.050  12.456  -8.437
  452    HA2  GLY  53           1HA      GLY  53   2.024  15.068  -7.862
  453    HA3  GLY  53           2HA      GLY  53   1.116  13.712  -8.513
  454    H    ARG  54           HN       ARG  54  -0.295  12.700  -7.224
  455    HA   ARG  54           HA       ARG  54  -0.178  13.309  -4.342
  456    HB2  ARG  54           2HB      ARG  54  -2.549  13.005  -6.180
  457    HB3  ARG  54           3HB      ARG  54  -2.697  12.928  -4.429
  458    HG2  ARG  54           2HG      ARG  54  -1.343  15.272  -5.676
  459    HG3  ARG  54           3HG      ARG  54  -3.105  15.167  -5.698
  460    HD2  ARG  54           2HD      ARG  54  -1.331  15.075  -3.259
  461    HD3  ARG  54           3HD      ARG  54  -2.348  16.425  -3.762
  462    HE   ARG  54           HE       ARG  54  -3.903  14.084  -3.448
  463   HH11  ARG  54          2HH1      ARG  54  -2.231  16.527  -1.616
  464   HH12  ARG  54          1HH1      ARG  54  -3.263  16.381  -0.232
  465   HH21  ARG  54          2HH2      ARG  54  -5.270  13.883  -1.632
  466   HH22  ARG  54          1HH2      ARG  54  -4.991  14.877  -0.242
  467    H    PHE  55           HN       PHE  55   0.672  11.540  -3.420
  468    HA   PHE  55           HA       PHE  55  -0.753   9.015  -3.774
  469    HB2  PHE  55           2HB      PHE  55   2.205   9.408  -4.196
  470    HB3  PHE  55           3HB      PHE  55   1.526   7.839  -3.775
  471    HD1  PHE  55           1HD      PHE  55  -0.231   6.847  -5.309
  472    HD2  PHE  55           2HD      PHE  55   2.210  10.158  -6.403
  473    HE1  PHE  55           1HE      PHE  55  -0.724   6.422  -7.682
  474    HE2  PHE  55           2HE      PHE  55   1.720   9.739  -8.777
  475    HZ   PHE  55           HZ       PHE  55   0.251   7.870  -9.420
  476    H    TRP  56           HN       TRP  56  -1.070   7.965  -1.905
  477    HA   TRP  56           HA       TRP  56   0.013   9.153   0.519
  478    HB2  TRP  56           2HB      TRP  56  -2.460   8.338   0.026
  479    HB3  TRP  56           3HB      TRP  56  -1.816   6.793   0.575
  480    HD1  TRP  56           1HD      TRP  56  -1.982   6.401   3.096
  481    HE1  TRP  56           1HE      TRP  56  -2.281   7.883   5.179
  482    HE3  TRP  56           3HE      TRP  56  -1.788  10.994   0.859
  483    HZ2  TRP  56           2HZ      TRP  56  -2.417  10.635   5.793
  484    HZ3  TRP  56           3HZ      TRP  56  -2.012  13.001   2.265
  485    HH2  TRP  56           2HH      TRP  56  -2.320  12.823   4.680
  486    H    LYS  57           HN       LYS  57   1.274   8.096   2.020
  487    HA   LYS  57           HA       LYS  57   2.392   5.505   1.168
  488    HB2  LYS  57           2HB      LYS  57   4.092   7.161   0.875
  489    HB3  LYS  57           3HB      LYS  57   3.763   7.866   2.452
  490    HG2  LYS  57           2HG      LYS  57   5.623   6.677   2.965
  491    HG3  LYS  57           3HG      LYS  57   4.408   5.433   3.268
  492    HD2  LYS  57           2HD      LYS  57   5.912   4.281   1.959
  493    HD3  LYS  57           3HD      LYS  57   4.783   4.874   0.738
  494    HE2  LYS  57           2HE      LYS  57   6.743   5.496  -0.242
  495    HE3  LYS  57           3HE      LYS  57   6.446   6.934   0.734
  496    HZ1  LYS  57           3HZ      LYS  57   8.198   4.658   1.492
  497    HZ2  LYS  57           1HZ      LYS  57   7.907   6.031   2.437
  498    HZ3  LYS  57           2HZ      LYS  57   8.723   6.177   0.963
  499    H    TYR  58           HN       TYR  58   1.847   3.921   2.502
  500    HA   TYR  58           HA       TYR  58   1.049   4.534   5.237
  501    HB2  TYR  58           2HB      TYR  58   0.875   1.998   3.601
  502    HB3  TYR  58           3HB      TYR  58   0.342   2.128   5.274
  503    HD1  TYR  58           2HD      TYR  58  -0.325   3.214   1.818
  504    HD2  TYR  58           1HD      TYR  58  -1.721   3.208   5.837
  505    HE1  TYR  58           2HE      TYR  58  -2.523   4.005   1.049
  506    HE2  TYR  58           1HE      TYR  58  -3.924   3.997   5.079
  507    HH   TYR  58           HH       TYR  58  -4.472   5.243   2.007
  508    H    ARG  59           HN       ARG  59   1.875   3.347   7.047
  509    HA   ARG  59           HA       ARG  59   4.585   2.270   6.625
  510    HB2  ARG  59           2HB      ARG  59   5.107   3.214   8.919
  511    HB3  ARG  59           3HB      ARG  59   4.918   4.391   7.627
  512    HG2  ARG  59           2HG      ARG  59   2.569   3.699   9.325
  513    HG3  ARG  59           3HG      ARG  59   3.811   4.785   9.952
  514    HD2  ARG  59           2HD      ARG  59   3.469   5.925   7.581
  515    HD3  ARG  59           3HD      ARG  59   1.880   5.176   7.729
  516    HE   ARG  59           HE       ARG  59   1.341   6.799   9.228
  517   HH11  ARG  59          2HH1      ARG  59   4.806   6.468   9.171
  518   HH12  ARG  59          1HH1      ARG  59   5.080   7.776  10.274
  519   HH21  ARG  59          2HH2      ARG  59   1.689   8.523  10.680
  520   HH22  ARG  59          1HH2      ARG  59   3.306   8.943  11.132
  521    H    VAL  60           HN       VAL  60   4.994   0.337   7.511
  522    HA   VAL  60           HA       VAL  60   3.118  -0.702   9.530
  523    HB   VAL  60           HB       VAL  60   4.178  -2.151   7.106
  524   HG11  VAL  60          1HG1      VAL  60   3.489  -3.183   9.719
  525   HG12  VAL  60          2HG1      VAL  60   2.459  -3.862   8.456
  526   HG13  VAL  60          3HG1      VAL  60   4.213  -4.005   8.338
  527   HG21  VAL  60          3HG2      VAL  60   1.901  -2.407   6.479
  528   HG22  VAL  60          1HG2      VAL  60   1.337  -1.812   8.040
  529   HG23  VAL  60          2HG2      VAL  60   2.121  -0.711   6.908
  530    H    GLY  61           HN       GLY  61   4.719  -0.099  11.099
  531    HA2  GLY  61           1HA      GLY  61   6.401  -0.643  12.566
  532    HA3  GLY  61           2HA      GLY  61   6.458  -2.219  11.791
  533    H    ASP  62           HN       ASP  62   7.786  -2.476   9.902
  534    HA   ASP  62           HA       ASP  62   9.836  -0.395   9.570
  535    HB2  ASP  62           2HB      ASP  62  10.243  -3.320  10.137
  536    HB3  ASP  62           3HB      ASP  62  11.468  -2.384   9.285
  537    H    TYR  63           HN       TYR  63   7.516  -1.051   7.959
  538    HA   TYR  63           HA       TYR  63   8.914  -1.625   5.448
  539    HB2  TYR  63           2HB      TYR  63   6.355  -2.932   6.378
  540    HB3  TYR  63           3HB      TYR  63   6.895  -2.948   4.703
  541    HD1  TYR  63           1HD      TYR  63   8.146  -3.792   8.122
  542    HD2  TYR  63           2HD      TYR  63   8.160  -4.741   3.975
  543    HE1  TYR  63           1HE      TYR  63   9.508  -5.787   8.589
  544    HE2  TYR  63           2HE      TYR  63   9.521  -6.738   4.430
  545    HH   TYR  63           HH       TYR  63   9.989  -8.253   6.330
  546    H    ARG  64           HN       ARG  64   8.207  -0.471   3.699
  547    HA   ARG  64           HA       ARG  64   6.162   1.568   4.258
  548    HB2  ARG  64           2HB      ARG  64   8.439   1.594   2.270
  549    HB3  ARG  64           3HB      ARG  64   7.246   2.873   2.448
  550    HG2  ARG  64           2HG      ARG  64   8.991   1.985   4.722
  551    HG3  ARG  64           3HG      ARG  64   9.491   3.224   3.569
  552    HD2  ARG  64           2HD      ARG  64   7.483   4.528   4.135
  553    HD3  ARG  64           3HD      ARG  64   7.036   3.301   5.319
  554    HE   ARG  64           HE       ARG  64   9.552   4.046   6.047
  555   HH11  ARG  64          2HH1      ARG  64   6.565   5.744   5.486
  556   HH12  ARG  64          1HH1      ARG  64   6.911   6.998   6.630
  557   HH21  ARG  64          2HH2      ARG  64  10.020   5.691   7.556
  558   HH22  ARG  64          1HH2      ARG  64   8.877   6.968   7.807
  559    H    LEU  65           HN       LEU  65   4.401   1.764   2.982
  560    HA   LEU  65           HA       LEU  65   4.241   0.041   0.599
  561    HB2  LEU  65           2HB      LEU  65   1.904   0.618   2.394
  562    HB3  LEU  65           3HB      LEU  65   2.032  -0.595   1.122
  563    HG   LEU  65           HG       LEU  65   3.632  -0.707   3.671
  564   HD11  LEU  65          1HD1      LEU  65   1.947  -2.512   4.271
  565   HD12  LEU  65          2HD1      LEU  65   0.909  -1.801   3.036
  566   HD13  LEU  65          3HD1      LEU  65   1.413  -0.838   4.425
  567   HD21  LEU  65          3HD2      LEU  65   4.699  -2.143   2.256
  568   HD22  LEU  65          1HD2      LEU  65   3.251  -2.454   1.298
  569   HD23  LEU  65          2HD2      LEU  65   3.448  -3.223   2.873
  570    H    ILE  66           HN       ILE  66   3.805   1.123  -1.199
  571    HA   ILE  66           HA       ILE  66   2.654   3.818  -0.973
  572    HB   ILE  66           HB       ILE  66   4.220   2.585  -3.243
  573   HG12  ILE  66          2HG1      ILE  66   5.973   4.184  -2.592
  574   HG13  ILE  66          3HG1      ILE  66   4.973   4.740  -1.255
  575   HG21  ILE  66          1HG2      ILE  66   4.260   5.001  -4.039
  576   HG22  ILE  66          2HG2      ILE  66   2.742   4.124  -4.227
  577   HG23  ILE  66          3HG2      ILE  66   2.935   5.279  -2.909
  578   HD11  ILE  66          3HD1      ILE  66   6.898   2.944  -0.957
  579   HD12  ILE  66          1HD1      ILE  66   5.428   2.926   0.016
  580   HD13  ILE  66          2HD1      ILE  66   5.580   1.850  -1.374
  581    H    CYS  67           HN       CYS  67   0.525   3.830  -1.276
  582    HA   CYS  67           HA       CYS  67  -0.597   2.115  -3.392
  583    HB2  CYS  67           2HB      CYS  67  -2.205   3.260  -1.122
  584    HB3  CYS  67           3HB      CYS  67  -2.590   1.892  -2.160
  585    HG   CYS  67           HG       CYS  67  -0.197   1.933   0.287
  586    H    HIS  68           HN       HIS  68  -2.715   3.036  -4.280
  587    HA   HIS  68           HA       HIS  68  -2.465   5.950  -4.627
  588    HB2  HIS  68           2HB      HIS  68  -1.678   4.609  -6.613
  589    HB3  HIS  68           3HB      HIS  68  -3.328   4.018  -6.784
  590    HD2  HIS  68           2HD      HIS  68  -2.824   7.789  -5.975
  591    HE1  HIS  68           1HE      HIS  68  -4.011   7.440 -10.033
  592    HE2  HIS  68           2HE      HIS  68  -3.487   9.026  -8.147
  593    H    ILE  69           HN       ILE  69  -4.145   6.802  -3.578
  594    HA   ILE  69           HA       ILE  69  -6.632   5.430  -3.241
  595    HB   ILE  69           HB       ILE  69  -5.936   8.317  -2.686
  596   HG12  ILE  69          2HG1      ILE  69  -6.159   6.038  -0.718
  597   HG13  ILE  69          3HG1      ILE  69  -4.633   6.513  -1.454
  598   HG21  ILE  69          1HG2      ILE  69  -8.416   7.522  -2.959
  599   HG22  ILE  69          2HG2      ILE  69  -8.161   6.852  -1.349
  600   HG23  ILE  69          3HG2      ILE  69  -7.957   8.581  -1.626
  601   HD11  ILE  69          3HD1      ILE  69  -4.547   8.502  -0.306
  602   HD12  ILE  69          1HD1      ILE  69  -6.290   8.547  -0.040
  603   HD13  ILE  69          2HD1      ILE  69  -5.286   7.425   0.879
  604    H    GLN  70           HN       GLN  70  -8.284   5.362  -4.604
  605    HA   GLN  70           HA       GLN  70  -8.401   7.348  -6.769
  606    HB2  GLN  70           2HB      GLN  70  -9.451   4.527  -6.584
  607    HB3  GLN  70           3HB      GLN  70  -9.896   5.629  -7.880
  608    HG2  GLN  70           2HG      GLN  70  -7.389   5.867  -8.296
  609    HG3  GLN  70           3HG      GLN  70  -7.214   4.443  -7.272
  610   HE21  GLN  70          1HE2      GLN  70  -6.531   4.691 -10.043
  611   HE22  GLN  70          2HE2      GLN  70  -7.490   3.542 -10.906
  612    H    ASP  71           HN       ASP  71  -9.516   8.949  -5.633
  613    HA   ASP  71           HA       ASP  71 -11.724   8.698  -4.018
  614    HB2  ASP  71           2HB      ASP  71 -11.046  10.873  -6.003
  615    HB3  ASP  71           3HB      ASP  71 -12.352  11.005  -4.828
  616    H    ARG  72           HN       ARG  72 -11.614   8.785  -7.549
  617    HA   ARG  72           HA       ARG  72 -14.161   9.072  -8.333
  618    HB2  ARG  72           2HB      ARG  72 -12.170   8.414  -9.759
  619    HB3  ARG  72           3HB      ARG  72 -12.510   6.747  -9.317
  620    HG2  ARG  72           2HG      ARG  72 -13.640   6.845 -11.280
  621    HG3  ARG  72           3HG      ARG  72 -14.921   7.387 -10.193
  622    HD2  ARG  72           2HD      ARG  72 -14.020   9.754 -10.669
  623    HD3  ARG  72           3HD      ARG  72 -13.204   9.006 -12.042
  624    HE   ARG  72           HE       ARG  72 -15.907   8.271 -12.093
  625   HH11  ARG  72          2HH1      ARG  72 -13.899  11.083 -12.515
  626   HH12  ARG  72          1HH1      ARG  72 -14.993  11.862 -13.609
  627   HH21  ARG  72          2HH2      ARG  72 -17.357   9.286 -13.533
  628   HH22  ARG  72          1HH2      ARG  72 -16.960  10.840 -14.187
  629    H    GLU  73           HN       GLU  73 -12.850   5.940  -7.236
  630    HA   GLU  73           HA       GLU  73 -15.590   5.181  -6.466
  631    HB2  GLU  73           2HB      GLU  73 -13.494   3.596  -7.913
  632    HB3  GLU  73           3HB      GLU  73 -14.697   2.776  -6.927
  633    HG2  GLU  73           2HG      GLU  73 -16.478   3.807  -8.255
  634    HG3  GLU  73           3HG      GLU  73 -15.261   4.597  -9.256
  635    H    ALA  74           HN       ALA  74 -13.341   6.382  -4.940
  636    HA   ALA  74           HA       ALA  74 -12.106   6.056  -3.027
  637    HB1  ALA  74           1HB      ALA  74 -14.319   6.382  -2.141
  638    HB2  ALA  74           2HB      ALA  74 -14.702   4.674  -2.362
  639    HB3  ALA  74           3HB      ALA  74 -13.489   5.160  -1.177
  640    H    THR  75           HN       THR  75 -11.076   4.335  -4.771
  641    HA   THR  75           HA       THR  75 -10.843   1.799  -3.284
  642    HB   THR  75           HB       THR  75 -10.531   2.267  -6.255
  643    HG1  THR  75           1HG      THR  75 -12.679   2.053  -5.756
  644   HG21  THR  75          3HG2      THR  75  -9.299   0.316  -4.617
  645   HG22  THR  75          1HG2      THR  75  -9.317   0.404  -6.378
  646   HG23  THR  75          2HG2      THR  75 -10.574  -0.494  -5.527
  647    H    VAL  76           HN       VAL  76  -8.897   1.293  -2.507
  648    HA   VAL  76           HA       VAL  76  -6.624   2.988  -3.258
  649    HB   VAL  76           HB       VAL  76  -6.927   1.133  -0.893
  650   HG11  VAL  76          1HG1      VAL  76  -4.759   1.403  -0.501
  651   HG12  VAL  76          2HG1      VAL  76  -4.614   2.211  -2.063
  652   HG13  VAL  76          3HG1      VAL  76  -4.917   3.156  -0.605
  653   HG21  VAL  76          3HG2      VAL  76  -7.599   3.973  -1.336
  654   HG22  VAL  76          1HG2      VAL  76  -8.296   2.801  -0.219
  655   HG23  VAL  76          2HG2      VAL  76  -6.771   3.595   0.174
  656    H    LEU  77           HN       LEU  77  -5.319   2.190  -4.761
  657    HA   LEU  77           HA       LEU  77  -4.962  -0.723  -4.935
  658    HB2  LEU  77           2HB      LEU  77  -5.761   0.149  -6.984
  659    HB3  LEU  77           3HB      LEU  77  -4.614   1.486  -6.943
  660    HG   LEU  77           HG       LEU  77  -2.861  -0.501  -7.072
  661   HD11  LEU  77          1HD1      LEU  77  -5.409  -1.639  -8.178
  662   HD12  LEU  77          2HD1      LEU  77  -4.279  -2.366  -7.036
  663   HD13  LEU  77          3HD1      LEU  77  -3.823  -2.179  -8.729
  664   HD21  LEU  77          3HD2      LEU  77  -2.759  -0.149  -9.462
  665   HD22  LEU  77          1HD2      LEU  77  -3.116   1.376  -8.650
  666   HD23  LEU  77          2HD2      LEU  77  -4.404   0.490  -9.468
  667    H    VAL  78           HN       VAL  78  -3.121  -1.558  -4.229
  668    HA   VAL  78           HA       VAL  78  -0.980   0.050  -3.286
  669    HB   VAL  78           HB       VAL  78  -1.035  -2.929  -3.790
  670   HG11  VAL  78          1HG1      VAL  78   0.724  -1.686  -1.751
  671   HG12  VAL  78          2HG1      VAL  78   0.972  -3.129  -2.737
  672   HG13  VAL  78          3HG1      VAL  78   1.196  -1.528  -3.443
  673   HG21  VAL  78          3HG2      VAL  78  -2.092  -1.221  -1.634
  674   HG22  VAL  78          1HG2      VAL  78  -2.600  -2.823  -2.169
  675   HG23  VAL  78          2HG2      VAL  78  -1.199  -2.649  -1.113
  676    H    LEU  79           HN       LEU  79   0.537   0.997  -4.462
  677    HA   LEU  79           HA       LEU  79   1.009   0.207  -7.199
  678    HB2  LEU  79           2HB      LEU  79   1.798   2.466  -5.448
  679    HB3  LEU  79           3HB      LEU  79   2.851   2.092  -6.811
  680    HG   LEU  79           HG       LEU  79  -0.095   2.686  -7.066
  681   HD11  LEU  79          1HD1      LEU  79   2.252   4.518  -7.539
  682   HD12  LEU  79          2HD1      LEU  79   1.127   4.625  -6.186
  683   HD13  LEU  79          3HD1      LEU  79   0.553   4.891  -7.832
  684   HD21  LEU  79          3HD2      LEU  79   0.854   1.344  -8.877
  685   HD22  LEU  79          1HD2      LEU  79   2.120   2.550  -9.110
  686   HD23  LEU  79          2HD2      LEU  79   0.436   2.966  -9.429
  687    H    ARG  80           HN       ARG  80   3.108   0.641  -4.344
  688    HA   ARG  80           HA       ARG  80   4.729  -1.615  -5.293
  689    HB2  ARG  80           2HB      ARG  80   5.781   1.063  -4.368
  690    HB3  ARG  80           3HB      ARG  80   6.779  -0.367  -4.594
  691    HG2  ARG  80           2HG      ARG  80   5.094   0.558  -6.862
  692    HG3  ARG  80           3HG      ARG  80   6.558   1.461  -6.465
  693    HD2  ARG  80           2HD      ARG  80   6.598  -1.520  -6.796
  694    HD3  ARG  80           3HD      ARG  80   6.727  -0.441  -8.185
  695    HE   ARG  80           HE       ARG  80   8.597   0.307  -6.209
  696   HH11  ARG  80          2HH1      ARG  80   7.982  -2.178  -8.569
  697   HH12  ARG  80          1HH1      ARG  80   9.657  -2.558  -8.796
  698   HH21  ARG  80          2HH2      ARG  80  10.805  -0.186  -6.499
  699   HH22  ARG  80          1HH2      ARG  80  11.262  -1.425  -7.617
  700    H    VAL  81           HN       VAL  81   6.191  -2.461  -3.569
  701    HA   VAL  81           HA       VAL  81   5.418  -1.853  -0.836
  702    HB   VAL  81           HB       VAL  81   4.978  -4.595  -2.025
  703   HG11  VAL  81          1HG1      VAL  81   5.003  -3.628   0.818
  704   HG12  VAL  81          2HG1      VAL  81   4.121  -5.076   0.330
  705   HG13  VAL  81          3HG1      VAL  81   5.869  -4.990   0.110
  706   HG21  VAL  81          3HG2      VAL  81   3.176  -3.007  -2.490
  707   HG22  VAL  81          1HG2      VAL  81   2.652  -4.259  -1.365
  708   HG23  VAL  81          2HG2      VAL  81   3.045  -2.647  -0.769
  709    H    GLY  82           HN       GLY  82   7.264  -1.720   0.248
  710    HA2  GLY  82           1HA      GLY  82   9.223  -3.841   0.084
  711    HA3  GLY  82           2HA      GLY  82   9.779  -2.299  -0.550
  712    H    HIS  83           HN       HIS  83  10.923  -3.656   1.660
  713    HA   HIS  83           HA       HIS  83  10.022  -2.668   4.142
  714    HB2  HIS  83           2HB      HIS  83  11.564  -4.585   3.912
  715    HB3  HIS  83           3HB      HIS  83  12.824  -3.491   3.348
  716    HD2  HIS  83           2HD      HIS  83  11.506  -4.928   6.606
  717    HE1  HIS  83           1HE      HIS  83  13.984  -1.647   7.651
  718    HE2  HIS  83           2HE      HIS  83  12.809  -3.714   8.482
  719    H    ALA  84           HN       ALA  84  10.702  -0.935   5.395
  720    HA   ALA  84           HA       ALA  84  10.932   1.531   4.389
  721    HB1  ALA  84           1HB      ALA  84  11.711   0.303   6.906
  722    HB2  ALA  84           2HB      ALA  84  12.669   1.733   6.521
  723    HB3  ALA  84           3HB      ALA  84  10.911   1.844   6.597
  724    H    ARG  85           HN       ARG  85  13.908  -0.057   5.545
  725    HA   ARG  85           HA       ARG  85  15.798   1.557   4.519
  726    HB2  ARG  85           2HB      ARG  85  15.880  -1.464   4.405
  727    HB3  ARG  85           3HB      ARG  85  17.277  -0.401   4.302
  728    HG2  ARG  85           2HG      ARG  85  15.456  -0.291   6.671
  729    HG3  ARG  85           3HG      ARG  85  16.712  -1.525   6.551
  730    HD2  ARG  85           2HD      ARG  85  17.207   1.439   6.311
  731    HD3  ARG  85           3HD      ARG  85  17.402   0.518   7.801
  732    HE   ARG  85           HE       ARG  85  18.913  -0.721   5.804
  733   HH11  ARG  85          2HH1      ARG  85  18.852   2.252   7.614
  734   HH12  ARG  85          1HH1      ARG  85  20.566   2.492   7.528
  735   HH21  ARG  85          2HH2      ARG  85  21.170  -0.417   5.684
  736   HH22  ARG  85          1HH2      ARG  85  21.883   0.974   6.430
  737    H    ASP  86           HN       ASP  86  14.482  -1.210   2.689
  738    HA   ASP  86           HA       ASP  86  15.748  -0.773   0.284
  739    HB2  ASP  86           2HB      ASP  86  12.894  -1.725   0.602
  740    HB3  ASP  86           3HB      ASP  86  13.964  -2.043  -0.761
  741    H    VAL  87           HN       VAL  87  12.339   0.132   0.790
  742    HA   VAL  87           HA       VAL  87  12.075   1.804  -1.384
  743    HB   VAL  87           HB       VAL  87  10.722   2.159   1.294
  744   HG11  VAL  87          1HG1      VAL  87  10.649   3.972  -0.617
  745   HG12  VAL  87          2HG1      VAL  87   9.455   2.868  -1.304
  746   HG13  VAL  87          3HG1      VAL  87   9.204   3.553   0.302
  747   HG21  VAL  87          3HG2      VAL  87   9.005   0.918  -0.542
  748   HG22  VAL  87          1HG2      VAL  87  10.545   0.067  -0.665
  749   HG23  VAL  87          2HG2      VAL  87   9.736   0.206   0.896
  750    H    TYR  88           HN       TYR  88  12.719   3.802  -1.902
  751    HA   TYR  88           HA       TYR  88  14.784   5.144  -0.836
  752    HB2  TYR  88           2HB      TYR  88  14.088   6.105  -2.803
  753    HB3  TYR  88           3HB      TYR  88  12.388   6.062  -2.349
  754    HD1  TYR  88           1HD      TYR  88  11.486   7.790  -0.794
  755    HD2  TYR  88           2HD      TYR  88  15.428   8.023  -2.379
  756    HE1  TYR  88           1HE      TYR  88  11.582  10.172  -0.189
  757    HE2  TYR  88           2HE      TYR  88  15.535  10.406  -1.778
  758    HH   TYR  88           HH       TYR  88  14.041  12.257  -1.321
  759    H    ARG  89           HN       ARG  89  15.049   7.010   0.517
  760    HA   ARG  89           HA       ARG  89  12.913   7.426   2.490
  761    HB2  ARG  89           2HB      ARG  89  15.831   6.939   3.117
  762    HB3  ARG  89           3HB      ARG  89  14.626   7.457   4.288
  763    HG2  ARG  89           2HG      ARG  89  13.597   5.408   4.344
  764    HG3  ARG  89           3HG      ARG  89  14.141   4.971   2.723
  765    HD2  ARG  89           2HD      ARG  89  15.953   5.220   5.120
  766    HD3  ARG  89           3HD      ARG  89  15.258   3.702   4.554
  767    HE   ARG  89           HE       ARG  89  16.596   4.946   2.423
  768   HH11  ARG  89          2HH1      ARG  89  17.265   3.367   5.453
  769   HH12  ARG  89          1HH1      ARG  89  18.827   2.801   4.963
  770   HH21  ARG  89          2HH2      ARG  89  18.652   4.207   1.766
  771   HH22  ARG  89          1HH2      ARG  89  19.615   3.280   2.866
  Start of MODEL    4
    1    H1   MET   1           HN       MET   1 -19.120   1.228   6.213
    2    HA   MET   1           HA       MET   1 -18.013  -0.557   4.287
    3    HB2  MET   1           2HB      MET   1 -19.101   0.373   2.293
    4    HB3  MET   1           3HB      MET   1 -20.265  -0.414   3.351
    5    HG2  MET   1           2HG      MET   1 -20.765   1.885   4.282
    6    HG3  MET   1           3HG      MET   1 -19.831   2.524   2.931
    7    HE1  MET   1           3HE      MET   1 -22.752   2.696   4.133
    8    HE2  MET   1           1HE      MET   1 -23.926   2.669   2.817
    9    HE3  MET   1           2HE      MET   1 -23.647   1.218   3.779
   10    H    GLY   2           HN       GLY   2 -16.183   0.289   3.457
   11    HA2  GLY   2           1HA      GLY   2 -15.796   3.206   3.720
   12    HA3  GLY   2           2HA      GLY   2 -14.553   2.062   4.203
   13    H    TYR   3           HN       TYR   3 -13.015   1.656   2.766
   14    HA   TYR   3           HA       TYR   3 -13.592   2.204  -0.072
   15    HB2  TYR   3           2HB      TYR   3 -11.121   2.699   1.571
   16    HB3  TYR   3           3HB      TYR   3 -11.038   2.571  -0.183
   17    HD1  TYR   3           2HD      TYR   3 -13.333   4.269   2.241
   18    HD2  TYR   3           1HD      TYR   3 -10.867   4.622  -1.209
   19    HE1  TYR   3           2HE      TYR   3 -13.957   6.640   2.044
   20    HE2  TYR   3           1HE      TYR   3 -11.484   6.994  -1.414
   21    HH   TYR   3           HH       TYR   3 -14.014   8.356  -0.107
   22    H    ARG   4           HN       ARG   4 -12.491   0.894  -1.638
   23    HA   ARG   4           HA       ARG   4 -12.288  -1.864  -0.789
   24    HB2  ARG   4           2HB      ARG   4 -13.479  -1.397  -2.840
   25    HB3  ARG   4           3HB      ARG   4 -12.081  -0.564  -3.508
   26    HG2  ARG   4           2HG      ARG   4 -10.957  -2.509  -3.953
   27    HG3  ARG   4           3HG      ARG   4 -11.799  -3.411  -2.692
   28    HD2  ARG   4           2HD      ARG   4 -12.694  -4.261  -4.668
   29    HD3  ARG   4           3HD      ARG   4 -13.894  -3.082  -4.139
   30    HE   ARG   4           HE       ARG   4 -11.971  -1.957  -5.929
   31   HH11  ARG   4          2HH1      ARG   4 -14.894  -3.840  -5.750
   32   HH12  ARG   4          1HH1      ARG   4 -15.431  -3.398  -7.337
   33   HH21  ARG   4          2HH2      ARG   4 -12.668  -1.367  -8.020
   34   HH22  ARG   4          1HH2      ARG   4 -14.163  -1.992  -8.627
   35    H    ILE   5           HN       ILE   5 -10.479  -3.233  -1.316
   36    HA   ILE   5           HA       ILE   5  -7.923  -1.771  -1.251
   37    HB   ILE   5           HB       ILE   5  -8.392  -4.592  -0.293
   38   HG12  ILE   5          2HG1      ILE   5  -9.721  -3.115   1.092
   39   HG13  ILE   5          3HG1      ILE   5  -8.297  -3.617   1.997
   40   HG21  ILE   5          1HG2      ILE   5  -6.074  -3.809  -0.978
   41   HG22  ILE   5          2HG2      ILE   5  -6.143  -2.731   0.415
   42   HG23  ILE   5          3HG2      ILE   5  -6.238  -4.477   0.646
   43   HD11  ILE   5          3HD1      ILE   5  -7.257  -1.505   1.674
   44   HD12  ILE   5          1HD1      ILE   5  -8.500  -1.004   0.528
   45   HD13  ILE   5          2HD1      ILE   5  -8.905  -1.214   2.232
   46    H    GLU   6           HN       GLU   6  -6.740  -1.887  -3.031
   47    HA   GLU   6           HA       GLU   6  -6.918  -4.316  -4.687
   48    HB2  GLU   6           2HB      GLU   6  -6.872  -1.431  -5.552
   49    HB3  GLU   6           3HB      GLU   6  -6.426  -2.736  -6.642
   50    HG2  GLU   6           2HG      GLU   6  -8.691  -3.752  -6.107
   51    HG3  GLU   6           3HG      GLU   6  -9.091  -2.198  -5.378
   52    H    PHE   7           HN       PHE   7  -5.014  -4.861  -5.880
   53    HA   PHE   7           HA       PHE   7  -2.552  -3.519  -5.020
   54    HB2  PHE   7           2HB      PHE   7  -3.253  -6.416  -4.670
   55    HB3  PHE   7           3HB      PHE   7  -1.573  -5.937  -4.894
   56    HD1  PHE   7           1HD      PHE   7  -4.514  -5.629  -2.703
   57    HD2  PHE   7           2HD      PHE   7  -0.349  -4.879  -3.157
   58    HE1  PHE   7           1HE      PHE   7  -4.350  -5.106  -0.304
   59    HE2  PHE   7           2HE      PHE   7  -0.178  -4.357  -0.759
   60    HZ   PHE   7           HZ       PHE   7  -2.180  -4.470   0.671
   61    H    ASP   8           HN       ASP   8  -1.259  -3.088  -6.677
   62    HA   ASP   8           HA       ASP   8  -1.897  -3.680  -9.326
   63    HB2  ASP   8           2HB      ASP   8   0.525  -2.992  -9.774
   64    HB3  ASP   8           3HB      ASP   8  -0.497  -1.814  -8.954
   65    HA   PRO   9           HA       PRO   9  -0.371  -7.713 -10.128
   66    HB2  PRO   9           2HB      PRO   9   0.562  -7.454 -12.664
   67    HB3  PRO   9           3HB      PRO   9  -1.161  -7.466 -12.271
   68    HG2  PRO   9           2HG      PRO   9   0.643  -5.139 -12.808
   69    HG3  PRO   9           3HG      PRO   9  -1.012  -5.426 -13.377
   70    HD2  PRO   9           2HD      PRO   9  -0.451  -3.786 -11.297
   71    HD3  PRO   9           3HD      PRO   9  -1.950  -4.732 -11.389
   72    H    ARG  10           HN       ARG  10   1.709  -5.057  -9.930
   73    HA   ARG  10           HA       ARG  10   4.122  -6.645 -10.381
   74    HB2  ARG  10           2HB      ARG  10   3.518  -3.732 -10.196
   75    HB3  ARG  10           3HB      ARG  10   5.130  -4.269  -9.744
   76    HG2  ARG  10           2HG      ARG  10   5.230  -3.650 -12.020
   77    HG3  ARG  10           3HG      ARG  10   5.261  -5.414 -11.977
   78    HD2  ARG  10           2HD      ARG  10   2.995  -5.562 -12.646
   79    HD3  ARG  10           3HD      ARG  10   2.727  -3.842 -12.365
   80    HE   ARG  10           HE       ARG  10   3.767  -5.047 -14.728
   81   HH11  ARG  10          2HH1      ARG  10   3.926  -2.191 -12.744
   82   HH12  ARG  10          1HH1      ARG  10   4.406  -1.154 -14.047
   83   HH21  ARG  10          2HH2      ARG  10   4.398  -3.692 -16.452
   84   HH22  ARG  10          1HH2      ARG  10   4.673  -2.008 -16.155
   85    H    ALA  11           HN       ALA  11   2.648  -4.618  -7.856
   86    HA   ALA  11           HA       ALA  11   4.567  -5.126  -5.866
   87    HB1  ALA  11           1HB      ALA  11   2.697  -3.351  -5.945
   88    HB2  ALA  11           2HB      ALA  11   1.689  -4.605  -5.223
   89    HB3  ALA  11           3HB      ALA  11   3.137  -4.048  -4.386
   90    H    GLU  12           HN       GLU  12   1.456  -6.702  -6.559
   91    HA   GLU  12           HA       GLU  12   1.105  -8.419  -4.532
   92    HB2  GLU  12           2HB      GLU  12   0.019  -8.270  -6.957
   93    HB3  GLU  12           3HB      GLU  12   1.038  -9.676  -7.231
   94    HG2  GLU  12           2HG      GLU  12  -0.759  -9.567  -4.849
   95    HG3  GLU  12           3HG      GLU  12  -1.401  -9.994  -6.434
   96    H    LYS  13           HN       LYS  13   3.484  -8.857  -7.119
   97    HA   LYS  13           HA       LYS  13   4.486 -11.313  -5.996
   98    HB2  LYS  13           2HB      LYS  13   5.107  -9.623  -8.364
   99    HB3  LYS  13           3HB      LYS  13   6.385 -10.672  -7.766
  100    HG2  LYS  13           2HG      LYS  13   3.667 -11.801  -8.237
  101    HG3  LYS  13           3HG      LYS  13   4.743 -11.508  -9.606
  102    HD2  LYS  13           2HD      LYS  13   5.287 -13.679  -9.064
  103    HD3  LYS  13           3HD      LYS  13   6.485 -12.782  -8.127
  104    HE2  LYS  13           2HE      LYS  13   5.433 -13.210  -6.123
  105    HE3  LYS  13           3HE      LYS  13   3.858 -13.445  -6.880
  106    HZ1  LYS  13           3HZ      LYS  13   5.032 -15.492  -6.002
  107    HZ2  LYS  13           1HZ      LYS  13   6.093 -15.334  -7.310
  108    HZ3  LYS  13           2HZ      LYS  13   4.442 -15.581  -7.585
  109    H    GLU  14           HN       GLU  14   5.591  -7.951  -6.210
  110    HA   GLU  14           HA       GLU  14   8.103  -8.252  -5.052
  111    HB2  GLU  14           2HB      GLU  14   6.192  -5.917  -4.865
  112    HB3  GLU  14           3HB      GLU  14   7.892  -5.857  -4.420
  113    HG2  GLU  14           2HG      GLU  14   8.548  -6.317  -6.694
  114    HG3  GLU  14           3HG      GLU  14   6.862  -6.514  -7.170
  115    H    LEU  15           HN       LEU  15   4.945  -8.254  -3.606
  116    HA   LEU  15           HA       LEU  15   6.008  -7.997  -0.911
  117    HB2  LEU  15           2HB      LEU  15   3.989  -6.866  -1.142
  118    HB3  LEU  15           3HB      LEU  15   3.264  -8.162  -2.092
  119    HG   LEU  15           HG       LEU  15   3.906  -8.470   0.831
  120   HD11  LEU  15          1HD1      LEU  15   2.181  -7.207   1.406
  121   HD12  LEU  15          2HD1      LEU  15   1.116  -8.127   0.344
  122   HD13  LEU  15          3HD1      LEU  15   1.989  -6.729  -0.281
  123   HD21  LEU  15          3HD2      LEU  15   1.808 -10.056   0.343
  124   HD22  LEU  15          1HD2      LEU  15   3.479 -10.584   0.143
  125   HD23  LEU  15          2HD2      LEU  15   2.546 -10.059  -1.260
  126    H    GLU  16           HN       GLU  16   4.180 -10.396  -2.805
  127    HA   GLU  16           HA       GLU  16   3.963 -12.431  -0.997
  128    HB2  GLU  16           2HB      GLU  16   4.434 -12.454  -3.963
  129    HB3  GLU  16           3HB      GLU  16   4.314 -13.962  -3.067
  130    HG2  GLU  16           2HG      GLU  16   2.200 -11.827  -3.005
  131    HG3  GLU  16           3HG      GLU  16   2.197 -13.173  -4.143
  132    H    LYS  17           HN       LYS  17   6.824 -11.438  -2.766
  133    HA   LYS  17           HA       LYS  17   8.445 -13.669  -2.211
  134    HB2  LYS  17           2HB      LYS  17   9.058 -10.791  -2.849
  135    HB3  LYS  17           3HB      LYS  17  10.339 -11.955  -2.534
  136    HG2  LYS  17           2HG      LYS  17   9.141 -13.362  -4.364
  137    HG3  LYS  17           3HG      LYS  17   8.430 -11.813  -4.822
  138    HD2  LYS  17           2HD      LYS  17  10.953 -11.024  -4.659
  139    HD3  LYS  17           3HD      LYS  17  11.254 -12.735  -4.974
  140    HE2  LYS  17           2HE      LYS  17   9.901 -12.618  -6.992
  141    HE3  LYS  17           3HE      LYS  17   9.532 -10.925  -6.665
  142    HZ1  LYS  17           3HZ      LYS  17  11.992 -12.130  -7.673
  143    HZ2  LYS  17           1HZ      LYS  17  12.155 -10.794  -6.648
  144    HZ3  LYS  17           2HZ      LYS  17  11.263 -10.658  -8.079
  145    H    LEU  18           HN       LEU  18   7.832 -10.692  -0.417
  146    HA   LEU  18           HA       LEU  18   9.790 -10.880   1.532
  147    HB2  LEU  18           2HB      LEU  18   6.954  -9.928   1.903
  148    HB3  LEU  18           3HB      LEU  18   8.324  -9.543   2.943
  149    HG   LEU  18           HG       LEU  18   8.274  -8.758   0.043
  150   HD11  LEU  18          1HD1      LEU  18   7.434  -6.929   2.263
  151   HD12  LEU  18          2HD1      LEU  18   6.261  -7.917   1.393
  152   HD13  LEU  18          3HD1      LEU  18   7.233  -6.731   0.522
  153   HD21  LEU  18          3HD2      LEU  18   9.822  -7.009   0.884
  154   HD22  LEU  18          1HD2      LEU  18  10.431  -8.650   1.098
  155   HD23  LEU  18          2HD2      LEU  18   9.763  -7.772   2.474
  156    H    ASP  19           HN       ASP  19   9.257 -11.312   3.932
  157    HA   ASP  19           HA       ASP  19   8.980 -14.022   4.352
  158    HB2  ASP  19           2HB      ASP  19   9.716 -12.032   5.939
  159    HB3  ASP  19           3HB      ASP  19   8.052 -12.168   6.501
  160    H    ARG  20           HN       ARG  20   7.273 -15.139   5.656
  161    HA   ARG  20           HA       ARG  20   4.756 -14.873   4.324
  162    HB2  ARG  20           2HB      ARG  20   5.579 -17.074   4.921
  163    HB3  ARG  20           3HB      ARG  20   5.627 -16.631   6.622
  164    HG2  ARG  20           2HG      ARG  20   3.670 -17.775   6.597
  165    HG3  ARG  20           3HG      ARG  20   3.056 -16.169   6.196
  166    HD2  ARG  20           2HD      ARG  20   3.178 -16.753   3.804
  167    HD3  ARG  20           3HD      ARG  20   3.716 -18.373   4.246
  168    HE   ARG  20           HE       ARG  20   1.540 -18.912   4.634
  169   HH11  ARG  20          2HH1      ARG  20   1.874 -15.455   4.871
  170   HH12  ARG  20          1HH1      ARG  20   0.180 -15.176   5.099
  171   HH21  ARG  20          2HH2      ARG  20  -0.694 -18.558   4.933
  172   HH22  ARG  20          1HH2      ARG  20  -1.280 -16.941   5.135
  173    H    GLU  21           HN       GLU  21   5.805 -14.477   7.704
  174    HA   GLU  21           HA       GLU  21   3.337 -13.690   8.752
  175    HB2  GLU  21           2HB      GLU  21   5.658 -14.245   9.889
  176    HB3  GLU  21           3HB      GLU  21   5.856 -12.500   9.828
  177    HG2  GLU  21           2HG      GLU  21   4.200 -12.113  11.347
  178    HG3  GLU  21           3HG      GLU  21   3.325 -13.586  10.935
  179    H    VAL  22           HN       VAL  22   6.016 -11.709   7.511
  180    HA   VAL  22           HA       VAL  22   4.898  -9.198   7.982
  181    HB   VAL  22           HB       VAL  22   6.745 -10.043   5.745
  182   HG11  VAL  22          1HG1      VAL  22   7.273  -7.745   5.421
  183   HG12  VAL  22          2HG1      VAL  22   5.515  -7.886   5.366
  184   HG13  VAL  22          3HG1      VAL  22   6.307  -7.262   6.814
  185   HG21  VAL  22          3HG2      VAL  22   7.118  -9.491   8.596
  186   HG22  VAL  22          1HG2      VAL  22   8.148 -10.368   7.464
  187   HG23  VAL  22          2HG2      VAL  22   8.221  -8.607   7.541
  188    H    ALA  23           HN       ALA  23   4.844 -11.100   4.964
  189    HA   ALA  23           HA       ALA  23   3.325  -9.449   3.388
  190    HB1  ALA  23           1HB      ALA  23   2.379 -11.831   2.579
  191    HB2  ALA  23           2HB      ALA  23   3.980 -11.223   2.158
  192    HB3  ALA  23           3HB      ALA  23   3.791 -12.358   3.494
  193    H    ARG  24           HN       ARG  24   2.055 -12.049   5.477
  194    HA   ARG  24           HA       ARG  24  -0.654 -11.538   5.046
  195    HB2  ARG  24           2HB      ARG  24   0.321 -13.563   6.164
  196    HB3  ARG  24           3HB      ARG  24   0.569 -12.583   7.603
  197    HG2  ARG  24           2HG      ARG  24  -1.993 -12.099   7.337
  198    HG3  ARG  24           3HG      ARG  24  -1.959 -13.603   6.415
  199    HD2  ARG  24           2HD      ARG  24  -1.443 -14.873   8.242
  200    HD3  ARG  24           3HD      ARG  24  -0.592 -13.557   9.050
  201    HE   ARG  24           HE       ARG  24  -3.233 -12.802   9.003
  202   HH11  ARG  24          2HH1      ARG  24  -1.409 -15.492  10.253
  203   HH12  ARG  24          1HH1      ARG  24  -2.492 -15.780  11.574
  204   HH21  ARG  24          2HH2      ARG  24  -4.666 -13.172  10.739
  205   HH22  ARG  24          1HH2      ARG  24  -4.345 -14.461  11.849
  206    H    ARG  25           HN       ARG  25   1.538 -10.276   7.533
  207    HA   ARG  25           HA       ARG  25  -0.335  -8.823   9.009
  208    HB2  ARG  25           2HB      ARG  25   1.707  -8.991  10.074
  209    HB3  ARG  25           3HB      ARG  25   2.618  -8.642   8.611
  210    HG2  ARG  25           2HG      ARG  25   1.983  -6.297   8.757
  211    HG3  ARG  25           3HG      ARG  25   1.035  -6.638  10.205
  212    HD2  ARG  25           2HD      ARG  25   2.971  -5.921  11.178
  213    HD3  ARG  25           3HD      ARG  25   3.330  -7.642  11.040
  214    HE   ARG  25           HE       ARG  25   4.184  -6.231   8.729
  215   HH11  ARG  25          2HH1      ARG  25   5.011  -6.856  12.053
  216   HH12  ARG  25          1HH1      ARG  25   6.709  -6.607  11.813
  217   HH21  ARG  25          2HH2      ARG  25   6.417  -5.901   8.401
  218   HH22  ARG  25          1HH2      ARG  25   7.508  -6.063   9.736
  219    H    ILE  26           HN       ILE  26   1.441  -7.994   6.085
  220    HA   ILE  26           HA       ILE  26   0.795  -5.255   6.006
  221    HB   ILE  26           HB       ILE  26   1.551  -7.221   3.861
  222   HG12  ILE  26          2HG1      ILE  26   2.976  -4.778   4.930
  223   HG13  ILE  26          3HG1      ILE  26   3.252  -6.415   5.515
  224   HG21  ILE  26          1HG2      ILE  26   0.626  -4.397   3.574
  225   HG22  ILE  26          2HG2      ILE  26   1.861  -5.030   2.487
  226   HG23  ILE  26          3HG2      ILE  26   0.277  -5.802   2.566
  227   HD11  ILE  26          3HD1      ILE  26   4.768  -6.693   3.939
  228   HD12  ILE  26          1HD1      ILE  26   3.520  -6.481   2.711
  229   HD13  ILE  26          2HD1      ILE  26   4.426  -5.086   3.297
  230    H    LEU  27           HN       LEU  27  -0.625  -7.911   4.086
  231    HA   LEU  27           HA       LEU  27  -2.729  -6.480   2.991
  232    HB2  LEU  27           2HB      LEU  27  -2.372  -9.377   3.658
  233    HB3  LEU  27           3HB      LEU  27  -3.883  -8.790   2.969
  234    HG   LEU  27           HG       LEU  27  -1.242  -8.321   1.616
  235   HD11  LEU  27          1HD1      LEU  27  -2.139 -10.324   0.177
  236   HD12  LEU  27          2HD1      LEU  27  -2.911 -10.785   1.694
  237   HD13  LEU  27          3HD1      LEU  27  -1.158 -10.609   1.615
  238   HD21  LEU  27          3HD2      LEU  27  -2.612  -7.085   0.354
  239   HD22  LEU  27          1HD2      LEU  27  -4.060  -7.816   1.046
  240   HD23  LEU  27          2HD2      LEU  27  -3.207  -8.625  -0.268
  241    H    ARG  28           HN       ARG  28  -2.726  -8.449   5.957
  242    HA   ARG  28           HA       ARG  28  -5.383  -7.997   6.690
  243    HB2  ARG  28           2HB      ARG  28  -3.561  -9.600   7.677
  244    HB3  ARG  28           3HB      ARG  28  -3.236  -8.254   8.761
  245    HG2  ARG  28           2HG      ARG  28  -5.624  -8.282   9.429
  246    HG3  ARG  28           3HG      ARG  28  -5.840  -9.725   8.437
  247    HD2  ARG  28           2HD      ARG  28  -4.628 -11.052   9.859
  248    HD3  ARG  28           3HD      ARG  28  -3.656  -9.707  10.456
  249    HE   ARG  28           HE       ARG  28  -6.007 -10.716  11.632
  250   HH11  ARG  28          2HH1      ARG  28  -4.434  -7.700  10.893
  251   HH12  ARG  28          1HH1      ARG  28  -5.170  -6.844  12.207
  252   HH21  ARG  28          2HH2      ARG  28  -6.982  -9.601  13.366
  253   HH22  ARG  28          1HH2      ARG  28  -6.619  -7.926  13.614
  254    H    PHE  29           HN       PHE  29  -2.455  -6.147   7.384
  255    HA   PHE  29           HA       PHE  29  -3.518  -4.338   9.223
  256    HB2  PHE  29           2HB      PHE  29  -1.182  -4.311   9.008
  257    HB3  PHE  29           3HB      PHE  29  -1.254  -4.168   7.254
  258    HD1  PHE  29           1HD      PHE  29  -1.948  -2.328  10.398
  259    HD2  PHE  29           2HD      PHE  29  -1.138  -2.081   6.227
  260    HE1  PHE  29           1HE      PHE  29  -1.703   0.112  10.594
  261    HE2  PHE  29           2HE      PHE  29  -0.890   0.360   6.416
  262    HZ   PHE  29           HZ       PHE  29  -1.172   1.459   8.602
  263    H    LEU  30           HN       LEU  30  -3.547  -4.314   5.700
  264    HA   LEU  30           HA       LEU  30  -4.844  -1.728   5.593
  265    HB2  LEU  30           2HB      LEU  30  -3.982  -3.731   3.533
  266    HB3  LEU  30           3HB      LEU  30  -4.994  -2.352   3.105
  267    HG   LEU  30           HG       LEU  30  -2.402  -1.896   4.522
  268   HD11  LEU  30          1HD1      LEU  30  -1.397  -3.066   2.866
  269   HD12  LEU  30          2HD1      LEU  30  -1.636  -1.557   1.988
  270   HD13  LEU  30          3HD1      LEU  30  -2.762  -2.895   1.762
  271   HD21  LEU  30          3HD2      LEU  30  -2.897   0.226   4.108
  272   HD22  LEU  30          1HD2      LEU  30  -4.446  -0.295   3.445
  273   HD23  LEU  30          2HD2      LEU  30  -3.050  -0.107   2.382
  274    H    ARG  31           HN       ARG  31  -5.739  -5.060   5.650
  275    HA   ARG  31           HA       ARG  31  -8.420  -4.547   4.646
  276    HB2  ARG  31           2HB      ARG  31  -6.990  -7.038   5.560
  277    HB3  ARG  31           3HB      ARG  31  -8.710  -7.026   5.192
  278    HG2  ARG  31           2HG      ARG  31  -8.330  -6.546   2.922
  279    HG3  ARG  31           3HG      ARG  31  -6.647  -6.103   3.218
  280    HD2  ARG  31           2HD      ARG  31  -6.653  -8.264   2.214
  281    HD3  ARG  31           3HD      ARG  31  -6.237  -8.471   3.915
  282    HE   ARG  31           HE       ARG  31  -8.099  -9.760   4.141
  283   HH11  ARG  31          2HH1      ARG  31  -8.514  -7.704   1.362
  284   HH12  ARG  31          1HH1      ARG  31 -10.027  -8.412   0.901
  285   HH21  ARG  31          2HH2      ARG  31 -10.090 -10.700   3.545
  286   HH22  ARG  31          1HH2      ARG  31 -10.923 -10.116   2.144
  287    H    GLU  32           HN       GLU  32  -6.817  -4.309   7.567
  288    HA   GLU  32           HA       GLU  32  -9.312  -4.700   9.086
  289    HB2  GLU  32           2HB      GLU  32  -6.438  -4.940   9.980
  290    HB3  GLU  32           3HB      GLU  32  -7.804  -4.939  11.085
  291    HG2  GLU  32           2HG      GLU  32  -7.114  -6.979   8.997
  292    HG3  GLU  32           3HG      GLU  32  -7.213  -7.193  10.744
  293    H    ARG  33           HN       ARG  33  -6.270  -2.892   9.537
  294    HA   ARG  33           HA       ARG  33  -7.444  -0.806  11.004
  295    HB2  ARG  33           2HB      ARG  33  -4.916  -0.692   9.351
  296    HB3  ARG  33           3HB      ARG  33  -5.351   0.386  10.670
  297    HG2  ARG  33           2HG      ARG  33  -5.136  -2.552  11.155
  298    HG3  ARG  33           3HG      ARG  33  -3.684  -1.552  11.085
  299    HD2  ARG  33           2HD      ARG  33  -4.132  -1.411  13.317
  300    HD3  ARG  33           3HD      ARG  33  -5.079  -0.040  12.742
  301    HE   ARG  33           HE       ARG  33  -6.845  -2.084  12.659
  302   HH11  ARG  33          2HH1      ARG  33  -4.720  -0.862  15.131
  303   HH12  ARG  33          1HH1      ARG  33  -5.755  -1.336  16.437
  304   HH21  ARG  33          2HH2      ARG  33  -8.216  -2.712  14.370
  305   HH22  ARG  33          1HH2      ARG  33  -7.743  -2.389  16.004
  306    H    VAL  34           HN       VAL  34  -5.985  -0.415   7.779
  307    HA   VAL  34           HA       VAL  34  -7.227   1.980   7.149
  308    HB   VAL  34           HB       VAL  34  -6.383  -0.195   5.228
  309   HG11  VAL  34          1HG1      VAL  34  -7.620   2.382   4.817
  310   HG12  VAL  34          2HG1      VAL  34  -6.032   2.303   4.050
  311   HG13  VAL  34          3HG1      VAL  34  -7.266   1.105   3.653
  312   HG21  VAL  34          3HG2      VAL  34  -4.822   1.243   7.004
  313   HG22  VAL  34          1HG2      VAL  34  -4.260   0.397   5.562
  314   HG23  VAL  34          2HG2      VAL  34  -4.646   2.116   5.482
  315    H    ALA  35           HN       ALA  35  -8.367  -1.321   6.711
  316    HA   ALA  35           HA       ALA  35 -10.541  -0.862   5.036
  317    HB1  ALA  35           1HB      ALA  35  -9.851  -3.099   5.494
  318    HB2  ALA  35           2HB      ALA  35 -10.168  -2.904   7.219
  319    HB3  ALA  35           3HB      ALA  35 -11.508  -2.922   6.073
  320    H    THR  36           HN       THR  36 -10.464  -0.914   8.599
  321    HA   THR  36           HA       THR  36 -13.189  -0.112   8.864
  322    HB   THR  36           HB       THR  36 -12.791   0.027  11.216
  323    HG1  THR  36           1HG      THR  36 -10.895   1.180  11.350
  324   HG21  THR  36          3HG2      THR  36 -12.763  -2.203  11.177
  325   HG22  THR  36          1HG2      THR  36 -11.003  -2.118  11.213
  326   HG23  THR  36          2HG2      THR  36 -11.849  -2.223   9.669
  327    H    LEU  37           HN       LEU  37 -10.103   1.568   8.820
  328    HA   LEU  37           HA       LEU  37 -10.806   4.034   9.837
  329    HB2  LEU  37           2HB      LEU  37  -8.899   3.240   7.662
  330    HB3  LEU  37           3HB      LEU  37  -9.088   4.922   8.153
  331    HG   LEU  37           HG       LEU  37  -8.303   2.730  10.063
  332   HD11  LEU  37          1HD1      LEU  37  -6.294   2.681   9.128
  333   HD12  LEU  37          2HD1      LEU  37  -6.105   4.386   9.536
  334   HD13  LEU  37          3HD1      LEU  37  -6.755   3.923   7.964
  335   HD21  LEU  37          3HD2      LEU  37  -7.628   5.608  10.386
  336   HD22  LEU  37          1HD2      LEU  37  -7.944   4.375  11.606
  337   HD23  LEU  37          2HD2      LEU  37  -9.284   5.092  10.710
  338    H    GLU  38           HN       GLU  38 -12.631   5.078   9.333
  339    HA   GLU  38           HA       GLU  38 -14.256   4.984   7.214
  340    HB2  GLU  38           2HB      GLU  38 -14.288   6.552   9.298
  341    HB3  GLU  38           3HB      GLU  38 -13.518   7.710   8.222
  342    HG2  GLU  38           2HG      GLU  38 -15.458   7.289   6.636
  343    HG3  GLU  38           3HG      GLU  38 -16.243   6.480   7.991
  344    H    ASP  39           HN       ASP  39 -11.236   6.816   7.316
  345    HA   ASP  39           HA       ASP  39 -11.360   7.027   4.384
  346    HB2  ASP  39           2HB      ASP  39 -10.025   9.168   6.000
  347    HB3  ASP  39           3HB      ASP  39 -10.697   9.254   4.374
  348    HA   PRO  40           HA       PRO  40  -7.402   5.104   4.482
  349    HB2  PRO  40           2HB      PRO  40  -6.508   5.854   2.031
  350    HB3  PRO  40           3HB      PRO  40  -7.752   4.620   2.264
  351    HG2  PRO  40           2HG      PRO  40  -8.061   7.510   1.547
  352    HG3  PRO  40           3HG      PRO  40  -8.898   6.096   0.881
  353    HD2  PRO  40           2HD      PRO  40 -10.026   7.720   2.731
  354    HD3  PRO  40           3HD      PRO  40 -10.374   5.981   2.647
  355    H    ARG  41           HN       ARG  41  -7.852   8.491   4.263
  356    HA   ARG  41           HA       ARG  41  -4.998   9.077   4.376
  357    HB2  ARG  41           2HB      ARG  41  -7.414  10.894   4.324
  358    HB3  ARG  41           3HB      ARG  41  -5.746  11.453   4.357
  359    HG2  ARG  41           2HG      ARG  41  -5.371  10.229   2.217
  360    HG3  ARG  41           3HG      ARG  41  -7.103   9.893   2.172
  361    HD2  ARG  41           2HD      ARG  41  -6.040  12.688   2.437
  362    HD3  ARG  41           3HD      ARG  41  -6.237  11.919   0.863
  363    HE   ARG  41           HE       ARG  41  -8.331  12.865   2.620
  364   HH11  ARG  41          2HH1      ARG  41  -7.499  10.867  -0.108
  365   HH12  ARG  41          1HH1      ARG  41  -9.107  10.851  -0.752
  366   HH21  ARG  41          2HH2      ARG  41 -10.452  12.850   1.782
  367   HH22  ARG  41          1HH2      ARG  41 -10.786  11.980   0.323
  368    H    SER  42           HN       SER  42  -5.780   7.603   6.540
  369    HA   SER  42           HA       SER  42  -5.911   9.572   8.728
  370    HB2  SER  42           2HB      SER  42  -7.813   8.043   8.747
  371    HB3  SER  42           3HB      SER  42  -6.727   6.655   8.718
  372    HG   SER  42           HG       SER  42  -7.535   8.175  10.819
  373    H    LEU  43           HN       LEU  43  -4.475   6.447   7.816
  374    HA   LEU  43           HA       LEU  43  -2.402   6.796   9.840
  375    HB2  LEU  43           2HB      LEU  43  -3.270   4.529   8.090
  376    HB3  LEU  43           3HB      LEU  43  -1.689   4.501   8.867
  377    HG   LEU  43           HG       LEU  43  -4.305   4.746  10.349
  378   HD11  LEU  43          1HD1      LEU  43  -4.202   2.598   9.232
  379   HD12  LEU  43          2HD1      LEU  43  -3.952   2.397  10.966
  380   HD13  LEU  43          3HD1      LEU  43  -2.578   2.323   9.863
  381   HD21  LEU  43          3HD2      LEU  43  -2.894   4.117  12.286
  382   HD22  LEU  43          1HD2      LEU  43  -2.458   5.674  11.581
  383   HD23  LEU  43          2HD2      LEU  43  -1.471   4.250  11.252
  384    H    GLY  44           HN       GLY  44  -2.587   6.109   6.342
  385    HA2  GLY  44           1HA      GLY  44   0.150   6.425   5.812
  386    HA3  GLY  44           2HA      GLY  44  -1.138   6.593   4.630
  387    H    GLU  45           HN       GLU  45   0.887   8.169   4.154
  388    HA   GLU  45           HA       GLU  45  -0.101  10.819   4.916
  389    HB2  GLU  45           2HB      GLU  45   2.140  11.653   5.330
  390    HB3  GLU  45           3HB      GLU  45   1.799  10.302   6.402
  391    HG2  GLU  45           2HG      GLU  45   3.174   9.749   3.828
  392    HG3  GLU  45           3HG      GLU  45   4.089  10.511   5.128
  393    HA   PRO  46           HA       PRO  46   0.291  11.614   0.606
  394    HB2  PRO  46           2HB      PRO  46   0.377  14.326   0.672
  395    HB3  PRO  46           3HB      PRO  46  -1.103  13.405   0.963
  396    HG2  PRO  46           2HG      PRO  46   0.778  14.643   2.936
  397    HG3  PRO  46           3HG      PRO  46  -0.996  14.634   2.934
  398    HD2  PRO  46           2HD      PRO  46   0.467  12.956   4.475
  399    HD3  PRO  46           3HD      PRO  46  -1.112  12.502   3.802
  400    H    LEU  47           HN       LEU  47   1.723  12.584  -0.981
  401    HA   LEU  47           HA       LEU  47   4.410  13.186   0.063
  402    HB2  LEU  47           2HB      LEU  47   3.583  11.287  -2.097
  403    HB3  LEU  47           3HB      LEU  47   5.173  12.047  -2.141
  404    HG   LEU  47           HG       LEU  47   5.526  11.076   0.187
  405   HD11  LEU  47          1HD1      LEU  47   4.000   9.769   1.151
  406   HD12  LEU  47          2HD1      LEU  47   3.666   8.904  -0.349
  407   HD13  LEU  47          3HD1      LEU  47   2.861  10.438  -0.019
  408   HD21  LEU  47          3HD2      LEU  47   6.142  10.143  -2.268
  409   HD22  LEU  47          1HD2      LEU  47   5.213   8.785  -1.634
  410   HD23  LEU  47          2HD2      LEU  47   6.635   9.362  -0.765
  411    H    ARG  48           HN       ARG  48   4.522  15.331  -0.299
  412    HA   ARG  48           HA       ARG  48   3.869  16.299  -3.003
  413    HB2  ARG  48           2HB      ARG  48   3.721  17.606  -0.306
  414    HB3  ARG  48           3HB      ARG  48   3.886  18.585  -1.757
  415    HG2  ARG  48           2HG      ARG  48   1.750  16.525  -1.698
  416    HG3  ARG  48           3HG      ARG  48   1.530  17.990  -0.739
  417    HD2  ARG  48           2HD      ARG  48   0.602  18.661  -2.719
  418    HD3  ARG  48           3HD      ARG  48   2.272  19.163  -2.974
  419    HE   ARG  48           HE       ARG  48   1.663  16.505  -3.912
  420   HH11  ARG  48          2HH1      ARG  48   1.771  19.895  -4.696
  421   HH12  ARG  48          1HH1      ARG  48   1.886  19.630  -6.404
  422   HH21  ARG  48          2HH2      ARG  48   1.814  16.143  -6.159
  423   HH22  ARG  48          1HH2      ARG  48   1.910  17.495  -7.235
  424    H    GLY  49           HN       GLY  49   5.591  16.646  -4.233
  425    HA2  GLY  49           1HA      GLY  49   7.820  18.184  -3.257
  426    HA3  GLY  49           2HA      GLY  49   8.226  16.502  -3.564
  427    HA   PRO  50           HA       PRO  50   8.778  18.984  -7.476
  428    HB2  PRO  50           2HB      PRO  50  11.327  18.173  -7.939
  429    HB3  PRO  50           3HB      PRO  50  10.932  19.579  -6.944
  430    HG2  PRO  50           2HG      PRO  50  11.632  16.795  -6.097
  431    HG3  PRO  50           3HG      PRO  50  12.178  18.340  -5.420
  432    HD2  PRO  50           2HD      PRO  50  10.217  16.861  -4.279
  433    HD3  PRO  50           3HD      PRO  50  10.242  18.635  -4.204
  434    H    GLU  51           HN       GLU  51   9.744  15.688  -6.610
  435    HA   GLU  51           HA       GLU  51   8.935  14.817  -9.307
  436    HB2  GLU  51           2HB      GLU  51  11.379  14.515  -8.614
  437    HB3  GLU  51           3HB      GLU  51  10.795  13.296  -7.490
  438    HG2  GLU  51           2HG      GLU  51  11.365  12.007  -9.289
  439    HG3  GLU  51           3HG      GLU  51   9.655  12.292  -9.604
  440    H    LEU  52           HN       LEU  52   7.029  15.186  -7.314
  441    HA   LEU  52           HA       LEU  52   6.018  12.472  -7.072
  442    HB2  LEU  52           2HB      LEU  52   6.242  14.291  -4.679
  443    HB3  LEU  52           3HB      LEU  52   5.481  12.703  -4.710
  444    HG   LEU  52           HG       LEU  52   8.399  13.076  -5.324
  445   HD11  LEU  52          1HD1      LEU  52   8.867  12.509  -2.994
  446   HD12  LEU  52          2HD1      LEU  52   7.143  12.578  -2.628
  447   HD13  LEU  52          3HD1      LEU  52   7.999  14.038  -3.124
  448   HD21  LEU  52          3HD2      LEU  52   6.745  10.922  -5.611
  449   HD22  LEU  52          1HD2      LEU  52   7.425  10.653  -4.006
  450   HD23  LEU  52          2HD2      LEU  52   8.495  10.840  -5.396
  451    H    GLY  53           HN       GLY  53   3.766  12.348  -6.894
  452    HA2  GLY  53           1HA      GLY  53   2.394  14.891  -7.485
  453    HA3  GLY  53           2HA      GLY  53   1.846  13.305  -8.010
  454    H    ARG  54           HN       ARG  54   0.072  12.684  -6.994
  455    HA   ARG  54           HA       ARG  54  -0.290  13.492  -4.184
  456    HB2  ARG  54           2HB      ARG  54  -1.921  14.344  -5.975
  457    HB3  ARG  54           3HB      ARG  54  -2.515  12.691  -6.045
  458    HG2  ARG  54           2HG      ARG  54  -3.127  12.781  -3.702
  459    HG3  ARG  54           3HG      ARG  54  -2.462  14.411  -3.574
  460    HD2  ARG  54           2HD      ARG  54  -4.719  13.621  -5.410
  461    HD3  ARG  54           3HD      ARG  54  -4.935  14.350  -3.820
  462    HE   ARG  54           HE       ARG  54  -3.232  15.899  -5.516
  463   HH11  ARG  54          2HH1      ARG  54  -6.549  15.177  -4.745
  464   HH12  ARG  54          1HH1      ARG  54  -7.149  16.699  -5.315
  465   HH21  ARG  54          2HH2      ARG  54  -4.010  17.906  -6.269
  466   HH22  ARG  54          1HH2      ARG  54  -5.704  18.251  -6.182
  467    H    PHE  55           HN       PHE  55   1.249  11.312  -4.532
  468    HA   PHE  55           HA       PHE  55  -0.411   8.928  -4.404
  469    HB2  PHE  55           2HB      PHE  55   2.585   9.159  -4.067
  470    HB3  PHE  55           3HB      PHE  55   1.665   7.689  -4.372
  471    HD1  PHE  55           1HD      PHE  55   0.623   7.321  -6.579
  472    HD2  PHE  55           2HD      PHE  55   3.200  10.624  -5.827
  473    HE1  PHE  55           1HE      PHE  55   0.908   7.645  -9.001
  474    HE2  PHE  55           2HE      PHE  55   3.489  10.954  -8.248
  475    HZ   PHE  55           HZ       PHE  55   2.342   9.464  -9.838
  476    H    TRP  56           HN       TRP  56  -0.948   7.854  -2.594
  477    HA   TRP  56           HA       TRP  56  -0.167   9.054  -0.043
  478    HB2  TRP  56           2HB      TRP  56  -2.615   8.445  -0.854
  479    HB3  TRP  56           3HB      TRP  56  -2.182   6.857  -0.227
  480    HD1  TRP  56           1HD      TRP  56  -2.015   6.575   2.395
  481    HE1  TRP  56           1HE      TRP  56  -2.722   8.070   4.367
  482    HE3  TRP  56           3HE      TRP  56  -2.792  10.947  -0.139
  483    HZ2  TRP  56           2HZ      TRP  56  -3.506  10.748   4.792
  484    HZ3  TRP  56           3HZ      TRP  56  -3.520  12.929   1.124
  485    HH2  TRP  56           2HH      TRP  56  -3.870  12.829   3.539
  486    H    LYS  57           HN       LYS  57   1.321   8.142   1.200
  487    HA   LYS  57           HA       LYS  57   2.134   5.380   0.635
  488    HB2  LYS  57           2HB      LYS  57   3.880   7.122   0.543
  489    HB3  LYS  57           3HB      LYS  57   3.553   7.529   2.222
  490    HG2  LYS  57           2HG      LYS  57   4.277   5.322   2.924
  491    HG3  LYS  57           3HG      LYS  57   4.548   4.860   1.241
  492    HD2  LYS  57           2HD      LYS  57   6.048   6.874   2.894
  493    HD3  LYS  57           3HD      LYS  57   6.672   5.433   2.087
  494    HE2  LYS  57           2HE      LYS  57   5.916   6.576  -0.086
  495    HE3  LYS  57           3HE      LYS  57   5.812   8.045   0.882
  496    HZ1  LYS  57           3HZ      LYS  57   7.991   8.299   0.717
  497    HZ2  LYS  57           1HZ      LYS  57   8.072   6.950  -0.301
  498    HZ3  LYS  57           2HZ      LYS  57   8.275   6.763   1.368
  499    H    TYR  58           HN       TYR  58   2.423   3.868   2.313
  500    HA   TYR  58           HA       TYR  58   1.048   4.537   4.831
  501    HB2  TYR  58           2HB      TYR  58   0.809   2.066   3.123
  502    HB3  TYR  58           3HB      TYR  58   0.358   2.067   4.825
  503    HD1  TYR  58           1HD      TYR  58  -1.394   3.801   5.570
  504    HD2  TYR  58           2HD      TYR  58  -0.721   2.753   1.502
  505    HE1  TYR  58           1HE      TYR  58  -3.617   4.674   4.984
  506    HE2  TYR  58           2HE      TYR  58  -2.942   3.624   0.904
  507    HH   TYR  58           HH       TYR  58  -5.112   4.975   3.373
  508    H    ARG  59           HN       ARG  59   1.832   3.580   6.718
  509    HA   ARG  59           HA       ARG  59   4.510   2.379   6.460
  510    HB2  ARG  59           2HB      ARG  59   4.780   4.468   7.531
  511    HB3  ARG  59           3HB      ARG  59   3.352   4.231   8.530
  512    HG2  ARG  59           2HG      ARG  59   4.444   2.722   9.941
  513    HG3  ARG  59           3HG      ARG  59   5.753   2.457   8.786
  514    HD2  ARG  59           2HD      ARG  59   6.531   3.844  10.610
  515    HD3  ARG  59           3HD      ARG  59   6.486   4.782   9.117
  516    HE   ARG  59           HE       ARG  59   4.064   5.207  10.378
  517   HH11  ARG  59          2HH1      ARG  59   7.435   5.745  11.063
  518   HH12  ARG  59          1HH1      ARG  59   7.146   7.136  12.053
  519   HH21  ARG  59          2HH2      ARG  59   3.671   7.038  11.681
  520   HH22  ARG  59          1HH2      ARG  59   5.005   7.871  12.405
  521    H    VAL  60           HN       VAL  60   4.799   0.389   7.231
  522    HA   VAL  60           HA       VAL  60   2.852  -0.669   9.171
  523    HB   VAL  60           HB       VAL  60   3.948  -2.120   6.759
  524   HG11  VAL  60          1HG1      VAL  60   3.284  -3.194   9.242
  525   HG12  VAL  60          2HG1      VAL  60   1.880  -3.506   8.218
  526   HG13  VAL  60          3HG1      VAL  60   3.477  -4.068   7.723
  527   HG21  VAL  60          3HG2      VAL  60   1.809  -0.436   6.879
  528   HG22  VAL  60          1HG2      VAL  60   1.985  -1.763   5.731
  529   HG23  VAL  60          2HG2      VAL  60   1.054  -1.995   7.211
  530    H    GLY  61           HN       GLY  61   4.294  -0.383  10.884
  531    HA2  GLY  61           1HA      GLY  61   5.993  -0.959  12.315
  532    HA3  GLY  61           2HA      GLY  61   5.982  -2.514  11.495
  533    H    ASP  62           HN       ASP  62   7.332  -2.791   9.627
  534    HA   ASP  62           HA       ASP  62   9.478  -0.801   9.363
  535    HB2  ASP  62           2HB      ASP  62   9.826  -3.778   9.753
  536    HB3  ASP  62           3HB      ASP  62  11.113  -2.705   9.209
  537    H    TYR  63           HN       TYR  63   7.249  -1.177   7.664
  538    HA   TYR  63           HA       TYR  63   8.653  -1.811   5.192
  539    HB2  TYR  63           2HB      TYR  63   6.068  -3.136   6.024
  540    HB3  TYR  63           3HB      TYR  63   6.684  -3.144   4.375
  541    HD1  TYR  63           1HD      TYR  63   7.567  -4.144   7.849
  542    HD2  TYR  63           2HD      TYR  63   8.193  -4.792   3.691
  543    HE1  TYR  63           1HE      TYR  63   8.908  -6.140   8.368
  544    HE2  TYR  63           2HE      TYR  63   9.534  -6.790   4.198
  545    HH   TYR  63           HH       TYR  63  10.639  -7.892   5.864
  546    H    ARG  64           HN       ARG  64   8.066  -0.532   3.517
  547    HA   ARG  64           HA       ARG  64   5.954   1.441   4.050
  548    HB2  ARG  64           2HB      ARG  64   8.196   1.599   2.029
  549    HB3  ARG  64           3HB      ARG  64   7.083   2.887   2.469
  550    HG2  ARG  64           2HG      ARG  64   8.950   1.620   4.449
  551    HG3  ARG  64           3HG      ARG  64   9.404   3.007   3.457
  552    HD2  ARG  64           2HD      ARG  64   6.868   3.110   5.020
  553    HD3  ARG  64           3HD      ARG  64   8.400   3.332   5.864
  554    HE   ARG  64           HE       ARG  64   8.245   4.986   3.560
  555   HH11  ARG  64          2HH1      ARG  64   7.111   4.685   6.837
  556   HH12  ARG  64          1HH1      ARG  64   6.892   6.389   7.057
  557   HH21  ARG  64          2HH2      ARG  64   7.961   7.233   3.836
  558   HH22  ARG  64          1HH2      ARG  64   7.375   7.838   5.348
  559    H    LEU  65           HN       LEU  65   4.209   1.600   2.767
  560    HA   LEU  65           HA       LEU  65   4.156  -0.026   0.311
  561    HB2  LEU  65           2HB      LEU  65   1.726   0.486   1.988
  562    HB3  LEU  65           3HB      LEU  65   1.974  -0.743   0.749
  563    HG   LEU  65           HG       LEU  65   3.430  -0.768   3.384
  564   HD11  LEU  65          1HD1      LEU  65   0.739  -1.866   2.651
  565   HD12  LEU  65          2HD1      LEU  65   1.209  -0.937   4.074
  566   HD13  LEU  65          3HD1      LEU  65   1.729  -2.613   3.905
  567   HD21  LEU  65          3HD2      LEU  65   3.318  -2.471   0.994
  568   HD22  LEU  65          1HD2      LEU  65   3.188  -3.330   2.529
  569   HD23  LEU  65          2HD2      LEU  65   4.583  -2.299   2.211
  570    H    ILE  66           HN       ILE  66   4.016   1.244  -1.407
  571    HA   ILE  66           HA       ILE  66   2.888   3.915  -1.176
  572    HB   ILE  66           HB       ILE  66   3.993   2.688  -3.691
  573   HG12  ILE  66          2HG1      ILE  66   5.616   2.417  -1.810
  574   HG13  ILE  66          3HG1      ILE  66   6.194   3.476  -3.092
  575   HG21  ILE  66          1HG2      ILE  66   2.748   4.832  -3.813
  576   HG22  ILE  66          2HG2      ILE  66   3.943   5.544  -2.730
  577   HG23  ILE  66          3HG2      ILE  66   4.431   4.965  -4.323
  578   HD11  ILE  66          3HD1      ILE  66   4.815   4.680  -0.750
  579   HD12  ILE  66          1HD1      ILE  66   6.478   4.121  -0.577
  580   HD13  ILE  66          2HD1      ILE  66   6.080   5.345  -1.783
  581    H    CYS  67           HN       CYS  67   0.701   3.819  -1.127
  582    HA   CYS  67           HA       CYS  67  -0.661   2.284  -3.231
  583    HB2  CYS  67           2HB      CYS  67  -1.612   3.331  -0.564
  584    HB3  CYS  67           3HB      CYS  67  -2.712   2.697  -1.783
  585    HG   CYS  67           HG       CYS  67  -0.147   0.862  -0.462
  586    H    HIS  68           HN       HIS  68  -2.722   3.312  -4.043
  587    HA   HIS  68           HA       HIS  68  -2.387   6.223  -4.340
  588    HB2  HIS  68           2HB      HIS  68  -1.665   4.920  -6.370
  589    HB3  HIS  68           3HB      HIS  68  -3.327   4.360  -6.527
  590    HD2  HIS  68           2HD      HIS  68  -2.525   8.112  -5.723
  591    HE1  HIS  68           1HE      HIS  68  -4.172   7.860  -9.624
  592    HE2  HIS  68           2HE      HIS  68  -3.325   9.399  -7.819
  593    H    ILE  69           HN       ILE  69  -4.022   7.070  -3.213
  594    HA   ILE  69           HA       ILE  69  -6.552   5.758  -2.920
  595    HB   ILE  69           HB       ILE  69  -5.697   8.554  -2.167
  596   HG12  ILE  69          2HG1      ILE  69  -6.097   6.107  -0.435
  597   HG13  ILE  69          3HG1      ILE  69  -4.530   6.664  -1.012
  598   HG21  ILE  69          1HG2      ILE  69  -8.178   8.181  -2.545
  599   HG22  ILE  69          2HG2      ILE  69  -8.121   7.095  -1.158
  600   HG23  ILE  69          3HG2      ILE  69  -7.706   8.797  -0.962
  601   HD11  ILE  69          3HD1      ILE  69  -6.308   8.486   0.550
  602   HD12  ILE  69          1HD1      ILE  69  -5.293   7.295   1.362
  603   HD13  ILE  69          2HD1      ILE  69  -4.557   8.535   0.346
  604    H    GLN  70           HN       GLN  70  -8.032   5.699  -4.469
  605    HA   GLN  70           HA       GLN  70  -8.209   7.943  -6.357
  606    HB2  GLN  70           2HB      GLN  70  -9.111   5.071  -6.557
  607    HB3  GLN  70           3HB      GLN  70  -9.573   6.301  -7.725
  608    HG2  GLN  70           2HG      GLN  70  -7.298   6.636  -8.374
  609    HG3  GLN  70           3HG      GLN  70  -6.725   5.590  -7.076
  610   HE21  GLN  70          1HE2      GLN  70  -5.901   5.089  -9.588
  611   HE22  GLN  70          2HE2      GLN  70  -6.650   3.657 -10.200
  612    H    ASP  71           HN       ASP  71  -9.456   9.345  -5.119
  613    HA   ASP  71           HA       ASP  71 -11.754   8.698  -3.681
  614    HB2  ASP  71           2HB      ASP  71 -10.376  10.936  -3.885
  615    HB3  ASP  71           3HB      ASP  71 -11.582  11.319  -5.111
  616    H    ARG  72           HN       ARG  72 -11.343   9.515  -7.088
  617    HA   ARG  72           HA       ARG  72 -13.913   9.915  -7.919
  618    HB2  ARG  72           2HB      ARG  72 -13.227   8.892 -10.090
  619    HB3  ARG  72           3HB      ARG  72 -12.090  10.083  -9.473
  620    HG2  ARG  72           2HG      ARG  72 -10.525   8.450  -8.876
  621    HG3  ARG  72           3HG      ARG  72 -11.714   7.150  -8.984
  622    HD2  ARG  72           2HD      ARG  72 -11.628   7.079 -11.280
  623    HD3  ARG  72           3HD      ARG  72 -11.113   8.760 -11.418
  624    HE   ARG  72           HE       ARG  72  -9.099   7.241 -10.157
  625   HH11  ARG  72          2HH1      ARG  72 -10.582   7.737 -13.268
  626   HH12  ARG  72          1HH1      ARG  72  -9.163   7.298 -14.160
  627   HH21  ARG  72          2HH2      ARG  72  -7.224   6.662 -11.320
  628   HH22  ARG  72          1HH2      ARG  72  -7.254   6.686 -13.051
  629    H    GLU  73           HN       GLU  73 -12.359   6.829  -7.197
  630    HA   GLU  73           HA       GLU  73 -15.001   5.540  -7.403
  631    HB2  GLU  73           2HB      GLU  73 -12.282   4.378  -8.024
  632    HB3  GLU  73           3HB      GLU  73 -13.760   3.431  -7.926
  633    HG2  GLU  73           2HG      GLU  73 -13.137   5.616  -9.895
  634    HG3  GLU  73           3HG      GLU  73 -13.266   3.889 -10.223
  635    H    ALA  74           HN       ALA  74 -12.979   6.703  -5.231
  636    HA   ALA  74           HA       ALA  74 -12.367   6.224  -3.080
  637    HB1  ALA  74           1HB      ALA  74 -14.621   4.530  -2.441
  638    HB2  ALA  74           2HB      ALA  74 -14.232   6.153  -1.869
  639    HB3  ALA  74           3HB      ALA  74 -15.112   5.939  -3.382
  640    H    THR  75           HN       THR  75 -11.041   4.555  -4.774
  641    HA   THR  75           HA       THR  75 -10.961   2.052  -3.231
  642    HB   THR  75           HB       THR  75 -10.627   2.250  -6.231
  643    HG1  THR  75           1HG      THR  75 -12.621   0.751  -4.914
  644   HG21  THR  75          3HG2      THR  75  -9.431   0.376  -5.981
  645   HG22  THR  75          1HG2      THR  75 -10.944  -0.405  -5.523
  646   HG23  THR  75          2HG2      THR  75  -9.869   0.231  -4.279
  647    H    VAL  76           HN       VAL  76  -8.988   1.457  -2.555
  648    HA   VAL  76           HA       VAL  76  -6.726   3.145  -3.319
  649    HB   VAL  76           HB       VAL  76  -6.843   1.066  -1.132
  650   HG11  VAL  76          1HG1      VAL  76  -4.638   1.411  -1.110
  651   HG12  VAL  76          2HG1      VAL  76  -4.763   2.804  -2.187
  652   HG13  VAL  76          3HG1      VAL  76  -5.006   3.005  -0.451
  653   HG21  VAL  76          3HG2      VAL  76  -8.518   2.831  -0.779
  654   HG22  VAL  76          1HG2      VAL  76  -7.224   2.897   0.417
  655   HG23  VAL  76          2HG2      VAL  76  -7.250   4.048  -0.918
  656    H    LEU  77           HN       LEU  77  -5.194   2.469  -4.663
  657    HA   LEU  77           HA       LEU  77  -4.926  -0.426  -5.143
  658    HB2  LEU  77           2HB      LEU  77  -5.850   0.442  -7.112
  659    HB3  LEU  77           3HB      LEU  77  -4.847   1.890  -7.046
  660    HG   LEU  77           HG       LEU  77  -2.915   0.086  -7.371
  661   HD11  LEU  77          1HD1      LEU  77  -5.057  -1.573  -7.520
  662   HD12  LEU  77          2HD1      LEU  77  -3.494  -1.883  -8.275
  663   HD13  LEU  77          3HD1      LEU  77  -4.806  -1.180  -9.221
  664   HD21  LEU  77          3HD2      LEU  77  -3.581   2.080  -8.790
  665   HD22  LEU  77          1HD2      LEU  77  -4.573   0.959  -9.722
  666   HD23  LEU  77          2HD2      LEU  77  -2.826   0.729  -9.636
  667    H    VAL  78           HN       VAL  78  -2.984  -1.269  -4.765
  668    HA   VAL  78           HA       VAL  78  -0.834   0.393  -3.854
  669    HB   VAL  78           HB       VAL  78  -0.633  -2.548  -4.471
  670   HG11  VAL  78          1HG1      VAL  78   0.733  -0.844  -2.390
  671   HG12  VAL  78          2HG1      VAL  78   1.050  -2.545  -2.738
  672   HG13  VAL  78          3HG1      VAL  78   1.439  -1.311  -3.937
  673   HG21  VAL  78          3HG2      VAL  78  -2.289  -2.891  -3.010
  674   HG22  VAL  78          1HG2      VAL  78  -1.151  -2.356  -1.772
  675   HG23  VAL  78          2HG2      VAL  78  -2.285  -1.208  -2.483
  676    H    LEU  79           HN       LEU  79   1.084   0.868  -4.841
  677    HA   LEU  79           HA       LEU  79   1.307   0.121  -7.682
  678    HB2  LEU  79           2HB      LEU  79   2.147   2.635  -6.255
  679    HB3  LEU  79           3HB      LEU  79   2.646   2.237  -7.897
  680    HG   LEU  79           HG       LEU  79  -0.230   2.561  -7.056
  681   HD11  LEU  79          1HD1      LEU  79  -0.153   4.764  -8.046
  682   HD12  LEU  79          2HD1      LEU  79   1.559   4.567  -8.420
  683   HD13  LEU  79          3HD1      LEU  79   1.028   4.654  -6.741
  684   HD21  LEU  79          3HD2      LEU  79  -0.599   2.773  -9.475
  685   HD22  LEU  79          1HD2      LEU  79   0.087   1.206  -9.044
  686   HD23  LEU  79          2HD2      LEU  79   1.114   2.452  -9.755
  687    H    ARG  80           HN       ARG  80   3.075   0.698  -4.683
  688    HA   ARG  80           HA       ARG  80   5.177  -1.096  -5.645
  689    HB2  ARG  80           2HB      ARG  80   5.573   1.713  -4.645
  690    HB3  ARG  80           3HB      ARG  80   6.846   0.508  -4.503
  691    HG2  ARG  80           2HG      ARG  80   5.555   1.008  -7.148
  692    HG3  ARG  80           3HG      ARG  80   6.801   2.102  -6.544
  693    HD2  ARG  80           2HD      ARG  80   7.075  -0.874  -6.956
  694    HD3  ARG  80           3HD      ARG  80   7.779   0.389  -7.965
  695    HE   ARG  80           HE       ARG  80   8.614   0.702  -5.284
  696   HH11  ARG  80          2HH1      ARG  80   9.104  -1.311  -8.082
  697   HH12  ARG  80          1HH1      ARG  80  10.723  -1.748  -7.645
  698   HH21  ARG  80          2HH2      ARG  80  10.744   0.134  -4.699
  699   HH22  ARG  80          1HH2      ARG  80  11.655  -0.927  -5.720
  700    H    VAL  81           HN       VAL  81   6.400  -2.099  -3.968
  701    HA   VAL  81           HA       VAL  81   5.535  -1.691  -1.220
  702    HB   VAL  81           HB       VAL  81   4.007  -3.419  -2.347
  703   HG11  VAL  81          1HG1      VAL  81   4.793  -5.558  -2.798
  704   HG12  VAL  81          2HG1      VAL  81   6.077  -4.524  -3.428
  705   HG13  VAL  81          3HG1      VAL  81   6.270  -5.319  -1.866
  706   HG21  VAL  81          3HG2      VAL  81   5.070  -4.908  -0.121
  707   HG22  VAL  81          1HG2      VAL  81   5.029  -3.182   0.240
  708   HG23  VAL  81          2HG2      VAL  81   3.555  -4.016  -0.252
  709    H    GLY  82           HN       GLY  82   7.342  -1.578  -0.071
  710    HA2  GLY  82           1HA      GLY  82   9.356  -3.639  -0.287
  711    HA3  GLY  82           2HA      GLY  82   9.897  -2.057  -0.827
  712    H    HIS  83           HN       HIS  83  11.005  -3.498   1.346
  713    HA   HIS  83           HA       HIS  83  10.007  -2.647   3.844
  714    HB2  HIS  83           2HB      HIS  83  11.621  -4.531   3.487
  715    HB3  HIS  83           3HB      HIS  83  12.873  -3.334   3.169
  716    HD2  HIS  83           2HD      HIS  83  12.711  -5.451   5.854
  717    HE1  HIS  83           1HE      HIS  83  12.533  -1.755   7.929
  718    HE2  HIS  83           2HE      HIS  83  13.060  -4.212   8.098
  719    H    ALA  84           HN       ALA  84  10.491  -0.912   5.132
  720    HA   ALA  84           HA       ALA  84  10.955   1.558   4.035
  721    HB1  ALA  84           1HB      ALA  84  10.367   2.103   6.103
  722    HB2  ALA  84           2HB      ALA  84  10.733   0.475   6.675
  723    HB3  ALA  84           3HB      ALA  84  11.999   1.702   6.640
  724    H    ARG  85           HN       ARG  85  13.366  -0.398   5.797
  725    HA   ARG  85           HA       ARG  85  15.562   1.233   5.478
  726    HB2  ARG  85           2HB      ARG  85  16.910  -0.639   5.975
  727    HB3  ARG  85           3HB      ARG  85  15.380  -0.942   6.789
  728    HG2  ARG  85           2HG      ARG  85  15.704  -2.982   5.858
  729    HG3  ARG  85           3HG      ARG  85  14.849  -2.205   4.524
  730    HD2  ARG  85           2HD      ARG  85  16.684  -3.219   3.501
  731    HD3  ARG  85           3HD      ARG  85  17.174  -1.535   3.681
  732    HE   ARG  85           HE       ARG  85  17.999  -3.116   5.901
  733   HH11  ARG  85          2HH1      ARG  85  18.771  -2.319   2.601
  734   HH12  ARG  85          1HH1      ARG  85  20.459  -2.671   2.774
  735   HH21  ARG  85          2HH2      ARG  85  20.219  -3.582   6.141
  736   HH22  ARG  85          1HH2      ARG  85  21.281  -3.390   4.787
  737    H    ASP  86           HN       ASP  86  14.011  -0.825   3.137
  738    HA   ASP  86           HA       ASP  86  16.179  -0.468   1.216
  739    HB2  ASP  86           2HB      ASP  86  13.753  -2.203   1.371
  740    HB3  ASP  86           3HB      ASP  86  14.416  -1.830  -0.218
  741    H    VAL  87           HN       VAL  87  12.655  -0.316   0.770
  742    HA   VAL  87           HA       VAL  87  12.528   1.294  -1.404
  743    HB   VAL  87           HB       VAL  87  10.561   0.291  -0.256
  744   HG11  VAL  87          1HG1      VAL  87  10.057   0.810   1.842
  745   HG12  VAL  87          2HG1      VAL  87  11.446   1.897   1.891
  746   HG13  VAL  87          3HG1      VAL  87   9.863   2.506   1.403
  747   HG21  VAL  87          3HG2      VAL  87   8.998   2.014  -0.901
  748   HG22  VAL  87          1HG2      VAL  87  10.262   3.240  -0.811
  749   HG23  VAL  87          2HG2      VAL  87  10.337   1.985  -2.047
  750    H    TYR  88           HN       TYR  88  13.319   2.263   1.847
  751    HA   TYR  88           HA       TYR  88  13.761   5.004   0.869
  752    HB2  TYR  88           2HB      TYR  88  11.769   4.521   2.549
  753    HB3  TYR  88           3HB      TYR  88  13.066   4.560   3.739
  754    HD1  TYR  88           1HD      TYR  88  14.552   6.643   3.804
  755    HD2  TYR  88           2HD      TYR  88  10.824   6.510   1.757
  756    HE1  TYR  88           1HE      TYR  88  14.451   9.100   3.840
  757    HE2  TYR  88           2HE      TYR  88  10.714   8.967   1.786
  758    HH   TYR  88           HH       TYR  88  12.516  10.889   1.933
  759    H    ARG  89           HN       ARG  89  15.857   5.432   0.882
  760    HA   ARG  89           HA       ARG  89  17.810   3.879   2.152
  761    HB2  ARG  89           2HB      ARG  89  18.430   5.200   0.262
  762    HB3  ARG  89           3HB      ARG  89  17.893   6.682   1.042
  763    HG2  ARG  89           2HG      ARG  89  20.303   6.564   1.035
  764    HG3  ARG  89           3HG      ARG  89  19.696   6.456   2.688
  765    HD2  ARG  89           2HD      ARG  89  19.954   4.021   2.617
  766    HD3  ARG  89           3HD      ARG  89  20.570   4.138   0.969
  767    HE   ARG  89           HE       ARG  89  22.011   4.654   3.391
  768   HH11  ARG  89          2HH1      ARG  89  21.787   5.421   0.002
  769   HH12  ARG  89          1HH1      ARG  89  23.455   5.868  -0.140
  770   HH21  ARG  89          2HH2      ARG  89  24.208   5.239   3.216
  771   HH22  ARG  89          1HH2      ARG  89  24.832   5.763   1.688
  Start of MODEL    5
    1    H1   MET   1           HN       MET   1 -19.657   1.931   4.647
    2    HA   MET   1           HA       MET   1 -18.839  -0.614   3.962
    3    HB2  MET   1           2HB      MET   1 -20.097   1.266   2.608
    4    HB3  MET   1           3HB      MET   1 -18.487   1.599   1.984
    5    HG2  MET   1           2HG      MET   1 -18.298  -0.608   1.097
    6    HG3  MET   1           3HG      MET   1 -19.791  -1.107   1.889
    7    HE1  MET   1           3HE      MET   1 -21.726   1.723   1.006
    8    HE2  MET   1           1HE      MET   1 -22.571   0.561  -0.018
    9    HE3  MET   1           2HE      MET   1 -21.965   0.066   1.562
   10    H    GLY   2           HN       GLY   2 -16.962   2.397   3.888
   11    HA2  GLY   2           1HA      GLY   2 -14.672   2.663   4.135
   12    HA3  GLY   2           2HA      GLY   2 -14.513   0.916   4.237
   13    H    TYR   3           HN       TYR   3 -12.586   2.045   2.879
   14    HA   TYR   3           HA       TYR   3 -13.263   2.254   0.065
   15    HB2  TYR   3           2HB      TYR   3 -10.725   2.619   1.640
   16    HB3  TYR   3           3HB      TYR   3 -10.708   2.554  -0.119
   17    HD1  TYR   3           2HD      TYR   3 -12.814   4.241   2.478
   18    HD2  TYR   3           1HD      TYR   3 -10.558   4.623  -1.109
   19    HE1  TYR   3           2HE      TYR   3 -13.371   6.635   2.390
   20    HE2  TYR   3           1HE      TYR   3 -11.107   7.018  -1.206
   21    HH   TYR   3           HH       TYR   3 -11.892   8.815   0.975
   22    H    ARG   4           HN       ARG   4 -12.163   0.983  -1.569
   23    HA   ARG   4           HA       ARG   4 -12.104  -1.814  -0.849
   24    HB2  ARG   4           2HB      ARG   4 -13.198  -1.136  -2.918
   25    HB3  ARG   4           3HB      ARG   4 -11.699  -0.428  -3.505
   26    HG2  ARG   4           2HG      ARG   4 -10.690  -2.532  -3.787
   27    HG3  ARG   4           3HG      ARG   4 -11.930  -3.341  -2.827
   28    HD2  ARG   4           2HD      ARG   4 -13.512  -3.200  -4.522
   29    HD3  ARG   4           3HD      ARG   4 -12.664  -1.886  -5.336
   30    HE   ARG   4           HE       ARG   4 -11.418  -3.439  -6.463
   31   HH11  ARG   4          2HH1      ARG   4 -12.975  -4.976  -3.756
   32   HH12  ARG   4          1HH1      ARG   4 -12.503  -6.576  -4.226
   33   HH21  ARG   4          2HH2      ARG   4 -10.790  -5.539  -7.093
   34   HH22  ARG   4          1HH2      ARG   4 -11.260  -6.895  -6.124
   35    H    ILE   5           HN       ILE   5 -10.355  -3.229  -1.152
   36    HA   ILE   5           HA       ILE   5  -7.729  -1.901  -1.079
   37    HB   ILE   5           HB       ILE   5  -8.446  -4.645  -0.040
   38   HG12  ILE   5          2HG1      ILE   5  -9.553  -2.925   1.284
   39   HG13  ILE   5          3HG1      ILE   5  -8.221  -3.620   2.201
   40   HG21  ILE   5          1HG2      ILE   5  -6.274  -4.992   0.297
   41   HG22  ILE   5          2HG2      ILE   5  -5.975  -3.583  -0.720
   42   HG23  ILE   5          3HG2      ILE   5  -6.065  -3.403   1.032
   43   HD11  ILE   5          3HD1      ILE   5  -8.374  -1.187   2.442
   44   HD12  ILE   5          1HD1      ILE   5  -6.847  -1.695   1.722
   45   HD13  ILE   5          2HD1      ILE   5  -8.116  -1.012   0.706
   46    H    GLU   6           HN       GLU   6  -7.022  -1.885  -3.147
   47    HA   GLU   6           HA       GLU   6  -7.023  -4.447  -4.602
   48    HB2  GLU   6           2HB      GLU   6  -7.369  -1.628  -5.484
   49    HB3  GLU   6           3HB      GLU   6  -6.501  -2.710  -6.564
   50    HG2  GLU   6           2HG      GLU   6  -9.108  -3.599  -5.447
   51    HG3  GLU   6           3HG      GLU   6  -9.098  -2.399  -6.738
   52    H    PHE   7           HN       PHE   7  -5.150  -4.860  -5.981
   53    HA   PHE   7           HA       PHE   7  -2.701  -3.482  -5.141
   54    HB2  PHE   7           2HB      PHE   7  -3.293  -6.417  -4.924
   55    HB3  PHE   7           3HB      PHE   7  -1.639  -5.863  -5.167
   56    HD1  PHE   7           1HD      PHE   7  -4.580  -5.402  -2.941
   57    HD2  PHE   7           2HD      PHE   7  -0.347  -5.237  -3.351
   58    HE1  PHE   7           1HE      PHE   7  -4.366  -5.001  -0.523
   59    HE2  PHE   7           2HE      PHE   7  -0.125  -4.837  -0.933
   60    HZ   PHE   7           HZ       PHE   7  -2.136  -4.719   0.484
   61    H    ASP   8           HN       ASP   8  -1.309  -3.092  -6.757
   62    HA   ASP   8           HA       ASP   8  -2.077  -3.514  -9.438
   63    HB2  ASP   8           2HB      ASP   8   0.294  -2.391  -8.046
   64    HB3  ASP   8           3HB      ASP   8   0.523  -2.902  -9.716
   65    HA   PRO   9           HA       PRO   9  -0.406  -7.414 -10.544
   66    HB2  PRO   9           2HB      PRO   9   0.689  -6.938 -12.982
   67    HB3  PRO   9           3HB      PRO   9  -1.056  -6.986 -12.705
   68    HG2  PRO   9           2HG      PRO   9   0.763  -4.618 -12.922
   69    HG3  PRO   9           3HG      PRO   9  -0.848  -4.858 -13.621
   70    HD2  PRO   9           2HD      PRO   9  -0.436  -3.401 -11.376
   71    HD3  PRO   9           3HD      PRO   9  -1.920  -4.338 -11.648
   72    H    ARG  10           HN       ARG  10   1.680  -4.726 -10.175
   73    HA   ARG  10           HA       ARG  10   4.095  -6.350 -10.460
   74    HB2  ARG  10           2HB      ARG  10   3.596  -3.398 -10.174
   75    HB3  ARG  10           3HB      ARG  10   5.200  -4.077  -9.932
   76    HG2  ARG  10           2HG      ARG  10   5.449  -4.638 -12.145
   77    HG3  ARG  10           3HG      ARG  10   3.709  -4.726 -12.428
   78    HD2  ARG  10           2HD      ARG  10   4.468  -2.777 -13.535
   79    HD3  ARG  10           3HD      ARG  10   3.644  -2.231 -12.076
   80    HE   ARG  10           HE       ARG  10   5.627  -1.377 -11.322
   81   HH11  ARG  10          2HH1      ARG  10   6.265  -3.613 -13.913
   82   HH12  ARG  10          1HH1      ARG  10   7.952  -3.226 -14.007
   83   HH21  ARG  10          2HH2      ARG  10   7.845  -0.858 -11.436
   84   HH22  ARG  10          1HH2      ARG  10   8.849  -1.659 -12.597
   85    H    ALA  11           HN       ALA  11   2.479  -4.289  -8.055
   86    HA   ALA  11           HA       ALA  11   4.259  -4.704  -5.942
   87    HB1  ALA  11           1HB      ALA  11   1.309  -4.098  -5.930
   88    HB2  ALA  11           2HB      ALA  11   2.317  -4.096  -4.483
   89    HB3  ALA  11           3HB      ALA  11   2.646  -2.957  -5.788
   90    H    GLU  12           HN       GLU  12   1.277  -6.460  -6.772
   91    HA   GLU  12           HA       GLU  12   0.969  -8.202  -4.751
   92    HB2  GLU  12           2HB      GLU  12   0.668  -8.493  -7.695
   93    HB3  GLU  12           3HB      GLU  12   0.590  -9.960  -6.730
   94    HG2  GLU  12           2HG      GLU  12  -1.062  -7.602  -5.961
   95    HG3  GLU  12           3HG      GLU  12  -1.576  -8.640  -7.290
   96    H    LYS  13           HN       LYS  13   3.343  -8.598  -7.364
   97    HA   LYS  13           HA       LYS  13   4.454 -10.992  -6.273
   98    HB2  LYS  13           2HB      LYS  13   5.561  -9.073  -8.331
   99    HB3  LYS  13           3HB      LYS  13   6.235 -10.655  -7.962
  100    HG2  LYS  13           2HG      LYS  13   3.378 -10.424  -8.791
  101    HG3  LYS  13           3HG      LYS  13   4.658 -10.349 -10.004
  102    HD2  LYS  13           2HD      LYS  13   4.691 -12.551  -7.990
  103    HD3  LYS  13           3HD      LYS  13   3.563 -12.643  -9.345
  104    HE2  LYS  13           2HE      LYS  13   5.233 -12.857 -10.896
  105    HE3  LYS  13           3HE      LYS  13   6.402 -11.969  -9.920
  106    HZ1  LYS  13           3HZ      LYS  13   5.522 -14.778  -9.579
  107    HZ2  LYS  13           1HZ      LYS  13   6.399 -13.942  -8.398
  108    HZ3  LYS  13           2HZ      LYS  13   7.079 -14.213  -9.923
  109    H    GLU  14           HN       GLU  14   5.356  -7.573  -6.206
  110    HA   GLU  14           HA       GLU  14   7.853  -7.783  -5.008
  111    HB2  GLU  14           2HB      GLU  14   5.751  -5.635  -4.688
  112    HB3  GLU  14           3HB      GLU  14   7.415  -5.480  -4.142
  113    HG2  GLU  14           2HG      GLU  14   8.197  -5.738  -6.440
  114    HG3  GLU  14           3HG      GLU  14   6.529  -5.892  -6.989
  115    H    LEU  15           HN       LEU  15   4.640  -7.796  -3.555
  116    HA   LEU  15           HA       LEU  15   5.695  -7.887  -0.865
  117    HB2  LEU  15           2HB      LEU  15   3.646  -6.723  -1.150
  118    HB3  LEU  15           3HB      LEU  15   2.920  -8.080  -2.009
  119    HG   LEU  15           HG       LEU  15   3.760  -8.503   0.813
  120   HD11  LEU  15          1HD1      LEU  15   1.726  -7.557   1.682
  121   HD12  LEU  15          2HD1      LEU  15   1.214  -7.073   0.066
  122   HD13  LEU  15          3HD1      LEU  15   2.617  -6.308   0.811
  123   HD21  LEU  15          3HD2      LEU  15   1.306  -9.374  -0.702
  124   HD22  LEU  15          1HD2      LEU  15   1.912 -10.011   0.827
  125   HD23  LEU  15          2HD2      LEU  15   2.815 -10.287  -0.663
  126    H    GLU  16           HN       GLU  16   4.121 -10.112  -3.126
  127    HA   GLU  16           HA       GLU  16   3.784 -12.318  -1.506
  128    HB2  GLU  16           2HB      GLU  16   4.258 -11.932  -4.419
  129    HB3  GLU  16           3HB      GLU  16   4.418 -13.562  -3.779
  130    HG2  GLU  16           2HG      GLU  16   2.114 -13.176  -2.736
  131    HG3  GLU  16           3HG      GLU  16   1.999 -11.800  -3.832
  132    H    LYS  17           HN       LYS  17   6.715 -11.049  -2.916
  133    HA   LYS  17           HA       LYS  17   8.349 -13.327  -2.515
  134    HB2  LYS  17           2HB      LYS  17   8.802 -10.443  -3.091
  135    HB3  LYS  17           3HB      LYS  17  10.159 -11.362  -2.454
  136    HG2  LYS  17           2HG      LYS  17   9.430 -13.047  -4.367
  137    HG3  LYS  17           3HG      LYS  17   8.790 -11.561  -5.074
  138    HD2  LYS  17           2HD      LYS  17  10.907 -11.494  -5.923
  139    HD3  LYS  17           3HD      LYS  17  11.186 -10.649  -4.399
  140    HE2  LYS  17           2HE      LYS  17  11.519 -13.623  -4.650
  141    HE3  LYS  17           3HE      LYS  17  12.823 -12.506  -5.048
  142    HZ1  LYS  17           3HZ      LYS  17  13.297 -12.800  -2.878
  143    HZ2  LYS  17           1HZ      LYS  17  11.711 -13.212  -2.455
  144    HZ3  LYS  17           2HZ      LYS  17  12.135 -11.588  -2.663
  145    H    LEU  18           HN       LEU  18   7.606 -10.506  -0.522
  146    HA   LEU  18           HA       LEU  18   9.441 -10.732   1.496
  147    HB2  LEU  18           2HB      LEU  18   6.519 -10.027   1.637
  148    HB3  LEU  18           3HB      LEU  18   7.616  -9.864   3.007
  149    HG   LEU  18           HG       LEU  18   7.943  -8.422   0.378
  150   HD11  LEU  18          1HD1      LEU  18   6.796  -7.459   2.993
  151   HD12  LEU  18          2HD1      LEU  18   5.923  -7.665   1.475
  152   HD13  LEU  18          3HD1      LEU  18   7.181  -6.436   1.609
  153   HD21  LEU  18          3HD2      LEU  18   9.575  -7.090   1.574
  154   HD22  LEU  18          1HD2      LEU  18  10.018  -8.796   1.648
  155   HD23  LEU  18          2HD2      LEU  18   9.285  -8.014   3.049
  156    H    ASP  19           HN       ASP  19   8.821 -11.438   3.836
  157    HA   ASP  19           HA       ASP  19   8.773 -14.235   3.900
  158    HB2  ASP  19           2HB      ASP  19   9.594 -12.519   5.676
  159    HB3  ASP  19           3HB      ASP  19   7.934 -12.581   6.262
  160    H    ARG  20           HN       ARG  20   7.190 -15.653   4.895
  161    HA   ARG  20           HA       ARG  20   4.603 -15.294   3.802
  162    HB2  ARG  20           2HB      ARG  20   5.927 -17.335   5.524
  163    HB3  ARG  20           3HB      ARG  20   4.169 -17.327   5.460
  164    HG2  ARG  20           2HG      ARG  20   4.609 -17.261   2.861
  165    HG3  ARG  20           3HG      ARG  20   6.145 -17.983   3.345
  166    HD2  ARG  20           2HD      ARG  20   4.641 -19.767   2.878
  167    HD3  ARG  20           3HD      ARG  20   4.834 -19.688   4.629
  168    HE   ARG  20           HE       ARG  20   2.567 -18.231   3.592
  169   HH11  ARG  20          2HH1      ARG  20   3.745 -21.260   4.839
  170   HH12  ARG  20          1HH1      ARG  20   2.180 -21.816   5.331
  171   HH21  ARG  20          2HH2      ARG  20   0.500 -18.952   4.236
  172   HH22  ARG  20          1HH2      ARG  20   0.335 -20.503   4.987
  173    H    GLU  21           HN       GLU  21   5.895 -15.031   7.086
  174    HA   GLU  21           HA       GLU  21   3.358 -14.498   8.288
  175    HB2  GLU  21           2HB      GLU  21   5.057 -15.437   9.676
  176    HB3  GLU  21           3HB      GLU  21   6.195 -14.165   9.254
  177    HG2  GLU  21           2HG      GLU  21   5.558 -13.444  11.309
  178    HG3  GLU  21           3HG      GLU  21   4.350 -12.623  10.322
  179    H    VAL  22           HN       VAL  22   6.099 -12.496   7.267
  180    HA   VAL  22           HA       VAL  22   5.143 -10.031   8.194
  181    HB   VAL  22           HB       VAL  22   6.887 -10.579   5.788
  182   HG11  VAL  22          1HG1      VAL  22   6.971  -8.033   7.330
  183   HG12  VAL  22          2HG1      VAL  22   7.372  -8.344   5.640
  184   HG13  VAL  22          3HG1      VAL  22   5.684  -8.265   6.147
  185   HG21  VAL  22          3HG2      VAL  22   8.059  -9.548   8.281
  186   HG22  VAL  22          1HG2      VAL  22   7.450 -11.201   8.361
  187   HG23  VAL  22          2HG2      VAL  22   8.665 -10.767   7.159
  188    H    ALA  23           HN       ALA  23   4.725 -11.633   5.054
  189    HA   ALA  23           HA       ALA  23   3.354  -9.619   3.718
  190    HB1  ALA  23           1HB      ALA  23   2.601 -11.294   2.201
  191    HB2  ALA  23           2HB      ALA  23   4.221 -11.750   2.728
  192    HB3  ALA  23           3HB      ALA  23   2.811 -12.565   3.405
  193    H    ARG  24           HN       ARG  24   2.030 -12.284   5.675
  194    HA   ARG  24           HA       ARG  24  -0.670 -11.686   5.372
  195    HB2  ARG  24           2HB      ARG  24   0.889 -13.023   7.567
  196    HB3  ARG  24           3HB      ARG  24  -0.848 -12.784   7.708
  197    HG2  ARG  24           2HG      ARG  24  -1.334 -14.321   6.101
  198    HG3  ARG  24           3HG      ARG  24   0.178 -14.053   5.231
  199    HD2  ARG  24           2HD      ARG  24   0.620 -16.101   6.132
  200    HD3  ARG  24           3HD      ARG  24   1.210 -15.075   7.439
  201    HE   ARG  24           HE       ARG  24  -1.555 -15.809   7.706
  202   HH11  ARG  24          2HH1      ARG  24   1.733 -16.761   8.337
  203   HH12  ARG  24          1HH1      ARG  24   1.317 -17.797   9.662
  204   HH21  ARG  24          2HH2      ARG  24  -2.116 -17.169   9.449
  205   HH22  ARG  24          1HH2      ARG  24  -0.873 -18.029  10.293
  206    H    ARG  25           HN       ARG  25   1.636 -10.534   7.813
  207    HA   ARG  25           HA       ARG  25  -0.113  -9.063   9.393
  208    HB2  ARG  25           2HB      ARG  25   2.084  -9.375  10.204
  209    HB3  ARG  25           3HB      ARG  25   2.805  -8.706   8.746
  210    HG2  ARG  25           2HG      ARG  25   2.351  -6.522   9.366
  211    HG3  ARG  25           3HG      ARG  25   1.085  -7.003  10.498
  212    HD2  ARG  25           2HD      ARG  25   4.038  -7.514  10.841
  213    HD3  ARG  25           3HD      ARG  25   3.116  -6.248  11.651
  214    HE   ARG  25           HE       ARG  25   2.111  -8.919  12.069
  215   HH11  ARG  25          2HH1      ARG  25   4.262  -6.427  13.201
  216   HH12  ARG  25          1HH1      ARG  25   4.320  -7.033  14.823
  217   HH21  ARG  25          2HH2      ARG  25   2.179  -9.726  14.201
  218   HH22  ARG  25          1HH2      ARG  25   3.135  -8.910  15.391
  219    H    ILE  26           HN       ILE  26   1.581  -8.132   6.431
  220    HA   ILE  26           HA       ILE  26   0.877  -5.419   6.417
  221    HB   ILE  26           HB       ILE  26   1.374  -7.246   4.064
  222   HG12  ILE  26          2HG1      ILE  26   3.231  -5.358   5.527
  223   HG13  ILE  26          3HG1      ILE  26   3.246  -7.112   5.672
  224   HG21  ILE  26          1HG2      ILE  26   0.264  -4.751   3.977
  225   HG22  ILE  26          2HG2      ILE  26   1.981  -4.403   3.781
  226   HG23  ILE  26          3HG2      ILE  26   1.173  -5.507   2.669
  227   HD11  ILE  26          3HD1      ILE  26   4.923  -5.894   4.098
  228   HD12  ILE  26          1HD1      ILE  26   4.170  -7.408   3.597
  229   HD13  ILE  26          2HD1      ILE  26   3.556  -5.872   2.984
  230    H    LEU  27           HN       LEU  27  -0.588  -8.041   4.485
  231    HA   LEU  27           HA       LEU  27  -2.711  -6.700   3.416
  232    HB2  LEU  27           2HB      LEU  27  -2.659  -9.523   4.470
  233    HB3  LEU  27           3HB      LEU  27  -3.919  -8.871   3.423
  234    HG   LEU  27           HG       LEU  27  -1.026  -8.976   2.601
  235   HD11  LEU  27          1HD1      LEU  27  -3.127 -11.013   1.904
  236   HD12  LEU  27          2HD1      LEU  27  -1.942 -11.243   3.190
  237   HD13  LEU  27          3HD1      LEU  27  -1.406 -11.050   1.521
  238   HD21  LEU  27          3HD2      LEU  27  -3.632  -8.628   1.130
  239   HD22  LEU  27          1HD2      LEU  27  -2.086  -8.925   0.335
  240   HD23  LEU  27          2HD2      LEU  27  -2.319  -7.460   1.290
  241    H    ARG  28           HN       ARG  28  -2.676  -8.362   6.565
  242    HA   ARG  28           HA       ARG  28  -5.283  -7.790   7.342
  243    HB2  ARG  28           2HB      ARG  28  -3.348  -9.212   8.461
  244    HB3  ARG  28           3HB      ARG  28  -3.115  -7.739   9.392
  245    HG2  ARG  28           2HG      ARG  28  -5.276  -7.859  10.318
  246    HG3  ARG  28           3HG      ARG  28  -5.788  -9.083   9.155
  247    HD2  ARG  28           2HD      ARG  28  -4.241 -10.685  10.143
  248    HD3  ARG  28           3HD      ARG  28  -3.681  -9.460  11.281
  249    HE   ARG  28           HE       ARG  28  -6.322  -9.541  11.775
  250   HH11  ARG  28          2HH1      ARG  28  -3.908 -12.035  11.506
  251   HH12  ARG  28          1HH1      ARG  28  -4.698 -13.101  12.620
  252   HH21  ARG  28          2HH2      ARG  28  -7.371 -10.935  13.244
  253   HH22  ARG  28          1HH2      ARG  28  -6.668 -12.474  13.607
  254    H    PHE  29           HN       PHE  29  -2.314  -5.937   7.989
  255    HA   PHE  29           HA       PHE  29  -3.379  -3.886   9.495
  256    HB2  PHE  29           2HB      PHE  29  -1.051  -3.876   9.324
  257    HB3  PHE  29           3HB      PHE  29  -1.081  -4.013   7.569
  258    HD1  PHE  29           1HD      PHE  29  -1.719  -1.700  10.384
  259    HD2  PHE  29           2HD      PHE  29  -1.020  -2.106   6.205
  260    HE1  PHE  29           1HE      PHE  29  -1.446   0.738  10.196
  261    HE2  PHE  29           2HE      PHE  29  -0.745   0.331   6.011
  262    HZ   PHE  29           HZ       PHE  29  -0.957   1.756   8.008
  263    H    LEU  30           HN       LEU  30  -3.481  -4.362   6.021
  264    HA   LEU  30           HA       LEU  30  -4.694  -1.763   5.567
  265    HB2  LEU  30           2HB      LEU  30  -4.145  -4.046   3.676
  266    HB3  LEU  30           3HB      LEU  30  -4.741  -2.454   3.208
  267    HG   LEU  30           HG       LEU  30  -2.133  -2.691   4.651
  268   HD11  LEU  30          1HD1      LEU  30  -1.870  -2.617   1.762
  269   HD12  LEU  30          2HD1      LEU  30  -2.596  -4.118   2.335
  270   HD13  LEU  30          3HD1      LEU  30  -1.026  -3.608   2.953
  271   HD21  LEU  30          3HD2      LEU  30  -3.593  -0.571   3.768
  272   HD22  LEU  30          1HD2      LEU  30  -2.502  -0.839   2.409
  273   HD23  LEU  30          2HD2      LEU  30  -1.847  -0.557   4.022
  274    H    ARG  31           HN       ARG  31  -5.638  -5.095   5.910
  275    HA   ARG  31           HA       ARG  31  -8.332  -4.603   4.942
  276    HB2  ARG  31           2HB      ARG  31  -6.927  -7.043   6.019
  277    HB3  ARG  31           3HB      ARG  31  -8.653  -7.027   5.683
  278    HG2  ARG  31           2HG      ARG  31  -8.194  -6.487   3.344
  279    HG3  ARG  31           3HG      ARG  31  -6.462  -6.510   3.683
  280    HD2  ARG  31           2HD      ARG  31  -7.065  -8.614   2.712
  281    HD3  ARG  31           3HD      ARG  31  -6.702  -8.875   4.418
  282    HE   ARG  31           HE       ARG  31  -9.272  -9.155   3.115
  283   HH11  ARG  31          2HH1      ARG  31  -7.538  -8.853   6.119
  284   HH12  ARG  31          1HH1      ARG  31  -8.805  -9.553   7.071
  285   HH21  ARG  31          2HH2      ARG  31 -10.948 -10.077   4.358
  286   HH22  ARG  31          1HH2      ARG  31 -10.744 -10.250   6.069
  287    H    GLU  32           HN       GLU  32  -6.675  -4.137   7.795
  288    HA   GLU  32           HA       GLU  32  -9.124  -4.422   9.406
  289    HB2  GLU  32           2HB      GLU  32  -6.214  -4.585  10.167
  290    HB3  GLU  32           3HB      GLU  32  -7.477  -4.338  11.365
  291    HG2  GLU  32           2HG      GLU  32  -8.543  -6.451  10.321
  292    HG3  GLU  32           3HG      GLU  32  -6.931  -6.730   9.665
  293    H    ARG  33           HN       ARG  33  -6.135  -2.471   9.467
  294    HA   ARG  33           HA       ARG  33  -7.321  -0.290  10.807
  295    HB2  ARG  33           2HB      ARG  33  -4.881  -0.206   9.027
  296    HB3  ARG  33           3HB      ARG  33  -5.286   0.909  10.326
  297    HG2  ARG  33           2HG      ARG  33  -4.886  -2.005  10.875
  298    HG3  ARG  33           3HG      ARG  33  -3.514  -0.902  10.752
  299    HD2  ARG  33           2HD      ARG  33  -4.114   0.269  12.644
  300    HD3  ARG  33           3HD      ARG  33  -5.814  -0.181  12.509
  301    HE   ARG  33           HE       ARG  33  -5.378  -2.055  13.746
  302   HH11  ARG  33          2HH1      ARG  33  -2.374  -0.737  12.580
  303   HH12  ARG  33          1HH1      ARG  33  -1.389  -1.812  13.515
  304   HH21  ARG  33          2HH2      ARG  33  -4.092  -3.477  14.981
  305   HH22  ARG  33          1HH2      ARG  33  -2.367  -3.371  14.880
  306    H    VAL  34           HN       VAL  34  -6.007  -0.188   7.498
  307    HA   VAL  34           HA       VAL  34  -7.343   2.092   6.677
  308    HB   VAL  34           HB       VAL  34  -6.508  -0.265   4.980
  309   HG11  VAL  34          1HG1      VAL  34  -8.201   1.428   4.026
  310   HG12  VAL  34          2HG1      VAL  34  -6.838   2.547   4.000
  311   HG13  VAL  34          3HG1      VAL  34  -6.765   1.046   3.076
  312   HG21  VAL  34          3HG2      VAL  34  -4.670   0.716   6.259
  313   HG22  VAL  34          1HG2      VAL  34  -4.498   1.052   4.536
  314   HG23  VAL  34          2HG2      VAL  34  -5.075   2.312   5.627
  315    H    ALA  35           HN       ALA  35  -8.392  -1.279   6.537
  316    HA   ALA  35           HA       ALA  35 -10.681  -0.987   4.985
  317    HB1  ALA  35           1HB      ALA  35 -11.411  -3.069   5.872
  318    HB2  ALA  35           2HB      ALA  35  -9.652  -3.139   5.761
  319    HB3  ALA  35           3HB      ALA  35 -10.426  -2.868   7.322
  320    H    THR  36           HN       THR  36 -10.384  -0.839   8.533
  321    HA   THR  36           HA       THR  36 -13.117  -0.093   8.911
  322    HB   THR  36           HB       THR  36 -12.551   0.228  11.245
  323    HG1  THR  36           1HG      THR  36 -10.347   1.137  10.541
  324   HG21  THR  36          3HG2      THR  36 -11.041  -2.023  11.410
  325   HG22  THR  36          1HG2      THR  36 -11.681  -2.168   9.774
  326   HG23  THR  36          2HG2      THR  36 -12.784  -2.015  11.141
  327    H    LEU  37           HN       LEU  37 -10.115   1.627   8.472
  328    HA   LEU  37           HA       LEU  37 -10.885   4.140   9.462
  329    HB2  LEU  37           2HB      LEU  37  -8.875   3.254   7.423
  330    HB3  LEU  37           3HB      LEU  37  -9.136   4.963   7.760
  331    HG   LEU  37           HG       LEU  37  -8.321   2.941   9.843
  332   HD11  LEU  37          1HD1      LEU  37  -6.256   3.028   9.050
  333   HD12  LEU  37          2HD1      LEU  37  -6.249   4.775   9.291
  334   HD13  LEU  37          3HD1      LEU  37  -6.773   4.100   7.749
  335   HD21  LEU  37          3HD2      LEU  37  -8.954   5.821   9.839
  336   HD22  LEU  37          1HD2      LEU  37  -7.515   5.346  10.741
  337   HD23  LEU  37          2HD2      LEU  37  -9.078   4.629  11.134
  338    H    GLU  38           HN       GLU  38 -12.697   5.131   8.833
  339    HA   GLU  38           HA       GLU  38 -14.238   4.851   6.652
  340    HB2  GLU  38           2HB      GLU  38 -13.540   7.425   8.064
  341    HB3  GLU  38           3HB      GLU  38 -14.826   7.298   6.873
  342    HG2  GLU  38           2HG      GLU  38 -16.080   5.837   8.242
  343    HG3  GLU  38           3HG      GLU  38 -14.724   5.593   9.341
  344    H    ASP  39           HN       ASP  39 -11.271   6.755   6.798
  345    HA   ASP  39           HA       ASP  39 -11.305   6.887   3.858
  346    HB2  ASP  39           2HB      ASP  39 -10.478   9.063   5.787
  347    HB3  ASP  39           3HB      ASP  39 -10.140   9.102   4.059
  348    HA   PRO  40           HA       PRO  40  -7.355   4.958   4.134
  349    HB2  PRO  40           2HB      PRO  40  -6.414   5.597   1.669
  350    HB3  PRO  40           3HB      PRO  40  -7.661   4.372   1.933
  351    HG2  PRO  40           2HG      PRO  40  -7.959   7.226   1.079
  352    HG3  PRO  40           3HG      PRO  40  -8.782   5.782   0.462
  353    HD2  PRO  40           2HD      PRO  40  -9.948   7.485   2.214
  354    HD3  PRO  40           3HD      PRO  40 -10.292   5.744   2.202
  355    H    ARG  41           HN       ARG  41  -7.833   8.302   3.930
  356    HA   ARG  41           HA       ARG  41  -5.063   9.065   3.749
  357    HB2  ARG  41           2HB      ARG  41  -7.643  10.520   4.199
  358    HB3  ARG  41           3HB      ARG  41  -6.119  11.327   4.542
  359    HG2  ARG  41           2HG      ARG  41  -5.506  10.516   2.124
  360    HG3  ARG  41           3HG      ARG  41  -7.260  10.453   1.939
  361    HD2  ARG  41           2HD      ARG  41  -5.961  12.886   3.091
  362    HD3  ARG  41           3HD      ARG  41  -5.968  12.634   1.346
  363    HE   ARG  41           HE       ARG  41  -8.561  12.348   2.531
  364   HH11  ARG  41          2HH1      ARG  41  -6.240  14.629   1.293
  365   HH12  ARG  41          1HH1      ARG  41  -7.429  15.830   0.912
  366   HH21  ARG  41          2HH2      ARG  41 -10.135  13.922   2.034
  367   HH22  ARG  41          1HH2      ARG  41  -9.644  15.428   1.335
  368    H    SER  42           HN       SER  42  -7.419   8.527   6.289
  369    HA   SER  42           HA       SER  42  -6.478   9.735   8.484
  370    HB2  SER  42           2HB      SER  42  -8.262   7.828   8.213
  371    HB3  SER  42           3HB      SER  42  -6.933   6.779   8.708
  372    HG   SER  42           HG       SER  42  -7.530   7.347  10.644
  373    H    LEU  43           HN       LEU  43  -5.178   6.589   7.410
  374    HA   LEU  43           HA       LEU  43  -2.776   7.091   9.009
  375    HB2  LEU  43           2HB      LEU  43  -4.006   4.642   7.806
  376    HB3  LEU  43           3HB      LEU  43  -2.306   4.650   8.273
  377    HG   LEU  43           HG       LEU  43  -4.537   5.292  10.191
  378   HD11  LEU  43          1HD1      LEU  43  -3.210   2.687  10.409
  379   HD12  LEU  43          2HD1      LEU  43  -4.265   2.864   9.007
  380   HD13  LEU  43          3HD1      LEU  43  -4.904   3.125  10.630
  381   HD21  LEU  43          3HD2      LEU  43  -2.407   6.114  10.913
  382   HD22  LEU  43          1HD2      LEU  43  -1.627   4.581  10.522
  383   HD23  LEU  43          2HD2      LEU  43  -2.784   4.667  11.850
  384    H    GLY  44           HN       GLY  44  -0.716   7.095   8.135
  385    HA2  GLY  44           1HA      GLY  44   0.870   6.862   6.391
  386    HA3  GLY  44           2HA      GLY  44  -0.450   6.816   5.231
  387    H    GLU  45           HN       GLU  45   1.530   8.358   4.486
  388    HA   GLU  45           HA       GLU  45   0.533  11.080   4.971
  389    HB2  GLU  45           2HB      GLU  45   2.796  11.956   4.964
  390    HB3  GLU  45           3HB      GLU  45   2.629  10.748   6.229
  391    HG2  GLU  45           2HG      GLU  45   3.987   9.242   5.169
  392    HG3  GLU  45           3HG      GLU  45   3.652   9.901   3.569
  393    HA   PRO  46           HA       PRO  46   0.330  11.374   0.588
  394    HB2  PRO  46           2HB      PRO  46   0.485  14.070   0.307
  395    HB3  PRO  46           3HB      PRO  46  -0.956  13.249   0.919
  396    HG2  PRO  46           2HG      PRO  46   1.221  14.635   2.435
  397    HG3  PRO  46           3HG      PRO  46  -0.533  14.697   2.689
  398    HD2  PRO  46           2HD      PRO  46   1.104  13.155   4.197
  399    HD3  PRO  46           3HD      PRO  46  -0.567  12.689   3.819
  400    H    LEU  47           HN       LEU  47   1.508  12.287  -1.297
  401    HA   LEU  47           HA       LEU  47   4.379  12.610  -0.711
  402    HB2  LEU  47           2HB      LEU  47   3.612  10.431  -1.794
  403    HB3  LEU  47           3HB      LEU  47   3.273  11.398  -3.228
  404    HG   LEU  47           HG       LEU  47   5.724  12.102  -3.127
  405   HD11  LEU  47          1HD1      LEU  47   5.909  11.157  -0.739
  406   HD12  LEU  47          2HD1      LEU  47   7.243  10.887  -1.859
  407   HD13  LEU  47          3HD1      LEU  47   6.090   9.593  -1.534
  408   HD21  LEU  47          3HD2      LEU  47   6.119  10.558  -4.705
  409   HD22  LEU  47          1HD2      LEU  47   4.444  10.080  -4.426
  410   HD23  LEU  47          2HD2      LEU  47   5.754   9.213  -3.623
  411    H    ARG  48           HN       ARG  48   5.522  14.136  -1.854
  412    HA   ARG  48           HA       ARG  48   3.947  15.869  -3.643
  413    HB2  ARG  48           2HB      ARG  48   5.095  17.801  -2.768
  414    HB3  ARG  48           3HB      ARG  48   4.382  16.911  -1.429
  415    HG2  ARG  48           2HG      ARG  48   7.199  16.318  -2.153
  416    HG3  ARG  48           3HG      ARG  48   6.847  17.840  -1.332
  417    HD2  ARG  48           2HD      ARG  48   5.774  15.242  -0.295
  418    HD3  ARG  48           3HD      ARG  48   7.416  15.758   0.086
  419    HE   ARG  48           HE       ARG  48   5.786  17.897   0.692
  420   HH11  ARG  48          2HH1      ARG  48   6.112  14.583   1.706
  421   HH12  ARG  48          1HH1      ARG  48   5.532  14.880   3.311
  422   HH21  ARG  48          2HH2      ARG  48   5.020  18.301   2.803
  423   HH22  ARG  48          1HH2      ARG  48   4.911  16.995   3.934
  424    H    GLY  49           HN       GLY  49   5.026  16.798  -5.407
  425    HA2  GLY  49           1HA      GLY  49   7.750  16.680  -5.955
  426    HA3  GLY  49           2HA      GLY  49   7.050  15.188  -6.567
  427    HA   PRO  50           HA       PRO  50   6.324  19.039  -9.377
  428    HB2  PRO  50           2HB      PRO  50   8.588  19.050 -10.876
  429    HB3  PRO  50           3HB      PRO  50   8.411  20.000  -9.396
  430    HG2  PRO  50           2HG      PRO  50   9.766  17.362  -9.803
  431    HG3  PRO  50           3HG      PRO  50  10.306  18.763  -8.860
  432    HD2  PRO  50           2HD      PRO  50   9.162  16.592  -7.717
  433    HD3  PRO  50           3HD      PRO  50   8.963  18.230  -7.064
  434    H    GLU  51           HN       GLU  51   7.122  15.767  -9.559
  435    HA   GLU  51           HA       GLU  51   5.939  15.595 -12.243
  436    HB2  GLU  51           2HB      GLU  51   7.492  13.865 -12.897
  437    HB3  GLU  51           3HB      GLU  51   8.395  15.290 -12.402
  438    HG2  GLU  51           2HG      GLU  51   9.234  14.287 -10.533
  439    HG3  GLU  51           3HG      GLU  51   7.865  13.188 -10.373
  440    H    LEU  52           HN       LEU  52   4.623  15.309  -9.759
  441    HA   LEU  52           HA       LEU  52   3.591  12.619 -10.088
  442    HB2  LEU  52           2HB      LEU  52   4.603  13.579  -7.415
  443    HB3  LEU  52           3HB      LEU  52   3.763  12.060  -7.723
  444    HG   LEU  52           HG       LEU  52   6.376  12.674  -9.060
  445   HD11  LEU  52          1HD1      LEU  52   5.885  11.884  -6.234
  446   HD12  LEU  52          2HD1      LEU  52   7.149  12.904  -6.921
  447   HD13  LEU  52          3HD1      LEU  52   7.237  11.151  -7.097
  448   HD21  LEU  52          3HD2      LEU  52   5.557  10.781 -10.034
  449   HD22  LEU  52          1HD2      LEU  52   4.646  10.303  -8.602
  450   HD23  LEU  52          2HD2      LEU  52   6.392  10.061  -8.657
  451    H    GLY  53           HN       GLY  53   1.498  12.331  -9.210
  452    HA2  GLY  53           1HA      GLY  53   0.071  14.859  -8.856
  453    HA3  GLY  53           2HA      GLY  53  -0.655  13.298  -9.206
  454    H    ARG  54           HN       ARG  54  -1.404  12.064  -7.563
  455    HA   ARG  54           HA       ARG  54  -0.815  12.955  -4.821
  456    HB2  ARG  54           2HB      ARG  54  -3.205  12.364  -4.269
  457    HB3  ARG  54           3HB      ARG  54  -2.994  13.796  -5.267
  458    HG2  ARG  54           2HG      ARG  54  -3.464  12.363  -7.266
  459    HG3  ARG  54           3HG      ARG  54  -3.888  11.065  -6.148
  460    HD2  ARG  54           2HD      ARG  54  -5.414  12.974  -5.114
  461    HD3  ARG  54           3HD      ARG  54  -5.315  13.596  -6.761
  462    HE   ARG  54           HE       ARG  54  -6.743  11.263  -5.869
  463   HH11  ARG  54          2HH1      ARG  54  -5.248  12.854  -8.581
  464   HH12  ARG  54          1HH1      ARG  54  -6.200  12.018  -9.763
  465   HH21  ARG  54          2HH2      ARG  54  -8.002  10.156  -7.416
  466   HH22  ARG  54          1HH2      ARG  54  -7.766  10.484  -9.099
  467    H    PHE  55           HN       PHE  55   0.470  11.332  -4.141
  468    HA   PHE  55           HA       PHE  55  -0.614   8.599  -4.324
  469    HB2  PHE  55           2HB      PHE  55   2.252   9.518  -4.571
  470    HB3  PHE  55           3HB      PHE  55   1.804   7.839  -4.285
  471    HD1  PHE  55           1HD      PHE  55  -0.127   7.012  -5.987
  472    HD2  PHE  55           2HD      PHE  55   2.726  10.081  -6.733
  473    HE1  PHE  55           1HE      PHE  55  -0.400   6.672  -8.408
  474    HE2  PHE  55           2HE      PHE  55   2.457   9.747  -9.156
  475    HZ   PHE  55           HZ       PHE  55   0.892   8.041  -9.996
  476    H    TRP  56           HN       TRP  56  -1.145   7.829  -2.401
  477    HA   TRP  56           HA       TRP  56   0.019   9.010   0.000
  478    HB2  TRP  56           2HB      TRP  56  -2.525   8.509  -0.467
  479    HB3  TRP  56           3HB      TRP  56  -2.093   6.891   0.079
  480    HD1  TRP  56           1HD      TRP  56  -1.599   6.555   2.655
  481    HE1  TRP  56           1HE      TRP  56  -1.976   8.045   4.720
  482    HE3  TRP  56           3HE      TRP  56  -2.493  11.001   0.295
  483    HZ2  TRP  56           2HZ      TRP  56  -2.574  10.748   5.274
  484    HZ3  TRP  56           3HZ      TRP  56  -2.960  12.991   1.665
  485    HH2  TRP  56           2HH      TRP  56  -2.999  12.865   4.103
  486    H    LYS  57           HN       LYS  57   1.100   7.844   1.573
  487    HA   LYS  57           HA       LYS  57   1.858   5.089   0.858
  488    HB2  LYS  57           2HB      LYS  57   3.669   7.192   2.058
  489    HB3  LYS  57           3HB      LYS  57   4.117   5.530   1.695
  490    HG2  LYS  57           2HG      LYS  57   3.808   5.931  -0.673
  491    HG3  LYS  57           3HG      LYS  57   3.264   7.578  -0.343
  492    HD2  LYS  57           2HD      LYS  57   5.718   7.194  -1.058
  493    HD3  LYS  57           3HD      LYS  57   5.386   8.287   0.288
  494    HE2  LYS  57           2HE      LYS  57   5.940   6.567   1.881
  495    HE3  LYS  57           3HE      LYS  57   6.117   5.377   0.592
  496    HZ1  LYS  57           3HZ      LYS  57   8.224   6.405   1.514
  497    HZ2  LYS  57           1HZ      LYS  57   7.781   7.820   0.698
  498    HZ3  LYS  57           2HZ      LYS  57   8.061   6.395  -0.170
  499    H    TYR  58           HN       TYR  58   1.951   3.618   2.501
  500    HA   TYR  58           HA       TYR  58   1.055   4.574   5.137
  501    HB2  TYR  58           2HB      TYR  58   0.784   1.790   3.989
  502    HB3  TYR  58           3HB      TYR  58   0.076   2.387   5.486
  503    HD1  TYR  58           1HD      TYR  58  -1.657   4.256   5.319
  504    HD2  TYR  58           2HD      TYR  58  -0.379   1.971   1.964
  505    HE1  TYR  58           1HE      TYR  58  -3.683   4.928   4.097
  506    HE2  TYR  58           2HE      TYR  58  -2.401   2.638   0.733
  507    HH   TYR  58           HH       TYR  58  -4.479   5.125   1.819
  508    H    ARG  59           HN       ARG  59   1.782   3.196   6.995
  509    HA   ARG  59           HA       ARG  59   4.507   2.165   6.579
  510    HB2  ARG  59           2HB      ARG  59   5.249   3.214   8.629
  511    HB3  ARG  59           3HB      ARG  59   4.575   4.439   7.561
  512    HG2  ARG  59           2HG      ARG  59   3.598   5.070   9.508
  513    HG3  ARG  59           3HG      ARG  59   2.383   3.920   8.947
  514    HD2  ARG  59           2HD      ARG  59   2.664   3.168  11.084
  515    HD3  ARG  59           3HD      ARG  59   3.901   2.211  10.268
  516    HE   ARG  59           HE       ARG  59   5.478   3.316  11.487
  517   HH11  ARG  59          2HH1      ARG  59   2.558   5.211  11.471
  518   HH12  ARG  59          1HH1      ARG  59   3.165   6.395  12.580
  519   HH21  ARG  59          2HH2      ARG  59   6.289   4.869  12.948
  520   HH22  ARG  59          1HH2      ARG  59   5.288   6.200  13.419
  521    H    VAL  60           HN       VAL  60   4.812   0.184   7.357
  522    HA   VAL  60           HA       VAL  60   2.931  -0.823   9.394
  523    HB   VAL  60           HB       VAL  60   4.217  -2.370   7.139
  524   HG11  VAL  60          1HG1      VAL  60   2.097  -3.622   8.741
  525   HG12  VAL  60          2HG1      VAL  60   3.591  -4.306   8.097
  526   HG13  VAL  60          3HG1      VAL  60   3.621  -3.366   9.590
  527   HG21  VAL  60          3HG2      VAL  60   1.851  -0.834   7.226
  528   HG22  VAL  60          1HG2      VAL  60   2.407  -1.906   5.941
  529   HG23  VAL  60          2HG2      VAL  60   1.366  -2.530   7.220
  530    H    GLY  61           HN       GLY  61   4.488  -0.072  10.984
  531    HA2  GLY  61           1HA      GLY  61   6.156  -0.463  12.512
  532    HA3  GLY  61           2HA      GLY  61   6.146  -2.125  11.939
  533    H    ASP  62           HN       ASP  62   7.376  -2.562   9.928
  534    HA   ASP  62           HA       ASP  62   9.620  -0.704   9.548
  535    HB2  ASP  62           2HB      ASP  62   9.721  -3.587  10.327
  536    HB3  ASP  62           3HB      ASP  62  10.978  -2.955   9.267
  537    H    TYR  63           HN       TYR  63   7.455  -0.808   7.867
  538    HA   TYR  63           HA       TYR  63   8.717  -1.651   5.402
  539    HB2  TYR  63           2HB      TYR  63   6.058  -2.794   6.276
  540    HB3  TYR  63           3HB      TYR  63   6.701  -2.911   4.642
  541    HD1  TYR  63           1HD      TYR  63   7.440  -3.825   8.171
  542    HD2  TYR  63           2HD      TYR  63   8.136  -4.665   4.058
  543    HE1  TYR  63           1HE      TYR  63   8.644  -5.876   8.799
  544    HE2  TYR  63           2HE      TYR  63   9.340  -6.718   4.675
  545    HH   TYR  63           HH       TYR  63  10.298  -7.846   6.392
  546    H    ARG  64           HN       ARG  64   7.885  -0.620   3.567
  547    HA   ARG  64           HA       ARG  64   5.975   1.550   4.143
  548    HB2  ARG  64           2HB      ARG  64   8.325   1.522   2.243
  549    HB3  ARG  64           3HB      ARG  64   7.135   2.814   2.326
  550    HG2  ARG  64           2HG      ARG  64   8.768   1.966   4.699
  551    HG3  ARG  64           3HG      ARG  64   9.309   3.194   3.553
  552    HD2  ARG  64           2HD      ARG  64   6.602   3.415   4.797
  553    HD3  ARG  64           3HD      ARG  64   8.028   3.886   5.721
  554    HE   ARG  64           HE       ARG  64   7.858   5.057   3.089
  555   HH11  ARG  64          2HH1      ARG  64   7.048   5.380   6.460
  556   HH12  ARG  64          1HH1      ARG  64   6.876   7.102   6.388
  557   HH21  ARG  64          2HH2      ARG  64   7.634   7.324   2.982
  558   HH22  ARG  64          1HH2      ARG  64   7.209   8.207   4.408
  559    H    LEU  65           HN       LEU  65   4.230   1.763   2.858
  560    HA   LEU  65           HA       LEU  65   4.084   0.069   0.453
  561    HB2  LEU  65           2HB      LEU  65   1.726   0.706   2.198
  562    HB3  LEU  65           3HB      LEU  65   1.846  -0.506   0.925
  563    HG   LEU  65           HG       LEU  65   3.412  -0.681   3.489
  564   HD11  LEU  65          1HD1      LEU  65   1.219  -0.725   4.279
  565   HD12  LEU  65          2HD1      LEU  65   1.623  -2.427   4.053
  566   HD13  LEU  65          3HD1      LEU  65   0.625  -1.591   2.862
  567   HD21  LEU  65          3HD2      LEU  65   4.365  -2.390   2.441
  568   HD22  LEU  65          1HD2      LEU  65   3.299  -2.192   1.050
  569   HD23  LEU  65          2HD2      LEU  65   2.794  -3.193   2.412
  570    H    ILE  66           HN       ILE  66   4.035   1.339  -1.274
  571    HA   ILE  66           HA       ILE  66   2.807   3.989  -1.087
  572    HB   ILE  66           HB       ILE  66   4.447   2.820  -3.338
  573   HG12  ILE  66          2HG1      ILE  66   6.162   4.507  -2.412
  574   HG13  ILE  66          3HG1      ILE  66   5.187   4.496  -0.946
  575   HG21  ILE  66          1HG2      ILE  66   4.689   5.315  -3.869
  576   HG22  ILE  66          2HG2      ILE  66   3.158   4.534  -4.261
  577   HG23  ILE  66          3HG2      ILE  66   3.291   5.538  -2.818
  578   HD11  ILE  66          3HD1      ILE  66   6.244   1.965  -2.148
  579   HD12  ILE  66          1HD1      ILE  66   7.206   2.951  -1.047
  580   HD13  ILE  66          2HD1      ILE  66   5.677   2.259  -0.504
  581    H    CYS  67           HN       CYS  67   0.645   3.766  -1.338
  582    HA   CYS  67           HA       CYS  67  -0.307   2.280  -3.695
  583    HB2  CYS  67           2HB      CYS  67  -1.985   3.098  -1.324
  584    HB3  CYS  67           3HB      CYS  67  -2.380   1.925  -2.574
  585    HG   CYS  67           HG       CYS  67   0.368   1.225  -0.765
  586    H    HIS  68           HN       HIS  68  -2.400   3.191  -4.608
  587    HA   HIS  68           HA       HIS  68  -2.190   6.128  -4.739
  588    HB2  HIS  68           2HB      HIS  68  -1.560   4.880  -6.828
  589    HB3  HIS  68           3HB      HIS  68  -3.220   4.298  -6.914
  590    HD2  HIS  68           2HD      HIS  68  -2.873   8.003  -5.914
  591    HE1  HIS  68           1HE      HIS  68  -3.943   7.873 -10.017
  592    HE2  HIS  68           2HE      HIS  68  -3.556   9.350  -8.014
  593    H    ILE  69           HN       ILE  69  -3.808   7.057  -3.680
  594    HA   ILE  69           HA       ILE  69  -6.298   5.693  -3.206
  595    HB   ILE  69           HB       ILE  69  -5.470   8.521  -2.541
  596   HG12  ILE  69          2HG1      ILE  69  -5.643   6.076  -0.768
  597   HG13  ILE  69          3HG1      ILE  69  -4.147   6.718  -1.437
  598   HG21  ILE  69          1HG2      ILE  69  -8.020   7.614  -2.687
  599   HG22  ILE  69          2HG2      ILE  69  -7.621   7.235  -1.012
  600   HG23  ILE  69          3HG2      ILE  69  -7.477   8.891  -1.599
  601   HD11  ILE  69          3HD1      ILE  69  -5.982   8.046   0.538
  602   HD12  ILE  69          1HD1      ILE  69  -4.342   7.459   0.815
  603   HD13  ILE  69          2HD1      ILE  69  -4.616   8.848  -0.237
  604    H    GLN  70           HN       GLN  70  -7.897   5.633  -4.628
  605    HA   GLN  70           HA       GLN  70  -8.164   7.834  -6.558
  606    HB2  GLN  70           2HB      GLN  70  -9.005   4.944  -6.664
  607    HB3  GLN  70           3HB      GLN  70  -9.625   6.139  -7.795
  608    HG2  GLN  70           2HG      GLN  70  -7.163   6.655  -8.291
  609    HG3  GLN  70           3HG      GLN  70  -6.827   5.125  -7.482
  610   HE21  GLN  70          1HE2      GLN  70  -6.397   5.881 -10.255
  611   HE22  GLN  70          2HE2      GLN  70  -7.291   4.752 -11.209
  612    H    ASP  71           HN       ASP  71  -9.435   9.293  -5.509
  613    HA   ASP  71           HA       ASP  71 -11.575   8.735  -3.810
  614    HB2  ASP  71           2HB      ASP  71 -11.205  11.149  -5.598
  615    HB3  ASP  71           3HB      ASP  71 -12.278  11.056  -4.203
  616    H    ARG  72           HN       ARG  72 -11.470   9.120  -7.313
  617    HA   ARG  72           HA       ARG  72 -13.992   9.400  -8.128
  618    HB2  ARG  72           2HB      ARG  72 -12.107   7.252  -9.116
  619    HB3  ARG  72           3HB      ARG  72 -13.540   7.803  -9.975
  620    HG2  ARG  72           2HG      ARG  72 -12.433  10.143  -9.795
  621    HG3  ARG  72           3HG      ARG  72 -10.958   9.220  -9.503
  622    HD2  ARG  72           2HD      ARG  72 -10.969   8.284 -11.613
  623    HD3  ARG  72           3HD      ARG  72 -12.704   8.515 -11.819
  624    HE   ARG  72           HE       ARG  72 -11.338  11.002 -11.650
  625   HH11  ARG  72          2HH1      ARG  72 -12.031   8.351 -13.797
  626   HH12  ARG  72          1HH1      ARG  72 -11.875   9.304 -15.235
  627   HH21  ARG  72          2HH2      ARG  72 -11.129  12.268 -13.536
  628   HH22  ARG  72          1HH2      ARG  72 -11.361  11.532 -15.085
  629    H    GLU  73           HN       GLU  73 -12.716   6.178  -7.266
  630    HA   GLU  73           HA       GLU  73 -15.472   5.390  -6.578
  631    HB2  GLU  73           2HB      GLU  73 -13.256   3.594  -7.581
  632    HB3  GLU  73           3HB      GLU  73 -14.908   3.110  -7.223
  633    HG2  GLU  73           2HG      GLU  73 -15.078   3.328  -9.468
  634    HG3  GLU  73           3HG      GLU  73 -15.459   4.985  -9.003
  635    H    ALA  74           HN       ALA  74 -13.467   6.624  -4.847
  636    HA   ALA  74           HA       ALA  74 -12.293   6.265  -2.889
  637    HB1  ALA  74           1HB      ALA  74 -13.918   6.283  -1.377
  638    HB2  ALA  74           2HB      ALA  74 -15.050   5.830  -2.652
  639    HB3  ALA  74           3HB      ALA  74 -14.278   4.582  -1.674
  640    H    THR  75           HN       THR  75 -11.354   4.460  -4.768
  641    HA   THR  75           HA       THR  75 -10.994   2.008  -3.169
  642    HB   THR  75           HB       THR  75 -10.922   2.322  -6.175
  643    HG1  THR  75           1HG      THR  75 -12.702   1.097  -4.339
  644   HG21  THR  75          3HG2      THR  75  -9.609   0.524  -6.253
  645   HG22  THR  75          1HG2      THR  75 -10.859  -0.396  -5.417
  646   HG23  THR  75          2HG2      THR  75  -9.598   0.420  -4.493
  647    H    VAL  76           HN       VAL  76  -8.958   1.350  -2.709
  648    HA   VAL  76           HA       VAL  76  -6.776   3.115  -3.579
  649    HB   VAL  76           HB       VAL  76  -6.850   1.183  -1.256
  650   HG11  VAL  76          1HG1      VAL  76  -4.664   2.336  -2.600
  651   HG12  VAL  76          2HG1      VAL  76  -4.833   3.205  -1.074
  652   HG13  VAL  76          3HG1      VAL  76  -4.654   1.450  -1.075
  653   HG21  VAL  76          3HG2      VAL  76  -7.580   2.836   0.079
  654   HG22  VAL  76          1HG2      VAL  76  -6.610   4.060  -0.741
  655   HG23  VAL  76          2HG2      VAL  76  -8.161   3.564  -1.419
  656    H    LEU  77           HN       LEU  77  -5.057   2.361  -4.693
  657    HA   LEU  77           HA       LEU  77  -4.897  -0.539  -5.173
  658    HB2  LEU  77           2HB      LEU  77  -5.815   0.371  -7.156
  659    HB3  LEU  77           3HB      LEU  77  -4.680   1.720  -7.144
  660    HG   LEU  77           HG       LEU  77  -2.911  -0.225  -7.422
  661   HD11  LEU  77          1HD1      LEU  77  -3.971  -2.207  -7.517
  662   HD12  LEU  77          2HD1      LEU  77  -4.240  -1.754  -9.200
  663   HD13  LEU  77          3HD1      LEU  77  -5.506  -1.486  -8.002
  664   HD21  LEU  77          3HD2      LEU  77  -2.767   0.350  -9.661
  665   HD22  LEU  77          1HD2      LEU  77  -3.625   1.726  -8.968
  666   HD23  LEU  77          2HD2      LEU  77  -4.517   0.483  -9.845
  667    H    VAL  78           HN       VAL  78  -3.061  -1.291  -4.369
  668    HA   VAL  78           HA       VAL  78  -0.887   0.293  -3.567
  669    HB   VAL  78           HB       VAL  78  -0.857  -2.665  -4.182
  670   HG11  VAL  78          1HG1      VAL  78   0.845  -1.352  -2.117
  671   HG12  VAL  78          2HG1      VAL  78   1.130  -2.828  -3.041
  672   HG13  VAL  78          3HG1      VAL  78   1.322  -1.253  -3.811
  673   HG21  VAL  78          3HG2      VAL  78  -1.023  -1.994  -1.389
  674   HG22  VAL  78          1HG2      VAL  78  -2.377  -1.292  -2.276
  675   HG23  VAL  78          2HG2      VAL  78  -2.075  -3.028  -2.356
  676    H    LEU  79           HN       LEU  79   0.954   0.927  -4.546
  677    HA   LEU  79           HA       LEU  79   1.264   0.230  -7.386
  678    HB2  LEU  79           2HB      LEU  79   1.806   2.669  -5.789
  679    HB3  LEU  79           3HB      LEU  79   2.893   2.321  -7.132
  680    HG   LEU  79           HG       LEU  79  -0.098   2.659  -7.354
  681   HD11  LEU  79          1HD1      LEU  79   1.749   4.564  -8.631
  682   HD12  LEU  79          2HD1      LEU  79   1.646   4.652  -6.873
  683   HD13  LEU  79          3HD1      LEU  79   0.191   4.836  -7.851
  684   HD21  LEU  79          3HD2      LEU  79   0.060   1.874  -9.426
  685   HD22  LEU  79          1HD2      LEU  79   1.709   1.370  -9.056
  686   HD23  LEU  79          2HD2      LEU  79   1.412   2.948  -9.786
  687    H    ARG  80           HN       ARG  80   3.128   0.783  -4.411
  688    HA   ARG  80           HA       ARG  80   5.098  -1.165  -5.374
  689    HB2  ARG  80           2HB      ARG  80   5.684   1.603  -4.329
  690    HB3  ARG  80           3HB      ARG  80   6.892   0.325  -4.348
  691    HG2  ARG  80           2HG      ARG  80   5.442   0.995  -6.863
  692    HG3  ARG  80           3HG      ARG  80   6.745   2.044  -6.302
  693    HD2  ARG  80           2HD      ARG  80   7.000  -0.931  -6.717
  694    HD3  ARG  80           3HD      ARG  80   7.484   0.286  -7.897
  695    HE   ARG  80           HE       ARG  80   8.699   0.691  -5.341
  696   HH11  ARG  80          2HH1      ARG  80   8.907  -1.111  -8.312
  697   HH12  ARG  80          1HH1      ARG  80  10.612  -1.385  -8.179
  698   HH21  ARG  80          2HH2      ARG  80  10.945   0.336  -5.154
  699   HH22  ARG  80          1HH2      ARG  80  11.770  -0.563  -6.382
  700    H    VAL  81           HN       VAL  81   6.383  -2.126  -3.673
  701    HA   VAL  81           HA       VAL  81   5.526  -1.689  -0.931
  702    HB   VAL  81           HB       VAL  81   3.883  -3.315  -1.765
  703   HG11  VAL  81          1HG1      VAL  81   4.410  -5.015  -3.100
  704   HG12  VAL  81          2HG1      VAL  81   6.044  -4.354  -3.182
  705   HG13  VAL  81          3HG1      VAL  81   5.650  -5.587  -1.984
  706   HG21  VAL  81          3HG2      VAL  81   3.948  -3.953   0.368
  707   HG22  VAL  81          1HG2      VAL  81   5.035  -5.250  -0.129
  708   HG23  VAL  81          2HG2      VAL  81   5.695  -3.720   0.449
  709    H    GLY  82           HN       GLY  82   7.375  -1.536   0.148
  710    HA2  GLY  82           1HA      GLY  82   9.326  -3.662   0.005
  711    HA3  GLY  82           2HA      GLY  82   9.900  -2.126  -0.628
  712    H    HIS  83           HN       HIS  83  11.009  -3.484   1.599
  713    HA   HIS  83           HA       HIS  83  10.101  -2.542   4.078
  714    HB2  HIS  83           2HB      HIS  83  11.730  -4.377   3.830
  715    HB3  HIS  83           3HB      HIS  83  12.933  -3.225   3.256
  716    HD2  HIS  83           2HD      HIS  83  11.335  -4.424   6.586
  717    HE1  HIS  83           1HE      HIS  83  14.344  -1.579   7.507
  718    HE2  HIS  83           2HE      HIS  83  12.797  -3.342   8.425
  719    H    ALA  84           HN       ALA  84  10.342  -0.669   5.153
  720    HA   ALA  84           HA       ALA  84  10.659   1.751   4.094
  721    HB1  ALA  84           1HB      ALA  84  10.242   1.120   6.537
  722    HB2  ALA  84           2HB      ALA  84  11.994   1.203   6.725
  723    HB3  ALA  84           3HB      ALA  84  11.093   2.631   6.216
  724    H    ARG  85           HN       ARG  85  13.450   0.121   5.618
  725    HA   ARG  85           HA       ARG  85  15.403   1.898   4.777
  726    HB2  ARG  85           2HB      ARG  85  16.102   0.363   6.384
  727    HB3  ARG  85           3HB      ARG  85  15.448  -1.010   5.501
  728    HG2  ARG  85           2HG      ARG  85  17.263  -1.156   4.105
  729    HG3  ARG  85           3HG      ARG  85  17.691   0.544   4.309
  730    HD2  ARG  85           2HD      ARG  85  19.297  -0.926   5.423
  731    HD3  ARG  85           3HD      ARG  85  18.446   0.097   6.580
  732    HE   ARG  85           HE       ARG  85  16.999  -2.216   6.519
  733   HH11  ARG  85          2HH1      ARG  85  20.330  -1.412   7.129
  734   HH12  ARG  85          1HH1      ARG  85  20.586  -2.735   8.218
  735   HH21  ARG  85          2HH2      ARG  85  17.323  -3.962   7.950
  736   HH22  ARG  85          1HH2      ARG  85  18.876  -4.186   8.683
  737    H    ASP  86           HN       ASP  86  14.350  -1.114   3.197
  738    HA   ASP  86           HA       ASP  86  16.054  -1.045   1.007
  739    HB2  ASP  86           2HB      ASP  86  14.397  -2.877   1.734
  740    HB3  ASP  86           3HB      ASP  86  13.201  -1.984   0.799
  741    H    VAL  87           HN       VAL  87  12.621  -0.076   0.915
  742    HA   VAL  87           HA       VAL  87  12.361   1.051  -1.482
  743    HB   VAL  87           HB       VAL  87  11.419   2.203   1.138
  744   HG11  VAL  87          1HG1      VAL  87  10.558   3.042  -1.629
  745   HG12  VAL  87          2HG1      VAL  87   9.910   3.637  -0.099
  746   HG13  VAL  87          3HG1      VAL  87  11.577   3.994  -0.550
  747   HG21  VAL  87          3HG2      VAL  87   9.432   1.196  -0.715
  748   HG22  VAL  87          1HG2      VAL  87  10.637  -0.027  -0.311
  749   HG23  VAL  87          2HG2      VAL  87   9.722   0.766   0.971
  750    H    TYR  88           HN       TYR  88  13.178   3.265   1.178
  751    HA   TYR  88           HA       TYR  88  15.474   4.335  -0.129
  752    HB2  TYR  88           2HB      TYR  88  14.697   6.299  -1.035
  753    HB3  TYR  88           3HB      TYR  88  13.308   5.261  -1.337
  754    HD1  TYR  88           2HD      TYR  88  14.621   7.498   1.359
  755    HD2  TYR  88           1HD      TYR  88  11.230   6.099  -0.797
  756    HE1  TYR  88           2HE      TYR  88  13.190   9.062   2.606
  757    HE2  TYR  88           1HE      TYR  88   9.790   7.660   0.443
  758    HH   TYR  88           HH       TYR  88   9.684   9.193   2.043
  759    H    ARG  89           HN       ARG  89  16.675   5.629   1.220
  760    HA   ARG  89           HA       ARG  89  16.420   5.383   3.943
  761    HB2  ARG  89           2HB      ARG  89  18.414   6.225   2.563
  762    HB3  ARG  89           3HB      ARG  89  17.670   7.814   2.682
  763    HG2  ARG  89           2HG      ARG  89  17.701   7.495   5.190
  764    HG3  ARG  89           3HG      ARG  89  18.736   6.096   4.901
  765    HD2  ARG  89           2HD      ARG  89  20.285   7.771   5.254
  766    HD3  ARG  89           3HD      ARG  89  20.148   7.766   3.496
  767    HE   ARG  89           HE       ARG  89  18.351   9.604   4.767
  768   HH11  ARG  89          2HH1      ARG  89  21.592   9.150   3.580
  769   HH12  ARG  89          1HH1      ARG  89  21.877  10.841   3.331
  770   HH21  ARG  89          2HH2      ARG  89  18.714  11.833   4.443
  771   HH22  ARG  89          1HH2      ARG  89  20.240  12.366   3.823
  Start of MODEL    6
    1    H1   MET   1           HN       MET   1 -18.885  -2.081   2.075
    2    HA   MET   1           HA       MET   1 -19.130   0.831   2.439
    3    HB2  MET   1           2HB      MET   1 -19.213   0.551   4.830
    4    HB3  MET   1           3HB      MET   1 -20.481  -0.430   4.107
    5    HG2  MET   1           2HG      MET   1 -19.307  -2.427   4.499
    6    HG3  MET   1           3HG      MET   1 -17.808  -1.568   4.847
    7    HE1  MET   1           3HE      MET   1 -17.958  -0.540   8.404
    8    HE2  MET   1           1HE      MET   1 -17.123  -0.574   6.850
    9    HE3  MET   1           2HE      MET   1 -18.388   0.618   7.145
   10    H    GLY   2           HN       GLY   2 -17.302   1.923   3.157
   11    HA2  GLY   2           1HA      GLY   2 -15.073   2.239   3.708
   12    HA3  GLY   2           2HA      GLY   2 -14.903   0.498   3.879
   13    H    TYR   3           HN       TYR   3 -13.010   2.220   2.645
   14    HA   TYR   3           HA       TYR   3 -13.221   2.217  -0.170
   15    HB2  TYR   3           2HB      TYR   3 -10.906   2.475   1.734
   16    HB3  TYR   3           3HB      TYR   3 -10.652   2.441  -0.007
   17    HD1  TYR   3           2HD      TYR   3 -12.858   4.184   2.464
   18    HD2  TYR   3           1HD      TYR   3 -10.504   4.479  -1.068
   19    HE1  TYR   3           2HE      TYR   3 -13.335   6.594   2.354
   20    HE2  TYR   3           1HE      TYR   3 -10.973   6.890  -1.187
   21    HH   TYR   3           HH       TYR   3 -13.037   8.413  -0.223
   22    H    ARG   4           HN       ARG   4 -12.242   0.883  -1.720
   23    HA   ARG   4           HA       ARG   4 -12.145  -1.903  -0.973
   24    HB2  ARG   4           2HB      ARG   4 -13.255  -1.327  -3.036
   25    HB3  ARG   4           3HB      ARG   4 -11.820  -0.501  -3.628
   26    HG2  ARG   4           2HG      ARG   4 -11.833  -2.540  -4.756
   27    HG3  ARG   4           3HG      ARG   4 -10.656  -2.763  -3.461
   28    HD2  ARG   4           2HD      ARG   4 -11.977  -4.721  -3.487
   29    HD3  ARG   4           3HD      ARG   4 -12.533  -3.776  -2.105
   30    HE   ARG   4           HE       ARG   4 -14.083  -3.178  -4.393
   31   HH11  ARG   4          2HH1      ARG   4 -13.568  -5.662  -2.008
   32   HH12  ARG   4          1HH1      ARG   4 -15.181  -6.285  -2.119
   33   HH21  ARG   4          2HH2      ARG   4 -16.209  -3.989  -4.548
   34   HH22  ARG   4          1HH2      ARG   4 -16.682  -5.333  -3.565
   35    H    ILE   5           HN       ILE   5 -10.381  -3.310  -1.323
   36    HA   ILE   5           HA       ILE   5  -7.769  -1.954  -1.246
   37    HB   ILE   5           HB       ILE   5  -8.438  -4.710  -0.209
   38   HG12  ILE   5          2HG1      ILE   5  -9.595  -3.009   1.106
   39   HG13  ILE   5          3HG1      ILE   5  -8.265  -3.693   2.035
   40   HG21  ILE   5          1HG2      ILE   5  -6.219  -4.945  -0.313
   41   HG22  ILE   5          2HG2      ILE   5  -5.962  -3.223  -0.589
   42   HG23  ILE   5          3HG2      ILE   5  -6.166  -3.831   1.054
   43   HD11  ILE   5          3HD1      ILE   5  -6.897  -1.725   1.427
   44   HD12  ILE   5          1HD1      ILE   5  -8.311  -1.033   0.633
   45   HD13  ILE   5          2HD1      ILE   5  -8.331  -1.326   2.373
   46    H    GLU   6           HN       GLU   6  -6.658  -2.091  -3.072
   47    HA   GLU   6           HA       GLU   6  -6.788  -4.599  -4.611
   48    HB2  GLU   6           2HB      GLU   6  -6.781  -1.763  -5.643
   49    HB3  GLU   6           3HB      GLU   6  -6.414  -3.151  -6.658
   50    HG2  GLU   6           2HG      GLU   6  -8.693  -4.053  -5.837
   51    HG3  GLU   6           3HG      GLU   6  -9.002  -2.377  -5.387
   52    H    PHE   7           HN       PHE   7  -4.883  -5.008  -5.956
   53    HA   PHE   7           HA       PHE   7  -2.453  -3.638  -5.050
   54    HB2  PHE   7           2HB      PHE   7  -3.054  -6.573  -4.864
   55    HB3  PHE   7           3HB      PHE   7  -1.394  -6.020  -5.063
   56    HD1  PHE   7           1HD      PHE   7  -4.391  -5.514  -2.917
   57    HD2  PHE   7           2HD      PHE   7  -0.144  -5.459  -3.203
   58    HE1  PHE   7           1HE      PHE   7  -4.235  -5.127  -0.492
   59    HE2  PHE   7           2HE      PHE   7   0.018  -5.074  -0.779
   60    HZ   PHE   7           HZ       PHE   7  -2.029  -4.908   0.580
   61    H    ASP   8           HN       ASP   8  -1.320  -2.976  -6.739
   62    HA   ASP   8           HA       ASP   8  -1.932  -3.448  -9.387
   63    HB2  ASP   8           2HB      ASP   8   0.448  -2.398  -7.950
   64    HB3  ASP   8           3HB      ASP   8   0.674  -2.863  -9.634
   65    HA   PRO   9           HA       PRO   9  -0.311  -7.348 -10.564
   66    HB2  PRO   9           2HB      PRO   9   0.795  -6.836 -12.990
   67    HB3  PRO   9           3HB      PRO   9  -0.951  -6.868 -12.718
   68    HG2  PRO   9           2HG      PRO   9   0.897  -4.519 -12.883
   69    HG3  PRO   9           3HG      PRO   9  -0.716  -4.725 -13.590
   70    HD2  PRO   9           2HD      PRO   9  -0.291  -3.319 -11.315
   71    HD3  PRO   9           3HD      PRO   9  -1.785  -4.232 -11.608
   72    H    ARG  10           HN       ARG  10   1.794  -4.709 -10.080
   73    HA   ARG  10           HA       ARG  10   4.200  -6.331 -10.437
   74    HB2  ARG  10           2HB      ARG  10   3.915  -3.405  -9.727
   75    HB3  ARG  10           3HB      ARG  10   5.426  -4.237 -10.072
   76    HG2  ARG  10           2HG      ARG  10   3.158  -3.909 -12.025
   77    HG3  ARG  10           3HG      ARG  10   4.603  -2.897 -11.965
   78    HD2  ARG  10           2HD      ARG  10   5.855  -5.183 -12.141
   79    HD3  ARG  10           3HD      ARG  10   4.316  -5.755 -12.783
   80    HE   ARG  10           HE       ARG  10   4.767  -3.566 -14.268
   81   HH11  ARG  10          2HH1      ARG  10   6.784  -6.280 -13.438
   82   HH12  ARG  10          1HH1      ARG  10   7.698  -6.218 -14.910
   83   HH21  ARG  10          2HH2      ARG  10   5.962  -3.474 -16.209
   84   HH22  ARG  10          1HH2      ARG  10   7.230  -4.621 -16.484
   85    H    ALA  11           HN       ALA  11   2.589  -4.386  -7.934
   86    HA   ALA  11           HA       ALA  11   4.364  -4.953  -5.843
   87    HB1  ALA  11           1HB      ALA  11   2.733  -4.074  -4.381
   88    HB2  ALA  11           2HB      ALA  11   2.547  -3.193  -5.898
   89    HB3  ALA  11           3HB      ALA  11   1.416  -4.481  -5.483
   90    H    GLU  12           HN       GLU  12   1.374  -6.592  -6.839
   91    HA   GLU  12           HA       GLU  12   0.968  -8.411  -4.887
   92    HB2  GLU  12           2HB      GLU  12   0.704  -8.551  -7.847
   93    HB3  GLU  12           3HB      GLU  12   0.556 -10.056  -6.950
   94    HG2  GLU  12           2HG      GLU  12  -1.033  -7.635  -6.192
   95    HG3  GLU  12           3HG      GLU  12  -1.570  -8.727  -7.467
   96    H    LYS  13           HN       LYS  13   3.425  -8.667  -7.428
   97    HA   LYS  13           HA       LYS  13   4.434 -11.171  -6.449
   98    HB2  LYS  13           2HB      LYS  13   5.433  -9.204  -8.505
   99    HB3  LYS  13           3HB      LYS  13   6.319 -10.664  -8.084
  100    HG2  LYS  13           2HG      LYS  13   3.464 -10.934  -8.855
  101    HG3  LYS  13           3HG      LYS  13   4.648 -10.591 -10.119
  102    HD2  LYS  13           2HD      LYS  13   5.945 -12.550  -9.435
  103    HD3  LYS  13           3HD      LYS  13   4.769 -12.888  -8.162
  104    HE2  LYS  13           2HE      LYS  13   3.028 -13.178  -9.865
  105    HE3  LYS  13           3HE      LYS  13   4.213 -12.854 -11.128
  106    HZ1  LYS  13           3HZ      LYS  13   4.329 -15.117  -9.208
  107    HZ2  LYS  13           1HZ      LYS  13   5.435 -14.814 -10.452
  108    HZ3  LYS  13           2HZ      LYS  13   3.838 -15.228 -10.823
  109    H    GLU  14           HN       GLU  14   5.412  -7.780  -6.245
  110    HA   GLU  14           HA       GLU  14   7.887  -8.176  -4.981
  111    HB2  GLU  14           2HB      GLU  14   5.992  -5.832  -4.734
  112    HB3  GLU  14           3HB      GLU  14   7.688  -5.827  -4.270
  113    HG2  GLU  14           2HG      GLU  14   8.420  -5.933  -6.479
  114    HG3  GLU  14           3HG      GLU  14   6.851  -6.479  -7.069
  115    H    LEU  15           HN       LEU  15   4.636  -8.272  -3.780
  116    HA   LEU  15           HA       LEU  15   5.465  -8.125  -1.001
  117    HB2  LEU  15           2HB      LEU  15   3.383  -7.070  -1.636
  118    HB3  LEU  15           3HB      LEU  15   2.774  -8.595  -2.277
  119    HG   LEU  15           HG       LEU  15   3.515  -8.461   0.605
  120   HD11  LEU  15          1HD1      LEU  15   0.941  -7.366  -0.519
  121   HD12  LEU  15          2HD1      LEU  15   2.219  -6.419   0.242
  122   HD13  LEU  15          3HD1      LEU  15   1.316  -7.602   1.188
  123   HD21  LEU  15          3HD2      LEU  15   1.577  -9.996   0.756
  124   HD22  LEU  15          1HD2      LEU  15   2.848 -10.584  -0.316
  125   HD23  LEU  15          2HD2      LEU  15   1.383  -9.873  -0.994
  126    H    GLU  16           HN       GLU  16   3.917 -10.510  -3.145
  127    HA   GLU  16           HA       GLU  16   3.733 -12.629  -1.380
  128    HB2  GLU  16           2HB      GLU  16   3.313 -13.965  -3.210
  129    HB3  GLU  16           3HB      GLU  16   2.991 -12.374  -3.884
  130    HG2  GLU  16           2HG      GLU  16   5.142 -12.325  -4.944
  131    HG3  GLU  16           3HG      GLU  16   5.609 -13.830  -4.155
  132    H    LYS  17           HN       LYS  17   6.526 -11.371  -3.043
  133    HA   LYS  17           HA       LYS  17   8.229 -13.608  -2.635
  134    HB2  LYS  17           2HB      LYS  17   9.941 -12.287  -3.499
  135    HB3  LYS  17           3HB      LYS  17   8.506 -11.604  -4.252
  136    HG2  LYS  17           2HG      LYS  17   9.520  -9.687  -3.592
  137    HG3  LYS  17           3HG      LYS  17   8.588 -10.025  -2.132
  138    HD2  LYS  17           2HD      LYS  17  10.684  -9.592  -1.265
  139    HD3  LYS  17           3HD      LYS  17  10.715 -11.350  -1.413
  140    HE2  LYS  17           2HE      LYS  17  11.920 -11.174  -3.513
  141    HE3  LYS  17           3HE      LYS  17  11.830  -9.414  -3.441
  142    HZ1  LYS  17           3HZ      LYS  17  13.958 -10.617  -2.650
  143    HZ2  LYS  17           1HZ      LYS  17  13.079 -10.902  -1.232
  144    HZ3  LYS  17           2HZ      LYS  17  13.361  -9.316  -1.748
  145    H    LEU  18           HN       LEU  18   7.367 -10.821  -0.708
  146    HA   LEU  18           HA       LEU  18   9.458 -10.953   1.174
  147    HB2  LEU  18           2HB      LEU  18   6.645  -9.904   1.367
  148    HB3  LEU  18           3HB      LEU  18   7.825  -9.743   2.666
  149    HG   LEU  18           HG       LEU  18   8.357  -8.662  -0.085
  150   HD11  LEU  18          1HD1      LEU  18   6.319  -7.786   1.688
  151   HD12  LEU  18          2HD1      LEU  18   6.848  -7.062   0.170
  152   HD13  LEU  18          3HD1      LEU  18   7.609  -6.583   1.687
  153   HD21  LEU  18          3HD2      LEU  18   9.360  -7.325   2.325
  154   HD22  LEU  18          1HD2      LEU  18  10.188  -7.736   0.822
  155   HD23  LEU  18          2HD2      LEU  18   9.978  -8.959   2.075
  156    H    ASP  19           HN       ASP  19   9.031 -11.451   3.548
  157    HA   ASP  19           HA       ASP  19   8.614 -14.176   3.886
  158    HB2  ASP  19           2HB      ASP  19   9.793 -12.546   5.456
  159    HB3  ASP  19           3HB      ASP  19   8.193 -12.146   6.076
  160    H    ARG  20           HN       ARG  20   6.942 -15.350   4.967
  161    HA   ARG  20           HA       ARG  20   4.360 -14.794   4.019
  162    HB2  ARG  20           2HB      ARG  20   5.525 -16.754   5.945
  163    HB3  ARG  20           3HB      ARG  20   3.777 -16.563   5.901
  164    HG2  ARG  20           2HG      ARG  20   4.135 -16.862   3.316
  165    HG3  ARG  20           3HG      ARG  20   5.620 -17.656   3.843
  166    HD2  ARG  20           2HD      ARG  20   3.069 -18.400   5.177
  167    HD3  ARG  20           3HD      ARG  20   3.358 -18.992   3.542
  168    HE   ARG  20           HE       ARG  20   4.523 -19.986   5.906
  169   HH11  ARG  20          2HH1      ARG  20   5.330 -19.202   2.612
  170   HH12  ARG  20          1HH1      ARG  20   6.609 -20.367   2.510
  171   HH21  ARG  20          2HH2      ARG  20   6.203 -21.523   5.785
  172   HH22  ARG  20          1HH2      ARG  20   7.103 -21.688   4.316
  173    H    GLU  21           HN       GLU  21   5.655 -14.608   7.336
  174    HA   GLU  21           HA       GLU  21   3.343 -13.603   8.544
  175    HB2  GLU  21           2HB      GLU  21   6.203 -13.052   9.352
  176    HB3  GLU  21           3HB      GLU  21   4.784 -12.920  10.381
  177    HG2  GLU  21           2HG      GLU  21   4.555 -15.190  10.598
  178    HG3  GLU  21           3HG      GLU  21   5.382 -15.528   9.079
  179    H    VAL  22           HN       VAL  22   5.844 -12.026   6.699
  180    HA   VAL  22           HA       VAL  22   5.199  -9.359   7.485
  181    HB   VAL  22           HB       VAL  22   6.784 -10.493   5.193
  182   HG11  VAL  22          1HG1      VAL  22   5.801  -8.522   4.283
  183   HG12  VAL  22          2HG1      VAL  22   6.128  -7.608   5.756
  184   HG13  VAL  22          3HG1      VAL  22   7.462  -8.127   4.725
  185   HG21  VAL  22          3HG2      VAL  22   8.659  -9.443   6.363
  186   HG22  VAL  22          1HG2      VAL  22   7.553  -8.846   7.601
  187   HG23  VAL  22          2HG2      VAL  22   7.808 -10.580   7.408
  188    H    ALA  23           HN       ALA  23   4.475 -11.301   4.592
  189    HA   ALA  23           HA       ALA  23   2.974  -9.372   3.230
  190    HB1  ALA  23           1HB      ALA  23   3.620 -12.126   2.904
  191    HB2  ALA  23           2HB      ALA  23   1.889 -11.914   2.635
  192    HB3  ALA  23           3HB      ALA  23   3.048 -10.972   1.698
  193    H    ARG  24           HN       ARG  24   1.911 -11.954   5.435
  194    HA   ARG  24           HA       ARG  24  -0.836 -11.441   5.288
  195    HB2  ARG  24           2HB      ARG  24  -1.033 -12.716   7.337
  196    HB3  ARG  24           3HB      ARG  24   0.162 -13.473   6.293
  197    HG2  ARG  24           2HG      ARG  24   1.951 -12.416   7.610
  198    HG3  ARG  24           3HG      ARG  24   0.728 -11.732   8.682
  199    HD2  ARG  24           2HD      ARG  24  -0.063 -14.138   9.021
  200    HD3  ARG  24           3HD      ARG  24   1.461 -14.615   8.273
  201    HE   ARG  24           HE       ARG  24   2.525 -14.095  10.223
  202   HH11  ARG  24          2HH1      ARG  24  -0.586 -12.534  10.194
  203   HH12  ARG  24          1HH1      ARG  24  -0.459 -11.960  11.824
  204   HH21  ARG  24          2HH2      ARG  24   2.705 -13.346  12.370
  205   HH22  ARG  24          1HH2      ARG  24   1.414 -12.422  13.061
  206    H    ARG  25           HN       ARG  25   1.575 -10.268   7.630
  207    HA   ARG  25           HA       ARG  25  -0.064  -8.778   9.271
  208    HB2  ARG  25           2HB      ARG  25   2.186  -9.008   9.928
  209    HB3  ARG  25           3HB      ARG  25   2.786  -8.381   8.399
  210    HG2  ARG  25           2HG      ARG  25   1.883  -6.160   8.999
  211    HG3  ARG  25           3HG      ARG  25   1.407  -6.814  10.567
  212    HD2  ARG  25           2HD      ARG  25   3.904  -7.532  10.720
  213    HD3  ARG  25           3HD      ARG  25   4.143  -6.310   9.472
  214    HE   ARG  25           HE       ARG  25   3.884  -4.705  11.071
  215   HH11  ARG  25          2HH1      ARG  25   2.507  -7.679  12.245
  216   HH12  ARG  25          1HH1      ARG  25   2.181  -7.055  13.828
  217   HH21  ARG  25          2HH2      ARG  25   3.460  -3.872  13.152
  218   HH22  ARG  25          1HH2      ARG  25   2.723  -4.890  14.342
  219    H    ILE  26           HN       ILE  26   1.406  -7.831   6.191
  220    HA   ILE  26           HA       ILE  26   0.610  -5.146   6.190
  221    HB   ILE  26           HB       ILE  26   1.130  -7.047   3.909
  222   HG12  ILE  26          2HG1      ILE  26   2.739  -4.747   5.041
  223   HG13  ILE  26          3HG1      ILE  26   3.048  -6.452   5.352
  224   HG21  ILE  26          1HG2      ILE  26   1.206  -5.068   2.451
  225   HG22  ILE  26          2HG2      ILE  26  -0.401  -5.340   3.124
  226   HG23  ILE  26          3HG2      ILE  26   0.631  -4.075   3.791
  227   HD11  ILE  26          3HD1      ILE  26   3.334  -6.709   2.852
  228   HD12  ILE  26          1HD1      ILE  26   3.356  -4.947   2.777
  229   HD13  ILE  26          2HD1      ILE  26   4.586  -5.806   3.705
  230    H    LEU  27           HN       LEU  27  -0.902  -7.844   4.404
  231    HA   LEU  27           HA       LEU  27  -3.171  -6.489   3.566
  232    HB2  LEU  27           2HB      LEU  27  -2.596  -9.373   4.118
  233    HB3  LEU  27           3HB      LEU  27  -4.218  -8.863   3.652
  234    HG   LEU  27           HG       LEU  27  -1.808  -8.228   1.971
  235   HD11  LEU  27          1HD1      LEU  27  -1.895 -10.231   0.877
  236   HD12  LEU  27          2HD1      LEU  27  -3.575 -10.531   1.322
  237   HD13  LEU  27          3HD1      LEU  27  -2.293 -10.759   2.512
  238   HD21  LEU  27          3HD2      LEU  27  -3.961  -8.566   0.338
  239   HD22  LEU  27          1HD2      LEU  27  -3.408  -7.016   0.972
  240   HD23  LEU  27          2HD2      LEU  27  -4.712  -7.885   1.782
  241    H    ARG  28           HN       ARG  28  -2.587  -8.242   6.580
  242    HA   ARG  28           HA       ARG  28  -5.227  -8.004   7.583
  243    HB2  ARG  28           2HB      ARG  28  -3.593  -9.661   8.416
  244    HB3  ARG  28           3HB      ARG  28  -2.641  -8.354   9.108
  245    HG2  ARG  28           2HG      ARG  28  -5.491  -8.554   9.901
  246    HG3  ARG  28           3HG      ARG  28  -4.365  -9.752  10.541
  247    HD2  ARG  28           2HD      ARG  28  -2.922  -7.573  11.014
  248    HD3  ARG  28           3HD      ARG  28  -4.520  -6.827  11.027
  249    HE   ARG  28           HE       ARG  28  -4.853  -7.758  13.076
  250   HH11  ARG  28          2HH1      ARG  28  -2.429  -9.618  11.407
  251   HH12  ARG  28          1HH1      ARG  28  -2.121 -10.666  12.753
  252   HH21  ARG  28          2HH2      ARG  28  -4.456  -9.130  14.853
  253   HH22  ARG  28          1HH2      ARG  28  -3.275 -10.388  14.712
  254    H    PHE  29           HN       PHE  29  -2.533  -5.848   7.453
  255    HA   PHE  29           HA       PHE  29  -3.498  -4.105   9.542
  256    HB2  PHE  29           2HB      PHE  29  -1.141  -4.139   9.298
  257    HB3  PHE  29           3HB      PHE  29  -1.242  -3.922   7.553
  258    HD1  PHE  29           1HD      PHE  29  -1.678  -2.242  10.807
  259    HD2  PHE  29           2HD      PHE  29  -1.355  -1.768   6.590
  260    HE1  PHE  29           1HE      PHE  29  -1.431   0.188  11.103
  261    HE2  PHE  29           2HE      PHE  29  -1.106   0.662   6.878
  262    HZ   PHE  29           HZ       PHE  29  -1.143   1.644   9.137
  263    H    LEU  30           HN       LEU  30  -3.666  -4.309   6.055
  264    HA   LEU  30           HA       LEU  30  -4.900  -1.684   5.833
  265    HB2  LEU  30           2HB      LEU  30  -4.098  -3.786   3.845
  266    HB3  LEU  30           3HB      LEU  30  -5.071  -2.391   3.382
  267    HG   LEU  30           HG       LEU  30  -2.488  -1.903   4.779
  268   HD11  LEU  30          1HD1      LEU  30  -2.777  -3.208   2.154
  269   HD12  LEU  30          2HD1      LEU  30  -1.424  -3.210   3.285
  270   HD13  LEU  30          3HD1      LEU  30  -1.677  -1.830   2.216
  271   HD21  LEU  30          3HD2      LEU  30  -3.161  -0.367   2.408
  272   HD22  LEU  30          1HD2      LEU  30  -2.807   0.178   4.048
  273   HD23  LEU  30          2HD2      LEU  30  -4.441  -0.333   3.622
  274    H    ARG  31           HN       ARG  31  -5.794  -5.039   5.926
  275    HA   ARG  31           HA       ARG  31  -8.468  -4.588   4.933
  276    HB2  ARG  31           2HB      ARG  31  -8.743  -6.879   4.996
  277    HB3  ARG  31           3HB      ARG  31  -7.001  -6.753   4.791
  278    HG2  ARG  31           2HG      ARG  31  -6.871  -6.905   7.338
  279    HG3  ARG  31           3HG      ARG  31  -8.550  -7.444   7.260
  280    HD2  ARG  31           2HD      ARG  31  -7.904  -9.282   5.797
  281    HD3  ARG  31           3HD      ARG  31  -6.230  -8.729   5.824
  282    HE   ARG  31           HE       ARG  31  -6.896  -9.115   8.454
  283   HH11  ARG  31          2HH1      ARG  31  -6.863 -11.074   5.575
  284   HH12  ARG  31          1HH1      ARG  31  -6.546 -12.550   6.426
  285   HH21  ARG  31          2HH2      ARG  31  -6.479 -11.052   9.585
  286   HH22  ARG  31          1HH2      ARG  31  -6.329 -12.536   8.706
  287    H    GLU  32           HN       GLU  32  -6.870  -4.281   7.907
  288    HA   GLU  32           HA       GLU  32  -9.406  -4.451   9.391
  289    HB2  GLU  32           2HB      GLU  32  -6.540  -4.686  10.298
  290    HB3  GLU  32           3HB      GLU  32  -7.874  -4.474  11.423
  291    HG2  GLU  32           2HG      GLU  32  -8.064  -6.673   9.442
  292    HG3  GLU  32           3HG      GLU  32  -6.940  -6.858  10.788
  293    H    ARG  33           HN       ARG  33  -6.388  -2.548   9.345
  294    HA   ARG  33           HA       ARG  33  -7.556  -0.352  10.746
  295    HB2  ARG  33           2HB      ARG  33  -5.048  -0.266   9.074
  296    HB3  ARG  33           3HB      ARG  33  -5.467   0.752  10.445
  297    HG2  ARG  33           2HG      ARG  33  -5.209  -2.192  10.832
  298    HG3  ARG  33           3HG      ARG  33  -3.759  -1.192  10.719
  299    HD2  ARG  33           2HD      ARG  33  -4.205  -0.085  12.677
  300    HD3  ARG  33           3HD      ARG  33  -5.946  -0.327  12.542
  301    HE   ARG  33           HE       ARG  33  -5.031  -2.829  12.940
  302   HH11  ARG  33          2HH1      ARG  33  -4.476   0.180  14.600
  303   HH12  ARG  33          1HH1      ARG  33  -4.229  -0.567  16.144
  304   HH21  ARG  33          2HH2      ARG  33  -4.707  -3.824  14.967
  305   HH22  ARG  33          1HH2      ARG  33  -4.359  -2.845  16.351
  306    H    VAL  34           HN       VAL  34  -6.097  -0.321   7.495
  307    HA   VAL  34           HA       VAL  34  -7.337   2.008   6.623
  308    HB   VAL  34           HB       VAL  34  -6.442  -0.343   4.949
  309   HG11  VAL  34          1HG1      VAL  34  -6.395   1.143   3.079
  310   HG12  VAL  34          2HG1      VAL  34  -7.996   1.256   3.813
  311   HG13  VAL  34          3HG1      VAL  34  -6.803   2.524   4.096
  312   HG21  VAL  34          3HG2      VAL  34  -4.469   0.270   5.883
  313   HG22  VAL  34          1HG2      VAL  34  -4.527   1.497   4.618
  314   HG23  VAL  34          2HG2      VAL  34  -5.027   1.900   6.261
  315    H    ALA  35           HN       ALA  35  -8.485  -1.302   6.617
  316    HA   ALA  35           HA       ALA  35 -10.652  -1.003   4.854
  317    HB1  ALA  35           1HB      ALA  35 -10.533  -2.870   7.215
  318    HB2  ALA  35           2HB      ALA  35 -11.477  -3.062   5.737
  319    HB3  ALA  35           3HB      ALA  35  -9.718  -3.169   5.679
  320    H    THR  36           HN       THR  36 -10.557  -0.843   8.413
  321    HA   THR  36           HA       THR  36 -13.289  -0.073   8.655
  322    HB   THR  36           HB       THR  36 -12.814   0.326  11.000
  323    HG1  THR  36           1HG      THR  36 -10.077  -0.230  10.574
  324   HG21  THR  36          3HG2      THR  36 -11.936  -2.112   9.630
  325   HG22  THR  36          1HG2      THR  36 -13.027  -1.914  11.001
  326   HG23  THR  36          2HG2      THR  36 -11.281  -1.922  11.256
  327    H    LEU  37           HN       LEU  37 -10.225   1.682   8.607
  328    HA   LEU  37           HA       LEU  37 -10.988   4.186   9.412
  329    HB2  LEU  37           2HB      LEU  37  -9.063   3.289   7.296
  330    HB3  LEU  37           3HB      LEU  37  -9.297   4.999   7.652
  331    HG   LEU  37           HG       LEU  37  -8.448   2.980   9.721
  332   HD11  LEU  37          1HD1      LEU  37  -6.204   4.278   9.345
  333   HD12  LEU  37          2HD1      LEU  37  -6.861   4.522   7.727
  334   HD13  LEU  37          3HD1      LEU  37  -6.620   2.888   8.343
  335   HD21  LEU  37          3HD2      LEU  37  -9.203   4.783  10.913
  336   HD22  LEU  37          1HD2      LEU  37  -8.815   5.933   9.633
  337   HD23  LEU  37          2HD2      LEU  37  -7.528   5.267  10.639
  338    H    GLU  38           HN       GLU  38 -12.597   5.458   8.800
  339    HA   GLU  38           HA       GLU  38 -14.253   5.079   6.620
  340    HB2  GLU  38           2HB      GLU  38 -13.655   7.699   8.007
  341    HB3  GLU  38           3HB      GLU  38 -15.066   7.358   7.015
  342    HG2  GLU  38           2HG      GLU  38 -14.411   5.818   9.508
  343    HG3  GLU  38           3HG      GLU  38 -15.410   7.270   9.504
  344    H    ASP  39           HN       ASP  39 -11.164   6.627   6.780
  345    HA   ASP  39           HA       ASP  39 -11.290   7.114   3.894
  346    HB2  ASP  39           2HB      ASP  39  -9.856   9.241   4.459
  347    HB3  ASP  39           3HB      ASP  39 -11.614   9.312   4.533
  348    HA   PRO  40           HA       PRO  40  -7.413   5.019   3.995
  349    HB2  PRO  40           2HB      PRO  40  -6.526   5.718   1.526
  350    HB3  PRO  40           3HB      PRO  40  -7.803   4.524   1.785
  351    HG2  PRO  40           2HG      PRO  40  -8.035   7.415   1.043
  352    HG3  PRO  40           3HG      PRO  40  -8.922   6.020   0.400
  353    HD2  PRO  40           2HD      PRO  40  -9.979   7.695   2.247
  354    HD3  PRO  40           3HD      PRO  40 -10.379   5.966   2.185
  355    H    ARG  41           HN       ARG  41  -7.721   8.439   3.529
  356    HA   ARG  41           HA       ARG  41  -4.872   8.941   3.648
  357    HB2  ARG  41           2HB      ARG  41  -7.259  10.795   3.650
  358    HB3  ARG  41           3HB      ARG  41  -5.588  11.344   3.688
  359    HG2  ARG  41           2HG      ARG  41  -5.202  10.195   1.534
  360    HG3  ARG  41           3HG      ARG  41  -6.915   9.774   1.490
  361    HD2  ARG  41           2HD      ARG  41  -6.908  11.692   0.228
  362    HD3  ARG  41           3HD      ARG  41  -7.243  12.349   1.829
  363    HE   ARG  41           HE       ARG  41  -4.447  12.249   1.089
  364   HH11  ARG  41          2HH1      ARG  41  -7.378  14.126   1.172
  365   HH12  ARG  41          1HH1      ARG  41  -6.560  15.649   1.064
  366   HH21  ARG  41          2HH2      ARG  41  -3.359  14.249   0.946
  367   HH22  ARG  41          1HH2      ARG  41  -4.274  15.718   0.935
  368    H    SER  42           HN       SER  42  -6.239   7.564   5.883
  369    HA   SER  42           HA       SER  42  -6.036   9.515   8.049
  370    HB2  SER  42           2HB      SER  42  -7.902   7.700   7.776
  371    HB3  SER  42           3HB      SER  42  -6.694   6.616   8.466
  372    HG   SER  42           HG       SER  42  -7.206   7.410  10.329
  373    H    LEU  43           HN       LEU  43  -4.704   6.333   7.169
  374    HA   LEU  43           HA       LEU  43  -2.502   6.794   9.059
  375    HB2  LEU  43           2HB      LEU  43  -3.699   4.336   7.845
  376    HB3  LEU  43           3HB      LEU  43  -2.056   4.304   8.482
  377    HG   LEU  43           HG       LEU  43  -4.506   5.027  10.087
  378   HD11  LEU  43          1HD1      LEU  43  -3.417   2.465   9.310
  379   HD12  LEU  43          2HD1      LEU  43  -4.918   2.844  10.154
  380   HD13  LEU  43          3HD1      LEU  43  -3.416   2.670  11.062
  381   HD21  LEU  43          3HD2      LEU  43  -2.911   4.621  11.990
  382   HD22  LEU  43          1HD2      LEU  43  -2.594   6.067  11.032
  383   HD23  LEU  43          2HD2      LEU  43  -1.609   4.623  10.800
  384    H    GLY  44           HN       GLY  44  -0.671   7.546   8.238
  385    HA2  GLY  44           1HA      GLY  44   1.197   6.860   6.713
  386    HA3  GLY  44           2HA      GLY  44  -0.014   6.860   5.439
  387    H    GLU  45           HN       GLU  45   1.723   8.332   4.534
  388    HA   GLU  45           HA       GLU  45   1.021  11.099   5.228
  389    HB2  GLU  45           2HB      GLU  45   3.296  11.827   5.054
  390    HB3  GLU  45           3HB      GLU  45   3.247  10.486   6.190
  391    HG2  GLU  45           2HG      GLU  45   4.102   8.979   4.517
  392    HG3  GLU  45           3HG      GLU  45   4.039  10.249   3.296
  393    HA   PRO  46           HA       PRO  46   0.292  11.516   0.908
  394    HB2  PRO  46           2HB      PRO  46   0.489  14.216   0.698
  395    HB3  PRO  46           3HB      PRO  46  -0.895  13.409   1.445
  396    HG2  PRO  46           2HG      PRO  46   1.480  14.688   2.743
  397    HG3  PRO  46           3HG      PRO  46  -0.231  14.784   3.199
  398    HD2  PRO  46           2HD      PRO  46   1.523  13.150   4.459
  399    HD3  PRO  46           3HD      PRO  46  -0.192  12.738   4.261
  400    H    LEU  47           HN       LEU  47   1.460  11.531  -0.943
  401    HA   LEU  47           HA       LEU  47   4.315  12.103  -0.717
  402    HB2  LEU  47           2HB      LEU  47   3.177   9.964  -1.728
  403    HB3  LEU  47           3HB      LEU  47   3.057  10.969  -3.171
  404    HG   LEU  47           HG       LEU  47   5.644  11.305  -2.708
  405   HD11  LEU  47          1HD1      LEU  47   5.154   8.547  -1.604
  406   HD12  LEU  47          2HD1      LEU  47   5.534   9.956  -0.615
  407   HD13  LEU  47          3HD1      LEU  47   6.703   9.368  -1.797
  408   HD21  LEU  47          3HD2      LEU  47   5.063   8.661  -3.877
  409   HD22  LEU  47          1HD2      LEU  47   5.947  10.033  -4.546
  410   HD23  LEU  47          2HD2      LEU  47   4.183  10.025  -4.568
  411    H    ARG  48           HN       ARG  48   5.311  13.740  -1.737
  412    HA   ARG  48           HA       ARG  48   3.857  15.218  -3.810
  413    HB2  ARG  48           2HB      ARG  48   3.557  16.328  -1.573
  414    HB3  ARG  48           3HB      ARG  48   5.297  16.577  -1.529
  415    HG2  ARG  48           2HG      ARG  48   5.250  18.180  -3.165
  416    HG3  ARG  48           3HG      ARG  48   3.766  17.554  -3.886
  417    HD2  ARG  48           2HD      ARG  48   2.662  18.279  -1.664
  418    HD3  ARG  48           3HD      ARG  48   4.111  19.261  -1.449
  419    HE   ARG  48           HE       ARG  48   3.081  19.755  -4.002
  420   HH11  ARG  48          2HH1      ARG  48   2.242  20.259  -0.661
  421   HH12  ARG  48          1HH1      ARG  48   1.317  21.690  -0.973
  422   HH21  ARG  48          2HH2      ARG  48   1.866  21.638  -4.426
  423   HH22  ARG  48          1HH2      ARG  48   1.103  22.473  -3.115
  424    H    GLY  49           HN       GLY  49   5.120  14.986  -5.543
  425    HA2  GLY  49           1HA      GLY  49   7.963  15.694  -5.267
  426    HA3  GLY  49           2HA      GLY  49   7.519  14.203  -6.085
  427    HA   PRO  50           HA       PRO  50   7.682  17.866  -9.063
  428    HB2  PRO  50           2HB      PRO  50   9.795  17.003 -10.533
  429    HB3  PRO  50           3HB      PRO  50   9.973  18.031  -9.106
  430    HG2  PRO  50           2HG      PRO  50  10.313  15.068  -9.359
  431    HG3  PRO  50           3HG      PRO  50  11.317  16.239  -8.484
  432    HD2  PRO  50           2HD      PRO  50   9.491  14.671  -7.243
  433    HD3  PRO  50           3HD      PRO  50   9.885  16.307  -6.679
  434    H    GLU  51           HN       GLU  51   8.382  14.430  -9.685
  435    HA   GLU  51           HA       GLU  51   6.721  14.580 -12.104
  436    HB2  GLU  51           2HB      GLU  51   8.988  13.720 -12.441
  437    HB3  GLU  51           3HB      GLU  51   8.708  12.474 -11.232
  438    HG2  GLU  51           2HG      GLU  51   6.837  11.638 -12.693
  439    HG3  GLU  51           3HG      GLU  51   7.426  12.742 -13.934
  440    H    LEU  52           HN       LEU  52   7.172  12.787  -9.097
  441    HA   LEU  52           HA       LEU  52   5.154  10.871  -9.494
  442    HB2  LEU  52           2HB      LEU  52   6.629  11.956  -7.159
  443    HB3  LEU  52           3HB      LEU  52   5.149  11.053  -6.842
  444    HG   LEU  52           HG       LEU  52   7.142   9.647  -6.648
  445   HD11  LEU  52          1HD1      LEU  52   5.821   7.989  -7.286
  446   HD12  LEU  52          2HD1      LEU  52   6.201   8.321  -8.976
  447   HD13  LEU  52          3HD1      LEU  52   4.833   9.125  -8.206
  448   HD21  LEU  52          3HD2      LEU  52   8.257  11.052  -8.592
  449   HD22  LEU  52          1HD2      LEU  52   7.598   9.750  -9.582
  450   HD23  LEU  52          2HD2      LEU  52   8.721   9.380  -8.273
  451    H    GLY  53           HN       GLY  53   2.993  10.903  -9.235
  452    HA2  GLY  53           1HA      GLY  53   1.670  13.434  -9.027
  453    HA3  GLY  53           2HA      GLY  53   0.896  11.862  -9.167
  454    H    ARG  54           HN       ARG  54  -0.663  12.304  -7.614
  455    HA   ARG  54           HA       ARG  54   0.280  12.857  -4.894
  456    HB2  ARG  54           2HB      ARG  54  -1.695  14.077  -6.165
  457    HB3  ARG  54           3HB      ARG  54  -2.619  12.697  -5.587
  458    HG2  ARG  54           2HG      ARG  54  -2.295  13.265  -3.348
  459    HG3  ARG  54           3HG      ARG  54  -0.947  14.341  -3.724
  460    HD2  ARG  54           2HD      ARG  54  -3.757  14.849  -4.671
  461    HD3  ARG  54           3HD      ARG  54  -3.147  15.449  -3.129
  462    HE   ARG  54           HE       ARG  54  -1.321  16.281  -4.998
  463   HH11  ARG  54          2HH1      ARG  54  -4.742  16.684  -4.493
  464   HH12  ARG  54          1HH1      ARG  54  -4.801  18.245  -5.242
  465   HH21  ARG  54          2HH2      ARG  54  -1.386  18.335  -5.986
  466   HH22  ARG  54          1HH2      ARG  54  -2.891  19.183  -6.092
  467    H    PHE  55           HN       PHE  55   1.039  10.850  -4.262
  468    HA   PHE  55           HA       PHE  55  -0.996   8.727  -4.068
  469    HB2  PHE  55           2HB      PHE  55   2.006   8.391  -4.246
  470    HB3  PHE  55           3HB      PHE  55   0.824   7.091  -4.135
  471    HD1  PHE  55           1HD      PHE  55  -0.969   7.023  -6.016
  472    HD2  PHE  55           2HD      PHE  55   2.740   9.089  -6.316
  473    HE1  PHE  55           1HE      PHE  55  -1.142   6.970  -8.470
  474    HE2  PHE  55           2HE      PHE  55   2.573   9.040  -8.770
  475    HZ   PHE  55           HZ       PHE  55   0.630   7.980  -9.850
  476    H    TRP  56           HN       TRP  56  -1.119   7.541  -2.148
  477    HA   TRP  56           HA       TRP  56  -0.163   8.989   0.189
  478    HB2  TRP  56           2HB      TRP  56  -2.566   8.066  -0.183
  479    HB3  TRP  56           3HB      TRP  56  -1.870   6.520   0.294
  480    HD1  TRP  56           1HD      TRP  56  -1.624   6.076   2.831
  481    HE1  TRP  56           1HE      TRP  56  -2.042   7.459   4.962
  482    HE3  TRP  56           3HE      TRP  56  -2.416  10.650   0.689
  483    HZ2  TRP  56           2HZ      TRP  56  -2.631  10.134   5.644
  484    HZ3  TRP  56           3HZ      TRP  56  -2.901  12.569   2.151
  485    HH2  TRP  56           2HH      TRP  56  -3.006  12.314   4.576
  486    H    LYS  57           HN       LYS  57   1.017   8.033   1.877
  487    HA   LYS  57           HA       LYS  57   2.442   5.562   1.132
  488    HB2  LYS  57           2HB      LYS  57   3.995   7.371   0.966
  489    HB3  LYS  57           3HB      LYS  57   3.471   8.045   2.504
  490    HG2  LYS  57           2HG      LYS  57   5.438   7.043   3.106
  491    HG3  LYS  57           3HG      LYS  57   4.286   5.752   3.453
  492    HD2  LYS  57           2HD      LYS  57   6.015   4.687   2.289
  493    HD3  LYS  57           3HD      LYS  57   4.764   4.942   1.070
  494    HE2  LYS  57           2HE      LYS  57   6.621   5.668  -0.064
  495    HE3  LYS  57           3HE      LYS  57   6.065   7.179   0.653
  496    HZ1  LYS  57           3HZ      LYS  57   7.728   7.112   2.262
  497    HZ2  LYS  57           1HZ      LYS  57   8.521   6.611   0.853
  498    HZ3  LYS  57           2HZ      LYS  57   8.056   5.471   2.013
  499    H    TYR  58           HN       TYR  58   2.007   3.926   2.443
  500    HA   TYR  58           HA       TYR  58   1.011   4.484   5.142
  501    HB2  TYR  58           2HB      TYR  58   0.885   2.017   3.405
  502    HB3  TYR  58           3HB      TYR  58   0.372   2.037   5.089
  503    HD1  TYR  58           1HD      TYR  58  -1.465   3.714   5.738
  504    HD2  TYR  58           2HD      TYR  58  -0.599   2.639   1.713
  505    HE1  TYR  58           1HE      TYR  58  -3.691   4.505   5.054
  506    HE2  TYR  58           2HE      TYR  58  -2.823   3.428   1.018
  507    HH   TYR  58           HH       TYR  58  -5.156   4.668   3.388
  508    H    ARG  59           HN       ARG  59   1.734   3.084   6.912
  509    HA   ARG  59           HA       ARG  59   4.478   2.087   6.558
  510    HB2  ARG  59           2HB      ARG  59   4.889   2.979   8.927
  511    HB3  ARG  59           3HB      ARG  59   4.860   4.147   7.613
  512    HG2  ARG  59           2HG      ARG  59   2.351   3.598   9.121
  513    HG3  ARG  59           3HG      ARG  59   3.595   4.617   9.847
  514    HD2  ARG  59           2HD      ARG  59   3.534   5.809   7.511
  515    HD3  ARG  59           3HD      ARG  59   1.930   5.083   7.416
  516    HE   ARG  59           HE       ARG  59   1.215   6.706   8.836
  517   HH11  ARG  59          2HH1      ARG  59   4.623   6.224   9.362
  518   HH12  ARG  59          1HH1      ARG  59   4.750   7.479  10.550
  519   HH21  ARG  59          2HH2      ARG  59   1.370   8.361  10.398
  520   HH22  ARG  59          1HH2      ARG  59   2.899   8.694  11.139
  521    H    VAL  60           HN       VAL  60   4.791   0.101   7.333
  522    HA   VAL  60           HA       VAL  60   2.857  -0.959   9.289
  523    HB   VAL  60           HB       VAL  60   4.105  -2.416   6.956
  524   HG11  VAL  60          1HG1      VAL  60   2.103  -3.951   8.262
  525   HG12  VAL  60          2HG1      VAL  60   3.815  -4.324   8.053
  526   HG13  VAL  60          3HG1      VAL  60   3.274  -3.428   9.473
  527   HG21  VAL  60          3HG2      VAL  60   1.822  -2.676   6.172
  528   HG22  VAL  60          1HG2      VAL  60   1.216  -1.818   7.589
  529   HG23  VAL  60          2HG2      VAL  60   2.195  -0.967   6.394
  530    H    GLY  61           HN       GLY  61   4.410  -0.300  10.916
  531    HA2  GLY  61           1HA      GLY  61   6.024  -0.826  12.464
  532    HA3  GLY  61           2HA      GLY  61   6.081  -2.425  11.737
  533    H    ASP  62           HN       ASP  62   7.407  -2.681   9.790
  534    HA   ASP  62           HA       ASP  62   9.559  -0.692   9.574
  535    HB2  ASP  62           2HB      ASP  62   9.811  -3.625  10.149
  536    HB3  ASP  62           3HB      ASP  62  11.083  -2.794   9.258
  537    H    TYR  63           HN       TYR  63   7.266  -1.196   7.885
  538    HA   TYR  63           HA       TYR  63   8.704  -1.752   5.397
  539    HB2  TYR  63           2HB      TYR  63   6.107  -3.048   6.232
  540    HB3  TYR  63           3HB      TYR  63   6.685  -3.026   4.570
  541    HD1  TYR  63           1HD      TYR  63   7.672  -4.093   8.000
  542    HD2  TYR  63           2HD      TYR  63   8.116  -4.703   3.812
  543    HE1  TYR  63           1HE      TYR  63   8.997  -6.118   8.441
  544    HE2  TYR  63           2HE      TYR  63   9.441  -6.730   4.242
  545    HH   TYR  63           HH       TYR  63  10.953  -7.525   6.359
  546    H    ARG  64           HN       ARG  64   8.197  -0.395   3.773
  547    HA   ARG  64           HA       ARG  64   6.097   1.589   4.299
  548    HB2  ARG  64           2HB      ARG  64   8.689   1.645   2.831
  549    HB3  ARG  64           3HB      ARG  64   7.398   2.693   2.258
  550    HG2  ARG  64           2HG      ARG  64   9.036   3.705   3.890
  551    HG3  ARG  64           3HG      ARG  64   7.325   3.886   4.282
  552    HD2  ARG  64           2HD      ARG  64   7.589   1.803   5.712
  553    HD3  ARG  64           3HD      ARG  64   9.328   2.002   5.499
  554    HE   ARG  64           HE       ARG  64   7.658   3.466   7.263
  555   HH11  ARG  64          2HH1      ARG  64  10.428   3.790   5.180
  556   HH12  ARG  64          1HH1      ARG  64  11.115   5.102   6.079
  557   HH21  ARG  64          2HH2      ARG  64   8.552   5.192   8.456
  558   HH22  ARG  64          1HH2      ARG  64  10.047   5.898   7.943
  559    H    LEU  65           HN       LEU  65   4.358   1.769   3.018
  560    HA   LEU  65           HA       LEU  65   4.310   0.185   0.534
  561    HB2  LEU  65           2HB      LEU  65   1.863   0.741   2.170
  562    HB3  LEU  65           3HB      LEU  65   2.113  -0.494   0.938
  563    HG   LEU  65           HG       LEU  65   3.479  -0.531   3.624
  564   HD11  LEU  65          1HD1      LEU  65   1.809  -2.283   4.198
  565   HD12  LEU  65          2HD1      LEU  65   0.906  -1.833   2.752
  566   HD13  LEU  65          3HD1      LEU  65   1.127  -0.662   4.051
  567   HD21  LEU  65          3HD2      LEU  65   3.009  -2.752   1.643
  568   HD22  LEU  65          1HD2      LEU  65   4.012  -2.792   3.094
  569   HD23  LEU  65          2HD2      LEU  65   4.493  -1.800   1.717
  570    H    ILE  66           HN       ILE  66   3.779   1.247  -1.268
  571    HA   ILE  66           HA       ILE  66   2.712   3.978  -0.989
  572    HB   ILE  66           HB       ILE  66   4.397   2.818  -3.211
  573   HG12  ILE  66          2HG1      ILE  66   6.045   4.537  -2.419
  574   HG13  ILE  66          3HG1      ILE  66   4.992   4.842  -1.043
  575   HG21  ILE  66          1HG2      ILE  66   4.276   4.875  -4.322
  576   HG22  ILE  66          2HG2      ILE  66   2.617   4.542  -3.828
  577   HG23  ILE  66          3HG2      ILE  66   3.594   5.694  -2.918
  578   HD11  ILE  66          3HD1      ILE  66   5.765   3.076   0.055
  579   HD12  ILE  66          1HD1      ILE  66   5.612   2.028  -1.355
  580   HD13  ILE  66          2HD1      ILE  66   7.051   3.027  -1.150
  581    H    CYS  67           HN       CYS  67   0.551   3.754  -1.213
  582    HA   CYS  67           HA       CYS  67  -0.423   2.313  -3.591
  583    HB2  CYS  67           2HB      CYS  67  -2.125   2.975  -1.200
  584    HB3  CYS  67           3HB      CYS  67  -2.404   1.762  -2.443
  585    HG   CYS  67           HG       CYS  67   0.406   1.003  -0.988
  586    H    HIS  68           HN       HIS  68  -2.453   3.203  -4.529
  587    HA   HIS  68           HA       HIS  68  -2.385   6.146  -4.467
  588    HB2  HIS  68           2HB      HIS  68  -1.731   5.040  -6.623
  589    HB3  HIS  68           3HB      HIS  68  -3.365   4.390  -6.724
  590    HD2  HIS  68           2HD      HIS  68  -2.682   8.126  -5.729
  591    HE1  HIS  68           1HE      HIS  68  -4.636   8.028  -9.494
  592    HE2  HIS  68           2HE      HIS  68  -3.710   9.495  -7.668
  593    H    ILE  69           HN       ILE  69  -4.112   7.151  -3.688
  594    HA   ILE  69           HA       ILE  69  -6.523   5.623  -3.129
  595    HB   ILE  69           HB       ILE  69  -5.728   8.434  -2.370
  596   HG12  ILE  69          2HG1      ILE  69  -6.113   6.022  -0.597
  597   HG13  ILE  69          3HG1      ILE  69  -4.553   6.458  -1.286
  598   HG21  ILE  69          1HG2      ILE  69  -8.053   8.544  -2.480
  599   HG22  ILE  69          2HG2      ILE  69  -8.253   6.892  -1.898
  600   HG23  ILE  69          3HG2      ILE  69  -7.734   8.161  -0.788
  601   HD11  ILE  69          3HD1      ILE  69  -4.669   8.619  -0.138
  602   HD12  ILE  69          1HD1      ILE  69  -6.208   8.142   0.579
  603   HD13  ILE  69          2HD1      ILE  69  -4.735   7.260   0.983
  604    H    GLN  70           HN       GLN  70  -8.113   5.541  -4.560
  605    HA   GLN  70           HA       GLN  70  -8.418   7.739  -6.482
  606    HB2  GLN  70           2HB      GLN  70  -9.231   4.845  -6.528
  607    HB3  GLN  70           3HB      GLN  70  -9.959   6.010  -7.626
  608    HG2  GLN  70           2HG      GLN  70  -7.771   6.542  -8.540
  609    HG3  GLN  70           3HG      GLN  70  -7.017   5.412  -7.416
  610   HE21  GLN  70          1HE2      GLN  70  -6.388   4.933  -9.879
  611   HE22  GLN  70          2HE2      GLN  70  -7.268   3.609 -10.555
  612    H    ASP  71           HN       ASP  71  -9.698   9.239  -5.548
  613    HA   ASP  71           HA       ASP  71 -11.780   8.777  -3.747
  614    HB2  ASP  71           2HB      ASP  71 -11.226  11.061  -5.637
  615    HB3  ASP  71           3HB      ASP  71 -12.587  11.076  -4.518
  616    H    ARG  72           HN       ARG  72 -11.814   9.035  -7.274
  617    HA   ARG  72           HA       ARG  72 -14.379   9.203  -7.982
  618    HB2  ARG  72           2HB      ARG  72 -12.258   7.333  -8.991
  619    HB3  ARG  72           3HB      ARG  72 -13.871   7.310  -9.692
  620    HG2  ARG  72           2HG      ARG  72 -12.256   9.830  -9.484
  621    HG3  ARG  72           3HG      ARG  72 -12.122   8.728 -10.856
  622    HD2  ARG  72           2HD      ARG  72 -14.742   9.882  -9.929
  623    HD3  ARG  72           3HD      ARG  72 -13.720  10.672 -11.129
  624    HE   ARG  72           HE       ARG  72 -14.000   8.212 -12.162
  625   HH11  ARG  72          2HH1      ARG  72 -16.312  10.480 -10.886
  626   HH12  ARG  72          1HH1      ARG  72 -17.599   9.947 -11.916
  627   HH21  ARG  72          2HH2      ARG  72 -15.686   7.501 -13.523
  628   HH22  ARG  72          1HH2      ARG  72 -17.242   8.251 -13.415
  629    H    GLU  73           HN       GLU  73 -12.926   6.099  -6.989
  630    HA   GLU  73           HA       GLU  73 -15.613   5.227  -6.155
  631    HB2  GLU  73           2HB      GLU  73 -13.494   3.734  -7.671
  632    HB3  GLU  73           3HB      GLU  73 -14.666   2.867  -6.688
  633    HG2  GLU  73           2HG      GLU  73 -15.478   4.823  -8.813
  634    HG3  GLU  73           3HG      GLU  73 -15.196   3.116  -9.146
  635    H    ALA  74           HN       ALA  74 -13.173   6.423  -4.772
  636    HA   ALA  74           HA       ALA  74 -11.892   6.092  -2.898
  637    HB1  ALA  74           1HB      ALA  74 -13.380   4.834  -1.096
  638    HB2  ALA  74           2HB      ALA  74 -13.720   6.488  -1.605
  639    HB3  ALA  74           3HB      ALA  74 -14.637   5.148  -2.292
  640    H    THR  75           HN       THR  75 -10.986   4.338  -4.683
  641    HA   THR  75           HA       THR  75 -10.764   1.792  -3.213
  642    HB   THR  75           HB       THR  75 -10.535   2.309  -6.182
  643    HG1  THR  75           1HG      THR  75 -12.453   1.198  -4.483
  644   HG21  THR  75          3HG2      THR  75  -8.834   0.681  -5.335
  645   HG22  THR  75          1HG2      THR  75  -9.991  -0.009  -6.472
  646   HG23  THR  75          2HG2      THR  75 -10.162  -0.317  -4.744
  647    H    VAL  76           HN       VAL  76  -8.812   1.208  -2.497
  648    HA   VAL  76           HA       VAL  76  -6.526   2.902  -3.186
  649    HB   VAL  76           HB       VAL  76  -6.698   0.813  -1.013
  650   HG11  VAL  76          1HG1      VAL  76  -4.506   1.166  -0.870
  651   HG12  VAL  76          2HG1      VAL  76  -4.579   2.487  -2.038
  652   HG13  VAL  76          3HG1      VAL  76  -4.878   2.802  -0.328
  653   HG21  VAL  76          3HG2      VAL  76  -7.707   2.262   0.364
  654   HG22  VAL  76          1HG2      VAL  76  -6.728   3.616  -0.201
  655   HG23  VAL  76          2HG2      VAL  76  -8.164   3.130  -1.102
  656    H    LEU  77           HN       LEU  77  -4.816   2.191  -4.312
  657    HA   LEU  77           HA       LEU  77  -4.606  -0.695  -4.854
  658    HB2  LEU  77           2HB      LEU  77  -5.525   0.284  -6.824
  659    HB3  LEU  77           3HB      LEU  77  -4.348   1.595  -6.790
  660    HG   LEU  77           HG       LEU  77  -2.626  -0.366  -7.091
  661   HD11  LEU  77          1HD1      LEU  77  -3.376  -2.359  -7.777
  662   HD12  LEU  77          2HD1      LEU  77  -4.647  -1.650  -8.772
  663   HD13  LEU  77          3HD1      LEU  77  -4.900  -1.865  -7.040
  664   HD21  LEU  77          3HD2      LEU  77  -4.356   0.543  -9.386
  665   HD22  LEU  77          1HD2      LEU  77  -2.680   0.001  -9.463
  666   HD23  LEU  77          2HD2      LEU  77  -3.081   1.514  -8.649
  667    H    VAL  78           HN       VAL  78  -2.748  -1.460  -4.119
  668    HA   VAL  78           HA       VAL  78  -0.603   0.199  -3.285
  669    HB   VAL  78           HB       VAL  78  -0.478  -2.776  -3.776
  670   HG11  VAL  78          1HG1      VAL  78   0.977  -1.296  -1.628
  671   HG12  VAL  78          2HG1      VAL  78   1.390  -2.817  -2.421
  672   HG13  VAL  78          3HG1      VAL  78   1.604  -1.289  -3.276
  673   HG21  VAL  78          3HG2      VAL  78  -2.222  -1.429  -2.052
  674   HG22  VAL  78          1HG2      VAL  78  -1.834  -3.150  -2.054
  675   HG23  VAL  78          2HG2      VAL  78  -0.922  -2.041  -1.029
  676    H    LEU  79           HN       LEU  79   0.770   1.204  -4.587
  677    HA   LEU  79           HA       LEU  79   1.223   0.284  -7.289
  678    HB2  LEU  79           2HB      LEU  79   2.017   2.681  -5.695
  679    HB3  LEU  79           3HB      LEU  79   2.871   2.309  -7.191
  680    HG   LEU  79           HG       LEU  79   0.963   3.996  -7.306
  681   HD11  LEU  79          1HD1      LEU  79   2.055   2.590  -9.193
  682   HD12  LEU  79          2HD1      LEU  79   0.544   3.442  -9.509
  683   HD13  LEU  79          3HD1      LEU  79   0.526   1.710  -9.181
  684   HD21  LEU  79          3HD2      LEU  79  -1.269   2.835  -7.694
  685   HD22  LEU  79          1HD2      LEU  79  -0.731   2.997  -6.022
  686   HD23  LEU  79          2HD2      LEU  79  -0.569   1.450  -6.855
  687    H    ARG  80           HN       ARG  80   3.339   1.022  -4.510
  688    HA   ARG  80           HA       ARG  80   5.161  -1.084  -5.463
  689    HB2  ARG  80           2HB      ARG  80   5.987   1.263  -5.931
  690    HB3  ARG  80           3HB      ARG  80   6.077   1.494  -4.190
  691    HG2  ARG  80           2HG      ARG  80   8.244   0.920  -4.775
  692    HG3  ARG  80           3HG      ARG  80   7.563  -0.602  -4.197
  693    HD2  ARG  80           2HD      ARG  80   7.375  -1.476  -6.346
  694    HD3  ARG  80           3HD      ARG  80   7.456   0.115  -7.102
  695    HE   ARG  80           HE       ARG  80   9.745  -0.018  -7.067
  696   HH11  ARG  80          2HH1      ARG  80   8.413  -2.483  -5.000
  697   HH12  ARG  80          1HH1      ARG  80   9.933  -3.277  -4.750
  698   HH21  ARG  80          2HH2      ARG  80  11.751  -1.055  -6.745
  699   HH22  ARG  80          1HH2      ARG  80  11.831  -2.464  -5.742
  700    H    VAL  81           HN       VAL  81   6.438  -2.103  -3.819
  701    HA   VAL  81           HA       VAL  81   5.612  -1.627  -1.053
  702    HB   VAL  81           HB       VAL  81   4.116  -3.390  -1.935
  703   HG11  VAL  81          1HG1      VAL  81   6.272  -5.395  -2.025
  704   HG12  VAL  81          2HG1      VAL  81   4.818  -5.242  -3.014
  705   HG13  VAL  81          3HG1      VAL  81   6.234  -4.252  -3.367
  706   HG21  VAL  81          3HG2      VAL  81   4.430  -4.952  -0.118
  707   HG22  VAL  81          1HG2      VAL  81   6.105  -4.435   0.078
  708   HG23  VAL  81          2HG2      VAL  81   4.789  -3.320   0.445
  709    H    GLY  82           HN       GLY  82   7.412  -1.381   0.088
  710    HA2  GLY  82           1HA      GLY  82   9.542  -3.327  -0.091
  711    HA3  GLY  82           2HA      GLY  82   9.989  -1.723  -0.653
  712    H    HIS  83           HN       HIS  83  11.160  -3.085   1.552
  713    HA   HIS  83           HA       HIS  83  10.100  -2.204   4.024
  714    HB2  HIS  83           2HB      HIS  83  11.749  -4.073   3.728
  715    HB3  HIS  83           3HB      HIS  83  12.986  -2.862   3.408
  716    HD2  HIS  83           2HD      HIS  83  11.925  -4.886   6.286
  717    HE1  HIS  83           1HE      HIS  83  13.192  -1.224   8.015
  718    HE2  HIS  83           2HE      HIS  83  12.684  -3.656   8.431
  719    H    ALA  84           HN       ALA  84  10.883  -0.558   5.426
  720    HA   ALA  84           HA       ALA  84  11.031   1.969   4.450
  721    HB1  ALA  84           1HB      ALA  84  11.764   2.690   6.563
  722    HB2  ALA  84           2HB      ALA  84  10.852   1.212   6.871
  723    HB3  ALA  84           3HB      ALA  84  12.615   1.177   6.876
  724    H    ARG  85           HN       ARG  85  13.954   0.319   5.663
  725    HA   ARG  85           HA       ARG  85  15.894   1.988   4.835
  726    HB2  ARG  85           2HB      ARG  85  17.398   0.100   4.663
  727    HB3  ARG  85           3HB      ARG  85  16.282  -0.166   5.995
  728    HG2  ARG  85           2HG      ARG  85  16.199  -2.219   5.040
  729    HG3  ARG  85           3HG      ARG  85  14.920  -1.434   4.111
  730    HD2  ARG  85           2HD      ARG  85  16.316  -2.595   2.569
  731    HD3  ARG  85           3HD      ARG  85  16.639  -0.872   2.383
  732    HE   ARG  85           HE       ARG  85  18.789  -1.248   3.052
  733   HH11  ARG  85          2HH1      ARG  85  16.825  -3.963   3.996
  734   HH12  ARG  85          1HH1      ARG  85  18.169  -4.914   4.537
  735   HH21  ARG  85          2HH2      ARG  85  20.567  -2.490   3.761
  736   HH22  ARG  85          1HH2      ARG  85  20.297  -4.075   4.404
  737    H    ASP  86           HN       ASP  86  14.016  -0.138   2.773
  738    HA   ASP  86           HA       ASP  86  15.597   0.340   0.426
  739    HB2  ASP  86           2HB      ASP  86  14.208  -1.722   0.817
  740    HB3  ASP  86           3HB      ASP  86  12.774  -0.730   0.568
  741    H    VAL  87           HN       VAL  87  12.140   1.033   0.929
  742    HA   VAL  87           HA       VAL  87  11.990   2.999  -1.062
  743    HB   VAL  87           HB       VAL  87  10.233   2.570   1.357
  744   HG11  VAL  87          1HG1      VAL  87   9.984   4.852   0.579
  745   HG12  VAL  87          2HG1      VAL  87   9.764   4.288  -1.079
  746   HG13  VAL  87          3HG1      VAL  87   8.556   3.910   0.151
  747   HG21  VAL  87          3HG2      VAL  87  10.469   1.295  -1.250
  748   HG22  VAL  87          1HG2      VAL  87   9.628   0.755   0.204
  749   HG23  VAL  87          2HG2      VAL  87   8.836   1.869  -0.911
  750    H    TYR  88           HN       TYR  88  11.640   5.294  -0.838
  751    HA   TYR  88           HA       TYR  88  13.622   6.696   0.385
  752    HB2  TYR  88           2HB      TYR  88  10.797   7.591  -0.204
  753    HB3  TYR  88           3HB      TYR  88  12.085   8.691   0.272
  754    HD1  TYR  88           1HD      TYR  88  14.375   8.018  -1.212
  755    HD2  TYR  88           2HD      TYR  88  10.312   7.757  -2.446
  756    HE1  TYR  88           1HE      TYR  88  15.082   8.211  -3.560
  757    HE2  TYR  88           2HE      TYR  88  11.008   7.948  -4.797
  758    HH   TYR  88           HH       TYR  88  14.197   8.833  -5.704
  759    H    ARG  89           HN       ARG  89  13.669   8.134   2.231
  760    HA   ARG  89           HA       ARG  89  13.314   7.011   4.654
  761    HB2  ARG  89           2HB      ARG  89  13.220   9.885   3.806
  762    HB3  ARG  89           3HB      ARG  89  12.963   9.460   5.492
  763    HG2  ARG  89           2HG      ARG  89  15.126   8.643   5.746
  764    HG3  ARG  89           3HG      ARG  89  15.365   8.473   4.005
  765    HD2  ARG  89           2HD      ARG  89  14.877  11.172   5.196
  766    HD3  ARG  89           3HD      ARG  89  16.482  10.447   5.286
  767    HE   ARG  89           HE       ARG  89  15.539  10.311   2.638
  768   HH11  ARG  89          2HH1      ARG  89  16.675  12.619   4.984
  769   HH12  ARG  89          1HH1      ARG  89  17.290  13.720   3.796
  770   HH21  ARG  89          2HH2      ARG  89  16.345  11.753   1.065
  771   HH22  ARG  89          1HH2      ARG  89  17.101  13.226   1.567
  Start of MODEL    7
    1    H1   MET   1           HN       MET   1 -19.066   0.501   4.525
    2    HA   MET   1           HA       MET   1 -18.343  -2.316   4.076
    3    HB2  MET   1           2HB      MET   1 -18.897  -0.236   1.953
    4    HB3  MET   1           3HB      MET   1 -18.248  -1.841   1.643
    5    HG2  MET   1           2HG      MET   1 -20.942  -1.230   2.837
    6    HG3  MET   1           3HG      MET   1 -20.633  -1.725   1.175
    7    HE1  MET   1           3HE      MET   1 -21.532  -5.195   1.409
    8    HE2  MET   1           1HE      MET   1 -22.644  -3.974   2.027
    9    HE3  MET   1           2HE      MET   1 -21.610  -3.606   0.647
   10    H    GLY   2           HN       GLY   2 -17.431   1.056   3.365
   11    HA2  GLY   2           1HA      GLY   2 -15.350   2.043   3.792
   12    HA3  GLY   2           2HA      GLY   2 -14.690   0.450   4.131
   13    H    TYR   3           HN       TYR   3 -13.124   2.023   2.692
   14    HA   TYR   3           HA       TYR   3 -13.539   2.004  -0.100
   15    HB2  TYR   3           2HB      TYR   3 -11.126   2.376   1.649
   16    HB3  TYR   3           3HB      TYR   3 -10.953   2.284  -0.100
   17    HD1  TYR   3           2HD      TYR   3 -13.416   3.962   2.163
   18    HD2  TYR   3           1HD      TYR   3 -10.594   4.377  -0.994
   19    HE1  TYR   3           2HE      TYR   3 -13.972   6.351   1.988
   20    HE2  TYR   3           1HE      TYR   3 -11.141   6.768  -1.176
   21    HH   TYR   3           HH       TYR   3 -12.150   8.515  -0.076
   22    H    ARG   4           HN       ARG   4 -12.262   0.805  -1.692
   23    HA   ARG   4           HA       ARG   4 -12.192  -2.019  -1.005
   24    HB2  ARG   4           2HB      ARG   4 -13.321  -1.315  -3.068
   25    HB3  ARG   4           3HB      ARG   4 -11.816  -0.628  -3.663
   26    HG2  ARG   4           2HG      ARG   4 -11.770  -2.623  -4.744
   27    HG3  ARG   4           3HG      ARG   4 -10.947  -3.090  -3.254
   28    HD2  ARG   4           2HD      ARG   4 -13.922  -3.344  -3.567
   29    HD3  ARG   4           3HD      ARG   4 -12.822  -4.609  -4.114
   30    HE   ARG   4           HE       ARG   4 -12.063  -4.157  -1.546
   31   HH11  ARG   4          2HH1      ARG   4 -15.095  -4.912  -3.082
   32   HH12  ARG   4          1HH1      ARG   4 -15.726  -5.764  -1.711
   33   HH21  ARG   4          2HH2      ARG   4 -12.883  -5.276   0.265
   34   HH22  ARG   4          1HH2      ARG   4 -14.468  -5.969   0.192
   35    H    ILE   5           HN       ILE   5 -10.399  -3.329  -1.109
   36    HA   ILE   5           HA       ILE   5  -7.820  -1.921  -1.164
   37    HB   ILE   5           HB       ILE   5  -8.397  -4.657  -0.030
   38   HG12  ILE   5          2HG1      ILE   5  -9.646  -2.982   1.221
   39   HG13  ILE   5          3HG1      ILE   5  -8.286  -3.551   2.182
   40   HG21  ILE   5          1HG2      ILE   5  -5.992  -3.385  -0.675
   41   HG22  ILE   5          2HG2      ILE   5  -6.138  -3.267   1.077
   42   HG23  ILE   5          3HG2      ILE   5  -6.207  -4.844   0.291
   43   HD11  ILE   5          3HD1      ILE   5  -8.253  -1.013   0.571
   44   HD12  ILE   5          1HD1      ILE   5  -8.682  -1.098   2.280
   45   HD13  ILE   5          2HD1      ILE   5  -7.061  -1.554   1.754
   46    H    GLU   6           HN       GLU   6  -7.096  -1.971  -3.221
   47    HA   GLU   6           HA       GLU   6  -7.026  -4.587  -4.576
   48    HB2  GLU   6           2HB      GLU   6  -7.094  -1.799  -5.738
   49    HB3  GLU   6           3HB      GLU   6  -6.808  -3.250  -6.689
   50    HG2  GLU   6           2HG      GLU   6  -9.290  -2.650  -5.096
   51    HG3  GLU   6           3HG      GLU   6  -9.122  -2.516  -6.846
   52    H    PHE   7           HN       PHE   7  -5.153  -4.882  -6.061
   53    HA   PHE   7           HA       PHE   7  -2.745  -3.456  -5.184
   54    HB2  PHE   7           2HB      PHE   7  -3.237  -6.416  -5.075
   55    HB3  PHE   7           3HB      PHE   7  -1.605  -5.796  -5.303
   56    HD1  PHE   7           1HD      PHE   7  -4.556  -5.424  -3.063
   57    HD2  PHE   7           2HD      PHE   7  -0.320  -5.292  -3.456
   58    HE1  PHE   7           1HE      PHE   7  -4.344  -5.108  -0.632
   59    HE2  PHE   7           2HE      PHE   7  -0.101  -4.977  -1.026
   60    HZ   PHE   7           HZ       PHE   7  -2.114  -4.885   0.390
   61    H    ASP   8           HN       ASP   8  -1.099  -3.323  -6.708
   62    HA   ASP   8           HA       ASP   8  -1.953  -3.544  -9.440
   63    HB2  ASP   8           2HB      ASP   8   0.410  -2.437  -8.011
   64    HB3  ASP   8           3HB      ASP   8   0.621  -2.871  -9.705
   65    HA   PRO   9           HA       PRO   9  -0.224  -7.399 -10.612
   66    HB2  PRO   9           2HB      PRO   9   0.834  -6.861 -13.054
   67    HB3  PRO   9           3HB      PRO   9  -0.907  -6.951 -12.760
   68    HG2  PRO   9           2HG      PRO   9   0.859  -4.542 -12.958
   69    HG3  PRO   9           3HG      PRO   9  -0.755  -4.805 -13.643
   70    HD2  PRO   9           2HD      PRO   9  -0.349  -3.375 -11.380
   71    HD3  PRO   9           3HD      PRO   9  -1.815  -4.340 -11.651
   72    H    ARG  10           HN       ARG  10   1.795  -4.690 -10.160
   73    HA   ARG  10           HA       ARG  10   4.252  -6.227 -10.546
   74    HB2  ARG  10           2HB      ARG  10   5.412  -4.098 -10.210
   75    HB3  ARG  10           3HB      ARG  10   4.186  -3.959 -11.463
   76    HG2  ARG  10           2HG      ARG  10   2.683  -3.097  -9.526
   77    HG3  ARG  10           3HG      ARG  10   4.223  -2.801  -8.716
   78    HD2  ARG  10           2HD      ARG  10   3.868  -1.854 -11.517
   79    HD3  ARG  10           3HD      ARG  10   3.086  -0.958 -10.216
   80    HE   ARG  10           HE       ARG  10   5.157  -0.250  -9.484
   81   HH11  ARG  10          2HH1      ARG  10   5.520  -2.692 -11.939
   82   HH12  ARG  10          1HH1      ARG  10   7.219  -2.421 -12.142
   83   HH21  ARG  10          2HH2      ARG  10   7.393   0.116  -9.742
   84   HH22  ARG  10          1HH2      ARG  10   8.284  -0.824 -10.890
   85    H    ALA  11           HN       ALA  11   2.674  -4.272  -8.022
   86    HA   ALA  11           HA       ALA  11   4.483  -4.854  -5.963
   87    HB1  ALA  11           1HB      ALA  11   2.523  -4.263  -4.456
   88    HB2  ALA  11           2HB      ALA  11   3.027  -3.040  -5.624
   89    HB3  ALA  11           3HB      ALA  11   1.596  -4.023  -5.937
   90    H    GLU  12           HN       GLU  12   1.566  -6.529  -7.042
   91    HA   GLU  12           HA       GLU  12   1.093  -8.303  -5.034
   92    HB2  GLU  12           2HB      GLU  12   0.117  -8.056  -7.500
   93    HB3  GLU  12           3HB      GLU  12   1.168  -9.435  -7.788
   94    HG2  GLU  12           2HG      GLU  12  -0.671  -9.509  -5.454
   95    HG3  GLU  12           3HG      GLU  12  -1.335  -9.748  -7.069
   96    H    LYS  13           HN       LYS  13   3.530  -8.669  -7.593
   97    HA   LYS  13           HA       LYS  13   4.535 -11.136  -6.546
   98    HB2  LYS  13           2HB      LYS  13   5.571  -9.209  -8.624
   99    HB3  LYS  13           3HB      LYS  13   6.431 -10.677  -8.178
  100    HG2  LYS  13           2HG      LYS  13   3.576 -10.898  -8.977
  101    HG3  LYS  13           3HG      LYS  13   4.790 -10.617 -10.228
  102    HD2  LYS  13           2HD      LYS  13   5.913 -12.623  -9.738
  103    HD3  LYS  13           3HD      LYS  13   5.089 -12.803  -8.187
  104    HE2  LYS  13           2HE      LYS  13   3.645 -12.871 -10.827
  105    HE3  LYS  13           3HE      LYS  13   4.305 -14.315 -10.061
  106    HZ1  LYS  13           3HZ      LYS  13   2.529 -14.430  -8.769
  107    HZ2  LYS  13           1HZ      LYS  13   1.854 -13.103  -9.573
  108    HZ3  LYS  13           2HZ      LYS  13   2.787 -12.865  -8.183
  109    H    GLU  14           HN       GLU  14   5.639  -7.764  -6.493
  110    HA   GLU  14           HA       GLU  14   8.077  -8.090  -5.232
  111    HB2  GLU  14           2HB      GLU  14   6.082  -5.845  -4.884
  112    HB3  GLU  14           3HB      GLU  14   7.768  -5.777  -4.391
  113    HG2  GLU  14           2HG      GLU  14   6.806  -6.173  -7.214
  114    HG3  GLU  14           3HG      GLU  14   7.350  -4.644  -6.527
  115    H    LEU  15           HN       LEU  15   4.845  -7.986  -3.833
  116    HA   LEU  15           HA       LEU  15   5.782  -8.033  -1.121
  117    HB2  LEU  15           2HB      LEU  15   3.685  -7.018  -1.471
  118    HB3  LEU  15           3HB      LEU  15   3.092  -8.389  -2.407
  119    HG   LEU  15           HG       LEU  15   3.776  -8.833   0.455
  120   HD11  LEU  15          1HD1      LEU  15   2.496  -6.718   0.423
  121   HD12  LEU  15          2HD1      LEU  15   1.631  -8.041   1.203
  122   HD13  LEU  15          3HD1      LEU  15   1.198  -7.550  -0.434
  123   HD21  LEU  15          3HD2      LEU  15   1.606  -9.850  -1.377
  124   HD22  LEU  15          1HD2      LEU  15   1.874 -10.369   0.287
  125   HD23  LEU  15          2HD2      LEU  15   3.091 -10.699  -0.946
  126    H    GLU  16           HN       GLU  16   4.378 -10.412  -3.348
  127    HA   GLU  16           HA       GLU  16   4.135 -12.592  -1.704
  128    HB2  GLU  16           2HB      GLU  16   4.840 -12.310  -4.600
  129    HB3  GLU  16           3HB      GLU  16   4.875 -13.901  -3.854
  130    HG2  GLU  16           2HG      GLU  16   2.502 -12.053  -3.954
  131    HG3  GLU  16           3HG      GLU  16   2.751 -13.479  -4.959
  132    H    LYS  17           HN       LYS  17   7.061 -11.288  -3.155
  133    HA   LYS  17           HA       LYS  17   8.801 -13.407  -2.560
  134    HB2  LYS  17           2HB      LYS  17   9.118 -10.507  -3.160
  135    HB3  LYS  17           3HB      LYS  17  10.495 -11.351  -2.464
  136    HG2  LYS  17           2HG      LYS  17  10.822 -12.641  -4.318
  137    HG3  LYS  17           3HG      LYS  17   9.124 -12.581  -4.795
  138    HD2  LYS  17           2HD      LYS  17  10.030 -11.203  -6.382
  139    HD3  LYS  17           3HD      LYS  17   9.666 -10.019  -5.124
  140    HE2  LYS  17           2HE      LYS  17  12.335 -11.388  -5.357
  141    HE3  LYS  17           3HE      LYS  17  11.965  -9.875  -6.182
  142    HZ1  LYS  17           3HZ      LYS  17  11.233  -9.199  -3.762
  143    HZ2  LYS  17           1HZ      LYS  17  12.843  -9.068  -4.268
  144    HZ3  LYS  17           2HZ      LYS  17  12.356 -10.390  -3.332
  145    H    LEU  18           HN       LEU  18   7.765 -10.625  -0.654
  146    HA   LEU  18           HA       LEU  18   9.542 -10.764   1.458
  147    HB2  LEU  18           2HB      LEU  18   6.607 -10.083   1.498
  148    HB3  LEU  18           3HB      LEU  18   7.720  -9.778   2.829
  149    HG   LEU  18           HG       LEU  18   8.123  -8.587   0.097
  150   HD11  LEU  18          1HD1      LEU  18   6.582  -7.017   0.434
  151   HD12  LEU  18          2HD1      LEU  18   7.073  -6.783   2.111
  152   HD13  LEU  18          3HD1      LEU  18   5.933  -8.063   1.696
  153   HD21  LEU  18          3HD2      LEU  18  10.036  -7.974   1.057
  154   HD22  LEU  18          1HD2      LEU  18   9.498  -8.513   2.647
  155   HD23  LEU  18          2HD2      LEU  18   9.075  -6.899   2.074
  156    H    ASP  19           HN       ASP  19   8.792 -11.403   3.775
  157    HA   ASP  19           HA       ASP  19   8.587 -14.230   3.830
  158    HB2  ASP  19           2HB      ASP  19   9.677 -12.599   5.543
  159    HB3  ASP  19           3HB      ASP  19   8.058 -12.509   6.232
  160    H    ARG  20           HN       ARG  20   6.941 -15.459   5.020
  161    HA   ARG  20           HA       ARG  20   4.349 -14.932   4.028
  162    HB2  ARG  20           2HB      ARG  20   4.990 -17.204   4.401
  163    HB3  ARG  20           3HB      ARG  20   5.370 -16.884   6.088
  164    HG2  ARG  20           2HG      ARG  20   3.343 -17.952   6.249
  165    HG3  ARG  20           3HG      ARG  20   2.858 -16.255   6.265
  166    HD2  ARG  20           2HD      ARG  20   2.471 -16.412   3.810
  167    HD3  ARG  20           3HD      ARG  20   2.803 -18.141   3.914
  168    HE   ARG  20           HE       ARG  20   0.839 -17.775   5.738
  169   HH11  ARG  20          2HH1      ARG  20   1.181 -16.919   2.381
  170   HH12  ARG  20          1HH1      ARG  20  -0.515 -17.027   2.046
  171   HH21  ARG  20          2HH2      ARG  20  -1.397 -17.922   5.309
  172   HH22  ARG  20          1HH2      ARG  20  -1.981 -17.597   3.713
  173    H    GLU  21           HN       GLU  21   5.607 -14.890   7.366
  174    HA   GLU  21           HA       GLU  21   3.302 -14.006   8.634
  175    HB2  GLU  21           2HB      GLU  21   5.519 -14.797   9.657
  176    HB3  GLU  21           3HB      GLU  21   6.060 -13.134   9.470
  177    HG2  GLU  21           2HG      GLU  21   3.934 -12.519  10.778
  178    HG3  GLU  21           3HG      GLU  21   3.903 -14.222  11.232
  179    H    VAL  22           HN       VAL  22   5.885 -12.134   7.104
  180    HA   VAL  22           HA       VAL  22   4.936  -9.582   7.857
  181    HB   VAL  22           HB       VAL  22   6.641 -10.394   5.499
  182   HG11  VAL  22          1HG1      VAL  22   5.809  -7.712   6.537
  183   HG12  VAL  22          2HG1      VAL  22   7.352  -7.919   5.705
  184   HG13  VAL  22          3HG1      VAL  22   5.842  -8.304   4.876
  185   HG21  VAL  22          3HG2      VAL  22   8.436  -9.358   6.994
  186   HG22  VAL  22          1HG2      VAL  22   7.258  -9.499   8.298
  187   HG23  VAL  22          2HG2      VAL  22   7.816 -10.943   7.454
  188    H    ALA  23           HN       ALA  23   4.672 -11.303   4.741
  189    HA   ALA  23           HA       ALA  23   3.152  -9.548   3.315
  190    HB1  ALA  23           1HB      ALA  23   3.136 -12.545   3.377
  191    HB2  ALA  23           2HB      ALA  23   2.096 -11.643   2.274
  192    HB3  ALA  23           3HB      ALA  23   3.848 -11.463   2.181
  193    H    ARG  24           HN       ARG  24   1.941 -11.964   5.624
  194    HA   ARG  24           HA       ARG  24  -0.792 -11.376   5.294
  195    HB2  ARG  24           2HB      ARG  24   0.070 -13.434   6.370
  196    HB3  ARG  24           3HB      ARG  24   0.603 -12.472   7.742
  197    HG2  ARG  24           2HG      ARG  24  -1.922 -11.739   7.787
  198    HG3  ARG  24           3HG      ARG  24  -2.141 -13.267   6.932
  199    HD2  ARG  24           2HD      ARG  24  -0.446 -13.256   9.373
  200    HD3  ARG  24           3HD      ARG  24  -2.192 -13.119   9.576
  201    HE   ARG  24           HE       ARG  24  -1.359 -15.274   7.853
  202   HH11  ARG  24          2HH1      ARG  24  -2.063 -14.296  11.119
  203   HH12  ARG  24          1HH1      ARG  24  -2.401 -15.905  11.667
  204   HH21  ARG  24          2HH2      ARG  24  -1.801 -17.397   8.562
  205   HH22  ARG  24          1HH2      ARG  24  -2.250 -17.668  10.212
  206    H    ARG  25           HN       ARG  25   1.594 -10.208   7.652
  207    HA   ARG  25           HA       ARG  25  -0.065  -8.651   9.231
  208    HB2  ARG  25           2HB      ARG  25   2.143  -8.935   9.987
  209    HB3  ARG  25           3HB      ARG  25   2.829  -8.386   8.463
  210    HG2  ARG  25           2HG      ARG  25   2.170  -6.117   8.930
  211    HG3  ARG  25           3HG      ARG  25   1.333  -6.629  10.397
  212    HD2  ARG  25           2HD      ARG  25   4.296  -6.822   9.866
  213    HD3  ARG  25           3HD      ARG  25   3.500  -5.669  10.937
  214    HE   ARG  25           HE       ARG  25   3.254  -7.333  12.517
  215   HH11  ARG  25          2HH1      ARG  25   4.383  -8.683   9.514
  216   HH12  ARG  25          1HH1      ARG  25   4.766 -10.227  10.201
  217   HH21  ARG  25          2HH2      ARG  25   3.754  -9.361  13.434
  218   HH22  ARG  25          1HH2      ARG  25   4.407 -10.611  12.430
  219    H    ILE  26           HN       ILE  26   1.528  -7.830   6.180
  220    HA   ILE  26           HA       ILE  26   0.794  -5.112   6.119
  221    HB   ILE  26           HB       ILE  26   1.366  -7.002   3.834
  222   HG12  ILE  26          2HG1      ILE  26   3.123  -4.915   5.140
  223   HG13  ILE  26          3HG1      ILE  26   3.207  -6.640   5.480
  224   HG21  ILE  26          1HG2      ILE  26   1.979  -4.484   2.954
  225   HG22  ILE  26          2HG2      ILE  26   0.513  -5.378   2.555
  226   HG23  ILE  26          3HG2      ILE  26   0.502  -4.214   3.880
  227   HD11  ILE  26          3HD1      ILE  26   3.413  -5.907   2.645
  228   HD12  ILE  26          1HD1      ILE  26   4.742  -5.372   3.672
  229   HD13  ILE  26          2HD1      ILE  26   4.326  -7.084   3.589
  230    H    LEU  27           HN       LEU  27  -0.609  -7.803   4.235
  231    HA   LEU  27           HA       LEU  27  -2.781  -6.486   3.186
  232    HB2  LEU  27           2HB      LEU  27  -2.560  -9.346   4.104
  233    HB3  LEU  27           3HB      LEU  27  -3.900  -8.722   3.144
  234    HG   LEU  27           HG       LEU  27  -1.034  -8.657   2.217
  235   HD11  LEU  27          1HD1      LEU  27  -1.467 -10.639   0.945
  236   HD12  LEU  27          2HD1      LEU  27  -3.137 -10.693   1.507
  237   HD13  LEU  27          3HD1      LEU  27  -1.817 -10.978   2.640
  238   HD21  LEU  27          3HD2      LEU  27  -3.700  -8.104   0.963
  239   HD22  LEU  27          1HD2      LEU  27  -2.310  -8.573  -0.017
  240   HD23  LEU  27          2HD2      LEU  27  -2.242  -7.110   0.966
  241    H    ARG  28           HN       ARG  28  -2.535  -8.100   6.332
  242    HA   ARG  28           HA       ARG  28  -5.213  -7.700   7.115
  243    HB2  ARG  28           2HB      ARG  28  -2.668  -8.380   8.505
  244    HB3  ARG  28           3HB      ARG  28  -4.015  -7.826   9.491
  245    HG2  ARG  28           2HG      ARG  28  -5.398  -9.623   8.724
  246    HG3  ARG  28           3HG      ARG  28  -4.179 -10.117   7.548
  247    HD2  ARG  28           2HD      ARG  28  -3.919 -11.616   9.326
  248    HD3  ARG  28           3HD      ARG  28  -2.630 -10.435   9.552
  249    HE   ARG  28           HE       ARG  28  -5.049  -9.833  10.993
  250   HH11  ARG  28          2HH1      ARG  28  -2.001 -11.514  11.057
  251   HH12  ARG  28          1HH1      ARG  28  -1.911 -11.553  12.787
  252   HH21  ARG  28          2HH2      ARG  28  -4.941  -9.878  13.271
  253   HH22  ARG  28          1HH2      ARG  28  -3.584 -10.623  14.045
  254    H    PHE  29           HN       PHE  29  -2.269  -5.808   7.706
  255    HA   PHE  29           HA       PHE  29  -3.342  -3.866   9.381
  256    HB2  PHE  29           2HB      PHE  29  -1.007  -3.845   9.175
  257    HB3  PHE  29           3HB      PHE  29  -1.069  -3.841   7.415
  258    HD1  PHE  29           1HD      PHE  29  -1.615  -1.775  10.426
  259    HD2  PHE  29           2HD      PHE  29  -1.117  -1.825   6.199
  260    HE1  PHE  29           1HE      PHE  29  -1.371   0.673  10.429
  261    HE2  PHE  29           2HE      PHE  29  -0.872   0.623   6.196
  262    HZ   PHE  29           HZ       PHE  29  -0.998   1.876   8.313
  263    H    LEU  30           HN       LEU  30  -3.500  -4.191   5.897
  264    HA   LEU  30           HA       LEU  30  -4.738  -1.581   5.579
  265    HB2  LEU  30           2HB      LEU  30  -4.072  -3.770   3.622
  266    HB3  LEU  30           3HB      LEU  30  -4.866  -2.263   3.172
  267    HG   LEU  30           HG       LEU  30  -2.235  -2.139   4.571
  268   HD11  LEU  30          1HD1      LEU  30  -1.357  -2.087   2.080
  269   HD12  LEU  30          2HD1      LEU  30  -2.715  -3.184   1.833
  270   HD13  LEU  30          3HD1      LEU  30  -1.454  -3.590   2.998
  271   HD21  LEU  30          3HD2      LEU  30  -4.012  -0.371   3.161
  272   HD22  LEU  30          1HD2      LEU  30  -2.414  -0.366   2.415
  273   HD23  LEU  30          2HD2      LEU  30  -2.588   0.009   4.130
  274    H    ARG  31           HN       ARG  31  -5.650  -4.903   5.890
  275    HA   ARG  31           HA       ARG  31  -8.358  -4.412   4.936
  276    HB2  ARG  31           2HB      ARG  31  -6.916  -6.881   5.890
  277    HB3  ARG  31           3HB      ARG  31  -8.646  -6.867   5.575
  278    HG2  ARG  31           2HG      ARG  31  -8.368  -6.627   3.301
  279    HG3  ARG  31           3HG      ARG  31  -6.757  -5.927   3.467
  280    HD2  ARG  31           2HD      ARG  31  -6.653  -8.197   2.570
  281    HD3  ARG  31           3HD      ARG  31  -5.874  -8.094   4.148
  282    HE   ARG  31           HE       ARG  31  -7.508  -9.466   5.022
  283   HH11  ARG  31          2HH1      ARG  31  -8.378  -8.473   1.801
  284   HH12  ARG  31          1HH1      ARG  31  -9.685  -9.603   1.666
  285   HH21  ARG  31          2HH2      ARG  31  -9.226 -10.957   4.856
  286   HH22  ARG  31          1HH2      ARG  31 -10.167 -11.014   3.404
  287    H    GLU  32           HN       GLU  32  -6.665  -4.042   7.779
  288    HA   GLU  32           HA       GLU  32  -9.093  -4.405   9.409
  289    HB2  GLU  32           2HB      GLU  32  -6.178  -4.674  10.092
  290    HB3  GLU  32           3HB      GLU  32  -7.381  -4.390  11.342
  291    HG2  GLU  32           2HG      GLU  32  -7.058  -6.766   9.554
  292    HG3  GLU  32           3HG      GLU  32  -7.097  -6.699  11.315
  293    H    ARG  33           HN       ARG  33  -6.081  -2.516   9.679
  294    HA   ARG  33           HA       ARG  33  -7.251  -0.386  11.079
  295    HB2  ARG  33           2HB      ARG  33  -4.806  -0.211   9.316
  296    HB3  ARG  33           3HB      ARG  33  -5.200   0.805  10.696
  297    HG2  ARG  33           2HG      ARG  33  -4.941  -2.117  11.147
  298    HG3  ARG  33           3HG      ARG  33  -3.472  -1.178  10.871
  299    HD2  ARG  33           2HD      ARG  33  -3.922   0.225  12.737
  300    HD3  ARG  33           3HD      ARG  33  -5.553  -0.422  12.910
  301    HE   ARG  33           HE       ARG  33  -3.089  -1.628  13.829
  302   HH11  ARG  33          2HH1      ARG  33  -6.462  -2.081  13.100
  303   HH12  ARG  33          1HH1      ARG  33  -6.624  -3.486  14.101
  304   HH21  ARG  33          2HH2      ARG  33  -3.289  -3.477  15.150
  305   HH22  ARG  33          1HH2      ARG  33  -4.819  -4.278  15.267
  306    H    VAL  34           HN       VAL  34  -5.931  -0.142   7.778
  307    HA   VAL  34           HA       VAL  34  -7.246   2.201   7.083
  308    HB   VAL  34           HB       VAL  34  -6.469  -0.035   5.205
  309   HG11  VAL  34          1HG1      VAL  34  -7.995   1.924   4.444
  310   HG12  VAL  34          2HG1      VAL  34  -6.509   2.874   4.513
  311   HG13  VAL  34          3HG1      VAL  34  -6.610   1.467   3.453
  312   HG21  VAL  34          3HG2      VAL  34  -4.884   1.818   6.788
  313   HG22  VAL  34          1HG2      VAL  34  -4.387   0.382   5.892
  314   HG23  VAL  34          2HG2      VAL  34  -4.538   1.931   5.063
  315    H    ALA  35           HN       ALA  35  -8.271  -1.161   6.648
  316    HA   ALA  35           HA       ALA  35 -10.530  -0.808   5.106
  317    HB1  ALA  35           1HB      ALA  35  -9.672  -3.003   5.684
  318    HB2  ALA  35           2HB      ALA  35 -10.137  -2.763   7.369
  319    HB3  ALA  35           3HB      ALA  35 -11.377  -2.878   6.120
  320    H    THR  36           HN       THR  36 -10.326  -0.739   8.663
  321    HA   THR  36           HA       THR  36 -13.060  -0.050   9.031
  322    HB   THR  36           HB       THR  36 -12.455   0.412  11.360
  323    HG1  THR  36           1HG      THR  36  -9.782   0.059  10.429
  324   HG21  THR  36          3HG2      THR  36 -11.144  -1.844  11.728
  325   HG22  THR  36          1HG2      THR  36 -11.481  -2.064  10.012
  326   HG23  THR  36          2HG2      THR  36 -12.810  -1.851  11.151
  327    H    LEU  37           HN       LEU  37 -10.057   1.826   8.958
  328    HA   LEU  37           HA       LEU  37 -10.942   4.294   9.765
  329    HB2  LEU  37           2HB      LEU  37  -8.959   3.527   7.642
  330    HB3  LEU  37           3HB      LEU  37  -9.242   5.205   8.101
  331    HG   LEU  37           HG       LEU  37  -8.279   3.046   9.977
  332   HD11  LEU  37          1HD1      LEU  37  -6.236   3.370   9.187
  333   HD12  LEU  37          2HD1      LEU  37  -6.363   5.092   9.549
  334   HD13  LEU  37          3HD1      LEU  37  -6.871   4.482   7.974
  335   HD21  LEU  37          3HD2      LEU  37  -9.162   5.821  10.315
  336   HD22  LEU  37          1HD2      LEU  37  -7.606   5.450  11.058
  337   HD23  LEU  37          2HD2      LEU  37  -9.036   4.514  11.494
  338    H    GLU  38           HN       GLU  38 -12.475   5.626   9.084
  339    HA   GLU  38           HA       GLU  38 -14.201   5.181   6.994
  340    HB2  GLU  38           2HB      GLU  38 -13.408   7.704   8.422
  341    HB3  GLU  38           3HB      GLU  38 -14.592   7.736   7.122
  342    HG2  GLU  38           2HG      GLU  38 -14.886   5.903   9.474
  343    HG3  GLU  38           3HG      GLU  38 -15.451   7.573   9.515
  344    H    ASP  39           HN       ASP  39 -11.171   6.980   6.971
  345    HA   ASP  39           HA       ASP  39 -11.282   6.985   4.033
  346    HB2  ASP  39           2HB      ASP  39 -10.022   9.259   5.540
  347    HB3  ASP  39           3HB      ASP  39 -10.562   9.208   3.864
  348    HA   PRO  40           HA       PRO  40  -7.306   5.121   4.296
  349    HB2  PRO  40           2HB      PRO  40  -6.371   5.742   1.823
  350    HB3  PRO  40           3HB      PRO  40  -7.611   4.514   2.101
  351    HG2  PRO  40           2HG      PRO  40  -7.925   7.358   1.220
  352    HG3  PRO  40           3HG      PRO  40  -8.741   5.903   0.618
  353    HD2  PRO  40           2HD      PRO  40  -9.914   7.617   2.355
  354    HD3  PRO  40           3HD      PRO  40 -10.249   5.874   2.361
  355    H    ARG  41           HN       ARG  41  -7.817   8.426   4.233
  356    HA   ARG  41           HA       ARG  41  -4.951   9.062   4.257
  357    HB2  ARG  41           2HB      ARG  41  -7.415  10.760   3.909
  358    HB3  ARG  41           3HB      ARG  41  -5.837  11.463   4.235
  359    HG2  ARG  41           2HG      ARG  41  -5.050  10.111   2.191
  360    HG3  ARG  41           3HG      ARG  41  -6.769   9.972   1.816
  361    HD2  ARG  41           2HD      ARG  41  -5.291  12.564   2.252
  362    HD3  ARG  41           3HD      ARG  41  -5.684  11.876   0.677
  363    HE   ARG  41           HE       ARG  41  -7.990  12.196   2.332
  364   HH11  ARG  41          2HH1      ARG  41  -5.802  13.861   0.196
  365   HH12  ARG  41          1HH1      ARG  41  -6.955  15.074  -0.251
  366   HH21  ARG  41          2HH2      ARG  41  -9.517  13.789   1.751
  367   HH22  ARG  41          1HH2      ARG  41  -9.067  15.033   0.635
  368    H    SER  42           HN       SER  42  -5.727   7.683   6.456
  369    HA   SER  42           HA       SER  42  -5.927   9.747   8.551
  370    HB2  SER  42           2HB      SER  42  -7.864   8.336   8.676
  371    HB3  SER  42           3HB      SER  42  -6.882   6.877   8.551
  372    HG   SER  42           HG       SER  42  -7.644   8.071  10.743
  373    H    LEU  43           HN       LEU  43  -4.555   6.539   7.846
  374    HA   LEU  43           HA       LEU  43  -2.550   6.906   9.924
  375    HB2  LEU  43           2HB      LEU  43  -3.343   4.628   8.146
  376    HB3  LEU  43           3HB      LEU  43  -1.823   4.593   9.037
  377    HG   LEU  43           HG       LEU  43  -4.443   5.018  10.438
  378   HD11  LEU  43          1HD1      LEU  43  -4.901   2.785  10.565
  379   HD12  LEU  43          2HD1      LEU  43  -3.225   2.310  10.291
  380   HD13  LEU  43          3HD1      LEU  43  -4.217   2.861   8.941
  381   HD21  LEU  43          3HD2      LEU  43  -1.992   5.326  11.388
  382   HD22  LEU  43          1HD2      LEU  43  -2.106   3.575  11.569
  383   HD23  LEU  43          2HD2      LEU  43  -3.284   4.622  12.361
  384    H    GLY  44           HN       GLY  44  -2.497   6.013   6.463
  385    HA2  GLY  44           1HA      GLY  44   0.199   6.264   5.987
  386    HA3  GLY  44           2HA      GLY  44  -1.038   6.612   4.789
  387    H    GLU  45           HN       GLU  45   1.105   8.032   4.421
  388    HA   GLU  45           HA       GLU  45   0.486  10.673   5.571
  389    HB2  GLU  45           2HB      GLU  45   2.850  11.236   5.488
  390    HB3  GLU  45           3HB      GLU  45   2.605   9.795   6.465
  391    HG2  GLU  45           2HG      GLU  45   3.243   8.429   4.482
  392    HG3  GLU  45           3HG      GLU  45   3.654   9.928   3.650
  393    HA   PRO  46           HA       PRO  46  -0.064  12.038   1.424
  394    HB2  PRO  46           2HB      PRO  46   0.367  14.695   1.781
  395    HB3  PRO  46           3HB      PRO  46  -1.102  13.878   2.327
  396    HG2  PRO  46           2HG      PRO  46   1.331  14.647   3.892
  397    HG3  PRO  46           3HG      PRO  46  -0.379  14.798   4.337
  398    HD2  PRO  46           2HD      PRO  46   1.192  12.792   5.252
  399    HD3  PRO  46           3HD      PRO  46  -0.546  12.583   4.952
  400    H    LEU  47           HN       LEU  47   1.611  11.209   0.216
  401    HA   LEU  47           HA       LEU  47   4.278  12.300   0.420
  402    HB2  LEU  47           2HB      LEU  47   3.552   9.871  -0.147
  403    HB3  LEU  47           3HB      LEU  47   3.350  10.499  -1.782
  404    HG   LEU  47           HG       LEU  47   5.953  10.945  -0.403
  405   HD11  LEU  47          1HD1      LEU  47   6.610   8.816  -0.368
  406   HD12  LEU  47          2HD1      LEU  47   5.876   8.473  -1.934
  407   HD13  LEU  47          3HD1      LEU  47   4.897   8.404  -0.468
  408   HD21  LEU  47          3HD2      LEU  47   4.930  10.662  -3.197
  409   HD22  LEU  47          1HD2      LEU  47   6.633  10.366  -2.847
  410   HD23  LEU  47          2HD2      LEU  47   5.920  11.938  -2.486
  411    H    ARG  48           HN       ARG  48   4.659  14.248  -0.409
  412    HA   ARG  48           HA       ARG  48   3.788  14.777  -3.160
  413    HB2  ARG  48           2HB      ARG  48   2.414  15.923  -1.204
  414    HB3  ARG  48           3HB      ARG  48   3.773  17.040  -1.216
  415    HG2  ARG  48           2HG      ARG  48   3.263  17.858  -3.295
  416    HG3  ARG  48           3HG      ARG  48   2.432  16.382  -3.790
  417    HD2  ARG  48           2HD      ARG  48   1.428  18.437  -1.823
  418    HD3  ARG  48           3HD      ARG  48   0.838  18.184  -3.465
  419    HE   ARG  48           HE       ARG  48   0.212  16.615  -1.130
  420   HH11  ARG  48          2HH1      ARG  48   0.318  16.697  -4.609
  421   HH12  ARG  48          1HH1      ARG  48  -0.868  15.449  -4.805
  422   HH21  ARG  48          2HH2      ARG  48  -1.350  14.971  -1.375
  423   HH22  ARG  48          1HH2      ARG  48  -1.817  14.469  -2.964
  424    H    GLY  49           HN       GLY  49   5.565  15.065  -4.328
  425    HA2  GLY  49           1HA      GLY  49   7.564  16.978  -3.506
  426    HA3  GLY  49           2HA      GLY  49   8.142  15.318  -3.523
  427    HA   PRO  50           HA       PRO  50   8.388  17.374  -7.790
  428    HB2  PRO  50           2HB      PRO  50  11.090  17.597  -7.926
  429    HB3  PRO  50           3HB      PRO  50  10.053  18.871  -7.275
  430    HG2  PRO  50           2HG      PRO  50  11.647  16.799  -5.818
  431    HG3  PRO  50           3HG      PRO  50  11.458  18.524  -5.455
  432    HD2  PRO  50           2HD      PRO  50  10.082  16.599  -4.139
  433    HD3  PRO  50           3HD      PRO  50   9.411  18.215  -4.441
  434    H    GLU  51           HN       GLU  51   9.492  14.643  -6.128
  435    HA   GLU  51           HA       GLU  51  10.612  13.367  -8.501
  436    HB2  GLU  51           2HB      GLU  51  10.565  12.730  -5.584
  437    HB3  GLU  51           3HB      GLU  51  10.779  11.414  -6.729
  438    HG2  GLU  51           2HG      GLU  51  12.491  13.830  -6.992
  439    HG3  GLU  51           3HG      GLU  51  12.833  12.677  -5.704
  440    H    LEU  52           HN       LEU  52   8.006  12.821  -6.143
  441    HA   LEU  52           HA       LEU  52   6.696  11.079  -8.124
  442    HB2  LEU  52           2HB      LEU  52   6.569  11.068  -5.117
  443    HB3  LEU  52           3HB      LEU  52   5.465  10.148  -6.137
  444    HG   LEU  52           HG       LEU  52   7.640   9.099  -7.100
  445   HD11  LEU  52          1HD1      LEU  52   9.058   9.088  -4.698
  446   HD12  LEU  52          2HD1      LEU  52   8.672  10.781  -5.004
  447   HD13  LEU  52          3HD1      LEU  52   9.537   9.840  -6.219
  448   HD21  LEU  52          3HD2      LEU  52   7.237   8.172  -4.329
  449   HD22  LEU  52          1HD2      LEU  52   7.165   7.282  -5.850
  450   HD23  LEU  52          2HD2      LEU  52   5.791   8.261  -5.335
  451    H    GLY  53           HN       GLY  53   4.561  11.417  -8.635
  452    HA2  GLY  53           1HA      GLY  53   3.558  14.052  -8.349
  453    HA3  GLY  53           2HA      GLY  53   2.682  12.683  -9.016
  454    H    ARG  54           HN       ARG  54   1.022  11.891  -7.888
  455    HA   ARG  54           HA       ARG  54   0.795  12.670  -5.054
  456    HB2  ARG  54           2HB      ARG  54  -0.815  13.911  -6.375
  457    HB3  ARG  54           3HB      ARG  54  -1.388  12.430  -7.130
  458    HG2  ARG  54           2HG      ARG  54  -2.310  11.659  -5.054
  459    HG3  ARG  54           3HG      ARG  54  -1.602  13.025  -4.188
  460    HD2  ARG  54           2HD      ARG  54  -3.003  14.570  -5.418
  461    HD3  ARG  54           3HD      ARG  54  -3.653  13.249  -6.387
  462    HE   ARG  54           HE       ARG  54  -4.427  13.987  -3.720
  463   HH11  ARG  54          2HH1      ARG  54  -4.297  11.406  -6.054
  464   HH12  ARG  54          1HH1      ARG  54  -5.600  10.517  -5.337
  465   HH21  ARG  54          2HH2      ARG  54  -6.143  12.825  -2.767
  466   HH22  ARG  54          1HH2      ARG  54  -6.650  11.326  -3.468
  467    H    PHE  55           HN       PHE  55   1.391  10.840  -4.024
  468    HA   PHE  55           HA       PHE  55  -0.278   8.475  -4.463
  469    HB2  PHE  55           2HB      PHE  55   2.742   8.430  -4.293
  470    HB3  PHE  55           3HB      PHE  55   1.712   7.002  -4.259
  471    HD1  PHE  55           1HD      PHE  55  -0.179   7.282  -6.315
  472    HD2  PHE  55           2HD      PHE  55   3.863   8.615  -6.276
  473    HE1  PHE  55           1HE      PHE  55  -0.128   7.186  -8.773
  474    HE2  PHE  55           2HE      PHE  55   3.921   8.522  -8.734
  475    HZ   PHE  55           HZ       PHE  55   1.923   7.808  -9.986
  476    H    TRP  56           HN       TRP  56  -1.026   7.647  -2.619
  477    HA   TRP  56           HA       TRP  56  -0.272   8.848  -0.118
  478    HB2  TRP  56           2HB      TRP  56  -2.623   8.201  -0.714
  479    HB3  TRP  56           3HB      TRP  56  -2.138   6.513  -0.579
  480    HD1  TRP  56           1HD      TRP  56  -2.693   5.488   1.688
  481    HE1  TRP  56           1HE      TRP  56  -3.001   6.358   4.091
  482    HE3  TRP  56           3HE      TRP  56  -1.628  10.427   0.906
  483    HZ2  TRP  56           2HZ      TRP  56  -2.817   8.813   5.472
  484    HZ3  TRP  56           3HZ      TRP  56  -1.716  11.970   2.821
  485    HH2  TRP  56           2HH      TRP  56  -2.299  11.178   5.056
  486    H    LYS  57           HN       LYS  57   0.941   8.009   1.493
  487    HA   LYS  57           HA       LYS  57   2.217   5.406   0.976
  488    HB2  LYS  57           2HB      LYS  57   3.829   7.199   0.979
  489    HB3  LYS  57           3HB      LYS  57   3.206   7.817   2.503
  490    HG2  LYS  57           2HG      LYS  57   5.057   6.713   3.238
  491    HG3  LYS  57           3HG      LYS  57   3.859   5.423   3.368
  492    HD2  LYS  57           2HD      LYS  57   5.644   4.385   2.295
  493    HD3  LYS  57           3HD      LYS  57   4.573   4.823   0.962
  494    HE2  LYS  57           2HE      LYS  57   6.544   5.599   0.121
  495    HE3  LYS  57           3HE      LYS  57   6.030   7.034   1.006
  496    HZ1  LYS  57           3HZ      LYS  57   7.611   6.739   2.591
  497    HZ2  LYS  57           1HZ      LYS  57   8.424   6.021   1.293
  498    HZ3  LYS  57           2HZ      LYS  57   7.638   5.054   2.437
  499    H    TYR  58           HN       TYR  58   2.225   3.840   2.525
  500    HA   TYR  58           HA       TYR  58   0.698   4.419   4.978
  501    HB2  TYR  58           2HB      TYR  58   0.748   2.005   3.192
  502    HB3  TYR  58           3HB      TYR  58   0.278   1.854   4.881
  503    HD1  TYR  58           1HD      TYR  58  -1.492   3.780   5.610
  504    HD2  TYR  58           2HD      TYR  58  -0.972   2.227   1.683
  505    HE1  TYR  58           1HE      TYR  58  -3.781   4.474   5.039
  506    HE2  TYR  58           2HE      TYR  58  -3.260   2.917   1.101
  507    HH   TYR  58           HH       TYR  58  -5.370   4.485   3.491
  508    H    ARG  59           HN       ARG  59   1.483   3.727   6.923
  509    HA   ARG  59           HA       ARG  59   4.249   2.741   6.901
  510    HB2  ARG  59           2HB      ARG  59   3.338   4.921   8.136
  511    HB3  ARG  59           3HB      ARG  59   2.974   3.748   9.395
  512    HG2  ARG  59           2HG      ARG  59   5.690   3.695   8.205
  513    HG3  ARG  59           3HG      ARG  59   5.283   5.030   9.286
  514    HD2  ARG  59           2HD      ARG  59   4.947   2.111   9.962
  515    HD3  ARG  59           3HD      ARG  59   6.333   3.093  10.435
  516    HE   ARG  59           HE       ARG  59   4.295   4.512  11.429
  517   HH11  ARG  59          2HH1      ARG  59   5.046   1.117  11.600
  518   HH12  ARG  59          1HH1      ARG  59   4.296   0.896  13.146
  519   HH21  ARG  59          2HH2      ARG  59   3.304   4.233  13.464
  520   HH22  ARG  59          1HH2      ARG  59   3.304   2.668  14.205
  521    H    VAL  60           HN       VAL  60   4.599   0.687   7.392
  522    HA   VAL  60           HA       VAL  60   2.773  -0.660   9.264
  523    HB   VAL  60           HB       VAL  60   3.819  -1.808   6.673
  524   HG11  VAL  60          1HG1      VAL  60   3.373  -3.167   9.049
  525   HG12  VAL  60          2HG1      VAL  60   1.900  -3.431   8.113
  526   HG13  VAL  60          3HG1      VAL  60   3.468  -3.872   7.435
  527   HG21  VAL  60          3HG2      VAL  60   1.165  -0.822   7.602
  528   HG22  VAL  60          1HG2      VAL  60   1.957  -0.627   6.038
  529   HG23  VAL  60          2HG2      VAL  60   1.223  -2.172   6.469
  530    H    GLY  61           HN       GLY  61   4.315  -0.406  10.916
  531    HA2  GLY  61           1HA      GLY  61   6.112  -1.019  12.206
  532    HA3  GLY  61           2HA      GLY  61   6.094  -2.517  11.288
  533    H    ASP  62           HN       ASP  62   7.895  -2.972  10.226
  534    HA   ASP  62           HA       ASP  62   9.770  -0.784   9.655
  535    HB2  ASP  62           2HB      ASP  62  10.114  -3.713  10.192
  536    HB3  ASP  62           3HB      ASP  62  11.349  -2.842   9.287
  537    H    TYR  63           HN       TYR  63   7.564  -1.120   7.947
  538    HA   TYR  63           HA       TYR  63   8.962  -1.605   5.448
  539    HB2  TYR  63           2HB      TYR  63   6.450  -3.109   6.206
  540    HB3  TYR  63           3HB      TYR  63   7.116  -3.044   4.578
  541    HD1  TYR  63           1HD      TYR  63   7.881  -4.126   8.048
  542    HD2  TYR  63           2HD      TYR  63   8.802  -4.537   3.914
  543    HE1  TYR  63           1HE      TYR  63   9.315  -6.056   8.565
  544    HE2  TYR  63           2HE      TYR  63  10.237  -6.469   4.420
  545    HH   TYR  63           HH       TYR  63  10.118  -8.211   7.047
  546    H    ARG  64           HN       ARG  64   8.191  -0.396   3.764
  547    HA   ARG  64           HA       ARG  64   5.983   1.440   4.414
  548    HB2  ARG  64           2HB      ARG  64   8.301   1.804   2.506
  549    HB3  ARG  64           3HB      ARG  64   7.006   2.968   2.755
  550    HG2  ARG  64           2HG      ARG  64   8.545   2.067   5.128
  551    HG3  ARG  64           3HG      ARG  64   9.325   3.171   3.994
  552    HD2  ARG  64           2HD      ARG  64   7.080   4.498   4.211
  553    HD3  ARG  64           3HD      ARG  64   6.925   3.596   5.717
  554    HE   ARG  64           HE       ARG  64   8.815   5.707   5.132
  555   HH11  ARG  64          2HH1      ARG  64   7.956   3.058   7.220
  556   HH12  ARG  64          1HH1      ARG  64   8.897   3.634   8.555
  557   HH21  ARG  64          2HH2      ARG  64  10.059   6.476   6.883
  558   HH22  ARG  64          1HH2      ARG  64  10.092   5.579   8.363
  559    H    LEU  65           HN       LEU  65   4.311   1.732   2.995
  560    HA   LEU  65           HA       LEU  65   4.325   0.083   0.557
  561    HB2  LEU  65           2HB      LEU  65   1.851   0.547   2.185
  562    HB3  LEU  65           3HB      LEU  65   2.137  -0.661   0.935
  563    HG   LEU  65           HG       LEU  65   3.488  -0.691   3.629
  564   HD11  LEU  65          1HD1      LEU  65   0.877  -0.958   3.470
  565   HD12  LEU  65          2HD1      LEU  65   1.843  -2.022   4.492
  566   HD13  LEU  65          3HD1      LEU  65   1.302  -2.575   2.907
  567   HD21  LEU  65          3HD2      LEU  65   3.406  -2.523   1.267
  568   HD22  LEU  65          1HD2      LEU  65   3.662  -3.172   2.887
  569   HD23  LEU  65          2HD2      LEU  65   4.788  -1.988   2.224
  570    H    ILE  66           HN       ILE  66   3.867   1.165  -1.243
  571    HA   ILE  66           HA       ILE  66   2.698   3.852  -0.988
  572    HB   ILE  66           HB       ILE  66   4.370   2.687  -3.217
  573   HG12  ILE  66          2HG1      ILE  66   5.937   4.562  -2.451
  574   HG13  ILE  66          3HG1      ILE  66   4.942   4.652  -1.002
  575   HG21  ILE  66          1HG2      ILE  66   2.553   4.372  -3.837
  576   HG22  ILE  66          2HG2      ILE  66   3.522   5.553  -2.958
  577   HG23  ILE  66          3HG2      ILE  66   4.200   4.724  -4.359
  578   HD11  ILE  66          3HD1      ILE  66   7.077   2.870  -1.614
  579   HD12  ILE  66          1HD1      ILE  66   6.170   3.048  -0.113
  580   HD13  ILE  66          2HD1      ILE  66   5.598   1.943  -1.363
  581    H    CYS  67           HN       CYS  67   0.559   3.748  -1.282
  582    HA   CYS  67           HA       CYS  67  -0.458   2.122  -3.517
  583    HB2  CYS  67           2HB      CYS  67  -2.067   3.114  -1.163
  584    HB3  CYS  67           3HB      CYS  67  -2.533   1.902  -2.350
  585    HG   CYS  67           HG       CYS  67   0.174   0.752  -1.057
  586    H    HIS  68           HN       HIS  68  -2.566   3.022  -4.435
  587    HA   HIS  68           HA       HIS  68  -2.317   5.944  -4.729
  588    HB2  HIS  68           2HB      HIS  68  -1.680   4.525  -6.742
  589    HB3  HIS  68           3HB      HIS  68  -3.379   4.072  -6.844
  590    HD2  HIS  68           2HD      HIS  68  -2.596   7.782  -6.023
  591    HE1  HIS  68           1HE      HIS  68  -3.871   7.563 -10.063
  592    HE2  HIS  68           2HE      HIS  68  -3.214   9.087  -8.169
  593    H    ILE  69           HN       ILE  69  -3.922   6.848  -3.612
  594    HA   ILE  69           HA       ILE  69  -6.432   5.532  -3.170
  595    HB   ILE  69           HB       ILE  69  -5.591   8.369  -2.564
  596   HG12  ILE  69          2HG1      ILE  69  -5.828   5.983  -0.720
  597   HG13  ILE  69          3HG1      ILE  69  -4.311   6.559  -1.402
  598   HG21  ILE  69          1HG2      ILE  69  -7.646   7.543  -0.843
  599   HG22  ILE  69          2HG2      ILE  69  -7.726   8.768  -2.108
  600   HG23  ILE  69          3HG2      ILE  69  -8.160   7.098  -2.470
  601   HD11  ILE  69          3HD1      ILE  69  -4.633   7.325   0.888
  602   HD12  ILE  69          1HD1      ILE  69  -4.578   8.675  -0.245
  603   HD13  ILE  69          2HD1      ILE  69  -6.125   8.135   0.409
  604    H    GLN  70           HN       GLN  70  -8.030   5.456  -4.592
  605    HA   GLN  70           HA       GLN  70  -8.238   7.578  -6.613
  606    HB2  GLN  70           2HB      GLN  70  -9.375   4.778  -6.592
  607    HB3  GLN  70           3HB      GLN  70  -9.633   5.955  -7.873
  608    HG2  GLN  70           2HG      GLN  70  -7.464   5.812  -8.630
  609    HG3  GLN  70           3HG      GLN  70  -6.854   5.217  -7.087
  610   HE21  GLN  70          1HE2      GLN  70  -5.818   3.728  -8.722
  611   HE22  GLN  70          2HE2      GLN  70  -6.669   2.270  -9.088
  612    H    ASP  71           HN       ASP  71  -9.342   9.086  -5.332
  613    HA   ASP  71           HA       ASP  71 -11.574   8.630  -3.750
  614    HB2  ASP  71           2HB      ASP  71 -10.666  10.762  -3.528
  615    HB3  ASP  71           3HB      ASP  71 -10.580  11.016  -5.269
  616    H    ARG  72           HN       ARG  72 -11.352   9.155  -7.229
  617    HA   ARG  72           HA       ARG  72 -13.959   9.591  -7.929
  618    HB2  ARG  72           2HB      ARG  72 -13.292   7.993  -9.954
  619    HB3  ARG  72           3HB      ARG  72 -12.625   9.611  -9.780
  620    HG2  ARG  72           2HG      ARG  72 -10.579   8.793  -8.954
  621    HG3  ARG  72           3HG      ARG  72 -11.247   7.183  -8.679
  622    HD2  ARG  72           2HD      ARG  72 -11.660   7.169 -11.226
  623    HD3  ARG  72           3HD      ARG  72 -10.513   8.508 -11.265
  624    HE   ARG  72           HE       ARG  72  -9.301   6.499  -9.813
  625   HH11  ARG  72          2HH1      ARG  72 -10.546   6.917 -13.037
  626   HH12  ARG  72          1HH1      ARG  72  -9.428   5.804 -13.753
  627   HH21  ARG  72          2HH2      ARG  72  -7.823   5.033 -10.744
  628   HH22  ARG  72          1HH2      ARG  72  -7.880   4.733 -12.448
  629    H    GLU  73           HN       GLU  73 -12.431   6.420  -7.404
  630    HA   GLU  73           HA       GLU  73 -15.129   5.255  -7.194
  631    HB2  GLU  73           2HB      GLU  73 -12.533   4.095  -8.173
  632    HB3  GLU  73           3HB      GLU  73 -13.853   3.061  -7.645
  633    HG2  GLU  73           2HG      GLU  73 -15.313   4.165  -9.319
  634    HG3  GLU  73           3HG      GLU  73 -13.904   5.049  -9.901
  635    H    ALA  74           HN       ALA  74 -13.331   6.562  -5.141
  636    HA   ALA  74           HA       ALA  74 -12.446   6.147  -3.051
  637    HB1  ALA  74           1HB      ALA  74 -15.119   4.767  -3.061
  638    HB2  ALA  74           2HB      ALA  74 -14.160   4.989  -1.597
  639    HB3  ALA  74           3HB      ALA  74 -14.730   6.393  -2.498
  640    H    THR  75           HN       THR  75 -11.291   4.389  -4.901
  641    HA   THR  75           HA       THR  75 -11.011   1.943  -3.278
  642    HB   THR  75           HB       THR  75 -10.906   2.238  -6.281
  643    HG1  THR  75           1HG      THR  75 -12.584   0.706  -6.162
  644   HG21  THR  75          3HG2      THR  75 -10.017  -0.059  -4.541
  645   HG22  THR  75          1HG2      THR  75  -9.063   0.823  -5.733
  646   HG23  THR  75          2HG2      THR  75 -10.381  -0.224  -6.258
  647    H    VAL  76           HN       VAL  76  -8.980   1.274  -2.771
  648    HA   VAL  76           HA       VAL  76  -6.776   3.034  -3.616
  649    HB   VAL  76           HB       VAL  76  -6.974   1.294  -1.153
  650   HG11  VAL  76          1HG1      VAL  76  -4.932   2.973  -0.660
  651   HG12  VAL  76          2HG1      VAL  76  -4.725   1.364  -1.356
  652   HG13  VAL  76          3HG1      VAL  76  -4.756   2.783  -2.404
  653   HG21  VAL  76          3HG2      VAL  76  -7.673   4.095  -1.716
  654   HG22  VAL  76          1HG2      VAL  76  -8.258   3.007  -0.457
  655   HG23  VAL  76          2HG2      VAL  76  -6.715   3.836  -0.258
  656    H    LEU  77           HN       LEU  77  -5.266   2.215  -4.901
  657    HA   LEU  77           HA       LEU  77  -4.991  -0.715  -5.050
  658    HB2  LEU  77           2HB      LEU  77  -5.876   0.161  -7.104
  659    HB3  LEU  77           3HB      LEU  77  -4.609   1.383  -7.177
  660    HG   LEU  77           HG       LEU  77  -3.022  -0.698  -7.288
  661   HD11  LEU  77          1HD1      LEU  77  -5.494  -1.877  -8.525
  662   HD12  LEU  77          2HD1      LEU  77  -4.973  -2.257  -6.884
  663   HD13  LEU  77          3HD1      LEU  77  -3.930  -2.647  -8.252
  664   HD21  LEU  77          3HD2      LEU  77  -4.712   0.063  -9.666
  665   HD22  LEU  77          1HD2      LEU  77  -3.068  -0.575  -9.684
  666   HD23  LEU  77          2HD2      LEU  77  -3.381   1.034  -9.034
  667    H    VAL  78           HN       VAL  78  -3.160  -1.451  -4.224
  668    HA   VAL  78           HA       VAL  78  -1.014   0.180  -3.420
  669    HB   VAL  78           HB       VAL  78  -0.939  -2.799  -3.912
  670   HG11  VAL  78          1HG1      VAL  78   0.962  -2.887  -2.581
  671   HG12  VAL  78          2HG1      VAL  78   1.220  -1.429  -3.541
  672   HG13  VAL  78          3HG1      VAL  78   0.661  -1.300  -1.873
  673   HG21  VAL  78          3HG2      VAL  78  -2.641  -2.712  -2.399
  674   HG22  VAL  78          1HG2      VAL  78  -1.277  -2.643  -1.283
  675   HG23  VAL  78          2HG2      VAL  78  -2.121  -1.162  -1.736
  676    H    LEU  79           HN       LEU  79   0.733   0.911  -4.455
  677    HA   LEU  79           HA       LEU  79   1.098   0.158  -7.253
  678    HB2  LEU  79           2HB      LEU  79   1.882   2.474  -5.562
  679    HB3  LEU  79           3HB      LEU  79   2.884   2.090  -6.961
  680    HG   LEU  79           HG       LEU  79  -0.080   2.616  -7.116
  681   HD11  LEU  79          1HD1      LEU  79   0.288   4.835  -7.503
  682   HD12  LEU  79          2HD1      LEU  79   1.942   4.580  -8.057
  683   HD13  LEU  79          3HD1      LEU  79   1.571   4.517  -6.334
  684   HD21  LEU  79          3HD2      LEU  79   1.001   1.261  -8.924
  685   HD22  LEU  79          1HD2      LEU  79   2.016   2.660  -9.278
  686   HD23  LEU  79          2HD2      LEU  79   0.266   2.770  -9.469
  687    H    ARG  80           HN       ARG  80   3.117   0.617  -4.349
  688    HA   ARG  80           HA       ARG  80   4.823  -1.580  -5.279
  689    HB2  ARG  80           2HB      ARG  80   5.765   1.148  -4.393
  690    HB3  ARG  80           3HB      ARG  80   6.821  -0.255  -4.485
  691    HG2  ARG  80           2HG      ARG  80   5.259   0.800  -6.828
  692    HG3  ARG  80           3HG      ARG  80   6.913   1.287  -6.452
  693    HD2  ARG  80           2HD      ARG  80   6.265  -1.616  -6.650
  694    HD3  ARG  80           3HD      ARG  80   6.427  -0.674  -8.132
  695    HE   ARG  80           HE       ARG  80   8.696  -0.421  -7.706
  696   HH11  ARG  80          2HH1      ARG  80   7.102  -2.033  -5.064
  697   HH12  ARG  80          1HH1      ARG  80   8.578  -2.556  -4.322
  698   HH21  ARG  80          2HH2      ARG  80  10.645  -1.103  -6.739
  699   HH22  ARG  80          1HH2      ARG  80  10.593  -2.026  -5.275
  700    H    VAL  81           HN       VAL  81   6.232  -2.435  -3.543
  701    HA   VAL  81           HA       VAL  81   5.419  -1.826  -0.818
  702    HB   VAL  81           HB       VAL  81   4.982  -4.542  -2.060
  703   HG11  VAL  81          1HG1      VAL  81   4.120  -4.488   0.632
  704   HG12  VAL  81          2HG1      VAL  81   5.394  -5.474  -0.088
  705   HG13  VAL  81          3HG1      VAL  81   5.781  -3.897   0.599
  706   HG21  VAL  81          3HG2      VAL  81   3.162  -2.493  -0.819
  707   HG22  VAL  81          1HG2      VAL  81   3.099  -3.172  -2.446
  708   HG23  VAL  81          2HG2      VAL  81   2.682  -4.174  -1.055
  709    H    GLY  82           HN       GLY  82   7.271  -1.622   0.246
  710    HA2  GLY  82           1HA      GLY  82   9.248  -3.737   0.143
  711    HA3  GLY  82           2HA      GLY  82   9.794  -2.197  -0.503
  712    H    HIS  83           HN       HIS  83  10.919  -3.524   1.740
  713    HA   HIS  83           HA       HIS  83  10.090  -2.793   4.241
  714    HB2  HIS  83           2HB      HIS  83  12.075  -4.181   3.809
  715    HB3  HIS  83           3HB      HIS  83  12.941  -2.762   3.228
  716    HD2  HIS  83           2HD      HIS  83  11.932  -4.448   6.569
  717    HE1  HIS  83           1HE      HIS  83  14.203  -0.982   7.477
  718    HE2  HIS  83           2HE      HIS  83  13.213  -3.115   8.378
  719    H    ALA  84           HN       ALA  84  10.816  -1.069   5.686
  720    HA   ALA  84           HA       ALA  84  10.522   1.509   4.415
  721    HB1  ALA  84           1HB      ALA  84  10.220   2.393   6.590
  722    HB2  ALA  84           2HB      ALA  84   9.392   0.836   6.567
  723    HB3  ALA  84           3HB      ALA  84  10.968   0.984   7.344
  724    H    ARG  85           HN       ARG  85  12.930   0.183   3.726
  725    HA   ARG  85           HA       ARG  85  14.901   1.999   4.950
  726    HB2  ARG  85           2HB      ARG  85  15.411  -0.212   5.728
  727    HB3  ARG  85           3HB      ARG  85  15.254  -0.878   4.108
  728    HG2  ARG  85           2HG      ARG  85  17.565  -0.757   4.577
  729    HG3  ARG  85           3HG      ARG  85  17.211   0.549   3.443
  730    HD2  ARG  85           2HD      ARG  85  17.146   1.072   6.384
  731    HD3  ARG  85           3HD      ARG  85  18.694   0.997   5.544
  732    HE   ARG  85           HE       ARG  85  17.269   2.712   4.025
  733   HH11  ARG  85          2HH1      ARG  85  17.924   2.544   7.440
  734   HH12  ARG  85          1HH1      ARG  85  17.850   4.260   7.672
  735   HH21  ARG  85          2HH2      ARG  85  17.168   4.972   4.317
  736   HH22  ARG  85          1HH2      ARG  85  17.419   5.640   5.895
  737    H    ASP  86           HN       ASP  86  14.562  -0.150   2.119
  738    HA   ASP  86           HA       ASP  86  16.270   1.348   0.459
  739    HB2  ASP  86           2HB      ASP  86  14.132  -0.697  -0.102
  740    HB3  ASP  86           3HB      ASP  86  15.022   0.084  -1.406
  741    H    VAL  87           HN       VAL  87  12.716   1.242   0.635
  742    HA   VAL  87           HA       VAL  87  12.151   3.086  -1.363
  743    HB   VAL  87           HB       VAL  87  10.625   2.625   1.204
  744   HG11  VAL  87          1HG1      VAL  87   9.502   3.678  -1.375
  745   HG12  VAL  87          2HG1      VAL  87   8.774   3.689   0.232
  746   HG13  VAL  87          3HG1      VAL  87  10.137   4.750  -0.127
  747   HG21  VAL  87          3HG2      VAL  87   9.424   0.950   0.102
  748   HG22  VAL  87          1HG2      VAL  87   9.986   1.466  -1.488
  749   HG23  VAL  87          2HG2      VAL  87  11.095   0.659  -0.380
  750    H    TYR  88           HN       TYR  88  12.696   3.650   2.103
  751    HA   TYR  88           HA       TYR  88  12.637   6.533   1.667
  752    HB2  TYR  88           2HB      TYR  88  11.611   5.176   3.687
  753    HB3  TYR  88           3HB      TYR  88  13.245   5.311   4.326
  754    HD1  TYR  88           2HD      TYR  88  10.644   7.490   2.751
  755    HD2  TYR  88           1HD      TYR  88  13.705   7.116   5.683
  756    HE1  TYR  88           2HE      TYR  88  10.132   9.754   3.565
  757    HE2  TYR  88           1HE      TYR  88  13.201   9.379   6.505
  758    HH   TYR  88           HH       TYR  88  10.468  11.219   5.263
  759    H    ARG  89           HN       ARG  89  14.445   7.488   1.028
  760    HA   ARG  89           HA       ARG  89  17.011   6.483   2.073
  761    HB2  ARG  89           2HB      ARG  89  18.043   7.415   0.017
  762    HB3  ARG  89           3HB      ARG  89  16.889   6.130  -0.313
  763    HG2  ARG  89           2HG      ARG  89  15.199   8.041  -0.674
  764    HG3  ARG  89           3HG      ARG  89  16.629   9.067  -0.806
  765    HD2  ARG  89           2HD      ARG  89  17.379   7.987  -2.722
  766    HD3  ARG  89           3HD      ARG  89  16.419   6.544  -2.401
  767    HE   ARG  89           HE       ARG  89  14.734   8.774  -2.834
  768   HH11  ARG  89          2HH1      ARG  89  16.811   6.541  -4.514
  769   HH12  ARG  89          1HH1      ARG  89  15.951   6.666  -6.013
  770   HH21  ARG  89          2HH2      ARG  89  13.594   8.948  -4.803
  771   HH22  ARG  89          1HH2      ARG  89  14.122   8.036  -6.176
  Start of MODEL    8
    1    H1   MET   1           HN       MET   1 -17.778  -0.923   6.567
    2    HA   MET   1           HA       MET   1 -18.314  -0.178   3.777
    3    HB2  MET   1           2HB      MET   1 -19.128   1.980   4.390
    4    HB3  MET   1           3HB      MET   1 -20.035   0.801   5.327
    5    HG2  MET   1           2HG      MET   1 -18.963   1.358   7.307
    6    HG3  MET   1           3HG      MET   1 -17.609   2.116   6.472
    7    HE1  MET   1           3HE      MET   1 -19.353   4.993   8.534
    8    HE2  MET   1           1HE      MET   1 -18.799   3.358   8.894
    9    HE3  MET   1           2HE      MET   1 -17.756   4.466   8.002
   10    H    GLY   2           HN       GLY   2 -16.845   1.285   2.856
   11    HA2  GLY   2           1HA      GLY   2 -14.927   2.847   3.882
   12    HA3  GLY   2           2HA      GLY   2 -14.231   1.251   4.122
   13    H    TYR   3           HN       TYR   3 -12.507   1.899   2.721
   14    HA   TYR   3           HA       TYR   3 -13.196   2.286  -0.092
   15    HB2  TYR   3           2HB      TYR   3 -10.626   2.563   1.460
   16    HB3  TYR   3           3HB      TYR   3 -10.668   2.610  -0.299
   17    HD1  TYR   3           2HD      TYR   3 -12.760   4.124   2.411
   18    HD2  TYR   3           1HD      TYR   3 -10.445   4.755  -1.103
   19    HE1  TYR   3           2HE      TYR   3 -13.299   6.522   2.494
   20    HE2  TYR   3           1HE      TYR   3 -10.977   7.155  -1.029
   21    HH   TYR   3           HH       TYR   3 -12.027   8.727   1.533
   22    H    ARG   4           HN       ARG   4 -11.997   1.067  -1.742
   23    HA   ARG   4           HA       ARG   4 -12.007  -1.755  -1.094
   24    HB2  ARG   4           2HB      ARG   4 -13.033  -0.871  -3.185
   25    HB3  ARG   4           3HB      ARG   4 -11.429  -0.402  -3.734
   26    HG2  ARG   4           2HG      ARG   4 -10.727  -2.646  -3.918
   27    HG3  ARG   4           3HG      ARG   4 -12.131  -3.233  -3.024
   28    HD2  ARG   4           2HD      ARG   4 -12.572  -1.701  -5.539
   29    HD3  ARG   4           3HD      ARG   4 -12.021  -3.372  -5.654
   30    HE   ARG   4           HE       ARG   4 -14.247  -3.122  -3.899
   31   HH11  ARG   4          2HH1      ARG   4 -13.348  -3.243  -7.260
   32   HH12  ARG   4          1HH1      ARG   4 -14.878  -3.865  -7.782
   33   HH21  ARG   4          2HH2      ARG   4 -16.266  -3.941  -4.574
   34   HH22  ARG   4          1HH2      ARG   4 -16.538  -4.261  -6.253
   35    H    ILE   5           HN       ILE   5 -10.266  -3.172  -1.349
   36    HA   ILE   5           HA       ILE   5  -7.630  -1.873  -1.211
   37    HB   ILE   5           HB       ILE   5  -8.340  -4.655  -0.284
   38   HG12  ILE   5          2HG1      ILE   5  -9.586  -3.013   1.028
   39   HG13  ILE   5          3HG1      ILE   5  -8.299  -3.720   1.999
   40   HG21  ILE   5          1HG2      ILE   5  -5.871  -3.261  -0.641
   41   HG22  ILE   5          2HG2      ILE   5  -6.116  -3.586   1.074
   42   HG23  ILE   5          3HG2      ILE   5  -6.145  -4.913  -0.087
   43   HD11  ILE   5          3HD1      ILE   5  -6.945  -1.748   1.702
   44   HD12  ILE   5          1HD1      ILE   5  -8.153  -1.048   0.625
   45   HD13  ILE   5          2HD1      ILE   5  -8.531  -1.300   2.329
   46    H    GLU   6           HN       GLU   6  -6.702  -1.871  -3.161
   47    HA   GLU   6           HA       GLU   6  -6.745  -4.380  -4.709
   48    HB2  GLU   6           2HB      GLU   6  -6.977  -1.528  -5.575
   49    HB3  GLU   6           3HB      GLU   6  -6.215  -2.685  -6.656
   50    HG2  GLU   6           2HG      GLU   6  -8.892  -3.265  -5.466
   51    HG3  GLU   6           3HG      GLU   6  -8.742  -2.217  -6.876
   52    H    PHE   7           HN       PHE   7  -4.837  -4.900  -5.900
   53    HA   PHE   7           HA       PHE   7  -2.410  -3.461  -5.095
   54    HB2  PHE   7           2HB      PHE   7  -3.015  -6.372  -4.691
   55    HB3  PHE   7           3HB      PHE   7  -1.354  -5.841  -4.933
   56    HD1  PHE   7           1HD      PHE   7  -4.337  -5.321  -2.791
   57    HD2  PHE   7           2HD      PHE   7  -0.109  -4.990  -3.159
   58    HE1  PHE   7           1HE      PHE   7  -4.177  -4.753  -0.403
   59    HE2  PHE   7           2HE      PHE   7   0.057  -4.422  -0.770
   60    HZ   PHE   7           HZ       PHE   7  -1.978  -4.304   0.611
   61    H    ASP   8           HN       ASP   8  -1.132  -3.032  -6.766
   62    HA   ASP   8           HA       ASP   8  -1.764  -3.612  -9.399
   63    HB2  ASP   8           2HB      ASP   8   0.721  -3.050  -9.819
   64    HB3  ASP   8           3HB      ASP   8  -0.296  -1.814  -9.083
   65    HA   PRO   9           HA       PRO   9  -0.387  -7.688 -10.251
   66    HB2  PRO   9           2HB      PRO   9   0.576  -7.435 -12.777
   67    HB3  PRO   9           3HB      PRO   9  -1.149  -7.382 -12.397
   68    HG2  PRO   9           2HG      PRO   9   0.752  -5.123 -12.890
   69    HG3  PRO   9           3HG      PRO   9  -0.909  -5.336 -13.475
   70    HD2  PRO   9           2HD      PRO   9  -0.299  -3.746 -11.369
   71    HD3  PRO   9           3HD      PRO   9  -1.834  -4.630 -11.485
   72    H    ARG  10           HN       ARG  10   1.810  -5.103 -10.079
   73    HA   ARG  10           HA       ARG  10   4.149  -6.812 -10.475
   74    HB2  ARG  10           2HB      ARG  10   3.864  -3.834 -10.061
   75    HB3  ARG  10           3HB      ARG  10   5.414  -4.657 -10.168
   76    HG2  ARG  10           2HG      ARG  10   5.166  -3.956 -12.323
   77    HG3  ARG  10           3HG      ARG  10   4.423  -5.554 -12.425
   78    HD2  ARG  10           2HD      ARG  10   2.240  -4.251 -11.818
   79    HD3  ARG  10           3HD      ARG  10   3.141  -2.857 -12.412
   80    HE   ARG  10           HE       ARG  10   3.164  -5.092 -14.215
   81   HH11  ARG  10          2HH1      ARG  10   1.409  -2.267 -13.186
   82   HH12  ARG  10          1HH1      ARG  10   0.576  -2.075 -14.694
   83   HH21  ARG  10          2HH2      ARG  10   2.075  -4.849 -16.205
   84   HH22  ARG  10          1HH2      ARG  10   0.956  -3.545 -16.409
   85    H    ALA  11           HN       ALA  11   2.646  -4.765  -8.001
   86    HA   ALA  11           HA       ALA  11   4.560  -5.230  -5.983
   87    HB1  ALA  11           1HB      ALA  11   3.010  -4.245  -4.475
   88    HB2  ALA  11           2HB      ALA  11   2.843  -3.400  -6.015
   89    HB3  ALA  11           3HB      ALA  11   1.649  -4.607  -5.538
   90    H    GLU  12           HN       GLU  12   1.358  -6.707  -6.519
   91    HA   GLU  12           HA       GLU  12   1.083  -8.426  -4.492
   92    HB2  GLU  12           2HB      GLU  12   0.584  -8.803  -7.419
   93    HB3  GLU  12           3HB      GLU  12   0.316 -10.148  -6.320
   94    HG2  GLU  12           2HG      GLU  12  -1.201  -8.678  -5.001
   95    HG3  GLU  12           3HG      GLU  12  -1.024  -7.457  -6.260
   96    H    LYS  13           HN       LYS  13   3.397  -8.795  -7.119
   97    HA   LYS  13           HA       LYS  13   4.323 -11.361  -6.171
   98    HB2  LYS  13           2HB      LYS  13   5.642  -9.567  -8.210
   99    HB3  LYS  13           3HB      LYS  13   5.865 -11.299  -8.006
  100    HG2  LYS  13           2HG      LYS  13   3.205 -10.114  -8.727
  101    HG3  LYS  13           3HG      LYS  13   4.416 -10.527  -9.944
  102    HD2  LYS  13           2HD      LYS  13   3.258 -12.491  -9.903
  103    HD3  LYS  13           3HD      LYS  13   4.417 -12.824  -8.613
  104    HE2  LYS  13           2HE      LYS  13   2.434 -13.424  -7.610
  105    HE3  LYS  13           3HE      LYS  13   2.593 -11.748  -7.089
  106    HZ1  LYS  13           3HZ      LYS  13   1.170 -12.216  -9.588
  107    HZ2  LYS  13           1HZ      LYS  13   0.865 -11.090  -8.362
  108    HZ3  LYS  13           2HZ      LYS  13   0.385 -12.701  -8.170
  109    H    GLU  14           HN       GLU  14   5.622  -8.054  -6.313
  110    HA   GLU  14           HA       GLU  14   8.101  -8.502  -5.171
  111    HB2  GLU  14           2HB      GLU  14   6.271  -6.112  -4.953
  112    HB3  GLU  14           3HB      GLU  14   7.928  -6.116  -4.366
  113    HG2  GLU  14           2HG      GLU  14   7.179  -6.709  -7.215
  114    HG3  GLU  14           3HG      GLU  14   7.589  -5.099  -6.625
  115    H    LEU  15           HN       LEU  15   4.999  -7.895  -3.572
  116    HA   LEU  15           HA       LEU  15   6.119  -8.005  -0.934
  117    HB2  LEU  15           2HB      LEU  15   4.194  -6.695  -1.123
  118    HB3  LEU  15           3HB      LEU  15   3.335  -7.930  -2.042
  119    HG   LEU  15           HG       LEU  15   4.076  -8.532   0.778
  120   HD11  LEU  15          1HD1      LEU  15   3.176  -6.272   0.918
  121   HD12  LEU  15          2HD1      LEU  15   2.046  -7.446   1.591
  122   HD13  LEU  15          3HD1      LEU  15   1.761  -6.768  -0.011
  123   HD21  LEU  15          3HD2      LEU  15   1.914  -9.712   0.682
  124   HD22  LEU  15          1HD2      LEU  15   3.036 -10.250  -0.568
  125   HD23  LEU  15          2HD2      LEU  15   1.709  -9.164  -0.982
  126    H    GLU  16           HN       GLU  16   4.178 -10.207  -2.933
  127    HA   GLU  16           HA       GLU  16   3.757 -12.266  -1.168
  128    HB2  GLU  16           2HB      GLU  16   4.141 -12.139  -4.122
  129    HB3  GLU  16           3HB      GLU  16   4.132 -13.722  -3.356
  130    HG2  GLU  16           2HG      GLU  16   1.940 -11.764  -2.818
  131    HG3  GLU  16           3HG      GLU  16   1.930 -12.750  -4.279
  132    H    LYS  17           HN       LYS  17   6.720 -11.349  -2.756
  133    HA   LYS  17           HA       LYS  17   8.143 -13.762  -2.214
  134    HB2  LYS  17           2HB      LYS  17   8.895 -11.007  -3.113
  135    HB3  LYS  17           3HB      LYS  17  10.155 -12.113  -2.581
  136    HG2  LYS  17           2HG      LYS  17   9.391 -13.745  -4.262
  137    HG3  LYS  17           3HG      LYS  17   8.200 -12.571  -4.826
  138    HD2  LYS  17           2HD      LYS  17  10.181 -10.991  -5.164
  139    HD3  LYS  17           3HD      LYS  17  11.199 -12.420  -4.975
  140    HE2  LYS  17           2HE      LYS  17   9.755 -13.472  -6.800
  141    HE3  LYS  17           3HE      LYS  17   9.156 -11.842  -7.101
  142    HZ1  LYS  17           3HZ      LYS  17  11.768 -12.993  -7.667
  143    HZ2  LYS  17           1HZ      LYS  17  11.761 -11.389  -7.131
  144    HZ3  LYS  17           2HZ      LYS  17  10.894 -11.820  -8.517
  145    H    LEU  18           HN       LEU  18   7.611 -10.762  -0.492
  146    HA   LEU  18           HA       LEU  18   9.637 -10.895   1.407
  147    HB2  LEU  18           2HB      LEU  18   6.827  -9.835   1.590
  148    HB3  LEU  18           3HB      LEU  18   8.014  -9.638   2.878
  149    HG   LEU  18           HG       LEU  18   8.531  -8.641   0.092
  150   HD11  LEU  18          1HD1      LEU  18   6.372  -7.771   1.376
  151   HD12  LEU  18          2HD1      LEU  18   7.403  -6.700   0.428
  152   HD13  LEU  18          3HD1      LEU  18   7.579  -6.768   2.181
  153   HD21  LEU  18          3HD2      LEU  18  10.423  -8.855   1.661
  154   HD22  LEU  18          1HD2      LEU  18   9.585  -7.786   2.786
  155   HD23  LEU  18          2HD2      LEU  18  10.099  -7.180   1.211
  156    H    ASP  19           HN       ASP  19   9.162 -11.265   3.827
  157    HA   ASP  19           HA       ASP  19   8.847 -13.971   4.303
  158    HB2  ASP  19           2HB      ASP  19   9.749 -12.013   5.816
  159    HB3  ASP  19           3HB      ASP  19   8.103 -12.017   6.443
  160    H    ARG  20           HN       ARG  20   7.161 -15.298   4.434
  161    HA   ARG  20           HA       ARG  20   4.616 -14.746   3.668
  162    HB2  ARG  20           2HB      ARG  20   5.799 -16.854   5.405
  163    HB3  ARG  20           3HB      ARG  20   4.046 -16.723   5.365
  164    HG2  ARG  20           2HG      ARG  20   5.538 -16.806   2.791
  165    HG3  ARG  20           3HG      ARG  20   5.323 -18.298   3.710
  166    HD2  ARG  20           2HD      ARG  20   3.462 -18.313   2.349
  167    HD3  ARG  20           3HD      ARG  20   2.832 -17.557   3.812
  168    HE   ARG  20           HE       ARG  20   3.776 -15.554   2.092
  169   HH11  ARG  20          2HH1      ARG  20   1.215 -17.902   2.308
  170   HH12  ARG  20          1HH1      ARG  20   0.101 -16.965   1.368
  171   HH21  ARG  20          2HH2      ARG  20   2.318 -14.312   0.853
  172   HH22  ARG  20          1HH2      ARG  20   0.729 -14.924   0.540
  173    H    GLU  21           HN       GLU  21   5.861 -14.608   6.987
  174    HA   GLU  21           HA       GLU  21   3.443 -13.998   8.263
  175    HB2  GLU  21           2HB      GLU  21   6.328 -13.576   8.942
  176    HB3  GLU  21           3HB      GLU  21   5.089 -12.838   9.947
  177    HG2  GLU  21           2HG      GLU  21   4.075 -15.173  10.108
  178    HG3  GLU  21           3HG      GLU  21   5.610 -15.747   9.459
  179    H    VAL  22           HN       VAL  22   6.001 -11.839   7.057
  180    HA   VAL  22           HA       VAL  22   4.842  -9.413   7.790
  181    HB   VAL  22           HB       VAL  22   6.565  -9.979   5.372
  182   HG11  VAL  22          1HG1      VAL  22   7.146  -7.445   6.096
  183   HG12  VAL  22          2HG1      VAL  22   5.958  -7.868   4.861
  184   HG13  VAL  22          3HG1      VAL  22   5.432  -7.508   6.506
  185   HG21  VAL  22          3HG2      VAL  22   7.648  -8.739   7.835
  186   HG22  VAL  22          1HG2      VAL  22   7.292 -10.466   7.890
  187   HG23  VAL  22          2HG2      VAL  22   8.415  -9.834   6.685
  188    H    ALA  23           HN       ALA  23   4.637 -11.112   4.663
  189    HA   ALA  23           HA       ALA  23   3.043  -9.391   3.257
  190    HB1  ALA  23           1HB      ALA  23   2.191 -12.151   2.896
  191    HB2  ALA  23           2HB      ALA  23   2.954 -11.041   1.756
  192    HB3  ALA  23           3HB      ALA  23   3.944 -11.962   2.888
  193    H    ARG  24           HN       ARG  24   1.869 -12.048   5.330
  194    HA   ARG  24           HA       ARG  24  -0.855 -11.507   5.074
  195    HB2  ARG  24           2HB      ARG  24  -0.012 -13.588   6.033
  196    HB3  ARG  24           3HB      ARG  24   0.632 -12.711   7.414
  197    HG2  ARG  24           2HG      ARG  24  -1.752 -11.989   7.885
  198    HG3  ARG  24           3HG      ARG  24  -2.240 -13.202   6.699
  199    HD2  ARG  24           2HD      ARG  24  -0.375 -14.004   8.876
  200    HD3  ARG  24           3HD      ARG  24  -2.078 -13.773   9.270
  201    HE   ARG  24           HE       ARG  24  -2.598 -15.659   8.048
  202   HH11  ARG  24          2HH1      ARG  24   0.728 -14.773   7.527
  203   HH12  ARG  24          1HH1      ARG  24   1.133 -16.253   6.723
  204   HH21  ARG  24          2HH2      ARG  24  -2.077 -17.612   6.991
  205   HH22  ARG  24          1HH2      ARG  24  -0.464 -17.867   6.418
  206    H    ARG  25           HN       ARG  25   1.530 -10.242   7.353
  207    HA   ARG  25           HA       ARG  25  -0.191  -8.879   9.071
  208    HB2  ARG  25           2HB      ARG  25   1.967  -8.944   9.872
  209    HB3  ARG  25           3HB      ARG  25   2.675  -8.588   8.303
  210    HG2  ARG  25           2HG      ARG  25   2.129  -6.275   8.498
  211    HG3  ARG  25           3HG      ARG  25   1.172  -6.572   9.951
  212    HD2  ARG  25           2HD      ARG  25   3.350  -7.485  10.955
  213    HD3  ARG  25           3HD      ARG  25   4.150  -6.684   9.604
  214    HE   ARG  25           HE       ARG  25   2.378  -4.954  11.044
  215   HH11  ARG  25          2HH1      ARG  25   5.581  -6.315  10.971
  216   HH12  ARG  25          1HH1      ARG  25   6.292  -5.024  11.883
  217   HH21  ARG  25          2HH2      ARG  25   3.302  -3.248  12.245
  218   HH22  ARG  25          1HH2      ARG  25   4.994  -3.281  12.608
  219    H    ILE  26           HN       ILE  26   1.387  -7.765   6.090
  220    HA   ILE  26           HA       ILE  26   0.471  -5.127   6.130
  221    HB   ILE  26           HB       ILE  26   1.055  -6.883   3.744
  222   HG12  ILE  26          2HG1      ILE  26   2.759  -4.863   5.218
  223   HG13  ILE  26          3HG1      ILE  26   2.960  -6.611   5.263
  224   HG21  ILE  26          1HG2      ILE  26   1.509  -4.115   3.247
  225   HG22  ILE  26          2HG2      ILE  26   0.408  -5.221   2.427
  226   HG23  ILE  26          3HG2      ILE  26  -0.138  -4.323   3.843
  227   HD11  ILE  26          3HD1      ILE  26   4.435  -5.109   3.707
  228   HD12  ILE  26          1HD1      ILE  26   3.876  -6.695   3.177
  229   HD13  ILE  26          2HD1      ILE  26   3.044  -5.238   2.631
  230    H    LEU  27           HN       LEU  27  -0.896  -7.899   4.345
  231    HA   LEU  27           HA       LEU  27  -3.157  -6.609   3.362
  232    HB2  LEU  27           2HB      LEU  27  -2.530  -9.465   3.994
  233    HB3  LEU  27           3HB      LEU  27  -4.143  -9.007   3.452
  234    HG   LEU  27           HG       LEU  27  -1.702  -8.307   1.851
  235   HD11  LEU  27          1HD1      LEU  27  -1.540 -10.352   0.908
  236   HD12  LEU  27          2HD1      LEU  27  -3.258 -10.698   1.095
  237   HD13  LEU  27          3HD1      LEU  27  -2.170 -10.873   2.471
  238   HD21  LEU  27          3HD2      LEU  27  -3.751  -8.818   0.141
  239   HD22  LEU  27          1HD2      LEU  27  -3.340  -7.221   0.768
  240   HD23  LEU  27          2HD2      LEU  27  -4.615  -8.167   1.535
  241    H    ARG  28           HN       ARG  28  -2.657  -8.299   6.428
  242    HA   ARG  28           HA       ARG  28  -5.353  -8.058   7.308
  243    HB2  ARG  28           2HB      ARG  28  -4.002  -9.775   8.278
  244    HB3  ARG  28           3HB      ARG  28  -2.774  -8.616   8.768
  245    HG2  ARG  28           2HG      ARG  28  -4.509  -7.588  10.276
  246    HG3  ARG  28           3HG      ARG  28  -5.525  -8.985   9.915
  247    HD2  ARG  28           2HD      ARG  28  -2.731  -9.467  10.813
  248    HD3  ARG  28           3HD      ARG  28  -3.910  -8.936  12.011
  249    HE   ARG  28           HE       ARG  28  -3.697 -11.524  10.886
  250   HH11  ARG  28          2HH1      ARG  28  -6.040  -9.176  11.942
  251   HH12  ARG  28          1HH1      ARG  28  -7.247 -10.359  12.324
  252   HH21  ARG  28          2HH2      ARG  28  -5.278 -13.091  11.384
  253   HH22  ARG  28          1HH2      ARG  28  -6.812 -12.585  12.007
  254    H    PHE  29           HN       PHE  29  -2.671  -5.916   7.234
  255    HA   PHE  29           HA       PHE  29  -3.657  -4.191   9.336
  256    HB2  PHE  29           2HB      PHE  29  -1.291  -4.257   9.131
  257    HB3  PHE  29           3HB      PHE  29  -1.361  -3.989   7.392
  258    HD1  PHE  29           1HD      PHE  29  -1.745  -2.411  10.691
  259    HD2  PHE  29           2HD      PHE  29  -1.534  -1.797   6.485
  260    HE1  PHE  29           1HE      PHE  29  -1.485   0.007  11.061
  261    HE2  PHE  29           2HE      PHE  29  -1.272   0.622   6.847
  262    HZ   PHE  29           HZ       PHE  29  -1.246   1.527   9.138
  263    H    LEU  30           HN       LEU  30  -3.755  -4.370   5.846
  264    HA   LEU  30           HA       LEU  30  -4.963  -1.732   5.619
  265    HB2  LEU  30           2HB      LEU  30  -4.123  -3.819   3.630
  266    HB3  LEU  30           3HB      LEU  30  -5.078  -2.415   3.157
  267    HG   LEU  30           HG       LEU  30  -2.528  -1.953   4.622
  268   HD11  LEU  30          1HD1      LEU  30  -2.549  -3.603   2.392
  269   HD12  LEU  30          2HD1      LEU  30  -1.165  -2.732   3.050
  270   HD13  LEU  30          3HD1      LEU  30  -2.128  -2.011   1.760
  271   HD21  LEU  30          3HD2      LEU  30  -2.730  -0.234   2.490
  272   HD22  LEU  30          1HD2      LEU  30  -3.254   0.103   4.139
  273   HD23  LEU  30          2HD2      LEU  30  -4.414  -0.489   2.950
  274    H    ARG  31           HN       ARG  31  -5.913  -5.012   5.906
  275    HA   ARG  31           HA       ARG  31  -8.565  -4.537   4.795
  276    HB2  ARG  31           2HB      ARG  31  -8.858  -6.826   4.770
  277    HB3  ARG  31           3HB      ARG  31  -7.114  -6.709   4.578
  278    HG2  ARG  31           2HG      ARG  31  -7.002  -6.954   7.121
  279    HG3  ARG  31           3HG      ARG  31  -8.683  -7.480   7.010
  280    HD2  ARG  31           2HD      ARG  31  -8.062  -9.288   5.535
  281    HD3  ARG  31           3HD      ARG  31  -6.393  -8.720   5.493
  282    HE   ARG  31           HE       ARG  31  -7.198  -9.246   8.155
  283   HH11  ARG  31          2HH1      ARG  31  -6.286 -10.838   5.197
  284   HH12  ARG  31          1HH1      ARG  31  -5.679 -12.253   5.992
  285   HH21  ARG  31          2HH2      ARG  31  -6.403 -11.103   9.214
  286   HH22  ARG  31          1HH2      ARG  31  -5.747 -12.403   8.277
  287    H    GLU  32           HN       GLU  32  -6.958  -4.402   7.790
  288    HA   GLU  32           HA       GLU  32  -9.492  -4.607   9.268
  289    HB2  GLU  32           2HB      GLU  32  -6.623  -4.815  10.180
  290    HB3  GLU  32           3HB      GLU  32  -7.978  -4.704  11.294
  291    HG2  GLU  32           2HG      GLU  32  -8.063  -6.807   9.204
  292    HG3  GLU  32           3HG      GLU  32  -6.956  -7.020  10.559
  293    H    ARG  33           HN       ARG  33  -6.472  -2.709   9.428
  294    HA   ARG  33           HA       ARG  33  -7.645  -0.569  10.861
  295    HB2  ARG  33           2HB      ARG  33  -5.155  -0.479   9.151
  296    HB3  ARG  33           3HB      ARG  33  -5.574   0.611  10.466
  297    HG2  ARG  33           2HG      ARG  33  -5.314  -2.309  11.009
  298    HG3  ARG  33           3HG      ARG  33  -3.865  -1.315  10.843
  299    HD2  ARG  33           2HD      ARG  33  -4.270  -1.213  13.116
  300    HD3  ARG  33           3HD      ARG  33  -5.055   0.253  12.531
  301    HE   ARG  33           HE       ARG  33  -7.065  -0.611  13.192
  302   HH11  ARG  33          2HH1      ARG  33  -4.729  -3.186  13.022
  303   HH12  ARG  33          1HH1      ARG  33  -5.786  -4.367  13.724
  304   HH21  ARG  33          2HH2      ARG  33  -8.466  -2.156  14.117
  305   HH22  ARG  33          1HH2      ARG  33  -7.911  -3.779  14.346
  306    H    VAL  34           HN       VAL  34  -6.235  -0.344   7.600
  307    HA   VAL  34           HA       VAL  34  -7.490   1.991   6.834
  308    HB   VAL  34           HB       VAL  34  -6.739  -0.324   5.043
  309   HG11  VAL  34          1HG1      VAL  34  -7.148   0.953   3.234
  310   HG12  VAL  34          2HG1      VAL  34  -8.244   1.805   4.324
  311   HG13  VAL  34          3HG1      VAL  34  -6.623   2.436   4.032
  312   HG21  VAL  34          3HG2      VAL  34  -5.190   1.900   6.283
  313   HG22  VAL  34          1HG2      VAL  34  -4.741   0.212   6.038
  314   HG23  VAL  34          2HG2      VAL  34  -4.735   1.333   4.677
  315    H    ALA  35           HN       ALA  35  -8.636  -1.340   6.495
  316    HA   ALA  35           HA       ALA  35 -10.888  -0.913   4.937
  317    HB1  ALA  35           1HB      ALA  35 -10.697  -2.884   7.209
  318    HB2  ALA  35           2HB      ALA  35 -11.727  -2.992   5.780
  319    HB3  ALA  35           3HB      ALA  35  -9.976  -3.128   5.618
  320    H    THR  36           HN       THR  36 -10.597  -0.788   8.479
  321    HA   THR  36           HA       THR  36 -13.318  -0.100   8.922
  322    HB   THR  36           HB       THR  36 -12.655   0.404  11.214
  323    HG1  THR  36           1HG      THR  36 -10.379   0.228  11.736
  324   HG21  THR  36          3HG2      THR  36 -12.823  -1.829  11.343
  325   HG22  THR  36          1HG2      THR  36 -11.060  -1.833  11.358
  326   HG23  THR  36          2HG2      THR  36 -11.930  -2.070   9.842
  327    H    LEU  37           HN       LEU  37 -10.358   1.862   9.306
  328    HA   LEU  37           HA       LEU  37 -11.301   4.300   9.855
  329    HB2  LEU  37           2HB      LEU  37  -9.280   3.726   7.693
  330    HB3  LEU  37           3HB      LEU  37  -9.500   5.276   8.503
  331    HG   LEU  37           HG       LEU  37  -8.723   2.777   9.987
  332   HD11  LEU  37          1HD1      LEU  37  -6.568   2.977   9.424
  333   HD12  LEU  37          2HD1      LEU  37  -6.622   4.739   9.453
  334   HD13  LEU  37          3HD1      LEU  37  -7.173   3.864   8.024
  335   HD21  LEU  37          3HD2      LEU  37  -8.531   4.091  11.796
  336   HD22  LEU  37          1HD2      LEU  37  -9.603   5.174  10.908
  337   HD23  LEU  37          2HD2      LEU  37  -7.860   5.437  10.875
  338    H    GLU  38           HN       GLU  38 -12.837   5.585   9.095
  339    HA   GLU  38           HA       GLU  38 -14.423   5.093   6.899
  340    HB2  GLU  38           2HB      GLU  38 -14.715   6.776   8.857
  341    HB3  GLU  38           3HB      GLU  38 -13.892   7.909   7.793
  342    HG2  GLU  38           2HG      GLU  38 -15.713   7.102   6.076
  343    HG3  GLU  38           3HG      GLU  38 -16.589   6.692   7.549
  344    H    ASP  39           HN       ASP  39 -11.446   6.957   7.086
  345    HA   ASP  39           HA       ASP  39 -11.442   7.108   4.145
  346    HB2  ASP  39           2HB      ASP  39 -10.379   9.225   6.028
  347    HB3  ASP  39           3HB      ASP  39 -10.348   9.287   4.268
  348    HA   PRO  40           HA       PRO  40  -7.574   5.020   4.445
  349    HB2  PRO  40           2HB      PRO  40  -6.599   5.621   1.984
  350    HB3  PRO  40           3HB      PRO  40  -7.893   4.444   2.244
  351    HG2  PRO  40           2HG      PRO  40  -8.079   7.306   1.386
  352    HG3  PRO  40           3HG      PRO  40  -8.953   5.893   0.766
  353    HD2  PRO  40           2HD      PRO  40 -10.061   7.642   2.512
  354    HD3  PRO  40           3HD      PRO  40 -10.471   5.915   2.501
  355    H    ARG  41           HN       ARG  41  -7.899   8.404   4.082
  356    HA   ARG  41           HA       ARG  41  -5.030   8.902   4.209
  357    HB2  ARG  41           2HB      ARG  41  -7.367  10.820   4.113
  358    HB3  ARG  41           3HB      ARG  41  -5.671  11.285   4.067
  359    HG2  ARG  41           2HG      ARG  41  -5.393  10.074   1.964
  360    HG3  ARG  41           3HG      ARG  41  -7.095   9.607   2.011
  361    HD2  ARG  41           2HD      ARG  41  -6.570  11.574   0.545
  362    HD3  ARG  41           3HD      ARG  41  -7.804  11.863   1.771
  363    HE   ARG  41           HE       ARG  41  -5.251  12.605   2.739
  364   HH11  ARG  41          2HH1      ARG  41  -7.763  13.631   0.558
  365   HH12  ARG  41          1HH1      ARG  41  -7.373  15.313   0.693
  366   HH21  ARG  41          2HH2      ARG  41  -4.728  14.818   2.924
  367   HH22  ARG  41          1HH2      ARG  41  -5.646  15.987   2.038
  368    H    SER  42           HN       SER  42  -5.850   7.527   6.412
  369    HA   SER  42           HA       SER  42  -5.985   9.564   8.535
  370    HB2  SER  42           2HB      SER  42  -7.875   8.001   8.564
  371    HB3  SER  42           3HB      SER  42  -6.759   6.637   8.643
  372    HG   SER  42           HG       SER  42  -5.984   7.972  10.617
  373    H    LEU  43           HN       LEU  43  -4.361   6.620   7.470
  374    HA   LEU  43           HA       LEU  43  -2.378   6.928   9.606
  375    HB2  LEU  43           2HB      LEU  43  -2.719   4.677   7.631
  376    HB3  LEU  43           3HB      LEU  43  -1.632   4.699   9.017
  377    HG   LEU  43           HG       LEU  43  -4.642   4.761   9.199
  378   HD11  LEU  43          1HD1      LEU  43  -3.568   2.385  10.265
  379   HD12  LEU  43          2HD1      LEU  43  -2.870   2.590   8.658
  380   HD13  LEU  43          3HD1      LEU  43  -4.622   2.572   8.863
  381   HD21  LEU  43          3HD2      LEU  43  -2.661   4.143  11.371
  382   HD22  LEU  43          1HD2      LEU  43  -4.378   4.515  11.520
  383   HD23  LEU  43          2HD2      LEU  43  -3.239   5.780  11.061
  384    H    GLY  44           HN       GLY  44  -2.157   5.853   6.212
  385    HA2  GLY  44           1HA      GLY  44   0.473   6.518   5.766
  386    HA3  GLY  44           2HA      GLY  44  -0.758   6.514   4.511
  387    H    GLU  45           HN       GLU  45   1.297   8.244   4.256
  388    HA   GLU  45           HA       GLU  45   0.051  10.838   4.887
  389    HB2  GLU  45           2HB      GLU  45   2.212  11.829   5.194
  390    HB3  GLU  45           3HB      GLU  45   2.126  10.397   6.210
  391    HG2  GLU  45           2HG      GLU  45   3.423   9.142   4.583
  392    HG3  GLU  45           3HG      GLU  45   3.482  10.553   3.527
  393    HA   PRO  46           HA       PRO  46   0.077  11.607   0.557
  394    HB2  PRO  46           2HB      PRO  46   0.066  14.322   0.584
  395    HB3  PRO  46           3HB      PRO  46  -1.349  13.351   1.007
  396    HG2  PRO  46           2HG      PRO  46   0.638  14.686   2.804
  397    HG3  PRO  46           3HG      PRO  46  -1.128  14.612   2.948
  398    HD2  PRO  46           2HD      PRO  46   0.519  13.011   4.382
  399    HD3  PRO  46           3HD      PRO  46  -1.092  12.490   3.847
  400    H    LEU  47           HN       LEU  47   1.475  12.082  -1.107
  401    HA   LEU  47           HA       LEU  47   4.247  12.363  -0.419
  402    HB2  LEU  47           2HB      LEU  47   3.446  10.910  -2.248
  403    HB3  LEU  47           3HB      LEU  47   2.932  12.345  -3.132
  404    HG   LEU  47           HG       LEU  47   5.322  13.077  -3.180
  405   HD11  LEU  47          1HD1      LEU  47   5.913  11.568  -1.201
  406   HD12  LEU  47          2HD1      LEU  47   7.065  11.665  -2.533
  407   HD13  LEU  47          3HD1      LEU  47   6.002  10.266  -2.387
  408   HD21  LEU  47          3HD2      LEU  47   5.085  10.367  -4.429
  409   HD22  LEU  47          1HD2      LEU  47   5.814  11.836  -5.076
  410   HD23  LEU  47          2HD2      LEU  47   4.059  11.698  -4.967
  411    H    ARG  48           HN       ARG  48   5.676  13.976  -1.356
  412    HA   ARG  48           HA       ARG  48   4.342  16.553  -1.859
  413    HB2  ARG  48           2HB      ARG  48   5.401  16.260   0.463
  414    HB3  ARG  48           3HB      ARG  48   6.948  16.313  -0.372
  415    HG2  ARG  48           2HG      ARG  48   6.673  18.503   0.269
  416    HG3  ARG  48           3HG      ARG  48   6.035  18.526  -1.376
  417    HD2  ARG  48           2HD      ARG  48   4.400  19.668  -0.217
  418    HD3  ARG  48           3HD      ARG  48   3.763  18.024  -0.218
  419    HE   ARG  48           HE       ARG  48   3.947  18.011   2.054
  420   HH11  ARG  48          2HH1      ARG  48   6.022  20.502   0.784
  421   HH12  ARG  48          1HH1      ARG  48   6.461  21.114   2.344
  422   HH21  ARG  48          2HH2      ARG  48   4.517  18.808   4.114
  423   HH22  ARG  48          1HH2      ARG  48   5.605  20.149   4.238
  424    H    GLY  49           HN       GLY  49   5.442  18.013  -3.232
  425    HA2  GLY  49           1HA      GLY  49   7.905  17.904  -4.350
  426    HA3  GLY  49           2HA      GLY  49   7.019  16.689  -5.260
  427    HA   PRO  50           HA       PRO  50   6.466  20.898  -7.226
  428    HB2  PRO  50           2HB      PRO  50   7.351  20.167  -9.686
  429    HB3  PRO  50           3HB      PRO  50   8.427  20.763  -8.417
  430    HG2  PRO  50           2HG      PRO  50   7.872  17.945  -9.261
  431    HG3  PRO  50           3HG      PRO  50   9.421  18.708  -8.860
  432    HD2  PRO  50           2HD      PRO  50   8.079  17.132  -7.115
  433    HD3  PRO  50           3HD      PRO  50   9.079  18.502  -6.590
  434    H    GLU  51           HN       GLU  51   5.988  17.719  -8.776
  435    HA   GLU  51           HA       GLU  51   3.304  18.627  -9.588
  436    HB2  GLU  51           2HB      GLU  51   3.461  17.246 -11.556
  437    HB3  GLU  51           3HB      GLU  51   4.869  18.297 -11.491
  438    HG2  GLU  51           2HG      GLU  51   5.980  16.253 -10.310
  439    HG3  GLU  51           3HG      GLU  51   4.683  15.352 -11.093
  440    H    LEU  52           HN       LEU  52   5.210  16.196  -8.045
  441    HA   LEU  52           HA       LEU  52   3.210  14.152  -8.023
  442    HB2  LEU  52           2HB      LEU  52   5.853  14.585  -6.739
  443    HB3  LEU  52           3HB      LEU  52   4.767  13.404  -6.008
  444    HG   LEU  52           HG       LEU  52   6.195  12.179  -7.420
  445   HD11  LEU  52          1HD1      LEU  52   4.689  11.055  -8.735
  446   HD12  LEU  52          2HD1      LEU  52   3.901  12.532  -9.289
  447   HD13  LEU  52          3HD1      LEU  52   3.601  11.931  -7.658
  448   HD21  LEU  52          3HD2      LEU  52   7.206  13.888  -8.721
  449   HD22  LEU  52          1HD2      LEU  52   5.669  14.318  -9.471
  450   HD23  LEU  52          2HD2      LEU  52   6.433  12.775  -9.852
  451    H    GLY  53           HN       GLY  53   2.190  13.321  -6.052
  452    HA2  GLY  53           1HA      GLY  53   1.982  14.355  -3.584
  453    HA3  GLY  53           2HA      GLY  53   1.049  15.509  -4.524
  454    H    ARG  54           HN       ARG  54   0.131  13.399  -6.386
  455    HA   ARG  54           HA       ARG  54  -2.158  12.565  -4.840
  456    HB2  ARG  54           2HB      ARG  54  -2.150  13.393  -7.278
  457    HB3  ARG  54           3HB      ARG  54  -1.590  11.777  -7.687
  458    HG2  ARG  54           2HG      ARG  54  -3.898  11.694  -7.992
  459    HG3  ARG  54           3HG      ARG  54  -3.638  10.935  -6.420
  460    HD2  ARG  54           2HD      ARG  54  -4.227  13.020  -5.305
  461    HD3  ARG  54           3HD      ARG  54  -4.448  13.805  -6.868
  462    HE   ARG  54           HE       ARG  54  -6.159  11.745  -7.025
  463   HH11  ARG  54          2HH1      ARG  54  -5.617  14.144  -4.561
  464   HH12  ARG  54          1HH1      ARG  54  -7.260  14.140  -4.012
  465   HH21  ARG  54          2HH2      ARG  54  -8.326  11.730  -6.311
  466   HH22  ARG  54          1HH2      ARG  54  -8.800  12.766  -5.007
  467    H    PHE  55           HN       PHE  55  -0.312  11.306  -3.558
  468    HA   PHE  55           HA       PHE  55  -0.772   8.522  -4.159
  469    HB2  PHE  55           2HB      PHE  55   2.042   9.633  -4.148
  470    HB3  PHE  55           3HB      PHE  55   1.637   7.920  -4.133
  471    HD1  PHE  55           2HD      PHE  55   1.403  11.021  -6.129
  472    HD2  PHE  55           1HD      PHE  55   1.123   6.774  -6.118
  473    HE1  PHE  55           2HE      PHE  55   1.326  11.022  -8.588
  474    HE2  PHE  55           1HE      PHE  55   1.046   6.769  -8.577
  475    HZ   PHE  55           HZ       PHE  55   1.147   8.895  -9.815
  476    H    TRP  56           HN       TRP  56  -1.287   7.634  -2.284
  477    HA   TRP  56           HA       TRP  56  -0.296   8.840   0.192
  478    HB2  TRP  56           2HB      TRP  56  -2.802   8.215  -0.401
  479    HB3  TRP  56           3HB      TRP  56  -2.303   6.629   0.183
  480    HD1  TRP  56           1HD      TRP  56  -1.986   6.327   2.774
  481    HE1  TRP  56           1HE      TRP  56  -2.495   7.824   4.805
  482    HE3  TRP  56           3HE      TRP  56  -2.818  10.743   0.338
  483    HZ2  TRP  56           2HZ      TRP  56  -3.161  10.521   5.307
  484    HZ3  TRP  56           3HZ      TRP  56  -3.386  12.735   1.667
  485    HH2  TRP  56           2HH      TRP  56  -3.554  12.623   4.100
  486    H    LYS  57           HN       LYS  57   1.170   7.882   1.448
  487    HA   LYS  57           HA       LYS  57   1.918   5.103   0.820
  488    HB2  LYS  57           2HB      LYS  57   3.611   7.320   1.988
  489    HB3  LYS  57           3HB      LYS  57   4.154   5.670   1.712
  490    HG2  LYS  57           2HG      LYS  57   4.978   6.744  -0.139
  491    HG3  LYS  57           3HG      LYS  57   3.437   6.135  -0.747
  492    HD2  LYS  57           2HD      LYS  57   3.292   8.297  -1.464
  493    HD3  LYS  57           3HD      LYS  57   2.582   8.481   0.141
  494    HE2  LYS  57           2HE      LYS  57   5.528   8.767  -0.133
  495    HE3  LYS  57           3HE      LYS  57   4.510  10.075  -0.733
  496    HZ1  LYS  57           3HZ      LYS  57   5.286   9.620   1.881
  497    HZ2  LYS  57           1HZ      LYS  57   3.636   9.250   1.827
  498    HZ3  LYS  57           2HZ      LYS  57   4.178  10.773   1.328
  499    H    TYR  58           HN       TYR  58   1.912   3.605   2.402
  500    HA   TYR  58           HA       TYR  58   1.073   4.496   5.075
  501    HB2  TYR  58           2HB      TYR  58   0.766   1.816   3.707
  502    HB3  TYR  58           3HB      TYR  58   0.291   2.143   5.369
  503    HD1  TYR  58           1HD      TYR  58  -1.514   3.865   5.793
  504    HD2  TYR  58           2HD      TYR  58  -0.666   2.341   1.912
  505    HE1  TYR  58           1HE      TYR  58  -3.717   4.634   5.016
  506    HE2  TYR  58           2HE      TYR  58  -2.866   3.107   1.124
  507    HH   TYR  58           HH       TYR  58  -4.561   5.193   2.142
  508    H    ARG  59           HN       ARG  59   1.935   3.363   6.934
  509    HA   ARG  59           HA       ARG  59   4.642   2.295   6.467
  510    HB2  ARG  59           2HB      ARG  59   5.351   3.337   8.560
  511    HB3  ARG  59           3HB      ARG  59   4.735   4.544   7.439
  512    HG2  ARG  59           2HG      ARG  59   2.570   4.485   8.655
  513    HG3  ARG  59           3HG      ARG  59   3.314   3.402   9.833
  514    HD2  ARG  59           2HD      ARG  59   3.378   5.656  10.677
  515    HD3  ARG  59           3HD      ARG  59   5.017   5.134  10.291
  516    HE   ARG  59           HE       ARG  59   4.227   6.404   8.038
  517   HH11  ARG  59          2HH1      ARG  59   4.243   7.291  11.405
  518   HH12  ARG  59          1HH1      ARG  59   4.455   8.982  11.093
  519   HH21  ARG  59          2HH2      ARG  59   4.506   8.628   7.614
  520   HH22  ARG  59          1HH2      ARG  59   4.604   9.742   8.936
  521    H    VAL  60           HN       VAL  60   4.797   0.236   7.028
  522    HA   VAL  60           HA       VAL  60   3.073  -0.771   9.197
  523    HB   VAL  60           HB       VAL  60   4.149  -2.189   6.762
  524   HG11  VAL  60          1HG1      VAL  60   3.483  -3.253   9.377
  525   HG12  VAL  60          2HG1      VAL  60   2.497  -3.962   8.097
  526   HG13  VAL  60          3HG1      VAL  60   4.257  -4.039   8.001
  527   HG21  VAL  60          3HG2      VAL  60   2.150  -0.977   6.288
  528   HG22  VAL  60          1HG2      VAL  60   1.711  -2.679   6.434
  529   HG23  VAL  60          2HG2      VAL  60   1.374  -1.564   7.758
  530    H    GLY  61           HN       GLY  61   4.486  -0.409  10.899
  531    HA2  GLY  61           1HA      GLY  61   6.218  -0.868  12.334
  532    HA3  GLY  61           2HA      GLY  61   6.323  -2.418  11.512
  533    H    ASP  62           HN       ASP  62   7.705  -2.606   9.666
  534    HA   ASP  62           HA       ASP  62   9.694  -0.457   9.402
  535    HB2  ASP  62           2HB      ASP  62  10.254  -3.403   9.782
  536    HB3  ASP  62           3HB      ASP  62  11.461  -2.242   9.238
  537    H    TYR  63           HN       TYR  63   7.529  -0.916   7.686
  538    HA   TYR  63           HA       TYR  63   8.972  -1.520   5.225
  539    HB2  TYR  63           2HB      TYR  63   6.365  -2.849   5.989
  540    HB3  TYR  63           3HB      TYR  63   7.079  -2.903   4.381
  541    HD1  TYR  63           1HD      TYR  63   7.938  -3.676   7.934
  542    HD2  TYR  63           2HD      TYR  63   8.443  -4.690   3.833
  543    HE1  TYR  63           1HE      TYR  63   9.246  -5.652   8.590
  544    HE2  TYR  63           2HE      TYR  63   9.752  -6.670   4.478
  545    HH   TYR  63           HH       TYR  63   9.735  -8.153   6.977
  546    H    ARG  64           HN       ARG  64   8.296  -0.345   3.477
  547    HA   ARG  64           HA       ARG  64   6.224   1.668   4.021
  548    HB2  ARG  64           2HB      ARG  64   8.674   1.672   2.283
  549    HB3  ARG  64           3HB      ARG  64   7.363   2.806   1.988
  550    HG2  ARG  64           2HG      ARG  64   8.736   2.542   4.648
  551    HG3  ARG  64           3HG      ARG  64   9.261   3.663   3.390
  552    HD2  ARG  64           2HD      ARG  64   6.469   3.610   4.519
  553    HD3  ARG  64           3HD      ARG  64   7.753   4.641   5.149
  554    HE   ARG  64           HE       ARG  64   7.398   4.960   2.336
  555   HH11  ARG  64          2HH1      ARG  64   6.135   5.875   5.448
  556   HH12  ARG  64          1HH1      ARG  64   5.456   7.364   4.880
  557   HH21  ARG  64          2HH2      ARG  64   6.507   6.917   1.575
  558   HH22  ARG  64          1HH2      ARG  64   5.667   7.955   2.676
  559    H    LEU  65           HN       LEU  65   4.421   1.751   2.824
  560    HA   LEU  65           HA       LEU  65   4.294   0.082   0.400
  561    HB2  LEU  65           2HB      LEU  65   1.930   0.608   2.167
  562    HB3  LEU  65           3HB      LEU  65   2.129  -0.635   0.934
  563    HG   LEU  65           HG       LEU  65   3.626  -0.597   3.552
  564   HD11  LEU  65          1HD1      LEU  65   2.088  -2.311   4.302
  565   HD12  LEU  65          2HD1      LEU  65   1.187  -2.198   2.790
  566   HD13  LEU  65          3HD1      LEU  65   1.206  -0.835   3.909
  567   HD21  LEU  65          3HD2      LEU  65   3.306  -2.672   1.388
  568   HD22  LEU  65          1HD2      LEU  65   4.038  -2.973   2.965
  569   HD23  LEU  65          2HD2      LEU  65   4.787  -1.831   1.849
  570    H    ILE  66           HN       ILE  66   4.096   1.326  -1.332
  571    HA   ILE  66           HA       ILE  66   2.947   3.987  -1.115
  572    HB   ILE  66           HB       ILE  66   3.955   2.731  -3.654
  573   HG12  ILE  66          2HG1      ILE  66   5.613   2.518  -1.730
  574   HG13  ILE  66          3HG1      ILE  66   6.182   3.375  -3.158
  575   HG21  ILE  66          1HG2      ILE  66   3.112   4.727  -4.306
  576   HG22  ILE  66          2HG2      ILE  66   3.274   5.443  -2.703
  577   HG23  ILE  66          3HG2      ILE  66   4.683   5.306  -3.754
  578   HD11  ILE  66          3HD1      ILE  66   6.826   4.429  -1.013
  579   HD12  ILE  66          1HD1      ILE  66   5.898   5.486  -2.076
  580   HD13  ILE  66          2HD1      ILE  66   5.117   4.723  -0.691
  581    H    CYS  67           HN       CYS  67   0.778   3.995  -1.077
  582    HA   CYS  67           HA       CYS  67  -0.652   2.365  -3.067
  583    HB2  CYS  67           2HB      CYS  67  -1.445   3.398  -0.355
  584    HB3  CYS  67           3HB      CYS  67  -2.660   2.907  -1.530
  585    HG   CYS  67           HG       CYS  67  -0.410   0.982   0.134
  586    H    HIS  68           HN       HIS  68  -2.579   3.328  -4.039
  587    HA   HIS  68           HA       HIS  68  -2.352   6.255  -4.298
  588    HB2  HIS  68           2HB      HIS  68  -1.578   4.872  -6.299
  589    HB3  HIS  68           3HB      HIS  68  -3.267   4.418  -6.509
  590    HD2  HIS  68           2HD      HIS  68  -2.479   8.112  -5.578
  591    HE1  HIS  68           1HE      HIS  68  -3.637   7.979  -9.657
  592    HE2  HIS  68           2HE      HIS  68  -3.014   9.462  -7.719
  593    H    ILE  69           HN       ILE  69  -4.017   6.995  -3.116
  594    HA   ILE  69           HA       ILE  69  -6.515   5.645  -2.881
  595    HB   ILE  69           HB       ILE  69  -5.781   8.490  -2.179
  596   HG12  ILE  69          2HG1      ILE  69  -6.025   6.034  -0.428
  597   HG13  ILE  69          3HG1      ILE  69  -4.504   6.734  -0.972
  598   HG21  ILE  69          1HG2      ILE  69  -7.938   7.430  -0.636
  599   HG22  ILE  69          2HG2      ILE  69  -7.908   8.857  -1.671
  600   HG23  ILE  69          3HG2      ILE  69  -8.321   7.284  -2.351
  601   HD11  ILE  69          3HD1      ILE  69  -5.335   7.288   1.383
  602   HD12  ILE  69          1HD1      ILE  69  -4.748   8.609   0.373
  603   HD13  ILE  69          2HD1      ILE  69  -6.482   8.357   0.576
  604    H    GLN  70           HN       GLN  70  -8.021   5.540  -4.398
  605    HA   GLN  70           HA       GLN  70  -8.175   7.664  -6.413
  606    HB2  GLN  70           2HB      GLN  70  -9.337   4.874  -6.395
  607    HB3  GLN  70           3HB      GLN  70  -9.551   6.038  -7.695
  608    HG2  GLN  70           2HG      GLN  70  -6.995   6.091  -7.813
  609    HG3  GLN  70           3HG      GLN  70  -7.056   4.622  -6.840
  610   HE21  GLN  70          1HE2      GLN  70  -5.995   4.813  -9.449
  611   HE22  GLN  70          2HE2      GLN  70  -6.952   3.817 -10.486
  612    H    ASP  71           HN       ASP  71  -9.361   9.236  -5.384
  613    HA   ASP  71           HA       ASP  71 -11.578   8.901  -3.755
  614    HB2  ASP  71           2HB      ASP  71 -10.483  11.051  -3.962
  615    HB3  ASP  71           3HB      ASP  71 -10.934  11.158  -5.662
  616    H    ARG  72           HN       ARG  72 -11.385   9.056  -7.274
  617    HA   ARG  72           HA       ARG  72 -13.889   9.394  -8.143
  618    HB2  ARG  72           2HB      ARG  72 -11.956   7.235  -8.984
  619    HB3  ARG  72           3HB      ARG  72 -13.448   7.573  -9.851
  620    HG2  ARG  72           2HG      ARG  72 -12.553   9.997  -9.961
  621    HG3  ARG  72           3HG      ARG  72 -10.995   9.256  -9.588
  622    HD2  ARG  72           2HD      ARG  72 -11.209   7.803 -11.534
  623    HD3  ARG  72           3HD      ARG  72 -12.786   8.505 -11.895
  624    HE   ARG  72           HE       ARG  72 -11.738  10.362 -12.762
  625   HH11  ARG  72          2HH1      ARG  72  -9.425   8.370 -11.088
  626   HH12  ARG  72          1HH1      ARG  72  -8.050   9.239 -11.683
  627   HH21  ARG  72          2HH2      ARG  72  -9.935  11.515 -13.552
  628   HH22  ARG  72          1HH2      ARG  72  -8.341  11.028 -13.084
  629    H    GLU  73           HN       GLU  73 -12.733   6.168  -7.137
  630    HA   GLU  73           HA       GLU  73 -15.505   5.534  -6.363
  631    HB2  GLU  73           2HB      GLU  73 -13.482   3.892  -7.847
  632    HB3  GLU  73           3HB      GLU  73 -14.715   3.100  -6.876
  633    HG2  GLU  73           2HG      GLU  73 -16.460   4.179  -8.174
  634    HG3  GLU  73           3HG      GLU  73 -15.243   5.025  -9.128
  635    H    ALA  74           HN       ALA  74 -13.303   6.620  -4.757
  636    HA   ALA  74           HA       ALA  74 -12.085   6.200  -2.847
  637    HB1  ALA  74           1HB      ALA  74 -13.532   6.026  -1.135
  638    HB2  ALA  74           2HB      ALA  74 -14.751   6.094  -2.408
  639    HB3  ALA  74           3HB      ALA  74 -14.247   4.537  -1.752
  640    H    THR  75           HN       THR  75 -11.034   4.534  -4.611
  641    HA   THR  75           HA       THR  75 -10.830   1.967  -3.175
  642    HB   THR  75           HB       THR  75 -10.701   2.452  -6.154
  643    HG1  THR  75           1HG      THR  75 -12.714   1.844  -5.997
  644   HG21  THR  75          3HG2      THR  75  -9.298   0.722  -6.288
  645   HG22  THR  75          1HG2      THR  75 -10.590  -0.295  -5.652
  646   HG23  THR  75          2HG2      THR  75  -9.412   0.424  -4.554
  647    H    VAL  76           HN       VAL  76  -8.877   1.527  -2.399
  648    HA   VAL  76           HA       VAL  76  -6.622   3.195  -3.196
  649    HB   VAL  76           HB       VAL  76  -6.804   1.136  -0.992
  650   HG11  VAL  76          1HG1      VAL  76  -4.787   3.288  -0.922
  651   HG12  VAL  76          2HG1      VAL  76  -4.669   1.601  -0.417
  652   HG13  VAL  76          3HG1      VAL  76  -4.533   2.024  -2.124
  653   HG21  VAL  76          3HG2      VAL  76  -6.553   3.843  -0.087
  654   HG22  VAL  76          1HG2      VAL  76  -7.949   3.698  -1.154
  655   HG23  VAL  76          2HG2      VAL  76  -7.815   2.663   0.267
  656    H    LEU  77           HN       LEU  77  -5.177   2.541  -4.636
  657    HA   LEU  77           HA       LEU  77  -4.868  -0.352  -5.106
  658    HB2  LEU  77           2HB      LEU  77  -5.762   0.466  -7.081
  659    HB3  LEU  77           3HB      LEU  77  -4.874   1.985  -6.969
  660    HG   LEU  77           HG       LEU  77  -2.782   0.532  -7.393
  661   HD11  LEU  77          1HD1      LEU  77  -3.055  -1.541  -8.439
  662   HD12  LEU  77          2HD1      LEU  77  -4.783  -1.291  -8.687
  663   HD13  LEU  77          3HD1      LEU  77  -4.160  -1.594  -7.065
  664   HD21  LEU  77          3HD2      LEU  77  -4.839   1.007  -9.548
  665   HD22  LEU  77          1HD2      LEU  77  -3.125   0.695  -9.822
  666   HD23  LEU  77          2HD2      LEU  77  -3.630   2.159  -8.978
  667    H    VAL  78           HN       VAL  78  -2.961  -1.164  -4.565
  668    HA   VAL  78           HA       VAL  78  -0.805   0.475  -3.695
  669    HB   VAL  78           HB       VAL  78  -0.870  -2.492  -4.264
  670   HG11  VAL  78          1HG1      VAL  78   1.129  -2.536  -2.758
  671   HG12  VAL  78          2HG1      VAL  78   1.405  -1.771  -4.324
  672   HG13  VAL  78          3HG1      VAL  78   1.187  -0.778  -2.882
  673   HG21  VAL  78          3HG2      VAL  78  -0.699  -1.708  -1.491
  674   HG22  VAL  78          1HG2      VAL  78  -2.131  -1.022  -2.259
  675   HG23  VAL  78          2HG2      VAL  78  -1.863  -2.765  -2.290
  676    H    LEU  79           HN       LEU  79   1.243   0.757  -4.604
  677    HA   LEU  79           HA       LEU  79   1.409   0.184  -7.491
  678    HB2  LEU  79           2HB      LEU  79   2.222   2.593  -5.907
  679    HB3  LEU  79           3HB      LEU  79   2.989   2.229  -7.452
  680    HG   LEU  79           HG       LEU  79   0.008   2.497  -7.213
  681   HD11  LEU  79          1HD1      LEU  79   1.784   4.773  -8.006
  682   HD12  LEU  79          2HD1      LEU  79   1.322   4.524  -6.323
  683   HD13  LEU  79          3HD1      LEU  79   0.081   4.794  -7.546
  684   HD21  LEU  79          3HD2      LEU  79   0.919   1.477  -9.241
  685   HD22  LEU  79          1HD2      LEU  79   1.943   2.891  -9.494
  686   HD23  LEU  79          2HD2      LEU  79   0.188   3.046  -9.582
  687    H    ARG  80           HN       ARG  80   3.302   0.676  -4.528
  688    HA   ARG  80           HA       ARG  80   5.210  -1.325  -5.489
  689    HB2  ARG  80           2HB      ARG  80   5.907   1.462  -4.571
  690    HB3  ARG  80           3HB      ARG  80   7.075   0.147  -4.569
  691    HG2  ARG  80           2HG      ARG  80   5.578   0.771  -7.070
  692    HG3  ARG  80           3HG      ARG  80   6.936   1.788  -6.585
  693    HD2  ARG  80           2HD      ARG  80   7.037  -1.206  -6.942
  694    HD3  ARG  80           3HD      ARG  80   7.603  -0.022  -8.120
  695    HE   ARG  80           HE       ARG  80   8.931   0.567  -5.786
  696   HH11  ARG  80          2HH1      ARG  80   8.642  -2.191  -7.892
  697   HH12  ARG  80          1HH1      ARG  80  10.229  -2.790  -7.540
  698   HH21  ARG  80          2HH2      ARG  80  11.022  -0.213  -5.314
  699   HH22  ARG  80          1HH2      ARG  80  11.581  -1.665  -6.073
  700    H    VAL  81           HN       VAL  81   6.511  -2.263  -3.790
  701    HA   VAL  81           HA       VAL  81   5.691  -1.714  -1.047
  702    HB   VAL  81           HB       VAL  81   5.215  -4.339  -2.438
  703   HG11  VAL  81          1HG1      VAL  81   6.046  -5.368  -0.633
  704   HG12  VAL  81          2HG1      VAL  81   6.089  -3.877   0.310
  705   HG13  VAL  81          3HG1      VAL  81   4.592  -4.802   0.189
  706   HG21  VAL  81          3HG2      VAL  81   3.356  -2.792  -2.431
  707   HG22  VAL  81          1HG2      VAL  81   3.012  -4.136  -1.342
  708   HG23  VAL  81          2HG2      VAL  81   3.505  -2.574  -0.687
  709    H    GLY  82           HN       GLY  82   7.541  -1.484   0.018
  710    HA2  GLY  82           1HA      GLY  82   9.540  -3.569  -0.066
  711    HA3  GLY  82           2HA      GLY  82  10.075  -2.041  -0.751
  712    H    HIS  83           HN       HIS  83  11.218  -3.308   1.518
  713    HA   HIS  83           HA       HIS  83  10.315  -2.351   3.977
  714    HB2  HIS  83           2HB      HIS  83  12.170  -4.060   3.483
  715    HB3  HIS  83           3HB      HIS  83  13.235  -2.668   3.308
  716    HD2  HIS  83           2HD      HIS  83  11.931  -4.949   6.033
  717    HE1  HIS  83           1HE      HIS  83  13.457  -1.510   7.992
  718    HE2  HIS  83           2HE      HIS  83  12.708  -3.899   8.265
  719    H    ALA  84           HN       ALA  84  10.557  -0.476   5.084
  720    HA   ALA  84           HA       ALA  84  10.643   1.956   3.979
  721    HB1  ALA  84           1HB      ALA  84  11.317   2.888   6.091
  722    HB2  ALA  84           2HB      ALA  84  10.278   1.493   6.388
  723    HB3  ALA  84           3HB      ALA  84  12.024   1.350   6.589
  724    H    ARG  85           HN       ARG  85  13.566   0.275   5.135
  725    HA   ARG  85           HA       ARG  85  15.427   2.208   4.389
  726    HB2  ARG  85           2HB      ARG  85  15.802  -0.792   4.420
  727    HB3  ARG  85           3HB      ARG  85  17.086   0.408   4.456
  728    HG2  ARG  85           2HG      ARG  85  16.566   1.072   6.633
  729    HG3  ARG  85           3HG      ARG  85  14.969   0.323   6.574
  730    HD2  ARG  85           2HD      ARG  85  15.898  -1.861   6.683
  731    HD3  ARG  85           3HD      ARG  85  17.530  -1.250   6.410
  732    HE   ARG  85           HE       ARG  85  16.232  -0.261   8.796
  733   HH11  ARG  85          2HH1      ARG  85  18.297  -2.692   7.401
  734   HH12  ARG  85          1HH1      ARG  85  19.037  -3.115   8.909
  735   HH21  ARG  85          2HH2      ARG  85  17.199  -0.809  10.788
  736   HH22  ARG  85          1HH2      ARG  85  18.411  -2.045  10.836
  737    H    ASP  86           HN       ASP  86  14.218  -0.585   2.555
  738    HA   ASP  86           HA       ASP  86  15.785  -0.236   0.266
  739    HB2  ASP  86           2HB      ASP  86  14.247  -2.202   0.917
  740    HB3  ASP  86           3HB      ASP  86  12.958  -1.265   0.169
  741    H    VAL  87           HN       VAL  87  12.305   0.515   0.451
  742    HA   VAL  87           HA       VAL  87  11.970   1.973  -1.792
  743    HB   VAL  87           HB       VAL  87  10.818   2.654   0.916
  744   HG11  VAL  87          1HG1      VAL  87  10.707   4.479  -0.830
  745   HG12  VAL  87          2HG1      VAL  87   9.678   3.394  -1.768
  746   HG13  VAL  87          3HG1      VAL  87   9.161   3.942  -0.173
  747   HG21  VAL  87          3HG2      VAL  87   9.547   0.849   0.680
  748   HG22  VAL  87          1HG2      VAL  87   8.978   1.428  -0.886
  749   HG23  VAL  87          2HG2      VAL  87  10.431   0.434  -0.789
  750    H    TYR  88           HN       TYR  88  12.568   3.646   1.300
  751    HA   TYR  88           HA       TYR  88  14.160   5.628  -0.190
  752    HB2  TYR  88           2HB      TYR  88  11.927   6.002   1.740
  753    HB3  TYR  88           3HB      TYR  88  13.266   7.141   1.824
  754    HD1  TYR  88           1HD      TYR  88  14.029   7.621  -0.893
  755    HD2  TYR  88           2HD      TYR  88  10.131   7.010   0.699
  756    HE1  TYR  88           1HE      TYR  88  13.072   8.891  -2.768
  757    HE2  TYR  88           2HE      TYR  88   9.162   8.278  -1.173
  758    HH   TYR  88           HH       TYR  88  10.462  10.300  -2.892
  759    H    ARG  89           HN       ARG  89  16.206   5.211   0.367
  760    HA   ARG  89           HA       ARG  89  16.970   4.147   2.897
  761    HB2  ARG  89           2HB      ARG  89  18.416   5.152   0.483
  762    HB3  ARG  89           3HB      ARG  89  19.314   4.944   1.981
  763    HG2  ARG  89           2HG      ARG  89  18.823   2.618   2.047
  764    HG3  ARG  89           3HG      ARG  89  17.669   2.766   0.720
  765    HD2  ARG  89           2HD      ARG  89  19.847   1.812   0.026
  766    HD3  ARG  89           3HD      ARG  89  19.433   3.301  -0.823
  767    HE   ARG  89           HE       ARG  89  20.967   4.038   1.357
  768   HH11  ARG  89          2HH1      ARG  89  21.344   2.092  -1.505
  769   HH12  ARG  89          1HH1      ARG  89  23.046   2.388  -1.640
  770   HH21  ARG  89          2HH2      ARG  89  23.207   4.435   1.190
  771   HH22  ARG  89          1HH2      ARG  89  24.105   3.720  -0.106
  Start of MODEL    9
    1    H1   MET   1           HN       MET   1 -19.208   4.583   1.198
    2    HA   MET   1           HA       MET   1 -18.534   4.253   4.000
    3    HB2  MET   1           2HB      MET   1 -20.807   3.723   3.067
    4    HB3  MET   1           3HB      MET   1 -20.077   2.369   2.213
    5    HG2  MET   1           2HG      MET   1 -19.445   1.343   4.305
    6    HG3  MET   1           3HG      MET   1 -20.060   2.731   5.200
    7    HE1  MET   1           3HE      MET   1 -21.473   1.163   6.731
    8    HE2  MET   1           1HE      MET   1 -22.316   2.656   6.316
    9    HE3  MET   1           2HE      MET   1 -23.188   1.124   6.320
   10    H    GLY   2           HN       GLY   2 -16.291   3.913   3.929
   11    HA2  GLY   2           1HA      GLY   2 -14.489   2.472   4.070
   12    HA3  GLY   2           2HA      GLY   2 -15.531   1.177   3.502
   13    H    TYR   3           HN       TYR   3 -12.900   1.415   2.661
   14    HA   TYR   3           HA       TYR   3 -13.242   2.223  -0.153
   15    HB2  TYR   3           2HB      TYR   3 -10.883   2.502   1.685
   16    HB3  TYR   3           3HB      TYR   3 -10.653   2.424  -0.058
   17    HD1  TYR   3           2HD      TYR   3 -12.890   4.217   2.352
   18    HD2  TYR   3           1HD      TYR   3 -10.447   4.450  -1.125
   19    HE1  TYR   3           2HE      TYR   3 -13.363   6.625   2.188
   20    HE2  TYR   3           1HE      TYR   3 -10.914   6.859  -1.298
   21    HH   TYR   3           HH       TYR   3 -13.342   8.365   0.071
   22    H    ARG   4           HN       ARG   4 -12.151   0.944  -1.736
   23    HA   ARG   4           HA       ARG   4 -12.135  -1.864  -1.057
   24    HB2  ARG   4           2HB      ARG   4 -13.163  -1.132  -3.148
   25    HB3  ARG   4           3HB      ARG   4 -11.631  -0.452  -3.682
   26    HG2  ARG   4           2HG      ARG   4 -11.910  -2.521  -4.798
   27    HG3  ARG   4           3HG      ARG   4 -10.670  -2.762  -3.566
   28    HD2  ARG   4           2HD      ARG   4 -11.953  -4.624  -3.218
   29    HD3  ARG   4           3HD      ARG   4 -12.730  -3.496  -2.107
   30    HE   ARG   4           HE       ARG   4 -13.954  -3.375  -4.655
   31   HH11  ARG   4          2HH1      ARG   4 -13.716  -5.384  -1.822
   32   HH12  ARG   4          1HH1      ARG   4 -15.278  -6.101  -2.039
   33   HH21  ARG   4          2HH2      ARG   4 -16.013  -4.311  -4.951
   34   HH22  ARG   4          1HH2      ARG   4 -16.583  -5.491  -3.820
   35    H    ILE   5           HN       ILE   5 -10.390  -3.273  -1.238
   36    HA   ILE   5           HA       ILE   5  -7.756  -1.967  -1.129
   37    HB   ILE   5           HB       ILE   5  -8.479  -4.709  -0.096
   38   HG12  ILE   5          2HG1      ILE   5  -9.716  -3.154   1.227
   39   HG13  ILE   5          3HG1      ILE   5  -8.291  -3.588   2.164
   40   HG21  ILE   5          1HG2      ILE   5  -6.050  -3.958  -0.738
   41   HG22  ILE   5          2HG2      ILE   5  -6.131  -3.115   0.808
   42   HG23  ILE   5          3HG2      ILE   5  -6.350  -4.864   0.745
   43   HD11  ILE   5          3HD1      ILE   5  -8.710  -1.225   2.334
   44   HD12  ILE   5          1HD1      ILE   5  -7.214  -1.501   1.443
   45   HD13  ILE   5          2HD1      ILE   5  -8.689  -1.064   0.579
   46    H    GLU   6           HN       GLU   6  -6.945  -1.996  -3.149
   47    HA   GLU   6           HA       GLU   6  -6.921  -4.580  -4.567
   48    HB2  GLU   6           2HB      GLU   6  -7.040  -1.759  -5.612
   49    HB3  GLU   6           3HB      GLU   6  -6.527  -3.100  -6.627
   50    HG2  GLU   6           2HG      GLU   6  -9.144  -3.126  -5.165
   51    HG3  GLU   6           3HG      GLU   6  -8.963  -2.391  -6.757
   52    H    PHE   7           HN       PHE   7  -5.017  -4.984  -5.916
   53    HA   PHE   7           HA       PHE   7  -2.605  -3.559  -5.051
   54    HB2  PHE   7           2HB      PHE   7  -3.154  -6.500  -4.802
   55    HB3  PHE   7           3HB      PHE   7  -1.506  -5.919  -5.014
   56    HD1  PHE   7           1HD      PHE   7  -4.509  -5.440  -2.872
   57    HD2  PHE   7           2HD      PHE   7  -0.266  -5.286  -3.169
   58    HE1  PHE   7           1HE      PHE   7  -4.360  -5.003  -0.456
   59    HE2  PHE   7           2HE      PHE   7  -0.109  -4.849  -0.753
   60    HZ   PHE   7           HZ       PHE   7  -2.158  -4.707   0.607
   61    H    ASP   8           HN       ASP   8  -1.199  -3.164  -6.652
   62    HA   ASP   8           HA       ASP   8  -1.900  -3.602  -9.335
   63    HB2  ASP   8           2HB      ASP   8   0.469  -2.531  -7.901
   64    HB3  ASP   8           3HB      ASP   8   0.719  -3.053  -9.565
   65    HA   PRO   9           HA       PRO   9  -0.303  -7.544 -10.401
   66    HB2  PRO   9           2HB      PRO   9   0.840  -7.101 -12.823
   67    HB3  PRO   9           3HB      PRO   9  -0.910  -7.108 -12.574
   68    HG2  PRO   9           2HG      PRO   9   0.966  -4.783 -12.769
   69    HG3  PRO   9           3HG      PRO   9  -0.640  -4.989 -13.492
   70    HD2  PRO   9           2HD      PRO   9  -0.230  -3.534 -11.246
   71    HD3  PRO   9           3HD      PRO   9  -1.729  -4.439 -11.537
   72    H    ARG  10           HN       ARG  10   1.831  -4.909  -9.982
   73    HA   ARG  10           HA       ARG  10   4.218  -6.576 -10.246
   74    HB2  ARG  10           2HB      ARG  10   3.772  -3.619  -9.926
   75    HB3  ARG  10           3HB      ARG  10   5.358  -4.333  -9.670
   76    HG2  ARG  10           2HG      ARG  10   3.912  -4.946 -12.195
   77    HG3  ARG  10           3HG      ARG  10   4.661  -3.360 -12.003
   78    HD2  ARG  10           2HD      ARG  10   6.800  -4.250 -11.846
   79    HD3  ARG  10           3HD      ARG  10   6.207  -5.849 -11.397
   80    HE   ARG  10           HE       ARG  10   6.568  -4.815 -14.055
   81   HH11  ARG  10          2HH1      ARG  10   4.868  -7.130 -12.087
   82   HH12  ARG  10          1HH1      ARG  10   4.554  -8.213 -13.402
   83   HH21  ARG  10          2HH2      ARG  10   6.161  -6.233 -15.795
   84   HH22  ARG  10          1HH2      ARG  10   5.291  -7.702 -15.511
   85    H    ALA  11           HN       ALA  11   2.641  -4.480  -7.840
   86    HA   ALA  11           HA       ALA  11   4.381  -5.045  -5.712
   87    HB1  ALA  11           1HB      ALA  11   2.871  -3.151  -5.658
   88    HB2  ALA  11           2HB      ALA  11   1.478  -4.233  -5.639
   89    HB3  ALA  11           3HB      ALA  11   2.583  -4.194  -4.265
   90    H    GLU  12           HN       GLU  12   1.488  -6.685  -6.871
   91    HA   GLU  12           HA       GLU  12   0.922  -8.363  -4.763
   92    HB2  GLU  12           2HB      GLU  12   0.608  -8.562  -7.714
   93    HB3  GLU  12           3HB      GLU  12   0.393 -10.034  -6.778
   94    HG2  GLU  12           2HG      GLU  12  -1.075  -7.476  -6.204
   95    HG3  GLU  12           3HG      GLU  12  -1.696  -8.745  -7.257
   96    H    LYS  13           HN       LYS  13   3.304  -8.845  -7.347
   97    HA   LYS  13           HA       LYS  13   4.181 -11.381  -6.380
   98    HB2  LYS  13           2HB      LYS  13   5.463  -9.421  -8.291
   99    HB3  LYS  13           3HB      LYS  13   6.080 -11.036  -7.970
  100    HG2  LYS  13           2HG      LYS  13   3.251 -10.770  -8.828
  101    HG3  LYS  13           3HG      LYS  13   4.519 -10.524 -10.031
  102    HD2  LYS  13           2HD      LYS  13   5.385 -12.707  -9.691
  103    HD3  LYS  13           3HD      LYS  13   4.411 -12.941  -8.238
  104    HE2  LYS  13           2HE      LYS  13   3.139 -12.451 -10.911
  105    HE3  LYS  13           3HE      LYS  13   3.648 -14.067 -10.423
  106    HZ1  LYS  13           3HZ      LYS  13   2.278 -13.569  -8.323
  107    HZ2  LYS  13           1HZ      LYS  13   1.457 -13.976  -9.745
  108    HZ3  LYS  13           2HZ      LYS  13   1.549 -12.360  -9.255
  109    H    GLU  14           HN       GLU  14   5.478  -8.081  -6.165
  110    HA   GLU  14           HA       GLU  14   7.848  -8.619  -4.838
  111    HB2  GLU  14           2HB      GLU  14   5.991  -6.250  -4.706
  112    HB3  GLU  14           3HB      GLU  14   7.521  -6.288  -3.839
  113    HG2  GLU  14           2HG      GLU  14   8.477  -6.907  -6.204
  114    HG3  GLU  14           3HG      GLU  14   6.998  -6.126  -6.760
  115    H    LEU  15           HN       LEU  15   4.694  -7.812  -3.388
  116    HA   LEU  15           HA       LEU  15   5.533  -8.193  -0.717
  117    HB2  LEU  15           2HB      LEU  15   3.603  -6.881  -1.103
  118    HB3  LEU  15           3HB      LEU  15   2.830  -8.165  -2.031
  119    HG   LEU  15           HG       LEU  15   3.434  -8.591   0.866
  120   HD11  LEU  15          1HD1      LEU  15   2.325  -6.497   0.959
  121   HD12  LEU  15          2HD1      LEU  15   1.119  -7.729   1.330
  122   HD13  LEU  15          3HD1      LEU  15   1.156  -6.985  -0.268
  123   HD21  LEU  15          3HD2      LEU  15   1.510  -9.661  -1.167
  124   HD22  LEU  15          1HD2      LEU  15   1.199  -9.837   0.561
  125   HD23  LEU  15          2HD2      LEU  15   2.656 -10.534  -0.148
  126    H    GLU  16           HN       GLU  16   3.864 -10.311  -3.020
  127    HA   GLU  16           HA       GLU  16   3.373 -12.470  -1.336
  128    HB2  GLU  16           2HB      GLU  16   3.702 -12.125  -4.271
  129    HB3  GLU  16           3HB      GLU  16   3.783 -13.764  -3.639
  130    HG2  GLU  16           2HG      GLU  16   1.578 -13.154  -2.437
  131    HG3  GLU  16           3HG      GLU  16   1.497 -11.842  -3.611
  132    H    LYS  17           HN       LYS  17   6.335 -11.339  -2.696
  133    HA   LYS  17           HA       LYS  17   7.744 -13.831  -2.184
  134    HB2  LYS  17           2HB      LYS  17   8.722 -12.942  -4.038
  135    HB3  LYS  17           3HB      LYS  17   8.339 -11.288  -3.578
  136    HG2  LYS  17           2HG      LYS  17  10.243 -11.053  -2.311
  137    HG3  LYS  17           3HG      LYS  17  10.410 -12.790  -2.047
  138    HD2  LYS  17           2HD      LYS  17  10.958 -13.033  -4.469
  139    HD3  LYS  17           3HD      LYS  17  10.953 -11.273  -4.597
  140    HE2  LYS  17           2HE      LYS  17  12.879 -11.043  -3.365
  141    HE3  LYS  17           3HE      LYS  17  12.633 -12.560  -2.500
  142    HZ1  LYS  17           3HZ      LYS  17  13.735 -12.127  -5.196
  143    HZ2  LYS  17           1HZ      LYS  17  13.021 -13.609  -4.804
  144    HZ3  LYS  17           2HZ      LYS  17  14.356 -13.055  -3.926
  145    H    LEU  18           HN       LEU  18   7.197 -10.749  -0.691
  146    HA   LEU  18           HA       LEU  18   9.391 -10.622   1.038
  147    HB2  LEU  18           2HB      LEU  18   6.584  -9.580   1.213
  148    HB3  LEU  18           3HB      LEU  18   7.740  -9.324   2.519
  149    HG   LEU  18           HG       LEU  18   8.243  -8.432  -0.313
  150   HD11  LEU  18          1HD1      LEU  18   7.515  -6.438   1.727
  151   HD12  LEU  18          2HD1      LEU  18   6.199  -7.455   1.142
  152   HD13  LEU  18          3HD1      LEU  18   7.143  -6.494   0.004
  153   HD21  LEU  18          3HD2      LEU  18   9.871  -8.609   1.962
  154   HD22  LEU  18          1HD2      LEU  18   9.477  -6.900   1.777
  155   HD23  LEU  18          2HD2      LEU  18  10.225  -7.780   0.445
  156    H    ASP  19           HN       ASP  19   9.296 -10.896   3.435
  157    HA   ASP  19           HA       ASP  19   9.116 -13.462   4.248
  158    HB2  ASP  19           2HB      ASP  19   9.972 -11.507   5.591
  159    HB3  ASP  19           3HB      ASP  19   8.302 -11.164   6.034
  160    H    ARG  20           HN       ARG  20   7.596 -14.925   4.755
  161    HA   ARG  20           HA       ARG  20   4.993 -14.746   3.911
  162    HB2  ARG  20           2HB      ARG  20   6.371 -16.478   5.920
  163    HB3  ARG  20           3HB      ARG  20   4.621 -16.573   5.775
  164    HG2  ARG  20           2HG      ARG  20   5.560 -18.275   4.409
  165    HG3  ARG  20           3HG      ARG  20   4.923 -17.024   3.340
  166    HD2  ARG  20           2HD      ARG  20   7.002 -16.345   2.669
  167    HD3  ARG  20           3HD      ARG  20   7.768 -16.839   4.178
  168    HE   ARG  20           HE       ARG  20   6.910 -19.148   2.891
  169   HH11  ARG  20          2HH1      ARG  20   9.171 -16.556   2.355
  170   HH12  ARG  20          1HH1      ARG  20  10.264 -17.527   1.425
  171   HH21  ARG  20          2HH2      ARG  20   8.341 -20.437   1.669
  172   HH22  ARG  20          1HH2      ARG  20   9.791 -19.734   1.035
  173    H    GLU  21           HN       GLU  21   6.224 -14.149   7.190
  174    HA   GLU  21           HA       GLU  21   3.737 -13.586   8.376
  175    HB2  GLU  21           2HB      GLU  21   6.569 -12.865   9.079
  176    HB3  GLU  21           3HB      GLU  21   5.220 -12.268  10.034
  177    HG2  GLU  21           2HG      GLU  21   4.538 -14.510  10.568
  178    HG3  GLU  21           3HG      GLU  21   5.769 -15.176   9.497
  179    H    VAL  22           HN       VAL  22   6.226 -11.393   7.083
  180    HA   VAL  22           HA       VAL  22   4.957  -8.978   7.578
  181    HB   VAL  22           HB       VAL  22   6.745  -9.727   5.263
  182   HG11  VAL  22          1HG1      VAL  22   6.007  -7.781   4.402
  183   HG12  VAL  22          2HG1      VAL  22   5.382  -7.211   5.950
  184   HG13  VAL  22          3HG1      VAL  22   7.102  -7.068   5.586
  185   HG21  VAL  22          3HG2      VAL  22   7.568  -8.071   7.606
  186   HG22  VAL  22          1HG2      VAL  22   7.493  -9.825   7.767
  187   HG23  VAL  22          2HG2      VAL  22   8.545  -9.096   6.554
  188    H    ALA  23           HN       ALA  23   4.805 -10.951   4.614
  189    HA   ALA  23           HA       ALA  23   3.125  -9.410   3.089
  190    HB1  ALA  23           1HB      ALA  23   3.580 -12.344   3.291
  191    HB2  ALA  23           2HB      ALA  23   2.244 -11.760   2.298
  192    HB3  ALA  23           3HB      ALA  23   3.893 -11.240   1.951
  193    H    ARG  24           HN       ARG  24   2.089 -12.003   5.313
  194    HA   ARG  24           HA       ARG  24  -0.664 -11.544   5.048
  195    HB2  ARG  24           2HB      ARG  24   0.034 -13.608   5.990
  196    HB3  ARG  24           3HB      ARG  24   0.977 -12.804   7.238
  197    HG2  ARG  24           2HG      ARG  24  -1.277 -11.862   8.040
  198    HG3  ARG  24           3HG      ARG  24  -1.990 -13.129   7.040
  199    HD2  ARG  24           2HD      ARG  24   0.163 -13.793   9.006
  200    HD3  ARG  24           3HD      ARG  24  -1.501 -13.590   9.551
  201    HE   ARG  24           HE       ARG  24  -1.563 -15.331   7.393
  202   HH11  ARG  24          2HH1      ARG  24  -0.212 -15.235  10.600
  203   HH12  ARG  24          1HH1      ARG  24  -0.279 -16.952  10.821
  204   HH21  ARG  24          2HH2      ARG  24  -1.656 -17.593   7.671
  205   HH22  ARG  24          1HH2      ARG  24  -1.100 -18.292   9.154
  206    H    ARG  25           HN       ARG  25   1.701 -10.260   7.348
  207    HA   ARG  25           HA       ARG  25  -0.091  -8.887   9.010
  208    HB2  ARG  25           2HB      ARG  25   2.115  -9.169   9.808
  209    HB3  ARG  25           3HB      ARG  25   2.817  -8.469   8.355
  210    HG2  ARG  25           2HG      ARG  25   1.710  -6.295   9.039
  211    HG3  ARG  25           3HG      ARG  25   1.400  -7.065  10.597
  212    HD2  ARG  25           2HD      ARG  25   4.148  -6.963   9.388
  213    HD3  ARG  25           3HD      ARG  25   3.515  -5.646  10.374
  214    HE   ARG  25           HE       ARG  25   4.479  -8.169  11.295
  215   HH11  ARG  25          2HH1      ARG  25   2.214  -5.612  11.967
  216   HH12  ARG  25          1HH1      ARG  25   2.163  -5.928  13.670
  217   HH21  ARG  25          2HH2      ARG  25   4.421  -8.594  13.536
  218   HH22  ARG  25          1HH2      ARG  25   3.419  -7.624  14.561
  219    H    ILE  26           HN       ILE  26   1.462  -7.969   5.987
  220    HA   ILE  26           HA       ILE  26   0.734  -5.239   6.028
  221    HB   ILE  26           HB       ILE  26   1.455  -7.107   3.780
  222   HG12  ILE  26          2HG1      ILE  26   2.917  -4.658   4.757
  223   HG13  ILE  26          3HG1      ILE  26   3.151  -6.237   5.499
  224   HG21  ILE  26          1HG2      ILE  26   0.119  -5.654   2.595
  225   HG22  ILE  26          2HG2      ILE  26   0.465  -4.295   3.663
  226   HG23  ILE  26          3HG2      ILE  26   1.680  -4.839   2.507
  227   HD11  ILE  26          3HD1      ILE  26   3.492  -5.854   2.553
  228   HD12  ILE  26          1HD1      ILE  26   4.790  -5.475   3.685
  229   HD13  ILE  26          2HD1      ILE  26   4.147  -7.116   3.597
  230    H    LEU  27           HN       LEU  27  -0.626  -7.829   3.981
  231    HA   LEU  27           HA       LEU  27  -2.809  -6.517   2.994
  232    HB2  LEU  27           2HB      LEU  27  -2.394  -9.385   3.751
  233    HB3  LEU  27           3HB      LEU  27  -3.934  -8.841   3.087
  234    HG   LEU  27           HG       LEU  27  -1.314  -8.447   1.658
  235   HD11  LEU  27          1HD1      LEU  27  -3.232 -10.620   0.952
  236   HD12  LEU  27          2HD1      LEU  27  -2.027 -10.891   2.210
  237   HD13  LEU  27          3HD1      LEU  27  -1.516 -10.467   0.577
  238   HD21  LEU  27          3HD2      LEU  27  -2.562  -7.306   0.224
  239   HD22  LEU  27          1HD2      LEU  27  -3.995  -7.596   1.210
  240   HD23  LEU  27          2HD2      LEU  27  -3.547  -8.743  -0.052
  241    H    ARG  28           HN       ARG  28  -2.681  -8.362   6.035
  242    HA   ARG  28           HA       ARG  28  -5.322  -7.948   6.833
  243    HB2  ARG  28           2HB      ARG  28  -3.520  -9.485   7.848
  244    HB3  ARG  28           3HB      ARG  28  -3.029  -8.074   8.776
  245    HG2  ARG  28           2HG      ARG  28  -4.457  -9.076  10.248
  246    HG3  ARG  28           3HG      ARG  28  -5.568  -7.990   9.411
  247    HD2  ARG  28           2HD      ARG  28  -5.886 -10.039   7.814
  248    HD3  ARG  28           3HD      ARG  28  -5.275 -10.953   9.193
  249    HE   ARG  28           HE       ARG  28  -7.385  -9.181   9.931
  250   HH11  ARG  28          2HH1      ARG  28  -6.695 -12.269   8.480
  251   HH12  ARG  28          1HH1      ARG  28  -8.224 -12.960   8.912
  252   HH21  ARG  28          2HH2      ARG  28  -9.401 -10.079  10.506
  253   HH22  ARG  28          1HH2      ARG  28  -9.763 -11.713  10.064
  254    H    PHE  29           HN       PHE  29  -2.406  -6.099   7.714
  255    HA   PHE  29           HA       PHE  29  -3.517  -4.202   9.354
  256    HB2  PHE  29           2HB      PHE  29  -1.190  -4.113   9.162
  257    HB3  PHE  29           3HB      PHE  29  -1.239  -4.086   7.403
  258    HD1  PHE  29           1HD      PHE  29  -1.935  -2.066  10.425
  259    HD2  PHE  29           2HD      PHE  29  -1.226  -2.062   6.228
  260    HE1  PHE  29           1HE      PHE  29  -1.737   0.387  10.464
  261    HE2  PHE  29           2HE      PHE  29  -1.026   0.390   6.261
  262    HZ   PHE  29           HZ       PHE  29  -1.281   1.618   8.380
  263    H    LEU  30           HN       LEU  30  -3.595  -4.351   5.843
  264    HA   LEU  30           HA       LEU  30  -4.919  -1.778   5.634
  265    HB2  LEU  30           2HB      LEU  30  -4.158  -3.853   3.590
  266    HB3  LEU  30           3HB      LEU  30  -4.999  -2.355   3.195
  267    HG   LEU  30           HG       LEU  30  -2.341  -2.312   4.584
  268   HD11  LEU  30          1HD1      LEU  30  -2.614  -3.589   2.209
  269   HD12  LEU  30          2HD1      LEU  30  -1.163  -2.729   2.721
  270   HD13  LEU  30          3HD1      LEU  30  -2.337  -1.931   1.674
  271   HD21  LEU  30          3HD2      LEU  30  -2.702  -0.126   4.477
  272   HD22  LEU  30          1HD2      LEU  30  -4.210  -0.383   3.599
  273   HD23  LEU  30          2HD2      LEU  30  -2.690  -0.235   2.717
  274    H    ARG  31           HN       ARG  31  -5.730  -5.157   5.680
  275    HA   ARG  31           HA       ARG  31  -8.433  -4.703   4.724
  276    HB2  ARG  31           2HB      ARG  31  -6.895  -7.136   5.595
  277    HB3  ARG  31           3HB      ARG  31  -8.637  -7.199   5.359
  278    HG2  ARG  31           2HG      ARG  31  -8.375  -6.535   3.043
  279    HG3  ARG  31           3HG      ARG  31  -6.631  -6.383   3.267
  280    HD2  ARG  31           2HD      ARG  31  -6.339  -8.686   3.492
  281    HD3  ARG  31           3HD      ARG  31  -8.042  -8.960   3.853
  282    HE   ARG  31           HE       ARG  31  -7.689  -7.908   1.235
  283   HH11  ARG  31          2HH1      ARG  31  -7.433 -10.824   3.119
  284   HH12  ARG  31          1HH1      ARG  31  -7.695 -11.875   1.767
  285   HH21  ARG  31          2HH2      ARG  31  -8.035  -9.281  -0.553
  286   HH22  ARG  31          1HH2      ARG  31  -8.036 -10.997  -0.321
  287    H    GLU  32           HN       GLU  32  -6.829  -4.366   7.623
  288    HA   GLU  32           HA       GLU  32  -9.290  -4.841   9.172
  289    HB2  GLU  32           2HB      GLU  32  -6.389  -5.078   9.910
  290    HB3  GLU  32           3HB      GLU  32  -7.607  -4.810  11.149
  291    HG2  GLU  32           2HG      GLU  32  -7.651  -7.095   9.194
  292    HG3  GLU  32           3HG      GLU  32  -6.992  -7.188  10.826
  293    H    ARG  33           HN       ARG  33  -6.343  -2.848   9.459
  294    HA   ARG  33           HA       ARG  33  -7.574  -0.803  10.943
  295    HB2  ARG  33           2HB      ARG  33  -5.152  -0.517   9.161
  296    HB3  ARG  33           3HB      ARG  33  -5.574   0.482  10.545
  297    HG2  ARG  33           2HG      ARG  33  -5.098  -2.454  10.864
  298    HG3  ARG  33           3HG      ARG  33  -3.754  -1.311  10.816
  299    HD2  ARG  33           2HD      ARG  33  -6.093  -1.020  12.687
  300    HD3  ARG  33           3HD      ARG  33  -4.630  -1.908  13.111
  301    HE   ARG  33           HE       ARG  33  -4.946   0.948  12.956
  302   HH11  ARG  33          2HH1      ARG  33  -2.692  -1.704  12.854
  303   HH12  ARG  33          1HH1      ARG  33  -1.334  -0.738  13.327
  304   HH21  ARG  33          2HH2      ARG  33  -3.165   2.230  13.579
  305   HH22  ARG  33          1HH2      ARG  33  -1.604   1.499  13.740
  306    H    VAL  34           HN       VAL  34  -6.308  -0.433   7.633
  307    HA   VAL  34           HA       VAL  34  -7.714   1.877   7.011
  308    HB   VAL  34           HB       VAL  34  -6.951  -0.263   5.024
  309   HG11  VAL  34          1HG1      VAL  34  -8.306   1.398   3.996
  310   HG12  VAL  34          2HG1      VAL  34  -7.424   2.702   4.794
  311   HG13  VAL  34          3HG1      VAL  34  -6.637   1.741   3.541
  312   HG21  VAL  34          3HG2      VAL  34  -5.290   1.864   6.352
  313   HG22  VAL  34          1HG2      VAL  34  -4.989   0.128   6.275
  314   HG23  VAL  34          2HG2      VAL  34  -4.830   1.115   4.823
  315    H    ALA  35           HN       ALA  35  -8.566  -1.491   6.228
  316    HA   ALA  35           HA       ALA  35 -10.841  -1.231   4.803
  317    HB1  ALA  35           1HB      ALA  35 -10.680  -3.123   7.138
  318    HB2  ALA  35           2HB      ALA  35 -11.560  -3.337   5.624
  319    HB3  ALA  35           3HB      ALA  35  -9.796  -3.366   5.630
  320    H    THR  36           HN       THR  36 -10.508  -0.654   8.261
  321    HA   THR  36           HA       THR  36 -13.345  -0.103   8.560
  322    HB   THR  36           HB       THR  36 -12.954   0.111  10.889
  323    HG1  THR  36           1HG      THR  36 -10.668   0.095  11.629
  324   HG21  THR  36          3HG2      THR  36 -11.627  -2.095   9.467
  325   HG22  THR  36          1HG2      THR  36 -12.837  -2.137  10.749
  326   HG23  THR  36          2HG2      THR  36 -11.137  -1.893  11.149
  327    H    LEU  37           HN       LEU  37 -10.293   1.686   9.006
  328    HA   LEU  37           HA       LEU  37 -11.081   4.146   9.704
  329    HB2  LEU  37           2HB      LEU  37  -9.137   3.456   7.510
  330    HB3  LEU  37           3HB      LEU  37  -9.304   5.068   8.203
  331    HG   LEU  37           HG       LEU  37  -8.640   2.714   9.936
  332   HD11  LEU  37          1HD1      LEU  37  -6.945   3.990   7.912
  333   HD12  LEU  37          2HD1      LEU  37  -6.780   2.430   8.717
  334   HD13  LEU  37          3HD1      LEU  37  -6.237   3.900   9.525
  335   HD21  LEU  37          3HD2      LEU  37  -7.443   4.600  11.163
  336   HD22  LEU  37          1HD2      LEU  37  -9.207   4.615  11.191
  337   HD23  LEU  37          2HD2      LEU  37  -8.333   5.698  10.107
  338    H    GLU  38           HN       GLU  38 -12.551   5.562   9.053
  339    HA   GLU  38           HA       GLU  38 -14.186   5.225   6.824
  340    HB2  GLU  38           2HB      GLU  38 -13.595   7.787   8.317
  341    HB3  GLU  38           3HB      GLU  38 -14.969   7.514   7.255
  342    HG2  GLU  38           2HG      GLU  38 -15.858   5.853   8.746
  343    HG3  GLU  38           3HG      GLU  38 -14.427   5.955   9.770
  344    H    ASP  39           HN       ASP  39 -11.119   6.832   7.158
  345    HA   ASP  39           HA       ASP  39 -11.169   7.423   4.279
  346    HB2  ASP  39           2HB      ASP  39 -11.410   9.440   5.969
  347    HB3  ASP  39           3HB      ASP  39  -9.666   9.240   6.115
  348    HA   PRO  40           HA       PRO  40  -7.443   5.047   4.328
  349    HB2  PRO  40           2HB      PRO  40  -6.602   5.658   1.820
  350    HB3  PRO  40           3HB      PRO  40  -7.932   4.538   2.141
  351    HG2  PRO  40           2HG      PRO  40  -8.034   7.425   1.355
  352    HG3  PRO  40           3HG      PRO  40  -9.015   6.070   0.767
  353    HD2  PRO  40           2HD      PRO  40  -9.920   7.828   2.617
  354    HD3  PRO  40           3HD      PRO  40 -10.413   6.122   2.598
  355    H    ARG  41           HN       ARG  41  -7.614   8.459   3.973
  356    HA   ARG  41           HA       ARG  41  -4.727   8.814   3.946
  357    HB2  ARG  41           2HB      ARG  41  -7.073  10.687   3.802
  358    HB3  ARG  41           3HB      ARG  41  -5.453  11.293   4.116
  359    HG2  ARG  41           2HG      ARG  41  -4.791  10.001   1.990
  360    HG3  ARG  41           3HG      ARG  41  -6.523   9.971   1.657
  361    HD2  ARG  41           2HD      ARG  41  -6.371  12.530   2.136
  362    HD3  ARG  41           3HD      ARG  41  -4.655  12.299   1.801
  363    HE   ARG  41           HE       ARG  41  -5.171  12.151  -0.413
  364   HH11  ARG  41          2HH1      ARG  41  -8.039  11.473   1.439
  365   HH12  ARG  41          1HH1      ARG  41  -9.071  11.376   0.050
  366   HH21  ARG  41          2HH2      ARG  41  -6.518  12.025  -2.250
  367   HH22  ARG  41          1HH2      ARG  41  -8.204  11.688  -2.048
  368    H    SER  42           HN       SER  42  -5.452   7.435   6.175
  369    HA   SER  42           HA       SER  42  -5.206   9.441   8.321
  370    HB2  SER  42           2HB      SER  42  -6.243   7.686   9.812
  371    HB3  SER  42           3HB      SER  42  -7.324   8.344   8.584
  372    HG   SER  42           HG       SER  42  -6.348   5.793   8.890
  373    H    LEU  43           HN       LEU  43  -4.269   6.212   7.223
  374    HA   LEU  43           HA       LEU  43  -2.105   6.166   9.197
  375    HB2  LEU  43           2HB      LEU  43  -3.407   4.077   7.492
  376    HB3  LEU  43           3HB      LEU  43  -1.824   3.793   8.213
  377    HG   LEU  43           HG       LEU  43  -4.308   4.458   9.790
  378   HD11  LEU  43          1HD1      LEU  43  -4.958   2.354   9.558
  379   HD12  LEU  43          2HD1      LEU  43  -3.427   1.811  10.245
  380   HD13  LEU  43          3HD1      LEU  43  -3.584   2.025   8.501
  381   HD21  LEU  43          3HD2      LEU  43  -1.698   4.696  10.531
  382   HD22  LEU  43          1HD2      LEU  43  -2.064   3.047  11.039
  383   HD23  LEU  43          2HD2      LEU  43  -3.038   4.390  11.637
  384    H    GLY  44           HN       GLY  44  -2.001   7.947   6.920
  385    HA2  GLY  44           1HA      GLY  44   0.595   7.133   5.911
  386    HA3  GLY  44           2HA      GLY  44  -0.663   7.277   4.692
  387    H    GLU  45           HN       GLU  45   1.443   8.838   4.319
  388    HA   GLU  45           HA       GLU  45   0.518  11.502   5.170
  389    HB2  GLU  45           2HB      GLU  45   2.757  12.277   5.337
  390    HB3  GLU  45           3HB      GLU  45   2.691  10.756   6.217
  391    HG2  GLU  45           2HG      GLU  45   4.616  10.450   5.053
  392    HG3  GLU  45           3HG      GLU  45   3.464   9.768   3.907
  393    HA   PRO  46           HA       PRO  46   0.202  12.542   0.915
  394    HB2  PRO  46           2HB      PRO  46   0.648  15.217   1.033
  395    HB3  PRO  46           3HB      PRO  46  -0.848  14.467   1.602
  396    HG2  PRO  46           2HG      PRO  46   1.538  15.363   3.173
  397    HG3  PRO  46           3HG      PRO  46  -0.185  15.568   3.540
  398    HD2  PRO  46           2HD      PRO  46   1.332  13.647   4.696
  399    HD3  PRO  46           3HD      PRO  46  -0.396  13.423   4.355
  400    H    LEU  47           HN       LEU  47   1.536  12.444  -0.788
  401    HA   LEU  47           HA       LEU  47   4.368  13.117  -0.364
  402    HB2  LEU  47           2HB      LEU  47   3.442  10.758  -1.099
  403    HB3  LEU  47           3HB      LEU  47   3.442  11.510  -2.692
  404    HG   LEU  47           HG       LEU  47   5.939  12.089  -2.008
  405   HD11  LEU  47          1HD1      LEU  47   5.367   9.553  -0.481
  406   HD12  LEU  47          2HD1      LEU  47   5.754  11.120   0.231
  407   HD13  LEU  47          3HD1      LEU  47   6.955  10.275  -0.747
  408   HD21  LEU  47          3HD2      LEU  47   4.866  10.570  -3.861
  409   HD22  LEU  47          1HD2      LEU  47   5.462   9.266  -2.833
  410   HD23  LEU  47          2HD2      LEU  47   6.586  10.459  -3.485
  411    H    ARG  48           HN       ARG  48   4.685  15.160  -1.018
  412    HA   ARG  48           HA       ARG  48   3.489  16.025  -3.559
  413    HB2  ARG  48           2HB      ARG  48   3.212  17.339  -1.340
  414    HB3  ARG  48           3HB      ARG  48   4.873  17.848  -1.613
  415    HG2  ARG  48           2HG      ARG  48   2.885  18.175  -3.806
  416    HG3  ARG  48           3HG      ARG  48   2.867  19.301  -2.447
  417    HD2  ARG  48           2HD      ARG  48   5.420  18.679  -3.881
  418    HD3  ARG  48           3HD      ARG  48   4.289  19.862  -4.537
  419    HE   ARG  48           HE       ARG  48   4.690  20.549  -1.890
  420   HH11  ARG  48          2HH1      ARG  48   6.616  20.232  -4.773
  421   HH12  ARG  48          1HH1      ARG  48   7.756  21.448  -4.302
  422   HH21  ARG  48          2HH2      ARG  48   6.185  22.152  -1.259
  423   HH22  ARG  48          1HH2      ARG  48   7.511  22.539  -2.303
  424    H    GLY  49           HN       GLY  49   4.877  15.312  -5.111
  425    HA2  GLY  49           1HA      GLY  49   7.622  16.386  -4.973
  426    HA3  GLY  49           2HA      GLY  49   7.323  14.736  -5.497
  427    HA   PRO  50           HA       PRO  50   6.828  18.057  -8.959
  428    HB2  PRO  50           2HB      PRO  50   9.382  18.302  -9.847
  429    HB3  PRO  50           3HB      PRO  50   8.685  19.366  -8.619
  430    HG2  PRO  50           2HG      PRO  50  10.463  16.982  -8.273
  431    HG3  PRO  50           3HG      PRO  50  10.527  18.554  -7.455
  432    HD2  PRO  50           2HD      PRO  50   9.445  16.356  -6.303
  433    HD3  PRO  50           3HD      PRO  50   8.848  17.996  -5.978
  434    H    GLU  51           HN       GLU  51   8.170  14.990  -8.441
  435    HA   GLU  51           HA       GLU  51   8.229  14.382 -11.315
  436    HB2  GLU  51           2HB      GLU  51  10.223  13.830  -9.851
  437    HB3  GLU  51           3HB      GLU  51   9.211  12.623  -9.069
  438    HG2  GLU  51           2HG      GLU  51  10.453  11.454 -10.670
  439    HG3  GLU  51           3HG      GLU  51   8.846  11.637 -11.370
  440    H    LEU  52           HN       LEU  52   7.122  12.939  -8.248
  441    HA   LEU  52           HA       LEU  52   5.352  11.123  -9.599
  442    HB2  LEU  52           2HB      LEU  52   5.899  11.795  -6.732
  443    HB3  LEU  52           3HB      LEU  52   4.531  10.776  -7.174
  444    HG   LEU  52           HG       LEU  52   7.295  10.074  -8.089
  445   HD11  LEU  52          1HD1      LEU  52   7.388   8.602  -6.034
  446   HD12  LEU  52          2HD1      LEU  52   6.105   9.612  -5.368
  447   HD13  LEU  52          3HD1      LEU  52   7.666  10.325  -5.775
  448   HD21  LEU  52          3HD2      LEU  52   4.642   8.795  -7.912
  449   HD22  LEU  52          1HD2      LEU  52   6.025   7.775  -7.515
  450   HD23  LEU  52          2HD2      LEU  52   5.939   8.570  -9.087
  451    H    GLY  53           HN       GLY  53   4.523  13.393  -6.986
  452    HA2  GLY  53           1HA      GLY  53   2.990  15.278  -7.671
  453    HA3  GLY  53           2HA      GLY  53   2.058  14.030  -8.484
  454    H    ARG  54           HN       ARG  54   0.755  12.652  -7.292
  455    HA   ARG  54           HA       ARG  54   0.563  13.214  -4.411
  456    HB2  ARG  54           2HB      ARG  54  -1.667  13.125  -6.437
  457    HB3  ARG  54           3HB      ARG  54  -1.955  12.931  -4.714
  458    HG2  ARG  54           2HG      ARG  54  -1.284  15.123  -4.238
  459    HG3  ARG  54           3HG      ARG  54  -0.507  15.316  -5.812
  460    HD2  ARG  54           2HD      ARG  54  -3.430  14.747  -5.707
  461    HD3  ARG  54           3HD      ARG  54  -2.867  16.371  -5.316
  462    HE   ARG  54           HE       ARG  54  -3.102  15.272  -7.891
  463   HH11  ARG  54          2HH1      ARG  54  -0.917  17.188  -5.975
  464   HH12  ARG  54          1HH1      ARG  54  -0.255  18.031  -7.337
  465   HH21  ARG  54          2HH2      ARG  54  -2.238  16.375  -9.692
  466   HH22  ARG  54          1HH2      ARG  54  -1.008  17.568  -9.450
  467    H    PHE  55           HN       PHE  55   1.043  11.394  -3.384
  468    HA   PHE  55           HA       PHE  55  -0.375   8.957  -4.028
  469    HB2  PHE  55           2HB      PHE  55   2.609   9.214  -4.344
  470    HB3  PHE  55           3HB      PHE  55   1.848   7.662  -4.008
  471    HD1  PHE  55           1HD      PHE  55  -0.467   7.519  -5.609
  472    HD2  PHE  55           2HD      PHE  55   3.262   9.352  -6.532
  473    HE1  PHE  55           1HE      PHE  55  -0.916   7.218  -8.010
  474    HE2  PHE  55           2HE      PHE  55   2.818   9.055  -8.933
  475    HZ   PHE  55           HZ       PHE  55   0.726   7.987  -9.675
  476    H    TRP  56           HN       TRP  56  -1.208   8.558  -2.082
  477    HA   TRP  56           HA       TRP  56  -0.100   9.338   0.371
  478    HB2  TRP  56           2HB      TRP  56  -2.521   8.500  -0.307
  479    HB3  TRP  56           3HB      TRP  56  -1.890   6.951   0.246
  480    HD1  TRP  56           1HD      TRP  56  -2.247   6.492   2.734
  481    HE1  TRP  56           1HE      TRP  56  -2.696   7.916   4.830
  482    HE3  TRP  56           3HE      TRP  56  -1.909  11.145   0.642
  483    HZ2  TRP  56           2HZ      TRP  56  -2.884  10.650   5.507
  484    HZ3  TRP  56           3HZ      TRP  56  -2.238  13.112   2.083
  485    HH2  TRP  56           2HH      TRP  56  -2.715  12.868   4.465
  486    H    LYS  57           HN       LYS  57   1.330   8.432   1.728
  487    HA   LYS  57           HA       LYS  57   2.432   5.805   0.976
  488    HB2  LYS  57           2HB      LYS  57   3.878   7.971   0.926
  489    HB3  LYS  57           3HB      LYS  57   3.898   7.798   2.676
  490    HG2  LYS  57           2HG      LYS  57   4.641   5.340   2.078
  491    HG3  LYS  57           3HG      LYS  57   5.170   6.118   0.585
  492    HD2  LYS  57           2HD      LYS  57   5.949   6.978   3.371
  493    HD3  LYS  57           3HD      LYS  57   6.956   6.022   2.281
  494    HE2  LYS  57           2HE      LYS  57   7.772   8.128   1.878
  495    HE3  LYS  57           3HE      LYS  57   6.525   8.018   0.636
  496    HZ1  LYS  57           3HZ      LYS  57   6.660  10.100   2.146
  497    HZ2  LYS  57           1HZ      LYS  57   5.849   9.132   3.272
  498    HZ3  LYS  57           2HZ      LYS  57   5.148   9.445   1.765
  499    H    TYR  58           HN       TYR  58   1.932   4.204   2.306
  500    HA   TYR  58           HA       TYR  58   1.047   4.811   5.023
  501    HB2  TYR  58           2HB      TYR  58   0.921   2.254   3.412
  502    HB3  TYR  58           3HB      TYR  58   0.298   2.438   5.047
  503    HD1  TYR  58           1HD      TYR  58  -1.708   3.766   5.473
  504    HD2  TYR  58           2HD      TYR  58  -0.240   3.209   1.519
  505    HE1  TYR  58           1HE      TYR  58  -3.858   4.550   4.571
  506    HE2  TYR  58           2HE      TYR  58  -2.385   3.992   0.606
  507    HH   TYR  58           HH       TYR  58  -4.709   5.570   2.466
  508    H    ARG  59           HN       ARG  59   1.763   3.385   6.796
  509    HA   ARG  59           HA       ARG  59   4.488   2.350   6.427
  510    HB2  ARG  59           2HB      ARG  59   5.262   3.407   8.437
  511    HB3  ARG  59           3HB      ARG  59   4.550   4.646   7.412
  512    HG2  ARG  59           2HG      ARG  59   2.411   4.237   8.801
  513    HG3  ARG  59           3HG      ARG  59   3.507   3.474   9.955
  514    HD2  ARG  59           2HD      ARG  59   3.208   5.781  10.566
  515    HD3  ARG  59           3HD      ARG  59   4.855   5.552   9.979
  516    HE   ARG  59           HE       ARG  59   3.094   6.398   7.903
  517   HH11  ARG  59          2HH1      ARG  59   4.946   7.515  10.631
  518   HH12  ARG  59          1HH1      ARG  59   5.122   9.126  10.017
  519   HH21  ARG  59          2HH2      ARG  59   3.320   8.514   7.084
  520   HH22  ARG  59          1HH2      ARG  59   4.197   9.693   8.000
  521    H    VAL  60           HN       VAL  60   4.756   0.375   7.238
  522    HA   VAL  60           HA       VAL  60   2.903  -0.552   9.332
  523    HB   VAL  60           HB       VAL  60   3.767  -2.011   6.843
  524   HG11  VAL  60          1HG1      VAL  60   2.728  -4.021   7.763
  525   HG12  VAL  60          2HG1      VAL  60   4.095  -3.501   8.751
  526   HG13  VAL  60          3HG1      VAL  60   2.445  -3.183   9.288
  527   HG21  VAL  60          3HG2      VAL  60   1.108  -2.441   7.166
  528   HG22  VAL  60          1HG2      VAL  60   1.279  -0.833   7.869
  529   HG23  VAL  60          2HG2      VAL  60   1.795  -1.130   6.209
  530    H    GLY  61           HN       GLY  61   4.175  -0.641  11.091
  531    HA2  GLY  61           1HA      GLY  61   5.952  -1.155  12.459
  532    HA3  GLY  61           2HA      GLY  61   5.981  -2.660  11.552
  533    H    ASP  62           HN       ASP  62   7.529  -2.986   9.990
  534    HA   ASP  62           HA       ASP  62   9.551  -0.858   9.720
  535    HB2  ASP  62           2HB      ASP  62  10.042  -3.842   9.831
  536    HB3  ASP  62           3HB      ASP  62  11.274  -2.602   9.616
  537    H    TYR  63           HN       TYR  63   7.337  -1.251   7.977
  538    HA   TYR  63           HA       TYR  63   8.799  -1.728   5.497
  539    HB2  TYR  63           2HB      TYR  63   6.221  -3.128   6.226
  540    HB3  TYR  63           3HB      TYR  63   6.871  -3.059   4.592
  541    HD1  TYR  63           1HD      TYR  63   7.833  -4.093   8.047
  542    HD2  TYR  63           2HD      TYR  63   8.285  -4.748   3.867
  543    HE1  TYR  63           1HE      TYR  63   9.195  -6.088   8.513
  544    HE2  TYR  63           2HE      TYR  63   9.647  -6.745   4.322
  545    HH   TYR  63           HH       TYR  63  10.330  -8.187   5.906
  546    H    ARG  64           HN       ARG  64   8.177  -0.426   3.841
  547    HA   ARG  64           HA       ARG  64   6.023   1.488   4.430
  548    HB2  ARG  64           2HB      ARG  64   8.441   1.746   2.636
  549    HB3  ARG  64           3HB      ARG  64   7.173   2.957   2.771
  550    HG2  ARG  64           2HG      ARG  64   8.711   2.021   5.167
  551    HG3  ARG  64           3HG      ARG  64   9.311   3.306   4.118
  552    HD2  ARG  64           2HD      ARG  64   6.515   3.487   5.116
  553    HD3  ARG  64           3HD      ARG  64   7.827   3.821   6.246
  554    HE   ARG  64           HE       ARG  64   6.936   5.492   4.110
  555   HH11  ARG  64          2HH1      ARG  64   9.722   4.573   5.984
  556   HH12  ARG  64          1HH1      ARG  64  10.552   6.072   5.727
  557   HH21  ARG  64          2HH2      ARG  64   8.018   7.469   3.764
  558   HH22  ARG  64          1HH2      ARG  64   9.581   7.719   4.464
  559    H    LEU  65           HN       LEU  65   4.315   1.678   3.099
  560    HA   LEU  65           HA       LEU  65   4.381   0.197   0.554
  561    HB2  LEU  65           2HB      LEU  65   1.896   0.485   2.205
  562    HB3  LEU  65           3HB      LEU  65   2.224  -0.644   0.891
  563    HG   LEU  65           HG       LEU  65   3.637  -0.789   3.544
  564   HD11  LEU  65          1HD1      LEU  65   1.346  -2.564   2.829
  565   HD12  LEU  65          2HD1      LEU  65   1.043  -0.992   3.568
  566   HD13  LEU  65          3HD1      LEU  65   2.027  -2.187   4.412
  567   HD21  LEU  65          3HD2      LEU  65   3.531  -2.407   1.068
  568   HD22  LEU  65          1HD2      LEU  65   3.588  -3.281   2.598
  569   HD23  LEU  65          2HD2      LEU  65   4.863  -2.134   2.191
  570    H    ILE  66           HN       ILE  66   3.706   1.279  -1.199
  571    HA   ILE  66           HA       ILE  66   2.458   3.915  -0.775
  572    HB   ILE  66           HB       ILE  66   4.043   3.174  -3.220
  573   HG12  ILE  66          2HG1      ILE  66   5.030   4.299  -0.599
  574   HG13  ILE  66          3HG1      ILE  66   5.614   2.875  -1.452
  575   HG21  ILE  66          1HG2      ILE  66   3.891   5.929  -2.159
  576   HG22  ILE  66          2HG2      ILE  66   3.853   5.348  -3.823
  577   HG23  ILE  66          3HG2      ILE  66   2.405   5.250  -2.822
  578   HD11  ILE  66          3HD1      ILE  66   5.882   5.109  -3.177
  579   HD12  ILE  66          1HD1      ILE  66   6.555   5.533  -1.603
  580   HD13  ILE  66          2HD1      ILE  66   7.143   4.107  -2.458
  581    H    CYS  67           HN       CYS  67   0.340   3.668  -1.145
  582    HA   CYS  67           HA       CYS  67  -0.486   2.155  -3.532
  583    HB2  CYS  67           2HB      CYS  67  -2.325   2.879  -1.264
  584    HB3  CYS  67           3HB      CYS  67  -2.509   1.605  -2.465
  585    HG   CYS  67           HG       CYS  67  -0.593   1.616   0.342
  586    H    HIS  68           HN       HIS  68  -2.388   2.981  -4.682
  587    HA   HIS  68           HA       HIS  68  -2.336   5.915  -4.772
  588    HB2  HIS  68           2HB      HIS  68  -1.733   4.695  -6.848
  589    HB3  HIS  68           3HB      HIS  68  -3.337   3.968  -6.859
  590    HD2  HIS  68           2HD      HIS  68  -4.118   7.414  -5.894
  591    HE1  HIS  68           1HE      HIS  68  -3.847   7.584 -10.125
  592    HE2  HIS  68           2HE      HIS  68  -4.541   8.805  -8.034
  593    H    ILE  69           HN       ILE  69  -3.967   6.933  -3.832
  594    HA   ILE  69           HA       ILE  69  -6.447   5.536  -3.268
  595    HB   ILE  69           HB       ILE  69  -5.600   8.348  -2.560
  596   HG12  ILE  69          2HG1      ILE  69  -5.687   5.839  -0.869
  597   HG13  ILE  69          3HG1      ILE  69  -4.224   6.582  -1.507
  598   HG21  ILE  69          1HG2      ILE  69  -8.135   7.554  -2.700
  599   HG22  ILE  69          2HG2      ILE  69  -7.750   6.929  -1.097
  600   HG23  ILE  69          3HG2      ILE  69  -7.556   8.647  -1.443
  601   HD11  ILE  69          3HD1      ILE  69  -4.414   7.227   0.758
  602   HD12  ILE  69          1HD1      ILE  69  -4.829   8.640  -0.212
  603   HD13  ILE  69          2HD1      ILE  69  -6.103   7.692   0.555
  604    H    GLN  70           HN       GLN  70  -8.077   5.538  -4.656
  605    HA   GLN  70           HA       GLN  70  -8.307   7.748  -6.578
  606    HB2  GLN  70           2HB      GLN  70  -9.154   4.872  -6.640
  607    HB3  GLN  70           3HB      GLN  70  -9.954   6.048  -7.675
  608    HG2  GLN  70           2HG      GLN  70  -7.631   6.673  -8.494
  609    HG3  GLN  70           3HG      GLN  70  -7.078   5.204  -7.692
  610   HE21  GLN  70          1HE2      GLN  70  -6.460   4.899 -10.054
  611   HE22  GLN  70          2HE2      GLN  70  -7.602   4.053 -11.036
  612    H    ASP  71           HN       ASP  71  -9.484   9.274  -5.517
  613    HA   ASP  71           HA       ASP  71 -11.578   8.863  -3.738
  614    HB2  ASP  71           2HB      ASP  71 -10.711  11.132  -5.466
  615    HB3  ASP  71           3HB      ASP  71 -12.312  11.221  -4.738
  616    H    ARG  72           HN       ARG  72 -11.654   9.232  -7.260
  617    HA   ARG  72           HA       ARG  72 -14.224   9.490  -7.916
  618    HB2  ARG  72           2HB      ARG  72 -12.154   8.797  -9.365
  619    HB3  ARG  72           3HB      ARG  72 -12.789   7.171  -9.154
  620    HG2  ARG  72           2HG      ARG  72 -14.637   9.306 -10.083
  621    HG3  ARG  72           3HG      ARG  72 -13.460   8.644 -11.219
  622    HD2  ARG  72           2HD      ARG  72 -14.340   6.347 -10.364
  623    HD3  ARG  72           3HD      ARG  72 -15.736   7.286  -9.836
  624    HE   ARG  72           HE       ARG  72 -15.084   6.539 -12.511
  625   HH11  ARG  72          2HH1      ARG  72 -16.605   9.002 -10.577
  626   HH12  ARG  72          1HH1      ARG  72 -17.654   9.537 -11.848
  627   HH21  ARG  72          2HH2      ARG  72 -16.460   7.234 -14.193
  628   HH22  ARG  72          1HH2      ARG  72 -17.571   8.530 -13.904
  629    H    GLU  73           HN       GLU  73 -12.846   6.295  -7.116
  630    HA   GLU  73           HA       GLU  73 -15.538   5.469  -6.250
  631    HB2  GLU  73           2HB      GLU  73 -13.492   4.008  -7.882
  632    HB3  GLU  73           3HB      GLU  73 -14.618   3.104  -6.879
  633    HG2  GLU  73           2HG      GLU  73 -15.539   5.139  -8.880
  634    HG3  GLU  73           3HG      GLU  73 -15.250   3.454  -9.309
  635    H    ALA  74           HN       ALA  74 -13.293   6.624  -4.723
  636    HA   ALA  74           HA       ALA  74 -11.941   6.188  -2.904
  637    HB1  ALA  74           1HB      ALA  74 -14.699   5.293  -2.383
  638    HB2  ALA  74           2HB      ALA  74 -13.484   4.757  -1.222
  639    HB3  ALA  74           3HB      ALA  74 -13.707   6.479  -1.533
  640    H    THR  75           HN       THR  75 -10.984   4.548  -4.748
  641    HA   THR  75           HA       THR  75 -10.774   1.919  -3.429
  642    HB   THR  75           HB       THR  75 -10.421   2.600  -6.353
  643    HG1  THR  75           1HG      THR  75 -12.198   0.901  -6.348
  644   HG21  THR  75          3HG2      THR  75 -10.315  -0.155  -5.157
  645   HG22  THR  75          1HG2      THR  75  -8.862   0.824  -5.356
  646   HG23  THR  75          2HG2      THR  75  -9.818   0.368  -6.766
  647    H    VAL  76           HN       VAL  76  -8.815   1.222  -2.798
  648    HA   VAL  76           HA       VAL  76  -6.508   2.945  -3.410
  649    HB   VAL  76           HB       VAL  76  -6.942   1.082  -1.072
  650   HG11  VAL  76          1HG1      VAL  76  -4.562   1.348  -1.981
  651   HG12  VAL  76          2HG1      VAL  76  -4.662   3.008  -1.388
  652   HG13  VAL  76          3HG1      VAL  76  -4.824   1.657  -0.265
  653   HG21  VAL  76          3HG2      VAL  76  -6.456   3.738  -0.258
  654   HG22  VAL  76          1HG2      VAL  76  -7.676   3.805  -1.531
  655   HG23  VAL  76          2HG2      VAL  76  -7.947   2.809  -0.101
  656    H    LEU  77           HN       LEU  77  -5.152   2.147  -4.863
  657    HA   LEU  77           HA       LEU  77  -4.833  -0.777  -5.040
  658    HB2  LEU  77           2HB      LEU  77  -5.755   0.027  -7.069
  659    HB3  LEU  77           3HB      LEU  77  -4.620   1.374  -7.130
  660    HG   LEU  77           HG       LEU  77  -2.868  -0.629  -7.275
  661   HD11  LEU  77          1HD1      LEU  77  -5.461  -1.856  -7.774
  662   HD12  LEU  77          2HD1      LEU  77  -3.897  -2.600  -7.448
  663   HD13  LEU  77          3HD1      LEU  77  -4.310  -2.101  -9.088
  664   HD21  LEU  77          3HD2      LEU  77  -4.378   0.066  -9.762
  665   HD22  LEU  77          1HD2      LEU  77  -2.640  -0.109  -9.518
  666   HD23  LEU  77          2HD2      LEU  77  -3.480   1.308  -8.887
  667    H    VAL  78           HN       VAL  78  -3.009  -1.436  -4.128
  668    HA   VAL  78           HA       VAL  78  -0.857   0.168  -3.389
  669    HB   VAL  78           HB       VAL  78  -0.720  -2.788  -3.992
  670   HG11  VAL  78          1HG1      VAL  78   1.397  -1.357  -3.562
  671   HG12  VAL  78          2HG1      VAL  78   0.842  -1.343  -1.887
  672   HG13  VAL  78          3HG1      VAL  78   1.194  -2.875  -2.688
  673   HG21  VAL  78          3HG2      VAL  78  -2.157  -3.110  -2.327
  674   HG22  VAL  78          1HG2      VAL  78  -1.007  -2.343  -1.231
  675   HG23  VAL  78          2HG2      VAL  78  -2.251  -1.375  -2.023
  676    H    LEU  79           HN       LEU  79   0.992   0.812  -4.354
  677    HA   LEU  79           HA       LEU  79   1.308   0.139  -7.197
  678    HB2  LEU  79           2HB      LEU  79   1.881   2.545  -5.560
  679    HB3  LEU  79           3HB      LEU  79   2.963   2.206  -6.909
  680    HG   LEU  79           HG       LEU  79  -0.025   2.500  -7.184
  681   HD11  LEU  79          1HD1      LEU  79   0.323   4.727  -7.932
  682   HD12  LEU  79          2HD1      LEU  79   2.075   4.546  -7.863
  683   HD13  LEU  79          3HD1      LEU  79   1.133   4.572  -6.373
  684   HD21  LEU  79          3HD2      LEU  79   2.182   2.543  -9.240
  685   HD22  LEU  79          1HD2      LEU  79   0.452   2.689  -9.548
  686   HD23  LEU  79          2HD2      LEU  79   1.112   1.176  -8.926
  687    H    ARG  80           HN       ARG  80   3.305   0.831  -4.322
  688    HA   ARG  80           HA       ARG  80   5.170  -1.252  -5.218
  689    HB2  ARG  80           2HB      ARG  80   6.060   0.983  -5.851
  690    HB3  ARG  80           3HB      ARG  80   6.016   1.448  -4.155
  691    HG2  ARG  80           2HG      ARG  80   8.203   0.836  -4.363
  692    HG3  ARG  80           3HG      ARG  80   7.494  -0.699  -3.856
  693    HD2  ARG  80           2HD      ARG  80   7.893   0.067  -6.740
  694    HD3  ARG  80           3HD      ARG  80   9.097  -0.815  -5.801
  695    HE   ARG  80           HE       ARG  80   6.786  -2.247  -5.500
  696   HH11  ARG  80          2HH1      ARG  80   8.698  -1.161  -8.199
  697   HH12  ARG  80          1HH1      ARG  80   8.268  -2.501  -9.210
  698   HH21  ARG  80          2HH2      ARG  80   6.213  -4.016  -6.822
  699   HH22  ARG  80          1HH2      ARG  80   6.854  -4.124  -8.426
  700    H    VAL  81           HN       VAL  81   6.062  -2.480  -3.613
  701    HA   VAL  81           HA       VAL  81   5.441  -1.745  -0.833
  702    HB   VAL  81           HB       VAL  81   5.081  -4.493  -2.039
  703   HG11  VAL  81          1HG1      VAL  81   5.474  -3.596   0.691
  704   HG12  VAL  81          2HG1      VAL  81   3.949  -4.461   0.487
  705   HG13  VAL  81          3HG1      VAL  81   5.469  -5.230   0.028
  706   HG21  VAL  81          3HG2      VAL  81   2.731  -4.202  -1.619
  707   HG22  VAL  81          1HG2      VAL  81   3.019  -2.637  -0.857
  708   HG23  VAL  81          2HG2      VAL  81   3.303  -2.842  -2.586
  709    H    GLY  82           HN       GLY  82   7.297  -1.544   0.225
  710    HA2  GLY  82           1HA      GLY  82   9.252  -3.672   0.156
  711    HA3  GLY  82           2HA      GLY  82   9.817  -2.163  -0.546
  712    H    HIS  83           HN       HIS  83  10.912  -3.458   1.749
  713    HA   HIS  83           HA       HIS  83  10.088  -2.553   4.213
  714    HB2  HIS  83           2HB      HIS  83  12.050  -4.098   3.635
  715    HB3  HIS  83           3HB      HIS  83  12.998  -2.628   3.431
  716    HD2  HIS  83           2HD      HIS  83  11.644  -4.891   6.242
  717    HE1  HIS  83           1HE      HIS  83  13.581  -1.588   8.069
  718    HE2  HIS  83           2HE      HIS  83  12.610  -3.885   8.421
  719    H    ALA  84           HN       ALA  84  11.058  -0.840   5.583
  720    HA   ALA  84           HA       ALA  84  10.589   1.699   4.560
  721    HB1  ALA  84           1HB      ALA  84  10.466   1.486   6.882
  722    HB2  ALA  84           2HB      ALA  84  12.065   0.749   6.992
  723    HB3  ALA  84           3HB      ALA  84  11.909   2.465   6.618
  724    H    ARG  85           HN       ARG  85  13.569  -0.153   4.729
  725    HA   ARG  85           HA       ARG  85  15.096   2.095   3.650
  726    HB2  ARG  85           2HB      ARG  85  17.050   0.921   4.236
  727    HB3  ARG  85           3HB      ARG  85  15.931   0.618   5.559
  728    HG2  ARG  85           2HG      ARG  85  16.809  -1.472   5.191
  729    HG3  ARG  85           3HG      ARG  85  15.338  -1.525   4.217
  730    HD2  ARG  85           2HD      ARG  85  16.494  -1.374   2.225
  731    HD3  ARG  85           3HD      ARG  85  17.891  -0.605   2.976
  732    HE   ARG  85           HE       ARG  85  18.780  -2.679   3.259
  733   HH11  ARG  85          2HH1      ARG  85  15.322  -2.995   3.007
  734   HH12  ARG  85          1HH1      ARG  85  15.345  -4.726   3.070
  735   HH21  ARG  85          2HH2      ARG  85  18.823  -4.958   3.342
  736   HH22  ARG  85          1HH2      ARG  85  17.336  -5.842   3.261
  737    H    ASP  86           HN       ASP  86  13.444  -0.673   2.605
  738    HA   ASP  86           HA       ASP  86  15.054  -1.320   0.339
  739    HB2  ASP  86           2HB      ASP  86  13.481  -2.928   1.372
  740    HB3  ASP  86           3HB      ASP  86  12.132  -1.925   0.844
  741    H    VAL  87           HN       VAL  87  11.848   0.233   0.580
  742    HA   VAL  87           HA       VAL  87  11.495   0.979  -2.029
  743    HB   VAL  87           HB       VAL  87  10.765   2.617   0.403
  744   HG11  VAL  87          1HG1      VAL  87   9.237   2.691  -2.152
  745   HG12  VAL  87          2HG1      VAL  87   9.399   3.921  -0.897
  746   HG13  VAL  87          3HG1      VAL  87  10.725   3.628  -2.023
  747   HG21  VAL  87          3HG2      VAL  87   9.042   1.232   0.770
  748   HG22  VAL  87          1HG2      VAL  87   8.684   1.076  -0.950
  749   HG23  VAL  87          2HG2      VAL  87   9.941   0.080  -0.217
  750    H    TYR  88           HN       TYR  88  13.017   2.999   0.488
  751    HA   TYR  88           HA       TYR  88  14.484   4.387  -1.657
  752    HB2  TYR  88           2HB      TYR  88  13.047   5.501   0.728
  753    HB3  TYR  88           3HB      TYR  88  14.438   6.354   0.067
  754    HD1  TYR  88           1HD      TYR  88  14.339   6.668  -2.582
  755    HD2  TYR  88           2HD      TYR  88  10.961   6.082  -0.062
  756    HE1  TYR  88           1HE      TYR  88  12.898   7.709  -4.282
  757    HE2  TYR  88           2HE      TYR  88   9.510   7.120  -1.756
  758    HH   TYR  88           HH       TYR  88  10.304   9.011  -3.947
  759    H    ARG  89           HN       ARG  89  16.315   3.104  -1.397
  760    HA   ARG  89           HA       ARG  89  17.605   2.173   0.757
  761    HB2  ARG  89           2HB      ARG  89  18.746   3.529  -1.674
  762    HB3  ARG  89           3HB      ARG  89  19.787   2.825  -0.444
  763    HG2  ARG  89           2HG      ARG  89  18.979   0.650  -0.863
  764    HG3  ARG  89           3HG      ARG  89  17.629   1.258  -1.824
  765    HD2  ARG  89           2HD      ARG  89  20.410   1.894  -2.683
  766    HD3  ARG  89           3HD      ARG  89  19.785   0.270  -2.967
  767    HE   ARG  89           HE       ARG  89  19.082   2.648  -4.376
  768   HH11  ARG  89          2HH1      ARG  89  17.870  -0.431  -3.293
  769   HH12  ARG  89          1HH1      ARG  89  16.678  -0.549  -4.545
  770   HH21  ARG  89          2HH2      ARG  89  17.516   2.504  -6.028
  771   HH22  ARG  89          1HH2      ARG  89  16.478   1.121  -6.100
  Start of MODEL   10
    1    H1   MET   1           HN       MET   1 -18.661   2.944   6.928
    2    HA   MET   1           HA       MET   1 -18.471   3.259   4.021
    3    HB2  MET   1           2HB      MET   1 -18.754   5.188   5.806
    4    HB3  MET   1           3HB      MET   1 -17.007   5.027   5.933
    5    HG2  MET   1           2HG      MET   1 -17.179   6.651   4.339
    6    HG3  MET   1           3HG      MET   1 -17.092   5.206   3.333
    7    HE1  MET   1           3HE      MET   1 -20.260   7.926   4.566
    8    HE2  MET   1           1HE      MET   1 -18.535   8.201   4.317
    9    HE3  MET   1           2HE      MET   1 -19.675   8.507   3.006
   10    H    GLY   2           HN       GLY   2 -17.052   1.873   3.152
   11    HA2  GLY   2           1HA      GLY   2 -14.323   1.877   4.239
   12    HA3  GLY   2           2HA      GLY   2 -15.125   0.335   3.983
   13    H    TYR   3           HN       TYR   3 -12.706   1.647   2.751
   14    HA   TYR   3           HA       TYR   3 -13.529   1.866  -0.041
   15    HB2  TYR   3           2HB      TYR   3 -10.970   2.459   1.427
   16    HB3  TYR   3           3HB      TYR   3 -11.017   2.374  -0.330
   17    HD1  TYR   3           2HD      TYR   3 -13.438   3.811   2.123
   18    HD2  TYR   3           1HD      TYR   3 -10.793   4.537  -1.130
   19    HE1  TYR   3           2HE      TYR   3 -14.195   6.150   2.037
   20    HE2  TYR   3           1HE      TYR   3 -11.542   6.878  -1.225
   21    HH   TYR   3           HH       TYR   3 -13.987   8.064  -0.347
   22    H    ARG   4           HN       ARG   4 -12.308   0.700  -1.703
   23    HA   ARG   4           HA       ARG   4 -12.050  -2.087  -0.990
   24    HB2  ARG   4           2HB      ARG   4 -13.153  -1.212  -3.106
   25    HB3  ARG   4           3HB      ARG   4 -11.535  -0.846  -3.690
   26    HG2  ARG   4           2HG      ARG   4 -11.824  -2.898  -4.620
   27    HG3  ARG   4           3HG      ARG   4 -11.119  -3.378  -3.075
   28    HD2  ARG   4           2HD      ARG   4 -13.304  -3.846  -2.172
   29    HD3  ARG   4           3HD      ARG   4 -14.078  -3.222  -3.629
   30    HE   ARG   4           HE       ARG   4 -12.295  -5.358  -4.224
   31   HH11  ARG   4          2HH1      ARG   4 -15.464  -4.640  -2.974
   32   HH12  ARG   4          1HH1      ARG   4 -16.138  -6.166  -3.444
   33   HH21  ARG   4          2HH2      ARG   4 -13.171  -7.370  -4.848
   34   HH22  ARG   4          1HH2      ARG   4 -14.832  -7.718  -4.509
   35    H    ILE   5           HN       ILE   5 -10.201  -3.381  -1.379
   36    HA   ILE   5           HA       ILE   5  -7.674  -1.864  -1.338
   37    HB   ILE   5           HB       ILE   5  -8.112  -4.615  -0.182
   38   HG12  ILE   5          2HG1      ILE   5  -9.474  -2.862   0.972
   39   HG13  ILE   5          3HG1      ILE   5  -8.250  -3.598   2.001
   40   HG21  ILE   5          1HG2      ILE   5  -5.892  -2.642   0.317
   41   HG22  ILE   5          2HG2      ILE   5  -5.981  -4.319   0.854
   42   HG23  ILE   5          3HG2      ILE   5  -5.801  -3.951  -0.861
   43   HD11  ILE   5          3HD1      ILE   5  -7.782  -1.008   0.565
   44   HD12  ILE   5          1HD1      ILE   5  -8.539  -1.088   2.155
   45   HD13  ILE   5          2HD1      ILE   5  -6.895  -1.687   1.929
   46    H    GLU   6           HN       GLU   6  -6.745  -1.969  -3.278
   47    HA   GLU   6           HA       GLU   6  -6.741  -4.560  -4.681
   48    HB2  GLU   6           2HB      GLU   6  -7.062  -1.769  -5.658
   49    HB3  GLU   6           3HB      GLU   6  -6.162  -2.883  -6.678
   50    HG2  GLU   6           2HG      GLU   6  -8.905  -3.495  -5.621
   51    HG3  GLU   6           3HG      GLU   6  -8.624  -2.673  -7.154
   52    H    PHE   7           HN       PHE   7  -4.824  -4.922  -6.078
   53    HA   PHE   7           HA       PHE   7  -2.407  -3.568  -5.118
   54    HB2  PHE   7           2HB      PHE   7  -2.997  -6.509  -5.012
   55    HB3  PHE   7           3HB      PHE   7  -1.338  -5.945  -5.185
   56    HD1  PHE   7           1HD      PHE   7  -4.351  -5.532  -3.045
   57    HD2  PHE   7           2HD      PHE   7  -0.105  -5.403  -3.306
   58    HE1  PHE   7           1HE      PHE   7  -4.214  -5.207  -0.609
   59    HE2  PHE   7           2HE      PHE   7   0.039  -5.079  -0.871
   60    HZ   PHE   7           HZ       PHE   7  -2.017  -4.982   0.480
   61    H    ASP   8           HN       ASP   8  -1.105  -2.987  -6.727
   62    HA   ASP   8           HA       ASP   8  -1.738  -3.325  -9.413
   63    HB2  ASP   8           2HB      ASP   8   0.631  -2.361  -7.908
   64    HB3  ASP   8           3HB      ASP   8   0.894  -2.804  -9.593
   65    HA   PRO   9           HA       PRO   9  -0.184  -7.222 -10.690
   66    HB2  PRO   9           2HB      PRO   9   0.992  -6.659 -13.071
   67    HB3  PRO   9           3HB      PRO   9  -0.760  -6.654 -12.840
   68    HG2  PRO   9           2HG      PRO   9   1.151  -4.350 -12.884
   69    HG3  PRO   9           3HG      PRO   9  -0.450  -4.490 -13.634
   70    HD2  PRO   9           2HD      PRO   9  -0.043  -3.172 -11.304
   71    HD3  PRO   9           3HD      PRO   9  -1.552  -4.035 -11.662
   72    H    ARG  10           HN       ARG  10   1.987  -4.643 -10.111
   73    HA   ARG  10           HA       ARG  10   4.350  -6.334 -10.437
   74    HB2  ARG  10           2HB      ARG  10   4.007  -3.390  -9.869
   75    HB3  ARG  10           3HB      ARG  10   5.570  -4.196  -9.833
   76    HG2  ARG  10           2HG      ARG  10   5.052  -4.939 -12.216
   77    HG3  ARG  10           3HG      ARG  10   3.755  -3.744 -12.175
   78    HD2  ARG  10           2HD      ARG  10   5.245  -1.960 -11.952
   79    HD3  ARG  10           3HD      ARG  10   6.562  -3.009 -11.428
   80    HE   ARG  10           HE       ARG  10   5.904  -2.316 -14.102
   81   HH11  ARG  10          2HH1      ARG  10   7.118  -4.917 -12.131
   82   HH12  ARG  10          1HH1      ARG  10   8.014  -5.649 -13.420
   83   HH21  ARG  10          2HH2      ARG  10   7.080  -3.271 -15.807
   84   HH22  ARG  10          1HH2      ARG  10   7.993  -4.712 -15.511
   85    H    ALA  11           HN       ALA  11   2.782  -4.336  -7.944
   86    HA   ALA  11           HA       ALA  11   4.489  -5.028  -5.829
   87    HB1  ALA  11           1HB      ALA  11   2.086  -3.531  -6.173
   88    HB2  ALA  11           2HB      ALA  11   1.914  -4.579  -4.764
   89    HB3  ALA  11           3HB      ALA  11   3.266  -3.451  -4.864
   90    H    GLU  12           HN       GLU  12   1.463  -6.494  -6.952
   91    HA   GLU  12           HA       GLU  12   0.910  -8.292  -4.987
   92    HB2  GLU  12           2HB      GLU  12   0.620  -8.358  -7.947
   93    HB3  GLU  12           3HB      GLU  12   0.372  -9.865  -7.076
   94    HG2  GLU  12           2HG      GLU  12  -1.178  -8.354  -5.581
   95    HG3  GLU  12           3HG      GLU  12  -1.226  -7.363  -7.038
   96    H    LYS  13           HN       LYS  13   3.233  -8.781  -7.635
   97    HA   LYS  13           HA       LYS  13   4.083 -11.341  -6.754
   98    HB2  LYS  13           2HB      LYS  13   5.332  -9.310  -8.604
   99    HB3  LYS  13           3HB      LYS  13   6.049 -10.885  -8.290
  100    HG2  LYS  13           2HG      LYS  13   3.606 -11.688  -8.974
  101    HG3  LYS  13           3HG      LYS  13   3.654 -10.167  -9.869
  102    HD2  LYS  13           2HD      LYS  13   5.740 -10.869 -10.943
  103    HD3  LYS  13           3HD      LYS  13   5.692 -12.388 -10.045
  104    HE2  LYS  13           2HE      LYS  13   3.468 -12.837 -11.118
  105    HE3  LYS  13           3HE      LYS  13   3.748 -11.426 -12.137
  106    HZ1  LYS  13           3HZ      LYS  13   5.220 -12.527 -13.393
  107    HZ2  LYS  13           1HZ      LYS  13   4.488 -13.920 -12.771
  108    HZ3  LYS  13           2HZ      LYS  13   5.918 -13.336 -12.082
  109    H    GLU  14           HN       GLU  14   5.480  -8.090  -6.410
  110    HA   GLU  14           HA       GLU  14   7.791  -8.819  -5.021
  111    HB2  GLU  14           2HB      GLU  14   6.166  -6.276  -4.862
  112    HB3  GLU  14           3HB      GLU  14   7.773  -6.471  -4.175
  113    HG2  GLU  14           2HG      GLU  14   8.732  -6.790  -6.343
  114    HG3  GLU  14           3HG      GLU  14   7.137  -6.823  -7.093
  115    H    LEU  15           HN       LEU  15   4.496  -8.503  -3.959
  116    HA   LEU  15           HA       LEU  15   5.064  -8.374  -1.164
  117    HB2  LEU  15           2HB      LEU  15   2.945  -7.622  -2.318
  118    HB3  LEU  15           3HB      LEU  15   2.513  -9.325  -2.445
  119    HG   LEU  15           HG       LEU  15   1.331  -8.557  -0.584
  120   HD11  LEU  15          1HD1      LEU  15   2.764 -10.626  -0.240
  121   HD12  LEU  15          2HD1      LEU  15   2.162  -9.825   1.210
  122   HD13  LEU  15          3HD1      LEU  15   3.836  -9.595   0.707
  123   HD21  LEU  15          3HD2      LEU  15   3.846  -7.204   0.386
  124   HD22  LEU  15          1HD2      LEU  15   2.272  -7.185   1.181
  125   HD23  LEU  15          2HD2      LEU  15   2.479  -6.395  -0.382
  126    H    GLU  16           HN       GLU  16   3.789 -10.977  -3.244
  127    HA   GLU  16           HA       GLU  16   3.705 -13.007  -1.376
  128    HB2  GLU  16           2HB      GLU  16   4.046 -12.921  -4.334
  129    HB3  GLU  16           3HB      GLU  16   4.352 -14.448  -3.520
  130    HG2  GLU  16           2HG      GLU  16   1.838 -13.001  -2.889
  131    HG3  GLU  16           3HG      GLU  16   1.969 -13.820  -4.444
  132    H    LYS  17           HN       LYS  17   6.454 -11.783  -3.194
  133    HA   LYS  17           HA       LYS  17   8.286 -13.824  -2.552
  134    HB2  LYS  17           2HB      LYS  17   8.474 -11.023  -3.537
  135    HB3  LYS  17           3HB      LYS  17   9.932 -11.740  -2.863
  136    HG2  LYS  17           2HG      LYS  17  10.150 -13.242  -4.561
  137    HG3  LYS  17           3HG      LYS  17   8.414 -13.311  -4.872
  138    HD2  LYS  17           2HD      LYS  17   9.170 -12.155  -6.719
  139    HD3  LYS  17           3HD      LYS  17   8.738 -10.834  -5.630
  140    HE2  LYS  17           2HE      LYS  17  10.970 -10.386  -5.104
  141    HE3  LYS  17           3HE      LYS  17  11.518 -11.957  -5.685
  142    HZ1  LYS  17           3HZ      LYS  17  11.749 -11.178  -7.744
  143    HZ2  LYS  17           1HZ      LYS  17  11.619  -9.629  -7.077
  144    HZ3  LYS  17           2HZ      LYS  17  10.254 -10.388  -7.725
  145    H    LEU  18           HN       LEU  18   7.460 -10.791  -0.929
  146    HA   LEU  18           HA       LEU  18   9.413 -10.675   1.003
  147    HB2  LEU  18           2HB      LEU  18   6.493  -9.973   1.136
  148    HB3  LEU  18           3HB      LEU  18   7.610  -9.633   2.455
  149    HG   LEU  18           HG       LEU  18   8.101  -8.585  -0.315
  150   HD11  LEU  18          1HD1      LEU  18   6.723  -6.799  -0.046
  151   HD12  LEU  18          2HD1      LEU  18   6.813  -6.849   1.714
  152   HD13  LEU  18          3HD1      LEU  18   5.790  -7.997   0.851
  153   HD21  LEU  18          3HD2      LEU  18   9.391  -8.413   2.250
  154   HD22  LEU  18          1HD2      LEU  18   8.922  -6.809   1.685
  155   HD23  LEU  18          2HD2      LEU  18   9.942  -7.836   0.676
  156    H    ASP  19           HN       ASP  19   8.869 -11.014   3.457
  157    HA   ASP  19           HA       ASP  19   8.906 -13.765   3.953
  158    HB2  ASP  19           2HB      ASP  19   9.707 -11.771   5.422
  159    HB3  ASP  19           3HB      ASP  19   8.063 -11.792   6.053
  160    H    ARG  20           HN       ARG  20   7.388 -15.025   5.260
  161    HA   ARG  20           HA       ARG  20   4.779 -14.960   4.161
  162    HB2  ARG  20           2HB      ARG  20   5.690 -17.075   4.792
  163    HB3  ARG  20           3HB      ARG  20   5.986 -16.528   6.437
  164    HG2  ARG  20           2HG      ARG  20   4.104 -17.777   6.748
  165    HG3  ARG  20           3HG      ARG  20   3.384 -16.193   6.455
  166    HD2  ARG  20           2HD      ARG  20   2.136 -17.532   5.056
  167    HD3  ARG  20           3HD      ARG  20   3.396 -16.959   3.964
  168    HE   ARG  20           HE       ARG  20   4.231 -19.367   5.141
  169   HH11  ARG  20          2HH1      ARG  20   1.885 -18.167   2.866
  170   HH12  ARG  20          1HH1      ARG  20   1.813 -19.643   1.963
  171   HH21  ARG  20          2HH2      ARG  20   4.145 -21.316   3.960
  172   HH22  ARG  20          1HH2      ARG  20   3.098 -21.434   2.586
  173    H    GLU  21           HN       GLU  21   5.930 -14.394   7.489
  174    HA   GLU  21           HA       GLU  21   3.467 -13.643   8.573
  175    HB2  GLU  21           2HB      GLU  21   6.313 -13.070   9.335
  176    HB3  GLU  21           3HB      GLU  21   4.988 -12.335  10.226
  177    HG2  GLU  21           2HG      GLU  21   5.378 -14.205  11.479
  178    HG3  GLU  21           3HG      GLU  21   4.116 -14.786  10.393
  179    H    VAL  22           HN       VAL  22   5.999 -11.694   7.049
  180    HA   VAL  22           HA       VAL  22   4.923  -9.163   7.540
  181    HB   VAL  22           HB       VAL  22   6.544 -10.084   5.162
  182   HG11  VAL  22          1HG1      VAL  22   7.071  -7.400   5.667
  183   HG12  VAL  22          2HG1      VAL  22   6.149  -8.063   4.316
  184   HG13  VAL  22          3HG1      VAL  22   5.317  -7.542   5.782
  185   HG21  VAL  22          3HG2      VAL  22   8.429  -9.788   6.385
  186   HG22  VAL  22          1HG2      VAL  22   7.733  -8.481   7.342
  187   HG23  VAL  22          2HG2      VAL  22   7.340 -10.157   7.722
  188    H    ALA  23           HN       ALA  23   4.610 -11.157   4.597
  189    HA   ALA  23           HA       ALA  23   2.968  -9.613   3.080
  190    HB1  ALA  23           1HB      ALA  23   3.411 -12.497   3.349
  191    HB2  ALA  23           2HB      ALA  23   1.862 -12.057   2.629
  192    HB3  ALA  23           3HB      ALA  23   3.365 -11.483   1.907
  193    H    ARG  24           HN       ARG  24   1.795 -12.016   5.446
  194    HA   ARG  24           HA       ARG  24  -0.916 -11.355   5.242
  195    HB2  ARG  24           2HB      ARG  24   0.718 -12.652   7.408
  196    HB3  ARG  24           3HB      ARG  24  -1.004 -12.359   7.617
  197    HG2  ARG  24           2HG      ARG  24  -1.511 -13.742   5.704
  198    HG3  ARG  24           3HG      ARG  24   0.209 -13.967   5.380
  199    HD2  ARG  24           2HD      ARG  24  -0.211 -15.890   6.532
  200    HD3  ARG  24           3HD      ARG  24   0.199 -14.828   7.878
  201    HE   ARG  24           HE       ARG  24  -2.590 -14.778   7.316
  202   HH11  ARG  24          2HH1      ARG  24  -0.089 -16.658   8.842
  203   HH12  ARG  24          1HH1      ARG  24  -1.166 -17.423   9.963
  204   HH21  ARG  24          2HH2      ARG  24  -4.019 -15.778   8.786
  205   HH22  ARG  24          1HH2      ARG  24  -3.401 -16.922   9.929
  206    H    ARG  25           HN       ARG  25   1.619 -10.108   7.369
  207    HA   ARG  25           HA       ARG  25   0.052  -8.557   9.066
  208    HB2  ARG  25           2HB      ARG  25   2.344  -8.868   9.613
  209    HB3  ARG  25           3HB      ARG  25   2.875  -8.205   8.073
  210    HG2  ARG  25           2HG      ARG  25   1.801  -6.019   8.851
  211    HG3  ARG  25           3HG      ARG  25   1.770  -6.760  10.452
  212    HD2  ARG  25           2HD      ARG  25   4.298  -6.721   8.854
  213    HD3  ARG  25           3HD      ARG  25   3.795  -5.290   9.754
  214    HE   ARG  25           HE       ARG  25   3.785  -7.679  11.338
  215   HH11  ARG  25          2HH1      ARG  25   5.762  -5.091  10.108
  216   HH12  ARG  25          1HH1      ARG  25   6.936  -5.211  11.376
  217   HH21  ARG  25          2HH2      ARG  25   5.324  -7.847  13.013
  218   HH22  ARG  25          1HH2      ARG  25   6.687  -6.779  13.027
  219    H    ILE  26           HN       ILE  26   1.519  -7.707   5.947
  220    HA   ILE  26           HA       ILE  26   0.695  -5.023   5.895
  221    HB   ILE  26           HB       ILE  26   1.223  -6.905   3.594
  222   HG12  ILE  26          2HG1      ILE  26   3.004  -4.752   4.740
  223   HG13  ILE  26          3HG1      ILE  26   3.094  -6.438   5.237
  224   HG21  ILE  26          1HG2      ILE  26   1.710  -4.568   2.490
  225   HG22  ILE  26          2HG2      ILE  26   0.079  -5.236   2.525
  226   HG23  ILE  26          3HG2      ILE  26   0.554  -4.007   3.697
  227   HD11  ILE  26          3HD1      ILE  26   4.631  -5.414   3.333
  228   HD12  ILE  26          1HD1      ILE  26   4.085  -7.091   3.313
  229   HD13  ILE  26          2HD1      ILE  26   3.250  -5.879   2.339
  230    H    LEU  27           HN       LEU  27  -0.699  -7.738   4.043
  231    HA   LEU  27           HA       LEU  27  -2.944  -6.492   3.082
  232    HB2  LEU  27           2HB      LEU  27  -2.720  -9.339   4.046
  233    HB3  LEU  27           3HB      LEU  27  -3.991  -8.717   2.996
  234    HG   LEU  27           HG       LEU  27  -1.078  -8.700   2.233
  235   HD11  LEU  27          1HD1      LEU  27  -1.163 -10.888   1.902
  236   HD12  LEU  27          2HD1      LEU  27  -2.491 -10.646   0.766
  237   HD13  LEU  27          3HD1      LEU  27  -2.832 -10.941   2.471
  238   HD21  LEU  27          3HD2      LEU  27  -1.739  -7.924   0.218
  239   HD22  LEU  27          1HD2      LEU  27  -3.102  -7.306   1.151
  240   HD23  LEU  27          2HD2      LEU  27  -3.262  -8.815   0.251
  241    H    ARG  28           HN       ARG  28  -2.574  -8.127   6.211
  242    HA   ARG  28           HA       ARG  28  -5.229  -7.732   7.081
  243    HB2  ARG  28           2HB      ARG  28  -3.513  -9.334   8.046
  244    HB3  ARG  28           3HB      ARG  28  -2.808  -7.948   8.867
  245    HG2  ARG  28           2HG      ARG  28  -4.199  -8.963  10.451
  246    HG3  ARG  28           3HG      ARG  28  -5.106  -7.563   9.873
  247    HD2  ARG  28           2HD      ARG  28  -6.445  -8.954   8.443
  248    HD3  ARG  28           3HD      ARG  28  -5.456 -10.364   8.818
  249    HE   ARG  28           HE       ARG  28  -6.398  -9.539  11.239
  250   HH11  ARG  28          2HH1      ARG  28  -7.864 -10.405   8.202
  251   HH12  ARG  28          1HH1      ARG  28  -9.320 -11.002   8.926
  252   HH21  ARG  28          2HH2      ARG  28  -8.311 -10.322  12.204
  253   HH22  ARG  28          1HH2      ARG  28  -9.574 -10.954  11.203
  254    H    PHE  29           HN       PHE  29  -2.266  -5.848   7.549
  255    HA   PHE  29           HA       PHE  29  -3.304  -3.929   9.303
  256    HB2  PHE  29           2HB      PHE  29  -0.977  -3.916   9.123
  257    HB3  PHE  29           3HB      PHE  29  -1.015  -3.946   7.364
  258    HD1  PHE  29           1HD      PHE  29  -1.642  -1.805  10.315
  259    HD2  PHE  29           2HD      PHE  29  -0.940  -1.962   6.120
  260    HE1  PHE  29           1HE      PHE  29  -1.359   0.639  10.274
  261    HE2  PHE  29           2HE      PHE  29  -0.655   0.481   6.072
  262    HZ   PHE  29           HZ       PHE  29  -0.864   1.785   8.151
  263    H    LEU  30           HN       LEU  30  -3.468  -4.214   5.819
  264    HA   LEU  30           HA       LEU  30  -4.668  -1.579   5.537
  265    HB2  LEU  30           2HB      LEU  30  -4.083  -3.727   3.505
  266    HB3  LEU  30           3HB      LEU  30  -4.726  -2.129   3.131
  267    HG   LEU  30           HG       LEU  30  -2.106  -2.379   4.550
  268   HD11  LEU  30          1HD1      LEU  30  -1.474  -2.066   1.878
  269   HD12  LEU  30          2HD1      LEU  30  -2.687  -3.346   1.879
  270   HD13  LEU  30          3HD1      LEU  30  -1.226  -3.516   2.852
  271   HD21  LEU  30          3HD2      LEU  30  -2.612  -0.398   2.427
  272   HD22  LEU  30          1HD2      LEU  30  -1.842  -0.208   4.003
  273   HD23  LEU  30          2HD2      LEU  30  -3.602  -0.241   3.880
  274    H    ARG  31           HN       ARG  31  -5.595  -4.928   5.664
  275    HA   ARG  31           HA       ARG  31  -8.279  -4.416   4.696
  276    HB2  ARG  31           2HB      ARG  31  -6.796  -6.852   5.629
  277    HB3  ARG  31           3HB      ARG  31  -8.548  -6.885   5.483
  278    HG2  ARG  31           2HG      ARG  31  -8.396  -6.339   3.131
  279    HG3  ARG  31           3HG      ARG  31  -6.642  -6.197   3.256
  280    HD2  ARG  31           2HD      ARG  31  -6.992  -8.334   2.372
  281    HD3  ARG  31           3HD      ARG  31  -6.685  -8.612   4.085
  282    HE   ARG  31           HE       ARG  31  -9.425  -8.379   3.808
  283   HH11  ARG  31          2HH1      ARG  31  -6.900 -10.471   2.639
  284   HH12  ARG  31          1HH1      ARG  31  -7.931 -11.858   2.507
  285   HH21  ARG  31          2HH2      ARG  31 -10.792 -10.197   3.640
  286   HH22  ARG  31          1HH2      ARG  31 -10.145 -11.701   3.076
  287    H    GLU  32           HN       GLU  32  -6.679  -3.996   7.580
  288    HA   GLU  32           HA       GLU  32  -9.162  -4.315   9.135
  289    HB2  GLU  32           2HB      GLU  32  -6.277  -4.543   9.986
  290    HB3  GLU  32           3HB      GLU  32  -7.597  -4.385  11.136
  291    HG2  GLU  32           2HG      GLU  32  -6.839  -6.674   9.416
  292    HG3  GLU  32           3HG      GLU  32  -7.384  -6.645  11.092
  293    H    ARG  33           HN       ARG  33  -6.125  -2.454   9.370
  294    HA   ARG  33           HA       ARG  33  -7.265  -0.300  10.769
  295    HB2  ARG  33           2HB      ARG  33  -4.827  -0.178   8.989
  296    HB3  ARG  33           3HB      ARG  33  -5.205   0.869  10.351
  297    HG2  ARG  33           2HG      ARG  33  -4.946  -2.057  10.825
  298    HG3  ARG  33           3HG      ARG  33  -3.487  -1.093  10.585
  299    HD2  ARG  33           2HD      ARG  33  -3.957   0.263  12.457
  300    HD3  ARG  33           3HD      ARG  33  -5.617  -0.321  12.559
  301    HE   ARG  33           HE       ARG  33  -3.763  -2.444  12.899
  302   HH11  ARG  33          2HH1      ARG  33  -5.181   0.282  14.535
  303   HH12  ARG  33          1HH1      ARG  33  -4.977  -0.395  16.117
  304   HH21  ARG  33          2HH2      ARG  33  -3.490  -3.347  14.975
  305   HH22  ARG  33          1HH2      ARG  33  -4.014  -2.459  16.366
  306    H    VAL  34           HN       VAL  34  -5.975  -0.122   7.452
  307    HA   VAL  34           HA       VAL  34  -7.286   2.229   6.746
  308    HB   VAL  34           HB       VAL  34  -6.471  -0.019   4.898
  309   HG11  VAL  34          1HG1      VAL  34  -6.730   2.905   4.242
  310   HG12  VAL  34          2HG1      VAL  34  -6.511   1.551   3.131
  311   HG13  VAL  34          3HG1      VAL  34  -8.038   1.749   3.993
  312   HG21  VAL  34          3HG2      VAL  34  -4.546   0.597   6.120
  313   HG22  VAL  34          1HG2      VAL  34  -4.432   1.457   4.585
  314   HG23  VAL  34          2HG2      VAL  34  -4.948   2.312   6.038
  315    H    ALA  35           HN       ALA  35  -8.349  -1.117   6.546
  316    HA   ALA  35           HA       ALA  35 -10.591  -0.805   4.919
  317    HB1  ALA  35           1HB      ALA  35 -10.377  -2.705   7.247
  318    HB2  ALA  35           2HB      ALA  35 -11.366  -2.887   5.798
  319    HB3  ALA  35           3HB      ALA  35  -9.608  -2.971   5.682
  320    H    THR  36           HN       THR  36 -10.362  -0.642   8.469
  321    HA   THR  36           HA       THR  36 -13.111   0.127   8.764
  322    HB   THR  36           HB       THR  36 -12.642   0.358  11.123
  323    HG1  THR  36           1HG      THR  36  -9.892  -0.019  10.470
  324   HG21  THR  36          3HG2      THR  36 -12.850  -1.874  11.028
  325   HG22  THR  36          1HG2      THR  36 -11.098  -1.914  11.221
  326   HG23  THR  36          2HG2      THR  36 -11.809  -1.999   9.610
  327    H    LEU  37           HN       LEU  37 -10.026   1.779   8.593
  328    HA   LEU  37           HA       LEU  37 -10.647   4.261   9.617
  329    HB2  LEU  37           2HB      LEU  37  -8.854   3.386   7.386
  330    HB3  LEU  37           3HB      LEU  37  -9.036   5.096   7.770
  331    HG   LEU  37           HG       LEU  37  -8.143   3.044   9.785
  332   HD11  LEU  37          1HD1      LEU  37  -6.254   2.901   8.605
  333   HD12  LEU  37          2HD1      LEU  37  -5.938   4.544   9.162
  334   HD13  LEU  37          3HD1      LEU  37  -6.679   4.276   7.584
  335   HD21  LEU  37          3HD2      LEU  37  -8.551   5.968   9.752
  336   HD22  LEU  37          1HD2      LEU  37  -7.095   5.388  10.561
  337   HD23  LEU  37          2HD2      LEU  37  -8.680   4.816  11.082
  338    H    GLU  38           HN       GLU  38 -12.483   5.325   9.209
  339    HA   GLU  38           HA       GLU  38 -14.210   5.218   7.155
  340    HB2  GLU  38           2HB      GLU  38 -13.328   7.580   8.788
  341    HB3  GLU  38           3HB      GLU  38 -14.564   7.756   7.551
  342    HG2  GLU  38           2HG      GLU  38 -15.849   5.943   8.694
  343    HG3  GLU  38           3HG      GLU  38 -14.664   6.013   9.998
  344    H    ASP  39           HN       ASP  39 -11.154   6.964   7.145
  345    HA   ASP  39           HA       ASP  39 -11.433   7.291   4.236
  346    HB2  ASP  39           2HB      ASP  39 -10.195   9.349   6.074
  347    HB3  ASP  39           3HB      ASP  39 -10.422   9.488   4.333
  348    HA   PRO  40           HA       PRO  40  -7.513   5.295   4.080
  349    HB2  PRO  40           2HB      PRO  40  -6.731   6.096   1.606
  350    HB3  PRO  40           3HB      PRO  40  -7.985   4.878   1.870
  351    HG2  PRO  40           2HG      PRO  40  -8.276   7.792   1.247
  352    HG3  PRO  40           3HG      PRO  40  -9.173   6.411   0.588
  353    HD2  PRO  40           2HD      PRO  40 -10.174   8.003   2.536
  354    HD3  PRO  40           3HD      PRO  40 -10.558   6.273   2.425
  355    H    ARG  41           HN       ARG  41  -7.921   8.669   4.089
  356    HA   ARG  41           HA       ARG  41  -5.033   9.175   4.105
  357    HB2  ARG  41           2HB      ARG  41  -7.365  11.099   4.020
  358    HB3  ARG  41           3HB      ARG  41  -5.669  11.565   3.998
  359    HG2  ARG  41           2HG      ARG  41  -5.383  10.335   1.885
  360    HG3  ARG  41           3HG      ARG  41  -7.106   9.954   1.900
  361    HD2  ARG  41           2HD      ARG  41  -6.068  12.774   2.009
  362    HD3  ARG  41           3HD      ARG  41  -6.380  11.939   0.488
  363    HE   ARG  41           HE       ARG  41  -8.649  12.123   0.871
  364   HH11  ARG  41          2HH1      ARG  41  -6.866  13.108   3.694
  365   HH12  ARG  41          1HH1      ARG  41  -8.244  13.796   4.485
  366   HH21  ARG  41          2HH2      ARG  41 -10.472  13.027   1.902
  367   HH22  ARG  41          1HH2      ARG  41 -10.295  13.749   3.466
  368    H    SER  42           HN       SER  42  -5.673   7.793   6.280
  369    HA   SER  42           HA       SER  42  -5.737   9.813   8.425
  370    HB2  SER  42           2HB      SER  42  -7.783   8.247   8.205
  371    HB3  SER  42           3HB      SER  42  -6.709   6.990   8.817
  372    HG   SER  42           HG       SER  42  -7.957   8.161  10.438
  373    H    LEU  43           HN       LEU  43  -4.684   6.520   7.591
  374    HA   LEU  43           HA       LEU  43  -2.513   6.761   9.550
  375    HB2  LEU  43           2HB      LEU  43  -3.846   4.443   8.207
  376    HB3  LEU  43           3HB      LEU  43  -2.237   4.264   8.904
  377    HG   LEU  43           HG       LEU  43  -4.583   5.241  10.513
  378   HD11  LEU  43          1HD1      LEU  43  -3.852   2.511  11.043
  379   HD12  LEU  43          2HD1      LEU  43  -4.367   2.704   9.368
  380   HD13  LEU  43          3HD1      LEU  43  -5.435   3.201  10.680
  381   HD21  LEU  43          3HD2      LEU  43  -3.242   4.621  12.394
  382   HD22  LEU  43          1HD2      LEU  43  -2.260   5.631  11.332
  383   HD23  LEU  43          2HD2      LEU  43  -2.026   3.882  11.351
  384    H    GLY  44           HN       GLY  44  -2.440   8.187   7.039
  385    HA2  GLY  44           1HA      GLY  44   0.126   7.185   6.098
  386    HA3  GLY  44           2HA      GLY  44  -1.157   7.246   4.899
  387    H    GLU  45           HN       GLU  45   1.196   8.680   4.595
  388    HA   GLU  45           HA       GLU  45   0.348  11.453   5.111
  389    HB2  GLU  45           2HB      GLU  45   2.640  12.114   5.065
  390    HB3  GLU  45           3HB      GLU  45   2.526  10.711   6.119
  391    HG2  GLU  45           2HG      GLU  45   3.491   9.293   4.502
  392    HG3  GLU  45           3HG      GLU  45   3.311  10.500   3.230
  393    HA   PRO  46           HA       PRO  46  -0.204  12.053   0.788
  394    HB2  PRO  46           2HB      PRO  46   0.145  14.743   0.669
  395    HB3  PRO  46           3HB      PRO  46  -1.304  13.991   1.348
  396    HG2  PRO  46           2HG      PRO  46   1.094  15.099   2.757
  397    HG3  PRO  46           3HG      PRO  46  -0.623  15.274   3.164
  398    HD2  PRO  46           2HD      PRO  46   1.000  13.511   4.424
  399    HD3  PRO  46           3HD      PRO  46  -0.728  13.199   4.162
  400    H    LEU  47           HN       LEU  47   0.896  12.842  -1.141
  401    HA   LEU  47           HA       LEU  47   3.809  13.096  -0.776
  402    HB2  LEU  47           2HB      LEU  47   2.986  10.878  -1.673
  403    HB3  LEU  47           3HB      LEU  47   2.472  11.755  -3.114
  404    HG   LEU  47           HG       LEU  47   5.011  12.519  -3.104
  405   HD11  LEU  47          1HD1      LEU  47   5.183   9.782  -1.864
  406   HD12  LEU  47          2HD1      LEU  47   5.431  11.279  -0.967
  407   HD13  LEU  47          3HD1      LEU  47   6.509  10.860  -2.297
  408   HD21  LEU  47          3HD2      LEU  47   4.820   9.779  -4.090
  409   HD22  LEU  47          1HD2      LEU  47   5.119  11.282  -4.963
  410   HD23  LEU  47          2HD2      LEU  47   3.466  10.800  -4.578
  411    H    ARG  48           HN       ARG  48   4.649  14.897  -1.583
  412    HA   ARG  48           HA       ARG  48   3.197  16.279  -3.742
  413    HB2  ARG  48           2HB      ARG  48   4.352  17.315  -1.198
  414    HB3  ARG  48           3HB      ARG  48   4.441  18.344  -2.621
  415    HG2  ARG  48           2HG      ARG  48   1.937  17.953  -2.861
  416    HG3  ARG  48           3HG      ARG  48   2.003  17.303  -1.222
  417    HD2  ARG  48           2HD      ARG  48   2.774  19.376  -0.345
  418    HD3  ARG  48           3HD      ARG  48   3.049  20.027  -1.960
  419    HE   ARG  48           HE       ARG  48   0.332  19.331  -1.655
  420   HH11  ARG  48          2HH1      ARG  48   2.665  21.700  -0.620
  421   HH12  ARG  48          1HH1      ARG  48   1.487  22.950  -0.390
  422   HH21  ARG  48          2HH2      ARG  48  -1.227  20.969  -1.357
  423   HH22  ARG  48          1HH2      ARG  48  -0.726  22.533  -0.809
  424    H    GLY  49           HN       GLY  49   4.548  15.176  -5.263
  425    HA2  GLY  49           1HA      GLY  49   7.279  16.300  -5.371
  426    HA3  GLY  49           2HA      GLY  49   6.938  14.634  -5.815
  427    HA   PRO  50           HA       PRO  50   6.287  17.816  -9.372
  428    HB2  PRO  50           2HB      PRO  50   8.775  17.912 -10.453
  429    HB3  PRO  50           3HB      PRO  50   8.216  19.054  -9.225
  430    HG2  PRO  50           2HG      PRO  50   9.916  16.611  -8.905
  431    HG3  PRO  50           3HG      PRO  50  10.105  18.211  -8.163
  432    HD2  PRO  50           2HD      PRO  50   9.022  16.111  -6.840
  433    HD3  PRO  50           3HD      PRO  50   8.519  17.788  -6.546
  434    H    GLU  51           HN       GLU  51   8.149  14.866  -9.017
  435    HA   GLU  51           HA       GLU  51   7.623  14.096 -11.783
  436    HB2  GLU  51           2HB      GLU  51   9.440  13.140  -9.629
  437    HB3  GLU  51           3HB      GLU  51   8.908  11.963 -10.823
  438    HG2  GLU  51           2HG      GLU  51  10.818  12.702 -11.811
  439    HG3  GLU  51           3HG      GLU  51   9.655  13.823 -12.517
  440    H    LEU  52           HN       LEU  52   6.770  13.198  -8.492
  441    HA   LEU  52           HA       LEU  52   4.958  11.130  -9.520
  442    HB2  LEU  52           2HB      LEU  52   6.110  11.676  -6.802
  443    HB3  LEU  52           3HB      LEU  52   4.747  10.583  -7.033
  444    HG   LEU  52           HG       LEU  52   6.399   9.441  -8.747
  445   HD11  LEU  52          1HD1      LEU  52   8.062  11.385  -8.059
  446   HD12  LEU  52          2HD1      LEU  52   8.630   9.761  -8.444
  447   HD13  LEU  52          3HD1      LEU  52   8.446  10.255  -6.761
  448   HD21  LEU  52          3HD2      LEU  52   6.255   7.801  -7.257
  449   HD22  LEU  52          1HD2      LEU  52   5.561   8.961  -6.124
  450   HD23  LEU  52          2HD2      LEU  52   7.299   8.664  -6.127
  451    H    GLY  53           HN       GLY  53   2.765  11.117  -9.000
  452    HA2  GLY  53           1HA      GLY  53   1.594  13.721  -8.670
  453    HA3  GLY  53           2HA      GLY  53   0.728  12.205  -8.878
  454    H    ARG  54           HN       ARG  54  -0.720  12.219  -7.261
  455    HA   ARG  54           HA       ARG  54   0.210  12.868  -4.554
  456    HB2  ARG  54           2HB      ARG  54  -2.494  12.849  -5.859
  457    HB3  ARG  54           3HB      ARG  54  -2.348  12.771  -4.108
  458    HG2  ARG  54           2HG      ARG  54  -0.857  14.907  -5.526
  459    HG3  ARG  54           3HG      ARG  54  -2.610  15.062  -5.393
  460    HD2  ARG  54           2HD      ARG  54  -0.725  14.610  -3.082
  461    HD3  ARG  54           3HD      ARG  54  -1.400  16.171  -3.547
  462    HE   ARG  54           HE       ARG  54  -3.412  14.192  -3.080
  463   HH11  ARG  54          2HH1      ARG  54  -1.303  16.498  -1.547
  464   HH12  ARG  54          1HH1      ARG  54  -2.316  16.697  -0.156
  465   HH21  ARG  54          2HH2      ARG  54  -4.755  14.445  -1.254
  466   HH22  ARG  54          1HH2      ARG  54  -4.279  15.527   0.011
  467    H    PHE  55           HN       PHE  55   1.300  10.650  -4.826
  468    HA   PHE  55           HA       PHE  55  -0.487   8.394  -4.429
  469    HB2  PHE  55           2HB      PHE  55   2.528   8.572  -4.581
  470    HB3  PHE  55           3HB      PHE  55   1.633   7.069  -4.379
  471    HD1  PHE  55           1HD      PHE  55  -0.530   7.185  -6.208
  472    HD2  PHE  55           2HD      PHE  55   3.425   8.686  -6.685
  473    HE1  PHE  55           1HE      PHE  55  -0.754   6.990  -8.650
  474    HE2  PHE  55           2HE      PHE  55   3.206   8.494  -9.128
  475    HZ   PHE  55           HZ       PHE  55   1.115   7.646 -10.114
  476    H    TRP  56           HN       TRP  56  -1.308   8.106  -2.466
  477    HA   TRP  56           HA       TRP  56  -0.338   9.203  -0.092
  478    HB2  TRP  56           2HB      TRP  56  -2.638   8.046  -0.717
  479    HB3  TRP  56           3HB      TRP  56  -1.863   6.636   0.000
  480    HD1  TRP  56           1HD      TRP  56  -2.206   6.394   2.521
  481    HE1  TRP  56           1HE      TRP  56  -2.868   7.961   4.453
  482    HE3  TRP  56           3HE      TRP  56  -2.371  10.816  -0.040
  483    HZ2  TRP  56           2HZ      TRP  56  -3.391  10.708   4.840
  484    HZ3  TRP  56           3HZ      TRP  56  -2.960  12.867   1.185
  485    HH2  TRP  56           2HH      TRP  56  -3.460  12.812   3.574
  486    H    LYS  57           HN       LYS  57   0.597   8.157   1.769
  487    HA   LYS  57           HA       LYS  57   2.281   5.837   1.094
  488    HB2  LYS  57           2HB      LYS  57   3.572   7.971   1.147
  489    HB3  LYS  57           3HB      LYS  57   3.100   8.173   2.829
  490    HG2  LYS  57           2HG      LYS  57   5.134   7.221   3.133
  491    HG3  LYS  57           3HG      LYS  57   4.155   5.756   3.036
  492    HD2  LYS  57           2HD      LYS  57   5.848   5.247   1.566
  493    HD3  LYS  57           3HD      LYS  57   4.661   5.959   0.471
  494    HE2  LYS  57           2HE      LYS  57   6.758   7.659   1.766
  495    HE3  LYS  57           3HE      LYS  57   7.135   6.715   0.326
  496    HZ1  LYS  57           3HZ      LYS  57   6.456   8.677  -0.595
  497    HZ2  LYS  57           1HZ      LYS  57   5.330   9.009   0.624
  498    HZ3  LYS  57           2HZ      LYS  57   4.979   7.853  -0.559
  499    H    TYR  58           HN       TYR  58   1.926   4.153   2.369
  500    HA   TYR  58           HA       TYR  58   0.714   4.622   5.010
  501    HB2  TYR  58           2HB      TYR  58   0.590   2.216   3.185
  502    HB3  TYR  58           3HB      TYR  58  -0.040   2.233   4.828
  503    HD1  TYR  58           1HD      TYR  58  -1.902   3.853   5.391
  504    HD2  TYR  58           2HD      TYR  58  -0.684   3.056   1.392
  505    HE1  TYR  58           1HE      TYR  58  -4.037   4.753   4.568
  506    HE2  TYR  58           2HE      TYR  58  -2.816   3.955   0.558
  507    HH   TYR  58           HH       TYR  58  -5.100   5.540   2.684
  508    H    ARG  59           HN       ARG  59   1.656   3.842   6.824
  509    HA   ARG  59           HA       ARG  59   4.302   2.611   6.502
  510    HB2  ARG  59           2HB      ARG  59   4.718   4.439   7.809
  511    HB3  ARG  59           3HB      ARG  59   3.098   4.453   8.493
  512    HG2  ARG  59           2HG      ARG  59   5.038   2.299   9.225
  513    HG3  ARG  59           3HG      ARG  59   5.097   3.878  10.011
  514    HD2  ARG  59           2HD      ARG  59   2.487   3.402  10.250
  515    HD3  ARG  59           3HD      ARG  59   3.056   1.734  10.185
  516    HE   ARG  59           HE       ARG  59   3.852   1.986  12.305
  517   HH11  ARG  59          2HH1      ARG  59   3.453   5.141  10.888
  518   HH12  ARG  59          1HH1      ARG  59   3.850   5.990  12.346
  519   HH21  ARG  59          2HH2      ARG  59   4.376   3.092  14.231
  520   HH22  ARG  59          1HH2      ARG  59   4.376   4.823  14.246
  521    H    VAL  60           HN       VAL  60   4.807   0.678   7.415
  522    HA   VAL  60           HA       VAL  60   2.826  -0.627   9.136
  523    HB   VAL  60           HB       VAL  60   3.994  -1.864   6.641
  524   HG11  VAL  60          1HG1      VAL  60   3.751  -3.853   7.594
  525   HG12  VAL  60          2HG1      VAL  60   3.190  -3.092   9.084
  526   HG13  VAL  60          3HG1      VAL  60   2.034  -3.524   7.822
  527   HG21  VAL  60          3HG2      VAL  60   1.362  -0.722   7.360
  528   HG22  VAL  60          1HG2      VAL  60   2.184  -0.788   5.801
  529   HG23  VAL  60          2HG2      VAL  60   1.350  -2.214   6.419
  530    H    GLY  61           HN       GLY  61   3.985  -0.872  10.952
  531    HA2  GLY  61           1HA      GLY  61   5.808  -1.284  12.325
  532    HA3  GLY  61           2HA      GLY  61   5.800  -2.801  11.436
  533    H    ASP  62           HN       ASP  62   7.477  -3.277  10.136
  534    HA   ASP  62           HA       ASP  62   9.525  -1.187   9.788
  535    HB2  ASP  62           2HB      ASP  62   9.794  -4.178  10.103
  536    HB3  ASP  62           3HB      ASP  62  11.118  -3.149   9.564
  537    H    TYR  63           HN       TYR  63   7.456  -1.270   7.976
  538    HA   TYR  63           HA       TYR  63   8.901  -1.900   5.539
  539    HB2  TYR  63           2HB      TYR  63   6.217  -3.133   6.183
  540    HB3  TYR  63           3HB      TYR  63   6.928  -3.107   4.573
  541    HD1  TYR  63           1HD      TYR  63   7.585  -4.269   8.050
  542    HD2  TYR  63           2HD      TYR  63   8.365  -4.818   3.903
  543    HE1  TYR  63           1HE      TYR  63   8.795  -6.349   8.559
  544    HE2  TYR  63           2HE      TYR  63   9.576  -6.900   4.400
  545    HH   TYR  63           HH       TYR  63   9.888  -8.093   7.733
  546    H    ARG  64           HN       ARG  64   8.240  -0.695   3.766
  547    HA   ARG  64           HA       ARG  64   6.315   1.445   4.381
  548    HB2  ARG  64           2HB      ARG  64   8.720   1.393   2.560
  549    HB3  ARG  64           3HB      ARG  64   7.526   2.684   2.528
  550    HG2  ARG  64           2HG      ARG  64   9.017   1.913   5.019
  551    HG3  ARG  64           3HG      ARG  64   9.613   3.117   3.874
  552    HD2  ARG  64           2HD      ARG  64   6.826   3.378   4.880
  553    HD3  ARG  64           3HD      ARG  64   8.149   3.793   5.970
  554    HE   ARG  64           HE       ARG  64   7.261   5.280   3.686
  555   HH11  ARG  64          2HH1      ARG  64   9.985   4.576   5.736
  556   HH12  ARG  64          1HH1      ARG  64  10.796   6.068   5.392
  557   HH21  ARG  64          2HH2      ARG  64   8.318   7.248   3.226
  558   HH22  ARG  64          1HH2      ARG  64   9.846   7.588   3.965
  559    H    LEU  65           HN       LEU  65   4.528   1.646   3.183
  560    HA   LEU  65           HA       LEU  65   4.373   0.149   0.651
  561    HB2  LEU  65           2HB      LEU  65   2.019   0.561   2.463
  562    HB3  LEU  65           3HB      LEU  65   2.192  -0.572   1.124
  563    HG   LEU  65           HG       LEU  65   3.661  -0.781   3.751
  564   HD11  LEU  65          1HD1      LEU  65   2.132  -2.583   4.282
  565   HD12  LEU  65          2HD1      LEU  65   1.266  -2.326   2.768
  566   HD13  LEU  65          3HD1      LEU  65   1.239  -1.085   4.021
  567   HD21  LEU  65          3HD2      LEU  65   4.000  -3.145   2.882
  568   HD22  LEU  65          1HD2      LEU  65   4.936  -1.870   2.102
  569   HD23  LEU  65          2HD2      LEU  65   3.504  -2.523   1.307
  570    H    ILE  66           HN       ILE  66   3.833   1.335  -1.057
  571    HA   ILE  66           HA       ILE  66   2.607   3.973  -0.588
  572    HB   ILE  66           HB       ILE  66   4.165   3.263  -3.056
  573   HG12  ILE  66          2HG1      ILE  66   5.190   4.174  -0.378
  574   HG13  ILE  66          3HG1      ILE  66   5.788   2.869  -1.397
  575   HG21  ILE  66          1HG2      ILE  66   2.593   5.366  -2.590
  576   HG22  ILE  66          2HG2      ILE  66   4.088   5.980  -1.887
  577   HG23  ILE  66          3HG2      ILE  66   4.053   5.469  -3.574
  578   HD11  ILE  66          3HD1      ILE  66   6.533   5.655  -1.332
  579   HD12  ILE  66          1HD1      ILE  66   7.352   4.282  -2.075
  580   HD13  ILE  66          2HD1      ILE  66   6.083   5.134  -2.956
  581    H    CYS  67           HN       CYS  67   0.468   3.602  -0.873
  582    HA   CYS  67           HA       CYS  67  -0.371   2.221  -3.330
  583    HB2  CYS  67           2HB      CYS  67  -2.131   2.857  -0.964
  584    HB3  CYS  67           3HB      CYS  67  -2.434   1.708  -2.262
  585    HG   CYS  67           HG       CYS  67   0.350   0.952  -0.635
  586    H    HIS  68           HN       HIS  68  -2.311   3.079  -4.413
  587    HA   HIS  68           HA       HIS  68  -2.310   6.021  -4.348
  588    HB2  HIS  68           2HB      HIS  68  -1.554   4.866  -6.463
  589    HB3  HIS  68           3HB      HIS  68  -3.199   4.262  -6.637
  590    HD2  HIS  68           2HD      HIS  68  -2.324   7.986  -5.691
  591    HE1  HIS  68           1HE      HIS  68  -4.337   7.918  -9.425
  592    HE2  HIS  68           2HE      HIS  68  -3.295   9.369  -7.649
  593    H    ILE  69           HN       ILE  69  -4.032   6.897  -3.426
  594    HA   ILE  69           HA       ILE  69  -6.462   5.375  -3.059
  595    HB   ILE  69           HB       ILE  69  -5.807   8.213  -2.258
  596   HG12  ILE  69          2HG1      ILE  69  -5.980   5.785  -0.477
  597   HG13  ILE  69          3HG1      ILE  69  -4.469   6.295  -1.223
  598   HG21  ILE  69          1HG2      ILE  69  -8.279   7.392  -2.564
  599   HG22  ILE  69          2HG2      ILE  69  -7.983   6.601  -1.017
  600   HG23  ILE  69          3HG2      ILE  69  -7.817   8.350  -1.158
  601   HD11  ILE  69          3HD1      ILE  69  -4.495   8.355  -0.038
  602   HD12  ILE  69          1HD1      ILE  69  -6.132   8.062   0.549
  603   HD13  ILE  69          2HD1      ILE  69  -4.797   7.062   1.122
  604    H    GLN  70           HN       GLN  70  -8.160   5.413  -4.369
  605    HA   GLN  70           HA       GLN  70  -8.377   7.612  -6.314
  606    HB2  GLN  70           2HB      GLN  70  -9.251   4.730  -6.483
  607    HB3  GLN  70           3HB      GLN  70  -9.767   5.955  -7.634
  608    HG2  GLN  70           2HG      GLN  70  -7.669   6.172  -8.554
  609    HG3  GLN  70           3HG      GLN  70  -6.860   5.554  -7.115
  610   HE21  GLN  70          1HE2      GLN  70  -5.674   4.059  -8.289
  611   HE22  GLN  70          2HE2      GLN  70  -6.388   2.641  -8.969
  612    H    ASP  71           HN       ASP  71  -9.577   8.982  -4.973
  613    HA   ASP  71           HA       ASP  71 -11.765   8.380  -3.419
  614    HB2  ASP  71           2HB      ASP  71 -11.054  10.578  -3.213
  615    HB3  ASP  71           3HB      ASP  71 -10.960  10.820  -4.955
  616    H    ARG  72           HN       ARG  72 -11.654   8.954  -6.902
  617    HA   ARG  72           HA       ARG  72 -14.184   9.232  -7.697
  618    HB2  ARG  72           2HB      ARG  72 -12.041   7.431  -8.776
  619    HB3  ARG  72           3HB      ARG  72 -13.625   7.471  -9.537
  620    HG2  ARG  72           2HG      ARG  72 -12.251  10.055  -9.039
  621    HG3  ARG  72           3HG      ARG  72 -11.654   9.024 -10.341
  622    HD2  ARG  72           2HD      ARG  72 -13.980   8.927 -11.233
  623    HD3  ARG  72           3HD      ARG  72 -14.447  10.108 -10.009
  624    HE   ARG  72           HE       ARG  72 -12.944  10.601 -12.424
  625   HH11  ARG  72          2HH1      ARG  72 -13.802  11.761  -9.256
  626   HH12  ARG  72          1HH1      ARG  72 -13.455  13.418  -9.626
  627   HH21  ARG  72          2HH2      ARG  72 -12.484  12.778 -12.924
  628   HH22  ARG  72          1HH2      ARG  72 -12.706  13.995 -11.713
  629    H    GLU  73           HN       GLU  73 -12.859   5.955  -7.181
  630    HA   GLU  73           HA       GLU  73 -15.584   5.081  -6.478
  631    HB2  GLU  73           2HB      GLU  73 -13.355   3.421  -7.670
  632    HB3  GLU  73           3HB      GLU  73 -14.981   2.862  -7.303
  633    HG2  GLU  73           2HG      GLU  73 -15.221   3.248  -9.521
  634    HG3  GLU  73           3HG      GLU  73 -15.643   4.848  -8.912
  635    H    ALA  74           HN       ALA  74 -13.629   6.209  -4.659
  636    HA   ALA  74           HA       ALA  74 -12.406   5.715  -2.756
  637    HB1  ALA  74           1HB      ALA  74 -14.816   3.999  -2.204
  638    HB2  ALA  74           2HB      ALA  74 -13.826   4.890  -1.047
  639    HB3  ALA  74           3HB      ALA  74 -14.859   5.763  -2.179
  640    H    THR  75           HN       THR  75 -11.219   4.220  -4.602
  641    HA   THR  75           HA       THR  75 -10.858   1.614  -3.276
  642    HB   THR  75           HB       THR  75 -10.938   2.190  -6.236
  643    HG1  THR  75           1HG      THR  75 -12.915   1.544  -5.671
  644   HG21  THR  75          3HG2      THR  75 -10.022  -0.364  -4.911
  645   HG22  THR  75          1HG2      THR  75  -8.950   0.809  -5.675
  646   HG23  THR  75          2HG2      THR  75 -10.145  -0.055  -6.643
  647    H    VAL  76           HN       VAL  76  -8.818   1.097  -2.755
  648    HA   VAL  76           HA       VAL  76  -6.691   2.932  -3.616
  649    HB   VAL  76           HB       VAL  76  -6.668   1.002  -1.292
  650   HG11  VAL  76          1HG1      VAL  76  -4.660   2.745  -2.522
  651   HG12  VAL  76          2HG1      VAL  76  -4.808   2.924  -0.773
  652   HG13  VAL  76          3HG1      VAL  76  -4.458   1.343  -1.471
  653   HG21  VAL  76          3HG2      VAL  76  -7.084   3.991  -1.280
  654   HG22  VAL  76          1HG2      VAL  76  -8.340   2.783  -1.007
  655   HG23  VAL  76          2HG2      VAL  76  -7.004   2.940   0.134
  656    H    LEU  77           HN       LEU  77  -4.850   2.207  -4.590
  657    HA   LEU  77           HA       LEU  77  -4.630  -0.682  -5.096
  658    HB2  LEU  77           2HB      LEU  77  -5.495   0.175  -7.112
  659    HB3  LEU  77           3HB      LEU  77  -4.438   1.585  -7.056
  660    HG   LEU  77           HG       LEU  77  -2.544  -0.220  -7.293
  661   HD11  LEU  77          1HD1      LEU  77  -5.018  -1.639  -8.211
  662   HD12  LEU  77          2HD1      LEU  77  -3.714  -2.230  -7.182
  663   HD13  LEU  77          3HD1      LEU  77  -3.439  -2.001  -8.908
  664   HD21  LEU  77          3HD2      LEU  77  -4.149   0.291  -9.763
  665   HD22  LEU  77          1HD2      LEU  77  -2.401   0.332  -9.532
  666   HD23  LEU  77          2HD2      LEU  77  -3.406   1.635  -8.895
  667    H    VAL  78           HN       VAL  78  -2.797  -1.398  -4.254
  668    HA   VAL  78           HA       VAL  78  -0.686   0.244  -3.385
  669    HB   VAL  78           HB       VAL  78  -0.526  -2.711  -3.987
  670   HG11  VAL  78          1HG1      VAL  78   1.578  -1.299  -3.506
  671   HG12  VAL  78          2HG1      VAL  78   0.971  -1.238  -1.850
  672   HG13  VAL  78          3HG1      VAL  78   1.339  -2.792  -2.600
  673   HG21  VAL  78          3HG2      VAL  78  -1.787  -3.169  -2.204
  674   HG22  VAL  78          1HG2      VAL  78  -0.950  -1.974  -1.213
  675   HG23  VAL  78          2HG2      VAL  78  -2.290  -1.479  -2.247
  676    H    LEU  79           HN       LEU  79   1.184   0.891  -4.306
  677    HA   LEU  79           HA       LEU  79   1.565   0.228  -7.143
  678    HB2  LEU  79           2HB      LEU  79   2.196   2.609  -5.467
  679    HB3  LEU  79           3HB      LEU  79   3.197   2.276  -6.878
  680    HG   LEU  79           HG       LEU  79   0.204   2.600  -7.004
  681   HD11  LEU  79          1HD1      LEU  79   0.525   4.771  -6.649
  682   HD12  LEU  79          2HD1      LEU  79   1.379   4.808  -8.190
  683   HD13  LEU  79          3HD1      LEU  79   2.279   4.593  -6.689
  684   HD21  LEU  79          3HD2      LEU  79   1.403   1.344  -8.824
  685   HD22  LEU  79          1HD2      LEU  79   2.267   2.839  -9.183
  686   HD23  LEU  79          2HD2      LEU  79   0.512   2.773  -9.351
  687    H    ARG  80           HN       ARG  80   3.533   0.936  -4.251
  688    HA   ARG  80           HA       ARG  80   5.432  -1.120  -5.161
  689    HB2  ARG  80           2HB      ARG  80   6.137   1.375  -5.427
  690    HB3  ARG  80           3HB      ARG  80   6.360   1.320  -3.684
  691    HG2  ARG  80           2HG      ARG  80   8.470   0.886  -4.617
  692    HG3  ARG  80           3HG      ARG  80   7.860  -0.677  -4.069
  693    HD2  ARG  80           2HD      ARG  80   8.757  -1.083  -6.201
  694    HD3  ARG  80           3HD      ARG  80   7.013  -1.002  -6.444
  695    HE   ARG  80           HE       ARG  80   7.318   0.857  -7.743
  696   HH11  ARG  80          2HH1      ARG  80  10.210   0.271  -5.895
  697   HH12  ARG  80          1HH1      ARG  80  11.137   1.483  -6.717
  698   HH21  ARG  80          2HH2      ARG  80   8.528   2.454  -8.832
  699   HH22  ARG  80          1HH2      ARG  80  10.178   2.724  -8.387
  700    H    VAL  81           HN       VAL  81   6.464  -2.319  -3.549
  701    HA   VAL  81           HA       VAL  81   5.651  -1.842  -0.776
  702    HB   VAL  81           HB       VAL  81   5.241  -4.447  -2.246
  703   HG11  VAL  81          1HG1      VAL  81   4.847  -3.924   0.696
  704   HG12  VAL  81          2HG1      VAL  81   4.644  -5.456  -0.157
  705   HG13  VAL  81          3HG1      VAL  81   6.250  -4.746   0.015
  706   HG21  VAL  81          3HG2      VAL  81   3.276  -2.745  -0.719
  707   HG22  VAL  81          1HG2      VAL  81   3.476  -2.708  -2.471
  708   HG23  VAL  81          2HG2      VAL  81   2.923  -4.182  -1.678
  709    H    GLY  82           HN       GLY  82   7.465  -1.751   0.367
  710    HA2  GLY  82           1HA      GLY  82   9.415  -3.878   0.184
  711    HA3  GLY  82           2HA      GLY  82  10.007  -2.313  -0.354
  712    H    HIS  83           HN       HIS  83  11.028  -3.804   1.845
  713    HA   HIS  83           HA       HIS  83  10.059  -3.001   4.338
  714    HB2  HIS  83           2HB      HIS  83  11.814  -4.769   3.856
  715    HB3  HIS  83           3HB      HIS  83  12.973  -3.454   3.692
  716    HD2  HIS  83           2HD      HIS  83  11.359  -5.591   6.420
  717    HE1  HIS  83           1HE      HIS  83  13.436  -2.448   8.371
  718    HE2  HIS  83           2HE      HIS  83  12.312  -4.685   8.648
  719    H    ALA  84           HN       ALA  84  10.894  -1.422   5.828
  720    HA   ALA  84           HA       ALA  84  10.871   1.167   4.983
  721    HB1  ALA  84           1HB      ALA  84  10.739   0.434   7.340
  722    HB2  ALA  84           2HB      ALA  84  12.482   0.165   7.326
  723    HB3  ALA  84           3HB      ALA  84  11.840   1.791   7.100
  724    H    ARG  85           HN       ARG  85  13.824  -0.721   5.650
  725    HA   ARG  85           HA       ARG  85  15.622   1.264   4.776
  726    HB2  ARG  85           2HB      ARG  85  17.304  -0.485   4.798
  727    HB3  ARG  85           3HB      ARG  85  16.267  -0.641   6.210
  728    HG2  ARG  85           2HG      ARG  85  15.062  -2.460   5.163
  729    HG3  ARG  85           3HG      ARG  85  16.018  -2.273   3.692
  730    HD2  ARG  85           2HD      ARG  85  18.024  -2.912   4.849
  731    HD3  ARG  85           3HD      ARG  85  17.179  -2.923   6.396
  732    HE   ARG  85           HE       ARG  85  15.918  -4.717   4.638
  733   HH11  ARG  85          2HH1      ARG  85  18.870  -4.347   6.445
  734   HH12  ARG  85          1HH1      ARG  85  19.130  -6.052   6.619
  735   HH21  ARG  85          2HH2      ARG  85  16.249  -6.963   4.860
  736   HH22  ARG  85          1HH2      ARG  85  17.639  -7.538   5.717
  737    H    ASP  86           HN       ASP  86  13.726  -1.079   3.076
  738    HA   ASP  86           HA       ASP  86  15.254  -1.066   0.661
  739    HB2  ASP  86           2HB      ASP  86  13.743  -2.927   1.276
  740    HB3  ASP  86           3HB      ASP  86  12.363  -1.848   1.095
  741    H    VAL  87           HN       VAL  87  12.022   0.260   1.397
  742    HA   VAL  87           HA       VAL  87  11.896   1.836  -0.951
  743    HB   VAL  87           HB       VAL  87  10.355   2.089   1.635
  744   HG11  VAL  87          1HG1      VAL  87   9.991   3.434  -1.033
  745   HG12  VAL  87          2HG1      VAL  87   8.707   3.321   0.172
  746   HG13  VAL  87          3HG1      VAL  87  10.196   4.188   0.548
  747   HG21  VAL  87          3HG2      VAL  87  10.198  -0.046   0.221
  748   HG22  VAL  87          1HG2      VAL  87   8.694   0.762   0.663
  749   HG23  VAL  87          2HG2      VAL  87   9.356   0.958  -0.960
  750    H    TYR  88           HN       TYR  88  11.908   4.151  -1.115
  751    HA   TYR  88           HA       TYR  88  14.126   5.466  -0.418
  752    HB2  TYR  88           2HB      TYR  88  11.506   6.936  -0.247
  753    HB3  TYR  88           3HB      TYR  88  13.047   7.508  -0.877
  754    HD1  TYR  88           1HD      TYR  88  13.933   5.827  -2.874
  755    HD2  TYR  88           2HD      TYR  88   9.884   6.634  -1.845
  756    HE1  TYR  88           1HE      TYR  88  13.237   5.206  -5.150
  757    HE2  TYR  88           2HE      TYR  88   9.177   6.014  -4.117
  758    HH   TYR  88           HH       TYR  88  10.790   4.271  -6.135
  759    H    ARG  89           HN       ARG  89  14.895   6.777   1.241
  760    HA   ARG  89           HA       ARG  89  14.358   5.951   3.858
  761    HB2  ARG  89           2HB      ARG  89  15.868   8.235   2.653
  762    HB3  ARG  89           3HB      ARG  89  15.583   8.220   4.388
  763    HG2  ARG  89           2HG      ARG  89  17.591   7.162   4.327
  764    HG3  ARG  89           3HG      ARG  89  16.527   5.764   4.164
  765    HD2  ARG  89           2HD      ARG  89  18.078   5.419   2.478
  766    HD3  ARG  89           3HD      ARG  89  16.746   6.195   1.623
  767    HE   ARG  89           HE       ARG  89  18.542   8.166   2.500
  768   HH11  ARG  89          2HH1      ARG  89  18.336   5.559   0.203
  769   HH12  ARG  89          1HH1      ARG  89  19.440   6.284  -0.918
  770   HH21  ARG  89          2HH2      ARG  89  19.998   9.132   1.033
  771   HH22  ARG  89          1HH2      ARG  89  20.386   8.316  -0.444
  Start of MODEL   11
    1    H1   MET   1           HN       MET   1 -21.026  -0.540   3.623
    2    HA   MET   1           HA       MET   1 -19.716   1.214   2.144
    3    HB2  MET   1           2HB      MET   1 -21.344   1.759   3.977
    4    HB3  MET   1           3HB      MET   1 -20.007   1.673   5.115
    5    HG2  MET   1           2HG      MET   1 -20.195   3.935   4.689
    6    HG3  MET   1           3HG      MET   1 -18.890   3.432   3.617
    7    HE1  MET   1           3HE      MET   1 -22.149   4.935   4.175
    8    HE2  MET   1           1HE      MET   1 -22.843   5.306   2.596
    9    HE3  MET   1           2HE      MET   1 -23.041   3.697   3.290
   10    H    GLY   2           HN       GLY   2 -17.786   2.402   2.124
   11    HA2  GLY   2           1HA      GLY   2 -15.694   2.814   3.537
   12    HA3  GLY   2           2HA      GLY   2 -15.567   1.061   3.529
   13    H    TYR   3           HN       TYR   3 -13.469   1.367   2.565
   14    HA   TYR   3           HA       TYR   3 -13.571   2.143  -0.272
   15    HB2  TYR   3           2HB      TYR   3 -11.373   2.213   1.773
   16    HB3  TYR   3           3HB      TYR   3 -10.993   2.181   0.054
   17    HD1  TYR   3           2HD      TYR   3 -13.225   4.039   2.412
   18    HD2  TYR   3           1HD      TYR   3 -10.680   4.210  -0.993
   19    HE1  TYR   3           2HE      TYR   3 -13.543   6.476   2.304
   20    HE2  TYR   3           1HE      TYR   3 -10.989   6.647  -1.110
   21    HH   TYR   3           HH       TYR   3 -11.671   8.479   0.165
   22    H    ARG   4           HN       ARG   4 -12.145   0.907  -1.737
   23    HA   ARG   4           HA       ARG   4 -12.354  -1.948  -1.137
   24    HB2  ARG   4           2HB      ARG   4 -13.381  -1.284  -3.210
   25    HB3  ARG   4           3HB      ARG   4 -11.921  -0.450  -3.722
   26    HG2  ARG   4           2HG      ARG   4 -10.757  -2.494  -4.029
   27    HG3  ARG   4           3HG      ARG   4 -12.035  -3.413  -3.232
   28    HD2  ARG   4           2HD      ARG   4 -12.524  -1.822  -5.734
   29    HD3  ARG   4           3HD      ARG   4 -11.954  -3.490  -5.779
   30    HE   ARG   4           HE       ARG   4 -14.607  -2.595  -5.213
   31   HH11  ARG   4          2HH1      ARG   4 -12.283  -5.107  -4.569
   32   HH12  ARG   4          1HH1      ARG   4 -13.483  -6.306  -4.218
   33   HH21  ARG   4          2HH2      ARG   4 -16.195  -4.166  -4.752
   34   HH22  ARG   4          1HH2      ARG   4 -15.708  -5.771  -4.323
   35    H    ILE   5           HN       ILE   5 -10.619  -3.377  -1.386
   36    HA   ILE   5           HA       ILE   5  -7.973  -2.091  -1.258
   37    HB   ILE   5           HB       ILE   5  -8.707  -4.827  -0.219
   38   HG12  ILE   5          2HG1      ILE   5  -9.936  -3.090   1.009
   39   HG13  ILE   5          3HG1      ILE   5  -8.690  -3.817   2.018
   40   HG21  ILE   5          1HG2      ILE   5  -6.574  -4.507   1.069
   41   HG22  ILE   5          2HG2      ILE   5  -6.381  -4.691  -0.674
   42   HG23  ILE   5          3HG2      ILE   5  -6.264  -3.093   0.062
   43   HD11  ILE   5          3HD1      ILE   5  -8.596  -1.138   0.658
   44   HD12  ILE   5          1HD1      ILE   5  -8.698  -1.463   2.389
   45   HD13  ILE   5          2HD1      ILE   5  -7.232  -1.875   1.499
   46    H    GLU   6           HN       GLU   6  -6.961  -2.214  -3.153
   47    HA   GLU   6           HA       GLU   6  -7.034  -4.779  -4.601
   48    HB2  GLU   6           2HB      GLU   6  -7.288  -1.977  -5.620
   49    HB3  GLU   6           3HB      GLU   6  -6.545  -3.198  -6.642
   50    HG2  GLU   6           2HG      GLU   6  -9.194  -3.733  -5.379
   51    HG3  GLU   6           3HG      GLU   6  -9.089  -2.721  -6.819
   52    H    PHE   7           HN       PHE   7  -5.128  -5.186  -5.956
   53    HA   PHE   7           HA       PHE   7  -2.713  -3.786  -5.044
   54    HB2  PHE   7           2HB      PHE   7  -3.284  -6.730  -4.923
   55    HB3  PHE   7           3HB      PHE   7  -1.631  -6.159  -5.117
   56    HD1  PHE   7           1HD      PHE   7  -4.620  -5.571  -2.968
   57    HD2  PHE   7           2HD      PHE   7  -0.377  -5.783  -3.230
   58    HE1  PHE   7           1HE      PHE   7  -4.456  -5.236  -0.536
   59    HE2  PHE   7           2HE      PHE   7  -0.207  -5.449  -0.799
   60    HZ   PHE   7           HZ       PHE   7  -2.248  -5.176   0.552
   61    H    ASP   8           HN       ASP   8  -1.432  -3.196  -6.665
   62    HA   ASP   8           HA       ASP   8  -2.097  -3.645  -9.355
   63    HB2  ASP   8           2HB      ASP   8   0.175  -2.402  -7.903
   64    HB3  ASP   8           3HB      ASP   8   0.465  -2.870  -9.576
   65    HA   PRO   9           HA       PRO   9  -0.171  -7.416 -10.495
   66    HB2  PRO   9           2HB      PRO   9   0.931  -6.831 -12.906
   67    HB3  PRO   9           3HB      PRO   9  -0.812  -6.991 -12.660
   68    HG2  PRO   9           2HG      PRO   9   0.860  -4.512 -12.808
   69    HG3  PRO   9           3HG      PRO   9  -0.722  -4.839 -13.538
   70    HD2  PRO   9           2HD      PRO   9  -0.437  -3.398 -11.263
   71    HD3  PRO   9           3HD      PRO   9  -1.855  -4.420 -11.574
   72    H    ARG  10           HN       ARG  10   1.718  -4.637  -9.955
   73    HA   ARG  10           HA       ARG  10   4.248  -6.063 -10.294
   74    HB2  ARG  10           2HB      ARG  10   3.475  -3.195  -9.962
   75    HB3  ARG  10           3HB      ARG  10   5.093  -3.695  -9.490
   76    HG2  ARG  10           2HG      ARG  10   5.229  -2.904 -11.715
   77    HG3  ARG  10           3HG      ARG  10   5.361  -4.662 -11.788
   78    HD2  ARG  10           2HD      ARG  10   3.875  -4.169 -13.505
   79    HD3  ARG  10           3HD      ARG  10   2.814  -4.618 -12.170
   80    HE   ARG  10           HE       ARG  10   2.056  -2.444 -12.067
   81   HH11  ARG  10          2HH1      ARG  10   4.815  -2.645 -14.181
   82   HH12  ARG  10          1HH1      ARG  10   4.612  -1.044 -14.812
   83   HH21  ARG  10          2HH2      ARG  10   1.778  -0.335 -12.890
   84   HH22  ARG  10          1HH2      ARG  10   2.884   0.269 -14.076
   85    H    ALA  11           HN       ALA  11   2.453  -4.284  -7.793
   86    HA   ALA  11           HA       ALA  11   4.233  -4.745  -5.680
   87    HB1  ALA  11           1HB      ALA  11   2.559  -3.955  -4.252
   88    HB2  ALA  11           2HB      ALA  11   2.240  -3.145  -5.787
   89    HB3  ALA  11           3HB      ALA  11   1.265  -4.533  -5.302
   90    H    GLU  12           HN       GLU  12   1.309  -6.541  -6.633
   91    HA   GLU  12           HA       GLU  12   1.059  -8.423  -4.739
   92    HB2  GLU  12           2HB      GLU  12   0.811  -8.570  -7.707
   93    HB3  GLU  12           3HB      GLU  12   0.712 -10.068  -6.792
   94    HG2  GLU  12           2HG      GLU  12  -1.007  -8.650  -5.365
   95    HG3  GLU  12           3HG      GLU  12  -1.156  -7.772  -6.886
   96    H    LYS  13           HN       LYS  13   3.440  -8.590  -7.373
   97    HA   LYS  13           HA       LYS  13   4.630 -11.005  -6.438
   98    HB2  LYS  13           2HB      LYS  13   5.639  -8.901  -8.360
   99    HB3  LYS  13           3HB      LYS  13   6.439 -10.440  -8.066
  100    HG2  LYS  13           2HG      LYS  13   3.578 -10.436  -8.893
  101    HG3  LYS  13           3HG      LYS  13   4.828 -10.130 -10.101
  102    HD2  LYS  13           2HD      LYS  13   5.040 -12.476  -8.249
  103    HD3  LYS  13           3HD      LYS  13   4.031 -12.562  -9.695
  104    HE2  LYS  13           2HE      LYS  13   6.018 -11.870 -11.033
  105    HE3  LYS  13           3HE      LYS  13   6.988 -11.991  -9.567
  106    HZ1  LYS  13           3HZ      LYS  13   6.261 -14.033 -11.341
  107    HZ2  LYS  13           1HZ      LYS  13   5.543 -14.364  -9.845
  108    HZ3  LYS  13           2HZ      LYS  13   7.216 -14.144  -9.949
  109    H    GLU  14           HN       GLU  14   5.439  -7.573  -6.131
  110    HA   GLU  14           HA       GLU  14   7.921  -7.833  -4.888
  111    HB2  GLU  14           2HB      GLU  14   5.817  -5.696  -4.498
  112    HB3  GLU  14           3HB      GLU  14   7.490  -5.567  -3.974
  113    HG2  GLU  14           2HG      GLU  14   6.729  -6.035  -6.838
  114    HG3  GLU  14           3HG      GLU  14   6.884  -4.423  -6.142
  115    H    LEU  15           HN       LEU  15   4.696  -8.209  -3.626
  116    HA   LEU  15           HA       LEU  15   5.617  -8.264  -0.869
  117    HB2  LEU  15           2HB      LEU  15   3.370  -7.331  -1.765
  118    HB3  LEU  15           3HB      LEU  15   2.863  -9.018  -1.769
  119    HG   LEU  15           HG       LEU  15   3.376  -9.107   0.670
  120   HD11  LEU  15          1HD1      LEU  15   4.369  -7.436   1.746
  121   HD12  LEU  15          2HD1      LEU  15   3.248  -6.250   1.079
  122   HD13  LEU  15          3HD1      LEU  15   4.687  -6.711   0.170
  123   HD21  LEU  15          3HD2      LEU  15   1.127  -8.338  -0.560
  124   HD22  LEU  15          1HD2      LEU  15   1.446  -6.885   0.388
  125   HD23  LEU  15          2HD2      LEU  15   1.276  -8.445   1.195
  126    H    GLU  16           HN       GLU  16   4.762 -10.466  -3.425
  127    HA   GLU  16           HA       GLU  16   4.347 -12.780  -1.860
  128    HB2  GLU  16           2HB      GLU  16   5.002 -12.264  -4.732
  129    HB3  GLU  16           3HB      GLU  16   5.116 -13.904  -4.111
  130    HG2  GLU  16           2HG      GLU  16   2.639 -12.293  -3.676
  131    HG3  GLU  16           3HG      GLU  16   2.921 -13.110  -5.212
  132    H    LYS  17           HN       LYS  17   7.220 -11.223  -3.104
  133    HA   LYS  17           HA       LYS  17   8.987 -13.408  -2.581
  134    HB2  LYS  17           2HB      LYS  17  10.743 -11.944  -3.198
  135    HB3  LYS  17           3HB      LYS  17   9.380 -11.512  -4.223
  136    HG2  LYS  17           2HG      LYS  17  10.043  -9.435  -3.599
  137    HG3  LYS  17           3HG      LYS  17   8.930  -9.782  -2.273
  138    HD2  LYS  17           2HD      LYS  17  10.812  -8.992  -1.168
  139    HD3  LYS  17           3HD      LYS  17  11.023 -10.743  -1.089
  140    HE2  LYS  17           2HE      LYS  17  12.430 -10.548  -3.172
  141    HE3  LYS  17           3HE      LYS  17  12.370  -8.800  -2.954
  142    HZ1  LYS  17           3HZ      LYS  17  13.683 -10.828  -1.267
  143    HZ2  LYS  17           1HZ      LYS  17  13.232  -9.337  -0.608
  144    HZ3  LYS  17           2HZ      LYS  17  14.320  -9.395  -1.901
  145    H    LEU  18           HN       LEU  18   7.622 -10.874  -0.689
  146    HA   LEU  18           HA       LEU  18   9.606 -10.792   1.351
  147    HB2  LEU  18           2HB      LEU  18   6.761  -9.882   1.146
  148    HB3  LEU  18           3HB      LEU  18   7.613  -9.821   2.687
  149    HG   LEU  18           HG       LEU  18   8.480  -8.401   0.170
  150   HD11  LEU  18          1HD1      LEU  18   6.589  -7.697   2.274
  151   HD12  LEU  18          2HD1      LEU  18   6.845  -6.972   0.688
  152   HD13  LEU  18          3HD1      LEU  18   7.866  -6.502   2.047
  153   HD21  LEU  18          3HD2      LEU  18   9.683  -8.803   2.835
  154   HD22  LEU  18          1HD2      LEU  18   9.747  -7.163   2.188
  155   HD23  LEU  18          2HD2      LEU  18  10.448  -8.499   1.274
  156    H    ASP  19           HN       ASP  19   9.114 -11.406   3.643
  157    HA   ASP  19           HA       ASP  19   8.810 -14.147   3.911
  158    HB2  ASP  19           2HB      ASP  19   9.691 -12.290   5.570
  159    HB3  ASP  19           3HB      ASP  19   8.045 -12.373   6.192
  160    H    ARG  20           HN       ARG  20   7.141 -15.397   4.974
  161    HA   ARG  20           HA       ARG  20   4.574 -14.913   3.870
  162    HB2  ARG  20           2HB      ARG  20   5.474 -16.899   5.964
  163    HB3  ARG  20           3HB      ARG  20   3.893 -16.908   5.195
  164    HG2  ARG  20           2HG      ARG  20   6.489 -17.167   3.698
  165    HG3  ARG  20           3HG      ARG  20   5.517 -18.534   4.245
  166    HD2  ARG  20           2HD      ARG  20   4.582 -16.353   2.383
  167    HD3  ARG  20           3HD      ARG  20   5.094 -17.966   1.889
  168    HE   ARG  20           HE       ARG  20   3.063 -18.249   3.781
  169   HH11  ARG  20          2HH1      ARG  20   3.500 -17.034   0.548
  170   HH12  ARG  20          1HH1      ARG  20   1.874 -17.379   0.058
  171   HH21  ARG  20          2HH2      ARG  20   0.920 -18.707   3.149
  172   HH22  ARG  20          1HH2      ARG  20   0.407 -18.330   1.539
  173    H    GLU  21           HN       GLU  21   5.634 -15.080   7.276
  174    HA   GLU  21           HA       GLU  21   3.293 -14.284   8.486
  175    HB2  GLU  21           2HB      GLU  21   5.630 -14.979   9.470
  176    HB3  GLU  21           3HB      GLU  21   5.894 -13.242   9.534
  177    HG2  GLU  21           2HG      GLU  21   4.265 -12.912  11.123
  178    HG3  GLU  21           3HG      GLU  21   3.404 -14.391  10.699
  179    H    VAL  22           HN       VAL  22   5.985 -12.167   7.496
  180    HA   VAL  22           HA       VAL  22   4.896  -9.729   8.208
  181    HB   VAL  22           HB       VAL  22   6.653 -10.357   5.832
  182   HG11  VAL  22          1HG1      VAL  22   6.898  -7.694   6.942
  183   HG12  VAL  22          2HG1      VAL  22   6.673  -8.202   5.267
  184   HG13  VAL  22          3HG1      VAL  22   5.275  -8.000   6.324
  185   HG21  VAL  22          3HG2      VAL  22   7.841 -10.985   7.742
  186   HG22  VAL  22          1HG2      VAL  22   8.386  -9.337   7.432
  187   HG23  VAL  22          2HG2      VAL  22   7.197  -9.649   8.696
  188    H    ALA  23           HN       ALA  23   4.692 -11.303   5.013
  189    HA   ALA  23           HA       ALA  23   3.161  -9.499   3.653
  190    HB1  ALA  23           1HB      ALA  23   2.098 -12.008   2.959
  191    HB2  ALA  23           2HB      ALA  23   3.377 -11.109   2.142
  192    HB3  ALA  23           3HB      ALA  23   3.785 -12.280   3.395
  193    H    ARG  24           HN       ARG  24   1.937 -12.103   5.751
  194    HA   ARG  24           HA       ARG  24  -0.788 -11.542   5.440
  195    HB2  ARG  24           2HB      ARG  24   0.859 -13.009   7.436
  196    HB3  ARG  24           3HB      ARG  24  -0.782 -12.582   7.901
  197    HG2  ARG  24           2HG      ARG  24  -1.090 -14.669   7.006
  198    HG3  ARG  24           3HG      ARG  24  -1.407 -13.645   5.604
  199    HD2  ARG  24           2HD      ARG  24   1.376 -14.582   6.096
  200    HD3  ARG  24           3HD      ARG  24   0.202 -15.726   5.448
  201    HE   ARG  24           HE       ARG  24   1.364 -13.464   4.086
  202   HH11  ARG  24          2HH1      ARG  24  -1.261 -15.749   4.177
  203   HH12  ARG  24          1HH1      ARG  24  -1.642 -15.576   2.496
  204   HH21  ARG  24          2HH2      ARG  24   0.871 -13.227   1.872
  205   HH22  ARG  24          1HH2      ARG  24  -0.429 -14.141   1.186
  206    H    ARG  25           HN       ARG  25   1.599 -10.285   7.721
  207    HA   ARG  25           HA       ARG  25  -0.149  -8.869   9.390
  208    HB2  ARG  25           2HB      ARG  25   1.999  -9.066  10.245
  209    HB3  ARG  25           3HB      ARG  25   2.757  -8.631   8.718
  210    HG2  ARG  25           2HG      ARG  25   2.043  -6.310   9.033
  211    HG3  ARG  25           3HG      ARG  25   1.309  -6.754  10.575
  212    HD2  ARG  25           2HD      ARG  25   4.227  -7.132   9.921
  213    HD3  ARG  25           3HD      ARG  25   3.580  -5.720  10.755
  214    HE   ARG  25           HE       ARG  25   3.291  -6.998  12.656
  215   HH11  ARG  25          2HH1      ARG  25   4.147  -9.028   9.960
  216   HH12  ARG  25          1HH1      ARG  25   4.445 -10.426  10.939
  217   HH21  ARG  25          2HH2      ARG  25   3.680  -8.831  13.956
  218   HH22  ARG  25          1HH2      ARG  25   4.178 -10.313  13.212
  219    H    ILE  26           HN       ILE  26   1.423  -7.964   6.362
  220    HA   ILE  26           HA       ILE  26   0.615  -5.245   6.397
  221    HB   ILE  26           HB       ILE  26   1.485  -7.051   4.146
  222   HG12  ILE  26          2HG1      ILE  26   2.864  -4.693   5.444
  223   HG13  ILE  26          3HG1      ILE  26   3.153  -6.371   5.888
  224   HG21  ILE  26          1HG2      ILE  26  -0.056  -5.321   3.304
  225   HG22  ILE  26          2HG2      ILE  26   0.979  -4.082   4.012
  226   HG23  ILE  26          3HG2      ILE  26   1.591  -5.105   2.713
  227   HD11  ILE  26          3HD1      ILE  26   3.430  -5.825   3.031
  228   HD12  ILE  26          1HD1      ILE  26   4.581  -4.968   4.056
  229   HD13  ILE  26          2HD1      ILE  26   4.476  -6.728   4.126
  230    H    LEU  27           HN       LEU  27  -0.553  -7.915   4.334
  231    HA   LEU  27           HA       LEU  27  -2.691  -6.733   3.151
  232    HB2  LEU  27           2HB      LEU  27  -2.437  -9.530   4.226
  233    HB3  LEU  27           3HB      LEU  27  -3.800  -9.004   3.240
  234    HG   LEU  27           HG       LEU  27  -0.937  -8.891   2.306
  235   HD11  LEU  27          1HD1      LEU  27  -1.376 -11.191   2.687
  236   HD12  LEU  27          2HD1      LEU  27  -1.581 -10.911   0.958
  237   HD13  LEU  27          3HD1      LEU  27  -2.995 -11.065   2.000
  238   HD21  LEU  27          3HD2      LEU  27  -3.602  -8.331   1.109
  239   HD22  LEU  27          1HD2      LEU  27  -2.350  -9.030   0.083
  240   HD23  LEU  27          2HD2      LEU  27  -2.066  -7.491   0.896
  241    H    ARG  28           HN       ARG  28  -2.748  -8.332   6.331
  242    HA   ARG  28           HA       ARG  28  -5.434  -7.852   6.927
  243    HB2  ARG  28           2HB      ARG  28  -2.993  -8.464   8.513
  244    HB3  ARG  28           3HB      ARG  28  -4.388  -7.846   9.387
  245    HG2  ARG  28           2HG      ARG  28  -4.816 -10.084   7.485
  246    HG3  ARG  28           3HG      ARG  28  -4.005 -10.428   9.015
  247    HD2  ARG  28           2HD      ARG  28  -5.856  -9.863  10.275
  248    HD3  ARG  28           3HD      ARG  28  -6.531  -8.837   9.010
  249    HE   ARG  28           HE       ARG  28  -6.852 -11.698   9.295
  250   HH11  ARG  28          2HH1      ARG  28  -7.125  -8.926   7.207
  251   HH12  ARG  28          1HH1      ARG  28  -8.265  -9.679   6.140
  252   HH21  ARG  28          2HH2      ARG  28  -8.352 -12.700   7.898
  253   HH22  ARG  28          1HH2      ARG  28  -8.962 -11.825   6.535
  254    H    PHE  29           HN       PHE  29  -2.551  -5.913   7.655
  255    HA   PHE  29           HA       PHE  29  -3.727  -3.908   9.160
  256    HB2  PHE  29           2HB      PHE  29  -1.390  -3.845   9.065
  257    HB3  PHE  29           3HB      PHE  29  -1.364  -3.946   7.307
  258    HD1  PHE  29           1HD      PHE  29  -2.110  -1.714  10.155
  259    HD2  PHE  29           2HD      PHE  29  -1.358  -2.008   5.976
  260    HE1  PHE  29           1HE      PHE  29  -1.901   0.734  10.024
  261    HE2  PHE  29           2HE      PHE  29  -1.146   0.439   5.839
  262    HZ   PHE  29           HZ       PHE  29  -1.417   1.814   7.864
  263    H    LEU  30           HN       LEU  30  -3.724  -4.389   5.692
  264    HA   LEU  30           HA       LEU  30  -5.002  -1.819   5.215
  265    HB2  LEU  30           2HB      LEU  30  -4.104  -4.043   3.400
  266    HB3  LEU  30           3HB      LEU  30  -4.999  -2.640   2.821
  267    HG   LEU  30           HG       LEU  30  -2.419  -2.294   4.306
  268   HD11  LEU  30          1HD1      LEU  30  -2.816  -3.305   1.547
  269   HD12  LEU  30          2HD1      LEU  30  -1.510  -3.610   2.692
  270   HD13  LEU  30          3HD1      LEU  30  -1.565  -2.088   1.803
  271   HD21  LEU  30          3HD2      LEU  30  -3.292  -0.214   4.027
  272   HD22  LEU  30          1HD2      LEU  30  -4.211  -0.668   2.592
  273   HD23  LEU  30          2HD2      LEU  30  -2.477  -0.371   2.471
  274    H    ARG  31           HN       ARG  31  -5.814  -5.193   5.470
  275    HA   ARG  31           HA       ARG  31  -8.482  -4.802   4.391
  276    HB2  ARG  31           2HB      ARG  31  -6.978  -7.183   5.449
  277    HB3  ARG  31           3HB      ARG  31  -8.708  -7.258   5.143
  278    HG2  ARG  31           2HG      ARG  31  -8.389  -6.815   2.820
  279    HG3  ARG  31           3HG      ARG  31  -6.676  -6.473   3.070
  280    HD2  ARG  31           2HD      ARG  31  -6.312  -8.790   3.755
  281    HD3  ARG  31           3HD      ARG  31  -8.026  -9.131   3.525
  282    HE   ARG  31           HE       ARG  31  -7.141  -8.144   1.117
  283   HH11  ARG  31          2HH1      ARG  31  -6.329 -10.820   3.191
  284   HH12  ARG  31          1HH1      ARG  31  -5.816 -11.842   1.890
  285   HH21  ARG  31          2HH2      ARG  31  -6.469  -9.480  -0.605
  286   HH22  ARG  31          1HH2      ARG  31  -5.896 -11.079  -0.269
  287    H    GLU  32           HN       GLU  32  -6.967  -4.326   7.325
  288    HA   GLU  32           HA       GLU  32  -9.483  -4.706   8.811
  289    HB2  GLU  32           2HB      GLU  32  -6.620  -4.778   9.765
  290    HB3  GLU  32           3HB      GLU  32  -7.999  -4.718  10.854
  291    HG2  GLU  32           2HG      GLU  32  -7.223  -6.911   8.961
  292    HG3  GLU  32           3HG      GLU  32  -7.361  -6.976  10.717
  293    H    ARG  33           HN       ARG  33  -6.551  -2.788   9.416
  294    HA   ARG  33           HA       ARG  33  -7.796  -0.659  10.659
  295    HB2  ARG  33           2HB      ARG  33  -5.324  -0.480   8.930
  296    HB3  ARG  33           3HB      ARG  33  -5.782   0.619  10.223
  297    HG2  ARG  33           2HG      ARG  33  -5.424  -2.269  10.848
  298    HG3  ARG  33           3HG      ARG  33  -4.000  -1.253  10.615
  299    HD2  ARG  33           2HD      ARG  33  -4.496   0.083  12.444
  300    HD3  ARG  33           3HD      ARG  33  -6.202  -0.362  12.432
  301    HE   ARG  33           HE       ARG  33  -4.911  -2.691  12.999
  302   HH11  ARG  33          2HH1      ARG  33  -4.917   0.500  14.390
  303   HH12  ARG  33          1HH1      ARG  33  -4.583  -0.057  15.996
  304   HH21  ARG  33          2HH2      ARG  33  -4.472  -3.437  15.109
  305   HH22  ARG  33          1HH2      ARG  33  -4.329  -2.297  16.404
  306    H    VAL  34           HN       VAL  34  -6.500  -0.470   7.342
  307    HA   VAL  34           HA       VAL  34  -7.892   1.844   6.628
  308    HB   VAL  34           HB       VAL  34  -6.961  -0.355   4.777
  309   HG11  VAL  34          1HG1      VAL  34  -8.570   1.429   3.908
  310   HG12  VAL  34          2HG1      VAL  34  -7.235   2.564   4.126
  311   HG13  VAL  34          3HG1      VAL  34  -7.062   1.197   3.024
  312   HG21  VAL  34          3HG2      VAL  34  -5.125   1.685   4.646
  313   HG22  VAL  34          1HG2      VAL  34  -5.514   1.616   6.364
  314   HG23  VAL  34          2HG2      VAL  34  -4.924   0.175   5.535
  315    H    ALA  35           HN       ALA  35  -8.867  -1.500   6.631
  316    HA   ALA  35           HA       ALA  35 -11.079  -1.310   4.895
  317    HB1  ALA  35           1HB      ALA  35 -11.825  -3.400   5.904
  318    HB2  ALA  35           2HB      ALA  35 -10.095  -3.447   5.562
  319    HB3  ALA  35           3HB      ALA  35 -10.662  -3.194   7.213
  320    H    THR  36           HN       THR  36 -10.890  -1.143   8.448
  321    HA   THR  36           HA       THR  36 -13.672  -0.440   8.688
  322    HB   THR  36           HB       THR  36 -12.618  -1.739  10.461
  323    HG1  THR  36           1HG      THR  36 -14.270  -0.530  11.257
  324   HG21  THR  36          3HG2      THR  36 -10.461  -1.247  10.868
  325   HG22  THR  36          1HG2      THR  36 -11.110  -0.032  11.968
  326   HG23  THR  36          2HG2      THR  36 -10.640   0.422  10.330
  327    H    LEU  37           HN       LEU  37 -10.723   1.246   8.227
  328    HA   LEU  37           HA       LEU  37 -11.548   3.733   9.388
  329    HB2  LEU  37           2HB      LEU  37  -9.278   2.861   7.645
  330    HB3  LEU  37           3HB      LEU  37  -9.581   4.575   7.919
  331    HG   LEU  37           HG       LEU  37  -8.985   2.537  10.064
  332   HD11  LEU  37          1HD1      LEU  37  -6.867   3.872  10.266
  333   HD12  LEU  37          2HD1      LEU  37  -7.282   4.626   8.727
  334   HD13  LEU  37          3HD1      LEU  37  -7.003   2.887   8.809
  335   HD21  LEU  37          3HD2      LEU  37 -10.273   5.020  10.236
  336   HD22  LEU  37          1HD2      LEU  37  -8.624   5.288  10.801
  337   HD23  LEU  37          2HD2      LEU  37  -9.624   4.049  11.558
  338    H    GLU  38           HN       GLU  38 -12.663   5.356   8.490
  339    HA   GLU  38           HA       GLU  38 -13.850   4.954   5.893
  340    HB2  GLU  38           2HB      GLU  38 -15.351   5.846   7.453
  341    HB3  GLU  38           3HB      GLU  38 -14.173   6.997   8.068
  342    HG2  GLU  38           2HG      GLU  38 -14.527   8.484   6.368
  343    HG3  GLU  38           3HG      GLU  38 -15.056   7.237   5.240
  344    H    ASP  39           HN       ASP  39 -11.390   6.997   7.320
  345    HA   ASP  39           HA       ASP  39 -10.944   8.248   4.690
  346    HB2  ASP  39           2HB      ASP  39 -10.371   9.234   7.483
  347    HB3  ASP  39           3HB      ASP  39  -9.652   9.975   6.056
  348    HA   PRO  40           HA       PRO  40  -7.360   5.483   4.963
  349    HB2  PRO  40           2HB      PRO  40  -6.856   5.537   2.296
  350    HB3  PRO  40           3HB      PRO  40  -8.082   4.490   3.021
  351    HG2  PRO  40           2HG      PRO  40  -8.417   7.126   1.643
  352    HG3  PRO  40           3HG      PRO  40  -9.394   5.654   1.494
  353    HD2  PRO  40           2HD      PRO  40 -10.156   7.761   3.015
  354    HD3  PRO  40           3HD      PRO  40 -10.564   6.085   3.433
  355    H    ARG  41           HN       ARG  41  -7.688   8.726   4.533
  356    HA   ARG  41           HA       ARG  41  -4.859   9.137   3.843
  357    HB2  ARG  41           2HB      ARG  41  -7.288  10.891   3.622
  358    HB3  ARG  41           3HB      ARG  41  -5.674  11.588   3.634
  359    HG2  ARG  41           2HG      ARG  41  -5.254   9.810   1.740
  360    HG3  ARG  41           3HG      ARG  41  -7.008   9.919   1.571
  361    HD2  ARG  41           2HD      ARG  41  -5.142  12.286   1.540
  362    HD3  ARG  41           3HD      ARG  41  -5.740  11.474   0.094
  363    HE   ARG  41           HE       ARG  41  -8.008  12.101   1.412
  364   HH11  ARG  41          2HH1      ARG  41  -5.209  13.953   0.489
  365   HH12  ARG  41          1HH1      ARG  41  -6.085  15.438   0.322
  366   HH21  ARG  41          2HH2      ARG  41  -9.173  14.050   1.196
  367   HH22  ARG  41          1HH2      ARG  41  -8.340  15.493   0.725
  368    H    SER  42           HN       SER  42  -5.340   8.194   6.376
  369    HA   SER  42           HA       SER  42  -4.780  10.567   8.030
  370    HB2  SER  42           2HB      SER  42  -6.606   8.259   8.546
  371    HB3  SER  42           3HB      SER  42  -5.753   8.976   9.913
  372    HG   SER  42           HG       SER  42  -7.913   9.887   8.623
  373    H    LEU  43           HN       LEU  43  -4.291   7.084   7.623
  374    HA   LEU  43           HA       LEU  43  -2.175   6.963   9.558
  375    HB2  LEU  43           2HB      LEU  43  -3.235   5.037   7.511
  376    HB3  LEU  43           3HB      LEU  43  -1.820   4.672   8.496
  377    HG   LEU  43           HG       LEU  43  -4.468   5.374   9.730
  378   HD11  LEU  43          1HD1      LEU  43  -5.037   3.520   8.402
  379   HD12  LEU  43          2HD1      LEU  43  -4.705   2.862  10.004
  380   HD13  LEU  43          3HD1      LEU  43  -3.502   2.713   8.723
  381   HD21  LEU  43          3HD2      LEU  43  -3.126   5.343  11.522
  382   HD22  LEU  43          1HD2      LEU  43  -1.828   4.523  10.654
  383   HD23  LEU  43          2HD2      LEU  43  -3.160   3.589  11.335
  384    H    GLY  44           HN       GLY  44  -2.247   6.509   6.014
  385    HA2  GLY  44           1HA      GLY  44   0.611   6.690   5.811
  386    HA3  GLY  44           2HA      GLY  44  -0.528   6.617   4.474
  387    H    GLU  45           HN       GLU  45   1.196   8.203   3.698
  388    HA   GLU  45           HA       GLU  45   0.200  10.904   4.238
  389    HB2  GLU  45           2HB      GLU  45   2.350  11.845   4.517
  390    HB3  GLU  45           3HB      GLU  45   2.318  10.429   5.557
  391    HG2  GLU  45           2HG      GLU  45   3.480   9.167   3.745
  392    HG3  GLU  45           3HG      GLU  45   3.652  10.692   2.876
  393    HA   PRO  46           HA       PRO  46   0.255  11.344  -0.130
  394    HB2  PRO  46           2HB      PRO  46   0.635  14.022  -0.363
  395    HB3  PRO  46           3HB      PRO  46  -0.889  13.312   0.183
  396    HG2  PRO  46           2HG      PRO  46   1.334  14.499   1.799
  397    HG3  PRO  46           3HG      PRO  46  -0.418  14.699   1.989
  398    HD2  PRO  46           2HD      PRO  46   1.032  13.011   3.533
  399    HD3  PRO  46           3HD      PRO  46  -0.655  12.686   3.086
  400    H    LEU  47           HN       LEU  47   2.002  10.395  -1.059
  401    HA   LEU  47           HA       LEU  47   4.685  11.178  -0.639
  402    HB2  LEU  47           2HB      LEU  47   3.959   8.943  -1.425
  403    HB3  LEU  47           3HB      LEU  47   3.526   9.664  -2.974
  404    HG   LEU  47           HG       LEU  47   6.325   9.681  -1.858
  405   HD11  LEU  47          1HD1      LEU  47   6.823   7.723  -2.941
  406   HD12  LEU  47          2HD1      LEU  47   5.469   7.868  -4.061
  407   HD13  LEU  47          3HD1      LEU  47   5.182   7.386  -2.389
  408   HD21  LEU  47          3HD2      LEU  47   6.775   9.980  -4.370
  409   HD22  LEU  47          1HD2      LEU  47   6.165  11.364  -3.463
  410   HD23  LEU  47          2HD2      LEU  47   5.071  10.425  -4.479
  411    H    ARG  48           HN       ARG  48   4.981  13.352  -1.013
  412    HA   ARG  48           HA       ARG  48   4.266  14.451  -3.617
  413    HB2  ARG  48           2HB      ARG  48   5.087  15.583  -0.987
  414    HB3  ARG  48           3HB      ARG  48   5.447  16.522  -2.430
  415    HG2  ARG  48           2HG      ARG  48   2.908  16.016  -2.958
  416    HG3  ARG  48           3HG      ARG  48   2.832  15.848  -1.203
  417    HD2  ARG  48           2HD      ARG  48   2.406  18.088  -1.425
  418    HD3  ARG  48           3HD      ARG  48   4.160  18.112  -1.250
  419    HE   ARG  48           HE       ARG  48   3.350  17.933  -3.981
  420   HH11  ARG  48          2HH1      ARG  48   3.793  20.132  -1.319
  421   HH12  ARG  48          1HH1      ARG  48   4.051  21.514  -2.332
  422   HH21  ARG  48          2HH2      ARG  48   3.688  19.744  -5.326
  423   HH22  ARG  48          1HH2      ARG  48   3.990  21.292  -4.612
  424    H    GLY  49           HN       GLY  49   5.697  14.998  -5.187
  425    HA2  GLY  49           1HA      GLY  49   8.461  15.390  -4.822
  426    HA3  GLY  49           2HA      GLY  49   8.189  13.723  -5.307
  427    HA   PRO  50           HA       PRO  50   7.958  16.918  -8.912
  428    HB2  PRO  50           2HB      PRO  50  10.569  17.116  -9.630
  429    HB3  PRO  50           3HB      PRO  50   9.798  18.228  -8.492
  430    HG2  PRO  50           2HG      PRO  50  11.528  15.848  -7.938
  431    HG3  PRO  50           3HG      PRO  50  11.549  17.448  -7.175
  432    HD2  PRO  50           2HD      PRO  50  10.372  15.300  -6.022
  433    HD3  PRO  50           3HD      PRO  50   9.768  16.954  -5.799
  434    H    GLU  51           HN       GLU  51   9.265  13.869  -8.195
  435    HA   GLU  51           HA       GLU  51   9.520  13.156 -11.031
  436    HB2  GLU  51           2HB      GLU  51  10.384  11.648  -8.557
  437    HB3  GLU  51           3HB      GLU  51  10.621  11.101 -10.211
  438    HG2  GLU  51           2HG      GLU  51  12.272  12.631 -10.631
  439    HG3  GLU  51           3HG      GLU  51  11.687  13.761  -9.412
  440    H    LEU  52           HN       LEU  52   7.809  12.338  -8.068
  441    HA   LEU  52           HA       LEU  52   6.143  10.434  -9.559
  442    HB2  LEU  52           2HB      LEU  52   6.479  10.872  -6.597
  443    HB3  LEU  52           3HB      LEU  52   5.351   9.724  -7.314
  444    HG   LEU  52           HG       LEU  52   7.555   8.790  -8.433
  445   HD11  LEU  52          1HD1      LEU  52   8.860  10.694  -7.334
  446   HD12  LEU  52          2HD1      LEU  52   9.518   9.064  -7.196
  447   HD13  LEU  52          3HD1      LEU  52   8.667   9.790  -5.832
  448   HD21  LEU  52          3HD2      LEU  52   5.955   7.665  -6.847
  449   HD22  LEU  52          1HD2      LEU  52   6.984   8.230  -5.531
  450   HD23  LEU  52          2HD2      LEU  52   7.631   7.126  -6.744
  451    H    GLY  53           HN       GLY  53   3.788  10.392  -8.627
  452    HA2  GLY  53           1HA      GLY  53   2.760  13.107  -8.988
  453    HA3  GLY  53           2HA      GLY  53   1.831  11.620  -9.112
  454    H    ARG  54           HN       ARG  54   0.204  12.053  -7.708
  455    HA   ARG  54           HA       ARG  54   0.901  12.909  -4.992
  456    HB2  ARG  54           2HB      ARG  54  -0.957  13.979  -6.503
  457    HB3  ARG  54           3HB      ARG  54  -1.915  12.607  -5.963
  458    HG2  ARG  54           2HG      ARG  54  -2.421  14.388  -4.507
  459    HG3  ARG  54           3HG      ARG  54  -1.365  13.300  -3.604
  460    HD2  ARG  54           2HD      ARG  54  -0.557  15.463  -3.158
  461    HD3  ARG  54           3HD      ARG  54   0.554  14.786  -4.347
  462    HE   ARG  54           HE       ARG  54  -0.055  16.455  -5.771
  463   HH11  ARG  54          2HH1      ARG  54  -2.558  16.074  -3.382
  464   HH12  ARG  54          1HH1      ARG  54  -3.480  17.429  -3.943
  465   HH21  ARG  54          2HH2      ARG  54  -1.260  18.242  -6.519
  466   HH22  ARG  54          1HH2      ARG  54  -2.742  18.661  -5.727
  467    H    PHE  55           HN       PHE  55   1.581  10.288  -5.670
  468    HA   PHE  55           HA       PHE  55  -0.379   8.381  -4.981
  469    HB2  PHE  55           2HB      PHE  55   2.621   8.135  -4.683
  470    HB3  PHE  55           3HB      PHE  55   1.465   6.810  -4.775
  471    HD1  PHE  55           1HD      PHE  55  -0.153   7.095  -6.958
  472    HD2  PHE  55           2HD      PHE  55   3.855   8.474  -6.573
  473    HE1  PHE  55           1HE      PHE  55   0.094   7.049  -9.406
  474    HE2  PHE  55           2HE      PHE  55   4.109   8.431  -9.019
  475    HZ   PHE  55           HZ       PHE  55   2.227   7.719 -10.439
  476    H    TRP  56           HN       TRP  56  -0.092   6.886  -3.043
  477    HA   TRP  56           HA       TRP  56   0.142   8.560  -0.639
  478    HB2  TRP  56           2HB      TRP  56  -2.031   7.300  -1.256
  479    HB3  TRP  56           3HB      TRP  56  -1.173   5.856  -0.727
  480    HD1  TRP  56           1HD      TRP  56  -1.746   5.252   1.680
  481    HE1  TRP  56           1HE      TRP  56  -2.349   6.543   3.824
  482    HE3  TRP  56           3HE      TRP  56  -1.506  10.021  -0.148
  483    HZ2  TRP  56           2HZ      TRP  56  -2.680   9.227   4.633
  484    HZ3  TRP  56           3HZ      TRP  56  -1.980  11.893   1.376
  485    HH2  TRP  56           2HH      TRP  56  -2.555  11.502   3.716
  486    H    LYS  57           HN       LYS  57   1.093   7.645   1.278
  487    HA   LYS  57           HA       LYS  57   2.914   5.391   0.803
  488    HB2  LYS  57           2HB      LYS  57   3.959   7.783   0.615
  489    HB3  LYS  57           3HB      LYS  57   3.854   7.766   2.370
  490    HG2  LYS  57           2HG      LYS  57   5.300   5.887   2.522
  491    HG3  LYS  57           3HG      LYS  57   5.236   5.622   0.777
  492    HD2  LYS  57           2HD      LYS  57   6.302   8.162   1.987
  493    HD3  LYS  57           3HD      LYS  57   7.324   6.753   1.692
  494    HE2  LYS  57           2HE      LYS  57   5.621   7.897  -0.491
  495    HE3  LYS  57           3HE      LYS  57   7.186   8.612  -0.104
  496    HZ1  LYS  57           3HZ      LYS  57   8.128   7.052  -1.336
  497    HZ2  LYS  57           1HZ      LYS  57   6.635   6.310  -1.626
  498    HZ3  LYS  57           2HZ      LYS  57   7.554   5.861  -0.280
  499    H    TYR  58           HN       TYR  58   2.234   3.890   2.189
  500    HA   TYR  58           HA       TYR  58   1.234   4.685   4.816
  501    HB2  TYR  58           2HB      TYR  58   1.068   2.170   3.187
  502    HB3  TYR  58           3HB      TYR  58   0.756   2.126   4.918
  503    HD1  TYR  58           1HD      TYR  58  -0.826   4.312   5.604
  504    HD2  TYR  58           2HD      TYR  58  -0.852   2.177   1.924
  505    HE1  TYR  58           1HE      TYR  58  -3.143   5.034   5.209
  506    HE2  TYR  58           2HE      TYR  58  -3.170   2.894   1.518
  507    HH   TYR  58           HH       TYR  58  -4.933   4.847   3.900
  508    H    ARG  59           HN       ARG  59   1.927   3.478   6.729
  509    HA   ARG  59           HA       ARG  59   4.708   2.531   6.534
  510    HB2  ARG  59           2HB      ARG  59   5.038   3.558   8.824
  511    HB3  ARG  59           3HB      ARG  59   4.883   4.694   7.491
  512    HG2  ARG  59           2HG      ARG  59   2.766   5.376   8.148
  513    HG3  ARG  59           3HG      ARG  59   2.496   3.928   9.120
  514    HD2  ARG  59           2HD      ARG  59   4.304   4.713  10.652
  515    HD3  ARG  59           3HD      ARG  59   4.359   6.216   9.731
  516    HE   ARG  59           HE       ARG  59   1.738   5.559  10.706
  517   HH11  ARG  59          2HH1      ARG  59   4.773   7.087  11.465
  518   HH12  ARG  59          1HH1      ARG  59   4.095   8.130  12.671
  519   HH21  ARG  59          2HH2      ARG  59   0.834   6.927  12.292
  520   HH22  ARG  59          1HH2      ARG  59   1.855   8.038  13.141
  521    H    VAL  60           HN       VAL  60   5.070   0.597   7.413
  522    HA   VAL  60           HA       VAL  60   3.181  -0.418   9.428
  523    HB   VAL  60           HB       VAL  60   4.232  -1.943   7.043
  524   HG11  VAL  60          1HG1      VAL  60   3.698  -2.936   9.591
  525   HG12  VAL  60          2HG1      VAL  60   2.268  -3.331   8.636
  526   HG13  VAL  60          3HG1      VAL  60   3.862  -3.865   8.101
  527   HG21  VAL  60          3HG2      VAL  60   1.645  -0.689   7.741
  528   HG22  VAL  60          1HG2      VAL  60   2.402  -0.931   6.167
  529   HG23  VAL  60          2HG2      VAL  60   1.578  -2.271   6.964
  530    H    GLY  61           HN       GLY  61   4.576  -0.161  11.140
  531    HA2  GLY  61           1HA      GLY  61   6.338  -0.617  12.541
  532    HA3  GLY  61           2HA      GLY  61   6.359  -2.189  11.757
  533    H    ASP  62           HN       ASP  62   7.698  -2.482   9.891
  534    HA   ASP  62           HA       ASP  62   9.786  -0.440   9.555
  535    HB2  ASP  62           2HB      ASP  62  10.198  -3.404   9.973
  536    HB3  ASP  62           3HB      ASP  62  11.454  -2.319   9.383
  537    H    TYR  63           HN       TYR  63   7.490  -0.987   7.921
  538    HA   TYR  63           HA       TYR  63   8.877  -1.550   5.417
  539    HB2  TYR  63           2HB      TYR  63   6.388  -3.000   6.329
  540    HB3  TYR  63           3HB      TYR  63   6.948  -2.982   4.660
  541    HD1  TYR  63           1HD      TYR  63   8.117  -3.833   8.101
  542    HD2  TYR  63           2HD      TYR  63   8.400  -4.640   3.933
  543    HE1  TYR  63           1HE      TYR  63   9.577  -5.754   8.578
  544    HE2  TYR  63           2HE      TYR  63   9.860  -6.563   4.398
  545    HH   TYR  63           HH       TYR  63  11.085  -7.205   7.610
  546    H    ARG  64           HN       ARG  64   8.078  -0.440   3.670
  547    HA   ARG  64           HA       ARG  64   5.954   1.503   4.271
  548    HB2  ARG  64           2HB      ARG  64   8.091   1.644   2.136
  549    HB3  ARG  64           3HB      ARG  64   6.930   2.904   2.533
  550    HG2  ARG  64           2HG      ARG  64   9.031   1.858   4.418
  551    HG3  ARG  64           3HG      ARG  64   9.184   3.321   3.443
  552    HD2  ARG  64           2HD      ARG  64   6.945   2.867   5.402
  553    HD3  ARG  64           3HD      ARG  64   8.457   3.665   5.833
  554    HE   ARG  64           HE       ARG  64   7.144   4.819   3.550
  555   HH11  ARG  64          2HH1      ARG  64   7.373   4.806   7.024
  556   HH12  ARG  64          1HH1      ARG  64   6.759   6.417   7.200
  557   HH21  ARG  64          2HH2      ARG  64   6.336   6.940   3.769
  558   HH22  ARG  64          1HH2      ARG  64   6.169   7.629   5.349
  559    H    LEU  65           HN       LEU  65   4.146   1.597   3.055
  560    HA   LEU  65           HA       LEU  65   3.996  -0.153   0.691
  561    HB2  LEU  65           2HB      LEU  65   1.645   0.381   2.468
  562    HB3  LEU  65           3HB      LEU  65   1.867  -0.906   1.284
  563    HG   LEU  65           HG       LEU  65   3.447  -0.749   3.842
  564   HD11  LEU  65          1HD1      LEU  65   1.105  -0.884   4.437
  565   HD12  LEU  65          2HD1      LEU  65   1.892  -2.435   4.727
  566   HD13  LEU  65          3HD1      LEU  65   0.869  -2.218   3.307
  567   HD21  LEU  65          3HD2      LEU  65   3.309  -3.345   3.176
  568   HD22  LEU  65          1HD2      LEU  65   4.595  -2.270   2.627
  569   HD23  LEU  65          2HD2      LEU  65   3.228  -2.621   1.569
  570    H    ILE  66           HN       ILE  66   4.144   1.355  -0.894
  571    HA   ILE  66           HA       ILE  66   2.686   3.844  -0.747
  572    HB   ILE  66           HB       ILE  66   4.221   2.686  -3.076
  573   HG12  ILE  66          2HG1      ILE  66   5.123   4.677  -0.983
  574   HG13  ILE  66          3HG1      ILE  66   5.610   2.986  -1.039
  575   HG21  ILE  66          1HG2      ILE  66   3.907   4.631  -4.190
  576   HG22  ILE  66          2HG2      ILE  66   2.447   4.684  -3.204
  577   HG23  ILE  66          3HG2      ILE  66   3.874   5.598  -2.716
  578   HD11  ILE  66          3HD1      ILE  66   7.289   4.559  -1.951
  579   HD12  ILE  66          1HD1      ILE  66   6.768   3.329  -3.101
  580   HD13  ILE  66          2HD1      ILE  66   6.147   4.975  -3.229
  581    H    CYS  67           HN       CYS  67   0.553   3.798  -1.042
  582    HA   CYS  67           HA       CYS  67  -0.524   2.091  -3.187
  583    HB2  CYS  67           2HB      CYS  67  -2.019   3.183  -0.796
  584    HB3  CYS  67           3HB      CYS  67  -2.619   2.026  -1.979
  585    HG   CYS  67           HG       CYS  67   0.102   1.257  -0.084
  586    H    HIS  68           HN       HIS  68  -2.638   2.987  -4.103
  587    HA   HIS  68           HA       HIS  68  -2.359   5.893  -4.509
  588    HB2  HIS  68           2HB      HIS  68  -1.721   4.505  -6.491
  589    HB3  HIS  68           3HB      HIS  68  -3.369   3.886  -6.534
  590    HD2  HIS  68           2HD      HIS  68  -4.480   7.138  -5.892
  591    HE1  HIS  68           1HE      HIS  68  -3.115   7.573  -9.886
  592    HE2  HIS  68           2HE      HIS  68  -4.454   8.608  -8.020
  593    H    ILE  69           HN       ILE  69  -3.935   6.791  -3.327
  594    HA   ILE  69           HA       ILE  69  -6.477   5.518  -2.922
  595    HB   ILE  69           HB       ILE  69  -5.578   8.316  -2.225
  596   HG12  ILE  69          2HG1      ILE  69  -5.842   5.881  -0.451
  597   HG13  ILE  69          3HG1      ILE  69  -4.319   6.441  -1.135
  598   HG21  ILE  69          1HG2      ILE  69  -8.094   7.805  -2.455
  599   HG22  ILE  69          2HG2      ILE  69  -7.883   6.868  -0.977
  600   HG23  ILE  69          3HG2      ILE  69  -7.525   8.595  -0.985
  601   HD11  ILE  69          3HD1      ILE  69  -4.101   7.588   0.756
  602   HD12  ILE  69          1HD1      ILE  69  -5.294   8.694   0.074
  603   HD13  ILE  69          2HD1      ILE  69  -5.806   7.408   1.168
  604    H    GLN  70           HN       GLN  70  -8.098   5.551  -4.319
  605    HA   GLN  70           HA       GLN  70  -8.257   7.765  -6.250
  606    HB2  GLN  70           2HB      GLN  70  -9.289   4.932  -6.399
  607    HB3  GLN  70           3HB      GLN  70  -9.693   6.176  -7.574
  608    HG2  GLN  70           2HG      GLN  70  -7.160   6.436  -7.873
  609    HG3  GLN  70           3HG      GLN  70  -7.046   4.886  -7.041
  610   HE21  GLN  70          1HE2      GLN  70  -6.034   4.856  -9.438
  611   HE22  GLN  70          2HE2      GLN  70  -7.072   4.094 -10.590
  612    H    ASP  71           HN       ASP  71  -9.415   9.212  -4.982
  613    HA   ASP  71           HA       ASP  71 -11.649   8.660  -3.423
  614    HB2  ASP  71           2HB      ASP  71 -10.371  10.822  -3.487
  615    HB3  ASP  71           3HB      ASP  71 -11.198  11.202  -4.995
  616    H    ARG  72           HN       ARG  72 -11.396   9.293  -6.878
  617    HA   ARG  72           HA       ARG  72 -13.966   9.761  -7.631
  618    HB2  ARG  72           2HB      ARG  72 -13.446   8.511  -9.734
  619    HB3  ARG  72           3HB      ARG  72 -12.221   9.687  -9.274
  620    HG2  ARG  72           2HG      ARG  72 -10.744   7.995  -8.529
  621    HG3  ARG  72           3HG      ARG  72 -12.005   6.764  -8.617
  622    HD2  ARG  72           2HD      ARG  72 -11.250   8.274 -11.078
  623    HD3  ARG  72           3HD      ARG  72 -10.208   6.970 -10.510
  624    HE   ARG  72           HE       ARG  72 -12.848   6.037 -10.591
  625   HH11  ARG  72          2HH1      ARG  72 -10.314   7.051 -12.751
  626   HH12  ARG  72          1HH1      ARG  72 -10.845   6.043 -14.057
  627   HH21  ARG  72          2HH2      ARG  72 -13.558   4.706 -12.302
  628   HH22  ARG  72          1HH2      ARG  72 -12.691   4.711 -13.800
  629    H    GLU  73           HN       GLU  73 -12.572   6.648  -6.720
  630    HA   GLU  73           HA       GLU  73 -15.302   5.556  -6.588
  631    HB2  GLU  73           2HB      GLU  73 -12.817   4.287  -7.711
  632    HB3  GLU  73           3HB      GLU  73 -14.153   3.308  -7.121
  633    HG2  GLU  73           2HG      GLU  73 -14.282   5.351  -9.326
  634    HG3  GLU  73           3HG      GLU  73 -14.293   3.599  -9.518
  635    H    ALA  74           HN       ALA  74 -13.136   6.692  -4.683
  636    HA   ALA  74           HA       ALA  74 -12.250   6.237  -2.620
  637    HB1  ALA  74           1HB      ALA  74 -14.975   6.022  -2.568
  638    HB2  ALA  74           2HB      ALA  74 -14.466   4.513  -1.810
  639    HB3  ALA  74           3HB      ALA  74 -13.927   6.057  -1.149
  640    H    THR  75           HN       THR  75 -11.145   4.541  -4.475
  641    HA   THR  75           HA       THR  75 -10.966   1.996  -2.996
  642    HB   THR  75           HB       THR  75 -10.766   2.485  -5.966
  643    HG1  THR  75           1HG      THR  75 -12.494   1.052  -6.016
  644   HG21  THR  75          3HG2      THR  75 -10.096  -0.042  -4.453
  645   HG22  THR  75          1HG2      THR  75  -8.936   1.002  -5.273
  646   HG23  THR  75          2HG2      THR  75 -10.153   0.132  -6.207
  647    H    VAL  76           HN       VAL  76  -8.965   1.225  -2.491
  648    HA   VAL  76           HA       VAL  76  -6.690   2.975  -3.155
  649    HB   VAL  76           HB       VAL  76  -6.993   1.109  -0.797
  650   HG11  VAL  76          1HG1      VAL  76  -4.926   3.189  -0.758
  651   HG12  VAL  76          2HG1      VAL  76  -4.851   1.501  -0.247
  652   HG13  VAL  76          3HG1      VAL  76  -4.667   1.918  -1.952
  653   HG21  VAL  76          3HG2      VAL  76  -8.049   2.757   0.253
  654   HG22  VAL  76          1HG2      VAL  76  -6.688   3.837  -0.052
  655   HG23  VAL  76          2HG2      VAL  76  -8.004   3.725  -1.220
  656    H    LEU  77           HN       LEU  77  -5.361   2.165  -4.626
  657    HA   LEU  77           HA       LEU  77  -5.033  -0.758  -4.779
  658    HB2  LEU  77           2HB      LEU  77  -5.980   0.006  -6.803
  659    HB3  LEU  77           3HB      LEU  77  -4.879   1.379  -6.885
  660    HG   LEU  77           HG       LEU  77  -3.073  -0.559  -7.056
  661   HD11  LEU  77          1HD1      LEU  77  -4.307  -2.500  -6.930
  662   HD12  LEU  77          2HD1      LEU  77  -4.187  -2.267  -8.673
  663   HD13  LEU  77          3HD1      LEU  77  -5.667  -1.822  -7.825
  664   HD21  LEU  77          3HD2      LEU  77  -4.732   0.827  -9.089
  665   HD22  LEU  77          1HD2      LEU  77  -3.674  -0.473  -9.638
  666   HD23  LEU  77          2HD2      LEU  77  -2.996   0.916  -8.788
  667    H    VAL  78           HN       VAL  78  -3.157  -1.485  -4.051
  668    HA   VAL  78           HA       VAL  78  -1.001   0.153  -3.304
  669    HB   VAL  78           HB       VAL  78  -0.915  -2.811  -3.881
  670   HG11  VAL  78          1HG1      VAL  78   1.128  -2.888  -2.921
  671   HG12  VAL  78          2HG1      VAL  78   1.197  -1.202  -3.438
  672   HG13  VAL  78          3HG1      VAL  78   0.757  -1.599  -1.776
  673   HG21  VAL  78          3HG2      VAL  78  -1.478  -1.426  -1.262
  674   HG22  VAL  78          1HG2      VAL  78  -2.708  -2.159  -2.293
  675   HG23  VAL  78          2HG2      VAL  78  -1.456  -3.164  -1.562
  676    H    LEU  79           HN       LEU  79   0.781   0.841  -4.340
  677    HA   LEU  79           HA       LEU  79   1.069   0.088  -7.167
  678    HB2  LEU  79           2HB      LEU  79   1.676   2.563  -5.619
  679    HB3  LEU  79           3HB      LEU  79   2.603   2.213  -7.076
  680    HG   LEU  79           HG       LEU  79  -0.402   2.467  -6.986
  681   HD11  LEU  79          1HD1      LEU  79   0.145   4.615  -8.268
  682   HD12  LEU  79          2HD1      LEU  79   1.759   4.461  -7.575
  683   HD13  LEU  79          3HD1      LEU  79   0.357   4.622  -6.517
  684   HD21  LEU  79          3HD2      LEU  79   1.110   1.188  -8.837
  685   HD22  LEU  79          1HD2      LEU  79   1.089   2.826  -9.491
  686   HD23  LEU  79          2HD2      LEU  79  -0.428   1.981  -9.180
  687    H    ARG  80           HN       ARG  80   3.065   0.925  -4.334
  688    HA   ARG  80           HA       ARG  80   5.050  -1.033  -5.275
  689    HB2  ARG  80           2HB      ARG  80   5.765   1.335  -5.713
  690    HB3  ARG  80           3HB      ARG  80   5.733   1.606  -3.976
  691    HG2  ARG  80           2HG      ARG  80   7.983   1.191  -4.581
  692    HG3  ARG  80           3HG      ARG  80   7.398  -0.251  -3.748
  693    HD2  ARG  80           2HD      ARG  80   8.606  -1.018  -5.630
  694    HD3  ARG  80           3HD      ARG  80   6.899  -1.216  -6.024
  695    HE   ARG  80           HE       ARG  80   7.187   0.247  -7.748
  696   HH11  ARG  80          2HH1      ARG  80   9.773   0.702  -5.462
  697   HH12  ARG  80          1HH1      ARG  80  10.622   1.842  -6.451
  698   HH21  ARG  80          2HH2      ARG  80   8.296   1.747  -9.060
  699   HH22  ARG  80          1HH2      ARG  80   9.781   2.437  -8.497
  700    H    VAL  81           HN       VAL  81   6.298  -2.046  -3.633
  701    HA   VAL  81           HA       VAL  81   5.525  -1.593  -0.861
  702    HB   VAL  81           HB       VAL  81   3.895  -3.255  -1.720
  703   HG11  VAL  81          1HG1      VAL  81   6.033  -4.274  -3.111
  704   HG12  VAL  81          2HG1      VAL  81   5.804  -5.456  -1.820
  705   HG13  VAL  81          3HG1      VAL  81   4.469  -5.062  -2.904
  706   HG21  VAL  81          3HG2      VAL  81   5.728  -4.678   0.172
  707   HG22  VAL  81          1HG2      VAL  81   4.912  -3.192   0.660
  708   HG23  VAL  81          2HG2      VAL  81   3.967  -4.599   0.172
  709    H    GLY  82           HN       GLY  82   7.393  -1.423   0.183
  710    HA2  GLY  82           1HA      GLY  82   9.370  -3.520  -0.015
  711    HA3  GLY  82           2HA      GLY  82   9.908  -1.972  -0.648
  712    H    HIS  83           HN       HIS  83  11.048  -3.366   1.566
  713    HA   HIS  83           HA       HIS  83  10.172  -2.378   4.051
  714    HB2  HIS  83           2HB      HIS  83  11.795  -4.291   3.625
  715    HB3  HIS  83           3HB      HIS  83  13.031  -3.063   3.368
  716    HD2  HIS  83           2HD      HIS  83  11.930  -5.209   6.149
  717    HE1  HIS  83           1HE      HIS  83  13.224  -1.639   8.041
  718    HE2  HIS  83           2HE      HIS  83  12.686  -4.080   8.350
  719    H    ALA  84           HN       ALA  84  10.626  -0.556   5.186
  720    HA   ALA  84           HA       ALA  84  11.004   1.859   4.093
  721    HB1  ALA  84           1HB      ALA  84  12.357   2.290   6.392
  722    HB2  ALA  84           2HB      ALA  84  10.601   2.161   6.286
  723    HB3  ALA  84           3HB      ALA  84  11.560   0.761   6.764
  724    H    ARG  85           HN       ARG  85  13.652  -0.255   5.162
  725    HA   ARG  85           HA       ARG  85  15.855   1.259   4.822
  726    HB2  ARG  85           2HB      ARG  85  15.282  -1.603   4.251
  727    HB3  ARG  85           3HB      ARG  85  16.803  -0.951   3.656
  728    HG2  ARG  85           2HG      ARG  85  15.963  -0.615   6.513
  729    HG3  ARG  85           3HG      ARG  85  16.795  -2.066   5.950
  730    HD2  ARG  85           2HD      ARG  85  18.601  -0.589   5.060
  731    HD3  ARG  85           3HD      ARG  85  17.795   0.774   5.835
  732    HE   ARG  85           HE       ARG  85  18.170  -1.127   7.803
  733   HH11  ARG  85          2HH1      ARG  85  20.161   0.761   5.661
  734   HH12  ARG  85          1HH1      ARG  85  21.507   0.817   6.750
  735   HH21  ARG  85          2HH2      ARG  85  19.936  -1.061   9.245
  736   HH22  ARG  85          1HH2      ARG  85  21.378  -0.221   8.788
  737    H    ASP  86           HN       ASP  86  14.562  -0.686   2.123
  738    HA   ASP  86           HA       ASP  86  16.099   0.495   0.122
  739    HB2  ASP  86           2HB      ASP  86  13.394  -0.843  -0.001
  740    HB3  ASP  86           3HB      ASP  86  14.289  -0.346  -1.434
  741    H    VAL  87           HN       VAL  87  12.722   1.208   1.013
  742    HA   VAL  87           HA       VAL  87  12.222   3.263  -0.754
  743    HB   VAL  87           HB       VAL  87  11.248   3.366   2.090
  744   HG11  VAL  87          1HG1      VAL  87  10.428   4.488  -0.513
  745   HG12  VAL  87          2HG1      VAL  87   9.127   3.919   0.535
  746   HG13  VAL  87          3HG1      VAL  87  10.255   5.146   1.114
  747   HG21  VAL  87          3HG2      VAL  87  10.925   1.213   0.187
  748   HG22  VAL  87          1HG2      VAL  87  10.444   1.300   1.881
  749   HG23  VAL  87          2HG2      VAL  87   9.373   1.926   0.627
  750    H    TYR  88           HN       TYR  88  12.217   5.568  -0.507
  751    HA   TYR  88           HA       TYR  88  14.666   6.544   0.645
  752    HB2  TYR  88           2HB      TYR  88  12.506   8.264  -0.551
  753    HB3  TYR  88           3HB      TYR  88  14.240   8.557  -0.504
  754    HD1  TYR  88           2HD      TYR  88  11.569   6.611  -2.133
  755    HD2  TYR  88           1HD      TYR  88  15.694   7.652  -2.174
  756    HE1  TYR  88           2HE      TYR  88  11.788   5.631  -4.378
  757    HE2  TYR  88           1HE      TYR  88  15.924   6.676  -4.420
  758    HH   TYR  88           HH       TYR  88  14.734   5.958  -6.246
  759    H    ARG  89           HN       ARG  89  12.004   5.714   2.149
  760    HA   ARG  89           HA       ARG  89  12.439   7.479   4.356
  761    HB2  ARG  89           2HB      ARG  89  10.142   8.390   4.447
  762    HB3  ARG  89           3HB      ARG  89  11.037   8.959   3.045
  763    HG2  ARG  89           2HG      ARG  89   9.282   6.567   2.777
  764    HG3  ARG  89           3HG      ARG  89   8.560   8.177   2.816
  765    HD2  ARG  89           2HD      ARG  89  10.803   7.424   0.957
  766    HD3  ARG  89           3HD      ARG  89   9.102   7.254   0.526
  767    HE   ARG  89           HE       ARG  89   9.606   9.877   1.434
  768   HH11  ARG  89          2HH1      ARG  89  10.197   7.778  -1.280
  769   HH12  ARG  89          1HH1      ARG  89  10.286   9.072  -2.428
  770   HH21  ARG  89          2HH2      ARG  89   9.722  11.589  -0.068
  771   HH22  ARG  89          1HH2      ARG  89  10.017  11.240  -1.737
  Start of MODEL   12
    1    H1   MET   1           HN       MET   1 -19.139   5.054   4.276
    2    HA   MET   1           HA       MET   1 -19.142   2.280   3.316
    3    HB2  MET   1           2HB      MET   1 -19.098   4.945   1.957
    4    HB3  MET   1           3HB      MET   1 -18.442   3.544   1.122
    5    HG2  MET   1           2HG      MET   1 -20.606   2.391   1.451
    6    HG3  MET   1           3HG      MET   1 -21.245   3.873   2.159
    7    HE1  MET   1           3HE      MET   1 -22.877   3.395  -1.425
    8    HE2  MET   1           1HE      MET   1 -22.678   2.451   0.052
    9    HE3  MET   1           2HE      MET   1 -23.311   4.094   0.136
   10    H    GLY   2           HN       GLY   2 -17.302   1.163   3.082
   11    HA2  GLY   2           1HA      GLY   2 -14.798   2.517   3.776
   12    HA3  GLY   2           2HA      GLY   2 -15.068   0.780   3.769
   13    H    TYR   3           HN       TYR   3 -12.943   2.427   2.527
   14    HA   TYR   3           HA       TYR   3 -13.362   2.410  -0.295
   15    HB2  TYR   3           2HB      TYR   3 -10.951   2.776   1.463
   16    HB3  TYR   3           3HB      TYR   3 -10.785   2.656  -0.285
   17    HD1  TYR   3           2HD      TYR   3 -13.188   4.419   1.979
   18    HD2  TYR   3           1HD      TYR   3 -10.409   4.723  -1.228
   19    HE1  TYR   3           2HE      TYR   3 -13.698   6.816   1.772
   20    HE2  TYR   3           1HE      TYR   3 -10.910   7.121  -1.443
   21    HH   TYR   3           HH       TYR   3 -11.941   8.965   0.486
   22    H    ARG   4           HN       ARG   4 -12.301   1.073  -1.848
   23    HA   ARG   4           HA       ARG   4 -12.210  -1.701  -1.030
   24    HB2  ARG   4           2HB      ARG   4 -13.360  -1.241  -3.078
   25    HB3  ARG   4           3HB      ARG   4 -11.991  -0.341  -3.714
   26    HG2  ARG   4           2HG      ARG   4 -10.836  -2.220  -4.279
   27    HG3  ARG   4           3HG      ARG   4 -11.564  -3.187  -2.995
   28    HD2  ARG   4           2HD      ARG   4 -13.646  -3.311  -4.226
   29    HD3  ARG   4           3HD      ARG   4 -12.998  -2.251  -5.477
   30    HE   ARG   4           HE       ARG   4 -11.264  -4.373  -5.364
   31   HH11  ARG   4          2HH1      ARG   4 -14.675  -3.960  -5.924
   32   HH12  ARG   4          1HH1      ARG   4 -14.806  -5.344  -6.958
   33   HH21  ARG   4          2HH2      ARG   4 -11.423  -6.197  -6.724
   34   HH22  ARG   4          1HH2      ARG   4 -12.955  -6.616  -7.411
   35    H    ILE   5           HN       ILE   5 -10.446  -3.090  -1.262
   36    HA   ILE   5           HA       ILE   5  -7.840  -1.726  -1.313
   37    HB   ILE   5           HB       ILE   5  -8.499  -4.442  -0.169
   38   HG12  ILE   5          2HG1      ILE   5  -9.593  -2.667   1.109
   39   HG13  ILE   5          3HG1      ILE   5  -8.257  -3.351   2.030
   40   HG21  ILE   5          1HG2      ILE   5  -6.310  -4.764  -0.025
   41   HG22  ILE   5          2HG2      ILE   5  -6.039  -3.240  -0.869
   42   HG23  ILE   5          3HG2      ILE   5  -6.132  -3.269   0.892
   43   HD11  ILE   5          3HD1      ILE   5  -8.204  -1.002   2.319
   44   HD12  ILE   5          1HD1      ILE   5  -6.862  -1.427   1.257
   45   HD13  ILE   5          2HD1      ILE   5  -8.331  -0.721   0.583
   46    H    GLU   6           HN       GLU   6  -6.852  -1.870  -3.214
   47    HA   GLU   6           HA       GLU   6  -6.987  -4.431  -4.667
   48    HB2  GLU   6           2HB      GLU   6  -7.174  -1.613  -5.643
   49    HB3  GLU   6           3HB      GLU   6  -6.427  -2.818  -6.683
   50    HG2  GLU   6           2HG      GLU   6  -9.184  -3.058  -5.505
   51    HG3  GLU   6           3HG      GLU   6  -8.832  -2.465  -7.127
   52    H    PHE   7           HN       PHE   7  -5.099  -4.867  -6.057
   53    HA   PHE   7           HA       PHE   7  -2.634  -3.563  -5.151
   54    HB2  PHE   7           2HB      PHE   7  -3.300  -6.485  -4.990
   55    HB3  PHE   7           3HB      PHE   7  -1.630  -5.968  -5.194
   56    HD1  PHE   7           1HD      PHE   7  -4.601  -5.439  -3.021
   57    HD2  PHE   7           2HD      PHE   7  -0.357  -5.430  -3.340
   58    HE1  PHE   7           1HE      PHE   7  -4.423  -5.080  -0.593
   59    HE2  PHE   7           2HE      PHE   7  -0.172  -5.073  -0.913
   60    HZ   PHE   7           HZ       PHE   7  -2.206  -4.898   0.464
   61    H    ASP   8           HN       ASP   8  -1.154  -3.243  -6.718
   62    HA   ASP   8           HA       ASP   8  -1.900  -3.604  -9.428
   63    HB2  ASP   8           2HB      ASP   8   0.460  -2.520  -7.982
   64    HB3  ASP   8           3HB      ASP   8   0.705  -3.011  -9.656
   65    HA   PRO   9           HA       PRO   9  -0.248  -7.516 -10.519
   66    HB2  PRO   9           2HB      PRO   9   0.887  -7.040 -12.939
   67    HB3  PRO   9           3HB      PRO   9  -0.863  -7.075 -12.689
   68    HG2  PRO   9           2HG      PRO   9   0.978  -4.721 -12.870
   69    HG3  PRO   9           3HG      PRO   9  -0.625  -4.946 -13.593
   70    HD2  PRO   9           2HD      PRO   9  -0.234  -3.500 -11.337
   71    HD3  PRO   9           3HD      PRO   9  -1.721  -4.424 -11.633
   72    H    ARG  10           HN       ARG  10   1.833  -4.868 -10.024
   73    HA   ARG  10           HA       ARG  10   4.257  -6.472 -10.345
   74    HB2  ARG  10           2HB      ARG  10   3.763  -3.538  -9.881
   75    HB3  ARG  10           3HB      ARG  10   5.364  -4.245  -9.709
   76    HG2  ARG  10           2HG      ARG  10   3.851  -4.742 -12.221
   77    HG3  ARG  10           3HG      ARG  10   4.586  -3.158 -11.965
   78    HD2  ARG  10           2HD      ARG  10   6.757  -4.131 -11.720
   79    HD3  ARG  10           3HD      ARG  10   6.082  -5.759 -11.711
   80    HE   ARG  10           HE       ARG  10   5.385  -4.475 -14.113
   81   HH11  ARG  10          2HH1      ARG  10   8.152  -5.813 -12.477
   82   HH12  ARG  10          1HH1      ARG  10   8.987  -6.213 -13.941
   83   HH21  ARG  10          2HH2      ARG  10   6.476  -4.997 -16.048
   84   HH22  ARG  10          1HH2      ARG  10   8.033  -5.748 -15.971
   85    H    ALA  11           HN       ALA  11   2.697  -4.445  -7.864
   86    HA   ALA  11           HA       ALA  11   4.416  -5.038  -5.755
   87    HB1  ALA  11           1HB      ALA  11   1.556  -4.705  -5.089
   88    HB2  ALA  11           2HB      ALA  11   2.976  -3.869  -4.459
   89    HB3  ALA  11           3HB      ALA  11   2.306  -3.410  -6.024
   90    H    GLU  12           HN       GLU  12   1.367  -6.632  -6.674
   91    HA   GLU  12           HA       GLU  12   0.988  -8.453  -4.736
   92    HB2  GLU  12           2HB      GLU  12   0.673  -8.593  -7.689
   93    HB3  GLU  12           3HB      GLU  12   0.530 -10.098  -6.792
   94    HG2  GLU  12           2HG      GLU  12  -1.052  -7.627  -6.141
   95    HG3  GLU  12           3HG      GLU  12  -1.618  -8.891  -7.232
   96    H    LYS  13           HN       LYS  13   3.229  -8.966  -7.458
   97    HA   LYS  13           HA       LYS  13   4.265 -11.409  -6.480
   98    HB2  LYS  13           2HB      LYS  13   5.504  -9.420  -8.391
   99    HB3  LYS  13           3HB      LYS  13   6.061 -11.069  -8.140
  100    HG2  LYS  13           2HG      LYS  13   3.225 -10.648  -8.917
  101    HG3  LYS  13           3HG      LYS  13   4.477 -10.432 -10.143
  102    HD2  LYS  13           2HD      LYS  13   5.352 -12.715  -9.383
  103    HD3  LYS  13           3HD      LYS  13   3.798 -12.897  -8.565
  104    HE2  LYS  13           2HE      LYS  13   3.376 -13.890 -10.604
  105    HE3  LYS  13           3HE      LYS  13   2.812 -12.243 -10.884
  106    HZ1  LYS  13           3HZ      LYS  13   4.350 -11.926 -12.440
  107    HZ2  LYS  13           1HZ      LYS  13   4.609 -13.598 -12.413
  108    HZ3  LYS  13           2HZ      LYS  13   5.590 -12.575 -11.490
  109    H    GLU  14           HN       GLU  14   5.355  -8.054  -6.196
  110    HA   GLU  14           HA       GLU  14   7.821  -8.484  -4.989
  111    HB2  GLU  14           2HB      GLU  14   5.867  -6.229  -4.501
  112    HB3  GLU  14           3HB      GLU  14   7.565  -6.213  -4.047
  113    HG2  GLU  14           2HG      GLU  14   6.768  -6.672  -6.888
  114    HG3  GLU  14           3HG      GLU  14   6.815  -5.041  -6.221
  115    H    LEU  15           HN       LEU  15   4.613  -8.192  -3.507
  116    HA   LEU  15           HA       LEU  15   5.493  -8.387  -0.830
  117    HB2  LEU  15           2HB      LEU  15   3.225  -7.616  -1.769
  118    HB3  LEU  15           3HB      LEU  15   2.811  -9.329  -1.786
  119    HG   LEU  15           HG       LEU  15   3.382  -9.314   0.704
  120   HD11  LEU  15          1HD1      LEU  15   2.980  -7.022   1.723
  121   HD12  LEU  15          2HD1      LEU  15   3.326  -6.369   0.122
  122   HD13  LEU  15          3HD1      LEU  15   4.555  -7.298   0.979
  123   HD21  LEU  15          3HD2      LEU  15   1.158  -9.532   0.577
  124   HD22  LEU  15          1HD2      LEU  15   1.019  -8.328  -0.704
  125   HD23  LEU  15          2HD2      LEU  15   1.111  -7.815   0.981
  126    H    GLU  16           HN       GLU  16   4.345 -10.805  -3.151
  127    HA   GLU  16           HA       GLU  16   4.229 -13.023  -1.497
  128    HB2  GLU  16           2HB      GLU  16   4.931 -12.741  -4.412
  129    HB3  GLU  16           3HB      GLU  16   4.848 -14.312  -3.628
  130    HG2  GLU  16           2HG      GLU  16   2.567 -14.192  -3.321
  131    HG3  GLU  16           3HG      GLU  16   2.542 -12.433  -3.423
  132    H    LYS  17           HN       LYS  17   7.016 -11.589  -3.122
  133    HA   LYS  17           HA       LYS  17   8.889 -13.595  -2.552
  134    HB2  LYS  17           2HB      LYS  17   9.019 -10.709  -3.262
  135    HB3  LYS  17           3HB      LYS  17  10.470 -11.440  -2.589
  136    HG2  LYS  17           2HG      LYS  17  10.804 -12.786  -4.403
  137    HG3  LYS  17           3HG      LYS  17   9.089 -12.842  -4.816
  138    HD2  LYS  17           2HD      LYS  17   9.216 -10.499  -5.564
  139    HD3  LYS  17           3HD      LYS  17  10.942 -10.489  -5.196
  140    HE2  LYS  17           2HE      LYS  17   9.618 -12.361  -7.154
  141    HE3  LYS  17           3HE      LYS  17  10.429 -10.861  -7.599
  142    HZ1  LYS  17           3HZ      LYS  17  11.642 -13.224  -7.539
  143    HZ2  LYS  17           1HZ      LYS  17  11.974 -12.698  -5.966
  144    HZ3  LYS  17           2HZ      LYS  17  12.452 -11.761  -7.291
  145    H    LEU  18           HN       LEU  18   7.866 -10.768  -0.691
  146    HA   LEU  18           HA       LEU  18   9.756 -10.885   1.353
  147    HB2  LEU  18           2HB      LEU  18   6.902  -9.949   1.307
  148    HB3  LEU  18           3HB      LEU  18   7.913  -9.813   2.745
  149    HG   LEU  18           HG       LEU  18   8.697  -8.585   0.115
  150   HD11  LEU  18          1HD1      LEU  18   6.776  -7.394   0.407
  151   HD12  LEU  18          2HD1      LEU  18   7.859  -6.458   1.436
  152   HD13  LEU  18          3HD1      LEU  18   6.758  -7.634   2.154
  153   HD21  LEU  18          3HD2      LEU  18  10.574  -8.359   1.330
  154   HD22  LEU  18          1HD2      LEU  18   9.740  -8.636   2.859
  155   HD23  LEU  18          2HD2      LEU  18   9.697  -7.041   2.108
  156    H    ASP  19           HN       ASP  19   8.950 -11.324   3.736
  157    HA   ASP  19           HA       ASP  19   8.703 -14.121   3.992
  158    HB2  ASP  19           2HB      ASP  19   9.700 -12.389   5.643
  159    HB3  ASP  19           3HB      ASP  19   8.044 -12.207   6.215
  160    H    ARG  20           HN       ARG  20   6.997 -15.296   5.113
  161    HA   ARG  20           HA       ARG  20   4.445 -14.758   3.986
  162    HB2  ARG  20           2HB      ARG  20   5.594 -17.015   4.764
  163    HB3  ARG  20           3HB      ARG  20   4.754 -16.657   6.267
  164    HG2  ARG  20           2HG      ARG  20   2.657 -16.861   5.292
  165    HG3  ARG  20           3HG      ARG  20   3.289 -16.644   3.659
  166    HD2  ARG  20           2HD      ARG  20   2.754 -18.940   3.872
  167    HD3  ARG  20           3HD      ARG  20   4.511 -18.825   3.965
  168    HE   ARG  20           HE       ARG  20   3.304 -18.760   6.546
  169   HH11  ARG  20          2HH1      ARG  20   4.251 -20.882   3.954
  170   HH12  ARG  20          1HH1      ARG  20   4.446 -22.263   4.981
  171   HH21  ARG  20          2HH2      ARG  20   3.556 -20.571   7.909
  172   HH22  ARG  20          1HH2      ARG  20   4.049 -22.086   7.230
  173    H    GLU  21           HN       GLU  21   5.723 -14.585   7.295
  174    HA   GLU  21           HA       GLU  21   3.335 -13.810   8.549
  175    HB2  GLU  21           2HB      GLU  21   5.595 -14.570   9.572
  176    HB3  GLU  21           3HB      GLU  21   6.030 -12.869   9.482
  177    HG2  GLU  21           2HG      GLU  21   3.770 -12.517  10.731
  178    HG3  GLU  21           3HG      GLU  21   3.975 -14.212  11.169
  179    H    VAL  22           HN       VAL  22   6.041 -11.833   7.348
  180    HA   VAL  22           HA       VAL  22   5.037  -9.329   8.024
  181    HB   VAL  22           HB       VAL  22   6.724 -10.055   5.624
  182   HG11  VAL  22          1HG1      VAL  22   5.589  -7.817   5.535
  183   HG12  VAL  22          2HG1      VAL  22   6.496  -7.377   6.983
  184   HG13  VAL  22          3HG1      VAL  22   7.351  -7.765   5.490
  185   HG21  VAL  22          3HG2      VAL  22   8.555 -10.050   6.948
  186   HG22  VAL  22          1HG2      VAL  22   7.916  -8.793   8.008
  187   HG23  VAL  22          2HG2      VAL  22   7.387 -10.464   8.203
  188    H    ALA  23           HN       ALA  23   4.660 -11.124   4.973
  189    HA   ALA  23           HA       ALA  23   3.167  -9.281   3.554
  190    HB1  ALA  23           1HB      ALA  23   2.787 -12.271   3.472
  191    HB2  ALA  23           2HB      ALA  23   2.401 -11.113   2.198
  192    HB3  ALA  23           3HB      ALA  23   4.081 -11.401   2.648
  193    H    ARG  24           HN       ARG  24   1.988 -11.832   5.737
  194    HA   ARG  24           HA       ARG  24  -0.744 -11.337   5.442
  195    HB2  ARG  24           2HB      ARG  24   0.954 -12.643   7.508
  196    HB3  ARG  24           3HB      ARG  24  -0.697 -12.234   7.954
  197    HG2  ARG  24           2HG      ARG  24  -1.467 -13.497   5.940
  198    HG3  ARG  24           3HG      ARG  24   0.200 -14.033   5.719
  199    HD2  ARG  24           2HD      ARG  24   0.168 -15.061   7.933
  200    HD3  ARG  24           3HD      ARG  24  -1.487 -14.505   8.174
  201    HE   ARG  24           HE       ARG  24  -1.172 -16.118   5.825
  202   HH11  ARG  24          2HH1      ARG  24  -1.657 -16.178   9.272
  203   HH12  ARG  24          1HH1      ARG  24  -2.410 -17.738   9.270
  204   HH21  ARG  24          2HH2      ARG  24  -2.162 -18.172   5.810
  205   HH22  ARG  24          1HH2      ARG  24  -2.697 -18.872   7.300
  206    H    ARG  25           HN       ARG  25   1.552 -10.048   7.831
  207    HA   ARG  25           HA       ARG  25  -0.219  -8.519   9.327
  208    HB2  ARG  25           2HB      ARG  25   2.010  -8.826  10.122
  209    HB3  ARG  25           3HB      ARG  25   2.696  -8.098   8.675
  210    HG2  ARG  25           2HG      ARG  25   2.171  -5.951   9.344
  211    HG3  ARG  25           3HG      ARG  25   0.906  -6.496  10.448
  212    HD2  ARG  25           2HD      ARG  25   3.858  -6.969  10.836
  213    HD3  ARG  25           3HD      ARG  25   2.936  -5.681  11.608
  214    HE   ARG  25           HE       ARG  25   1.829  -8.278  12.083
  215   HH11  ARG  25          2HH1      ARG  25   4.250  -5.997  13.114
  216   HH12  ARG  25          1HH1      ARG  25   4.340  -6.624  14.727
  217   HH21  ARG  25          2HH2      ARG  25   1.939  -9.111  14.203
  218   HH22  ARG  25          1HH2      ARG  25   3.026  -8.396  15.345
  219    H    ILE  26           HN       ILE  26   1.571  -7.651   6.391
  220    HA   ILE  26           HA       ILE  26   0.753  -4.966   6.261
  221    HB   ILE  26           HB       ILE  26   1.652  -6.889   4.126
  222   HG12  ILE  26          2HG1      ILE  26   2.988  -4.430   5.269
  223   HG13  ILE  26          3HG1      ILE  26   3.274  -6.063   5.859
  224   HG21  ILE  26          1HG2      ILE  26   1.959  -4.574   2.876
  225   HG22  ILE  26          2HG2      ILE  26   0.469  -5.508   2.756
  226   HG23  ILE  26          3HG2      ILE  26   0.565  -4.140   3.865
  227   HD11  ILE  26          3HD1      ILE  26   3.922  -6.608   3.443
  228   HD12  ILE  26          1HD1      ILE  26   4.020  -4.861   3.225
  229   HD13  ILE  26          2HD1      ILE  26   5.046  -5.661   4.417
  230    H    LEU  27           HN       LEU  27  -0.451  -7.718   4.329
  231    HA   LEU  27           HA       LEU  27  -2.571  -6.481   3.098
  232    HB2  LEU  27           2HB      LEU  27  -2.342  -9.307   4.111
  233    HB3  LEU  27           3HB      LEU  27  -3.647  -8.747   3.067
  234    HG   LEU  27           HG       LEU  27  -0.749  -8.594   2.270
  235   HD11  LEU  27          1HD1      LEU  27  -1.175 -10.911   2.663
  236   HD12  LEU  27          2HD1      LEU  27  -1.229 -10.636   0.923
  237   HD13  LEU  27          3HD1      LEU  27  -2.728 -10.822   1.832
  238   HD21  LEU  27          3HD2      LEU  27  -1.482  -7.919   0.239
  239   HD22  LEU  27          1HD2      LEU  27  -2.847  -7.332   1.188
  240   HD23  LEU  27          2HD2      LEU  27  -2.965  -8.870   0.333
  241    H    ARG  28           HN       ARG  28  -2.605  -8.139   6.245
  242    HA   ARG  28           HA       ARG  28  -5.311  -7.698   6.831
  243    HB2  ARG  28           2HB      ARG  28  -2.881  -8.367   8.416
  244    HB3  ARG  28           3HB      ARG  28  -4.295  -7.800   9.294
  245    HG2  ARG  28           2HG      ARG  28  -4.464 -10.047   7.318
  246    HG3  ARG  28           3HG      ARG  28  -4.008 -10.313   9.002
  247    HD2  ARG  28           2HD      ARG  28  -6.261 -10.618   9.173
  248    HD3  ARG  28           3HD      ARG  28  -6.184  -8.877   9.440
  249    HE   ARG  28           HE       ARG  28  -7.282  -8.559   7.456
  250   HH11  ARG  28          2HH1      ARG  28  -6.083 -11.825   7.589
  251   HH12  ARG  28          1HH1      ARG  28  -6.916 -12.328   6.156
  252   HH21  ARG  28          2HH2      ARG  28  -8.383  -9.209   5.567
  253   HH22  ARG  28          1HH2      ARG  28  -8.223 -10.839   5.005
  254    H    PHE  29           HN       PHE  29  -2.428  -5.782   7.596
  255    HA   PHE  29           HA       PHE  29  -3.583  -3.841   9.199
  256    HB2  PHE  29           2HB      PHE  29  -1.220  -3.852   9.010
  257    HB3  PHE  29           3HB      PHE  29  -1.283  -3.713   7.256
  258    HD1  PHE  29           1HD      PHE  29  -1.910  -1.891  10.412
  259    HD2  PHE  29           2HD      PHE  29  -1.312  -1.614   6.207
  260    HE1  PHE  29           1HE      PHE  29  -1.705   0.554  10.605
  261    HE2  PHE  29           2HE      PHE  29  -1.105   0.830   6.394
  262    HZ   PHE  29           HZ       PHE  29  -1.301   1.917   8.595
  263    H    LEU  30           HN       LEU  30  -3.587  -4.156   5.703
  264    HA   LEU  30           HA       LEU  30  -4.900  -1.588   5.352
  265    HB2  LEU  30           2HB      LEU  30  -3.901  -3.710   3.488
  266    HB3  LEU  30           3HB      LEU  30  -4.960  -2.424   2.914
  267    HG   LEU  30           HG       LEU  30  -2.467  -1.686   4.374
  268   HD11  LEU  30          1HD1      LEU  30  -2.618  -2.903   1.655
  269   HD12  LEU  30          2HD1      LEU  30  -1.404  -3.110   2.916
  270   HD13  LEU  30          3HD1      LEU  30  -1.450  -1.620   1.974
  271   HD21  LEU  30          3HD2      LEU  30  -4.206  -0.034   3.659
  272   HD22  LEU  30          1HD2      LEU  30  -3.828  -0.452   1.987
  273   HD23  LEU  30          2HD2      LEU  30  -2.591   0.271   3.017
  274    H    ARG  31           HN       ARG  31  -5.711  -4.940   5.600
  275    HA   ARG  31           HA       ARG  31  -8.397  -4.516   4.544
  276    HB2  ARG  31           2HB      ARG  31  -6.766  -6.906   5.285
  277    HB3  ARG  31           3HB      ARG  31  -8.519  -7.048   5.295
  278    HG2  ARG  31           2HG      ARG  31  -8.646  -6.480   2.977
  279    HG3  ARG  31           3HG      ARG  31  -6.926  -6.088   2.931
  280    HD2  ARG  31           2HD      ARG  31  -6.287  -8.319   3.087
  281    HD3  ARG  31           3HD      ARG  31  -7.846  -8.818   3.742
  282    HE   ARG  31           HE       ARG  31  -8.305  -7.849   1.180
  283   HH11  ARG  31          2HH1      ARG  31  -6.572 -10.460   2.698
  284   HH12  ARG  31          1HH1      ARG  31  -6.736 -11.529   1.344
  285   HH21  ARG  31          2HH2      ARG  31  -8.527  -9.247  -0.608
  286   HH22  ARG  31          1HH2      ARG  31  -7.847 -10.838  -0.536
  287    H    GLU  32           HN       GLU  32  -6.818  -4.177   7.452
  288    HA   GLU  32           HA       GLU  32  -9.292  -4.662   8.978
  289    HB2  GLU  32           2HB      GLU  32  -6.407  -4.807   9.851
  290    HB3  GLU  32           3HB      GLU  32  -7.755  -4.802  10.980
  291    HG2  GLU  32           2HG      GLU  32  -7.014  -6.890   8.964
  292    HG3  GLU  32           3HG      GLU  32  -7.180  -7.051  10.712
  293    H    ARG  33           HN       ARG  33  -6.325  -2.764   9.517
  294    HA   ARG  33           HA       ARG  33  -7.552  -0.713  10.947
  295    HB2  ARG  33           2HB      ARG  33  -5.082  -0.470   9.222
  296    HB3  ARG  33           3HB      ARG  33  -5.526   0.569  10.569
  297    HG2  ARG  33           2HG      ARG  33  -5.095  -2.371  10.947
  298    HG3  ARG  33           3HG      ARG  33  -3.750  -1.228  10.960
  299    HD2  ARG  33           2HD      ARG  33  -4.342  -1.444  13.210
  300    HD3  ARG  33           3HD      ARG  33  -5.107   0.061  12.703
  301    HE   ARG  33           HE       ARG  33  -7.129  -0.883  13.161
  302   HH11  ARG  33          2HH1      ARG  33  -4.796  -3.426  12.710
  303   HH12  ARG  33          1HH1      ARG  33  -5.897  -4.692  13.142
  304   HH21  ARG  33          2HH2      ARG  33  -8.589  -2.540  13.732
  305   HH22  ARG  33          1HH2      ARG  33  -8.055  -4.187  13.722
  306    H    VAL  34           HN       VAL  34  -6.213  -0.278   7.674
  307    HA   VAL  34           HA       VAL  34  -7.596   2.060   7.086
  308    HB   VAL  34           HB       VAL  34  -6.738  -0.029   5.081
  309   HG11  VAL  34          1HG1      VAL  34  -6.329   2.345   3.885
  310   HG12  VAL  34          2HG1      VAL  34  -7.826   1.423   3.735
  311   HG13  VAL  34          3HG1      VAL  34  -7.717   2.747   4.895
  312   HG21  VAL  34          3HG2      VAL  34  -4.796   1.906   5.109
  313   HG22  VAL  34          1HG2      VAL  34  -5.198   1.740   6.818
  314   HG23  VAL  34          2HG2      VAL  34  -4.682   0.330   5.892
  315    H    ALA  35           HN       ALA  35  -8.416  -1.282   6.162
  316    HA   ALA  35           HA       ALA  35 -10.680  -0.911   4.702
  317    HB1  ALA  35           1HB      ALA  35 -11.262  -3.108   5.164
  318    HB2  ALA  35           2HB      ALA  35  -9.525  -3.091   5.471
  319    HB3  ALA  35           3HB      ALA  35 -10.659  -3.026   6.820
  320    H    THR  36           HN       THR  36 -10.551  -1.114   8.256
  321    HA   THR  36           HA       THR  36 -13.322  -0.572   8.607
  322    HB   THR  36           HB       THR  36 -12.829  -0.348  10.971
  323    HG1  THR  36           1HG      THR  36 -10.080  -0.716  10.576
  324   HG21  THR  36          3HG2      THR  36 -12.919  -2.597  10.614
  325   HG22  THR  36          1HG2      THR  36 -11.235  -2.486  11.124
  326   HG23  THR  36          2HG2      THR  36 -11.634  -2.569   9.408
  327    H    LEU  37           HN       LEU  37 -10.397   1.416   8.996
  328    HA   LEU  37           HA       LEU  37 -11.370   3.758   9.922
  329    HB2  LEU  37           2HB      LEU  37  -9.359   3.259   7.751
  330    HB3  LEU  37           3HB      LEU  37  -9.715   4.884   8.333
  331    HG   LEU  37           HG       LEU  37  -8.724   2.656  10.104
  332   HD11  LEU  37          1HD1      LEU  37  -6.707   4.533   9.826
  333   HD12  LEU  37          2HD1      LEU  37  -7.301   4.290   8.184
  334   HD13  LEU  37          3HD1      LEU  37  -6.741   2.912   9.132
  335   HD21  LEU  37          3HD2      LEU  37  -8.314   5.505  10.747
  336   HD22  LEU  37          1HD2      LEU  37  -8.717   4.147  11.797
  337   HD23  LEU  37          2HD2      LEU  37  -9.977   4.921  10.835
  338    H    GLU  38           HN       GLU  38 -13.056   4.969   9.399
  339    HA   GLU  38           HA       GLU  38 -14.762   4.715   7.316
  340    HB2  GLU  38           2HB      GLU  38 -13.951   7.290   8.674
  341    HB3  GLU  38           3HB      GLU  38 -15.368   7.114   7.649
  342    HG2  GLU  38           2HG      GLU  38 -14.914   5.473  10.123
  343    HG3  GLU  38           3HG      GLU  38 -15.784   7.005  10.119
  344    H    ASP  39           HN       ASP  39 -11.799   6.642   7.335
  345    HA   ASP  39           HA       ASP  39 -11.941   6.745   4.400
  346    HB2  ASP  39           2HB      ASP  39 -12.497   8.951   5.739
  347    HB3  ASP  39           3HB      ASP  39 -10.744   9.046   5.888
  348    HA   PRO  40           HA       PRO  40  -7.864   5.094   4.615
  349    HB2  PRO  40           2HB      PRO  40  -7.026   5.739   2.115
  350    HB3  PRO  40           3HB      PRO  40  -8.181   4.440   2.436
  351    HG2  PRO  40           2HG      PRO  40  -8.691   7.248   1.530
  352    HG3  PRO  40           3HG      PRO  40  -9.429   5.738   0.964
  353    HD2  PRO  40           2HD      PRO  40 -10.665   7.399   2.709
  354    HD3  PRO  40           3HD      PRO  40 -10.891   5.638   2.742
  355    H    ARG  41           HN       ARG  41  -8.549   8.419   4.174
  356    HA   ARG  41           HA       ARG  41  -5.775   9.256   4.125
  357    HB2  ARG  41           2HB      ARG  41  -8.394  10.745   4.185
  358    HB3  ARG  41           3HB      ARG  41  -6.846  11.567   4.335
  359    HG2  ARG  41           2HG      ARG  41  -7.241   9.722   2.041
  360    HG3  ARG  41           3HG      ARG  41  -8.047  11.292   2.011
  361    HD2  ARG  41           2HD      ARG  41  -5.762  12.278   2.578
  362    HD3  ARG  41           3HD      ARG  41  -5.106  10.698   2.153
  363    HE   ARG  41           HE       ARG  41  -5.518  11.146  -0.065
  364   HH11  ARG  41          2HH1      ARG  41  -7.080  13.532   1.931
  365   HH12  ARG  41          1HH1      ARG  41  -7.477  14.573   0.604
  366   HH21  ARG  41          2HH2      ARG  41  -6.034  12.508  -1.821
  367   HH22  ARG  41          1HH2      ARG  41  -6.882  13.989  -1.530
  368    H    SER  42           HN       SER  42  -6.387   7.690   6.362
  369    HA   SER  42           HA       SER  42  -6.337   9.663   8.550
  370    HB2  SER  42           2HB      SER  42  -8.240   8.087   8.656
  371    HB3  SER  42           3HB      SER  42  -7.107   6.736   8.681
  372    HG   SER  42           HG       SER  42  -7.002   7.020  10.748
  373    H    LEU  43           HN       LEU  43  -4.955   6.583   7.451
  374    HA   LEU  43           HA       LEU  43  -2.633   7.081   9.189
  375    HB2  LEU  43           2HB      LEU  43  -3.873   4.571   8.126
  376    HB3  LEU  43           3HB      LEU  43  -2.189   4.592   8.646
  377    HG   LEU  43           HG       LEU  43  -4.466   5.397  10.443
  378   HD11  LEU  43          1HD1      LEU  43  -3.466   2.718   9.692
  379   HD12  LEU  43          2HD1      LEU  43  -5.065   3.224  10.235
  380   HD13  LEU  43          3HD1      LEU  43  -3.764   3.011  11.406
  381   HD21  LEU  43          3HD2      LEU  43  -2.456   4.432  11.993
  382   HD22  LEU  43          1HD2      LEU  43  -2.697   6.136  11.611
  383   HD23  LEU  43          2HD2      LEU  43  -1.549   5.177  10.676
  384    H    GLY  44           HN       GLY  44  -0.585   7.115   8.348
  385    HA2  GLY  44           1HA      GLY  44   1.026   6.663   6.640
  386    HA3  GLY  44           2HA      GLY  44  -0.281   6.622   5.466
  387    H    GLU  45           HN       GLU  45   1.605   8.043   4.530
  388    HA   GLU  45           HA       GLU  45   0.776  10.824   4.955
  389    HB2  GLU  45           2HB      GLU  45   3.102  11.589   4.834
  390    HB3  GLU  45           3HB      GLU  45   2.848  10.532   6.216
  391    HG2  GLU  45           2HG      GLU  45   4.014   8.767   5.230
  392    HG3  GLU  45           3HG      GLU  45   3.915   9.482   3.622
  393    HA   PRO  46           HA       PRO  46   0.554  10.950   0.567
  394    HB2  PRO  46           2HB      PRO  46   0.857  13.618   0.166
  395    HB3  PRO  46           3HB      PRO  46  -0.621  12.908   0.826
  396    HG2  PRO  46           2HG      PRO  46   1.648  14.233   2.260
  397    HG3  PRO  46           3HG      PRO  46  -0.097  14.406   2.526
  398    HD2  PRO  46           2HD      PRO  46   1.467  12.841   4.087
  399    HD3  PRO  46           3HD      PRO  46  -0.232  12.454   3.744
  400    H    LEU  47           HN       LEU  47   1.773  11.537  -1.358
  401    HA   LEU  47           HA       LEU  47   4.651  11.878  -0.822
  402    HB2  LEU  47           2HB      LEU  47   3.648   9.604  -1.708
  403    HB3  LEU  47           3HB      LEU  47   3.699  10.449  -3.253
  404    HG   LEU  47           HG       LEU  47   6.164  10.340  -1.573
  405   HD11  LEU  47          1HD1      LEU  47   6.694   8.187  -2.071
  406   HD12  LEU  47          2HD1      LEU  47   5.714   8.165  -3.537
  407   HD13  LEU  47          3HD1      LEU  47   4.942   8.016  -1.958
  408   HD21  LEU  47          3HD2      LEU  47   6.263  11.714  -3.521
  409   HD22  LEU  47          1HD2      LEU  47   5.564  10.442  -4.523
  410   HD23  LEU  47          2HD2      LEU  47   7.185  10.247  -3.855
  411    H    ARG  48           HN       ARG  48   5.655  13.486  -1.861
  412    HA   ARG  48           HA       ARG  48   4.378  14.658  -4.231
  413    HB2  ARG  48           2HB      ARG  48   3.908  15.949  -2.071
  414    HB3  ARG  48           3HB      ARG  48   5.617  16.361  -2.078
  415    HG2  ARG  48           2HG      ARG  48   5.421  17.608  -4.058
  416    HG3  ARG  48           3HG      ARG  48   3.834  16.927  -4.422
  417    HD2  ARG  48           2HD      ARG  48   4.230  18.468  -1.896
  418    HD3  ARG  48           3HD      ARG  48   4.052  19.336  -3.421
  419    HE   ARG  48           HE       ARG  48   1.842  18.612  -3.558
  420   HH11  ARG  48          2HH1      ARG  48   3.455  17.255  -0.787
  421   HH12  ARG  48          1HH1      ARG  48   1.989  16.728  -0.028
  422   HH21  ARG  48          2HH2      ARG  48  -0.095  17.924  -2.568
  423   HH22  ARG  48          1HH2      ARG  48  -0.029  17.109  -1.043
  424    H    GLY  49           HN       GLY  49   5.748  14.951  -5.871
  425    HA2  GLY  49           1HA      GLY  49   8.297  15.962  -5.835
  426    HA3  GLY  49           2HA      GLY  49   8.508  14.236  -5.577
  427    HA   PRO  50           HA       PRO  50   7.956  15.424 -10.169
  428    HB2  PRO  50           2HB      PRO  50  10.556  15.335 -10.943
  429    HB3  PRO  50           3HB      PRO  50   9.770  16.816 -10.386
  430    HG2  PRO  50           2HG      PRO  50  11.555  14.939  -8.885
  431    HG3  PRO  50           3HG      PRO  50  11.547  16.713  -8.889
  432    HD2  PRO  50           2HD      PRO  50  10.425  15.255  -6.902
  433    HD3  PRO  50           3HD      PRO  50   9.787  16.833  -7.407
  434    H    GLU  51           HN       GLU  51   9.321  13.006  -8.222
  435    HA   GLU  51           HA       GLU  51  10.050  11.161 -10.283
  436    HB2  GLU  51           2HB      GLU  51   9.736  11.024  -7.313
  437    HB3  GLU  51           3HB      GLU  51   9.813   9.525  -8.228
  438    HG2  GLU  51           2HG      GLU  51  11.890  11.652  -8.566
  439    HG3  GLU  51           3HG      GLU  51  11.981  10.479  -7.253
  440    H    LEU  52           HN       LEU  52   7.281  11.405  -8.061
  441    HA   LEU  52           HA       LEU  52   5.777   9.654  -9.893
  442    HB2  LEU  52           2HB      LEU  52   5.722   9.893  -6.905
  443    HB3  LEU  52           3HB      LEU  52   4.354   9.225  -7.794
  444    HG   LEU  52           HG       LEU  52   7.115   8.084  -8.093
  445   HD11  LEU  52          1HD1      LEU  52   5.598   6.452  -6.372
  446   HD12  LEU  52          2HD1      LEU  52   5.536   8.086  -5.712
  447   HD13  LEU  52          3HD1      LEU  52   7.094   7.316  -6.015
  448   HD21  LEU  52          3HD2      LEU  52   4.337   6.971  -8.473
  449   HD22  LEU  52          1HD2      LEU  52   5.837   6.068  -8.683
  450   HD23  LEU  52          2HD2      LEU  52   5.469   7.426  -9.747
  451    H    GLY  53           HN       GLY  53   4.936  11.876  -7.232
  452    HA2  GLY  53           1HA      GLY  53   3.993  14.090  -8.064
  453    HA3  GLY  53           2HA      GLY  53   2.928  13.078  -9.029
  454    H    ARG  54           HN       ARG  54   1.055  12.412  -8.165
  455    HA   ARG  54           HA       ARG  54   0.583  13.063  -5.338
  456    HB2  ARG  54           2HB      ARG  54  -1.298  12.804  -7.683
  457    HB3  ARG  54           3HB      ARG  54  -1.856  12.928  -6.020
  458    HG2  ARG  54           2HG      ARG  54  -1.990  15.100  -6.877
  459    HG3  ARG  54           3HG      ARG  54  -0.523  15.087  -5.895
  460    HD2  ARG  54           2HD      ARG  54   0.871  15.091  -7.755
  461    HD3  ARG  54           3HD      ARG  54  -0.396  14.494  -8.826
  462    HE   ARG  54           HE       ARG  54   0.156  17.222  -8.165
  463   HH11  ARG  54          2HH1      ARG  54  -2.346  14.991  -9.106
  464   HH12  ARG  54          1HH1      ARG  54  -3.342  16.210  -9.828
  465   HH21  ARG  54          2HH2      ARG  54  -1.147  18.836  -9.113
  466   HH22  ARG  54          1HH2      ARG  54  -2.659  18.397  -9.833
  467    H    PHE  55           HN       PHE  55   1.114  11.260  -4.216
  468    HA   PHE  55           HA       PHE  55  -0.573   8.928  -4.597
  469    HB2  PHE  55           2HB      PHE  55   2.444   8.780  -4.715
  470    HB3  PHE  55           3HB      PHE  55   1.398   7.382  -4.490
  471    HD1  PHE  55           1HD      PHE  55  -0.034   6.595  -6.303
  472    HD2  PHE  55           2HD      PHE  55   2.659   9.845  -6.847
  473    HE1  PHE  55           1HE      PHE  55  -0.264   6.372  -8.742
  474    HE2  PHE  55           2HE      PHE  55   2.433   9.628  -9.287
  475    HZ   PHE  55           HZ       PHE  55   0.970   7.891 -10.238
  476    H    TRP  56           HN       TRP  56  -0.749   7.618  -2.749
  477    HA   TRP  56           HA       TRP  56   0.115   8.956  -0.290
  478    HB2  TRP  56           2HB      TRP  56  -2.346   8.203  -0.894
  479    HB3  TRP  56           3HB      TRP  56  -1.784   6.648  -0.287
  480    HD1  TRP  56           1HD      TRP  56  -1.715   6.335   2.287
  481    HE1  TRP  56           1HE      TRP  56  -2.229   7.849   4.304
  482    HE3  TRP  56           3HE      TRP  56  -2.170  10.807  -0.149
  483    HZ2  TRP  56           2HZ      TRP  56  -2.758  10.577   4.797
  484    HZ3  TRP  56           3HZ      TRP  56  -2.682  12.821   1.168
  485    HH2  TRP  56           2HH      TRP  56  -2.970  12.706   3.590
  486    H    LYS  57           HN       LYS  57   0.882   7.667   1.510
  487    HA   LYS  57           HA       LYS  57   2.094   5.104   0.742
  488    HB2  LYS  57           2HB      LYS  57   3.586   7.131   2.394
  489    HB3  LYS  57           3HB      LYS  57   4.213   5.683   1.618
  490    HG2  LYS  57           2HG      LYS  57   4.374   6.674  -0.425
  491    HG3  LYS  57           3HG      LYS  57   3.037   7.785  -0.115
  492    HD2  LYS  57           2HD      LYS  57   4.987   9.116  -0.139
  493    HD3  LYS  57           3HD      LYS  57   4.558   8.926   1.563
  494    HE2  LYS  57           2HE      LYS  57   6.206   7.096   1.736
  495    HE3  LYS  57           3HE      LYS  57   6.664   7.376   0.057
  496    HZ1  LYS  57           3HZ      LYS  57   7.206   9.706   0.754
  497    HZ2  LYS  57           1HZ      LYS  57   8.222   8.512   1.390
  498    HZ3  LYS  57           2HZ      LYS  57   7.023   9.206   2.360
  499    H    TYR  58           HN       TYR  58   2.522   3.672   2.483
  500    HA   TYR  58           HA       TYR  58   1.220   4.393   5.023
  501    HB2  TYR  58           2HB      TYR  58   0.896   1.867   3.407
  502    HB3  TYR  58           3HB      TYR  58   0.484   1.953   5.116
  503    HD1  TYR  58           1HD      TYR  58  -1.382   3.383   5.871
  504    HD2  TYR  58           2HD      TYR  58  -0.505   2.865   1.740
  505    HE1  TYR  58           1HE      TYR  58  -3.605   4.262   5.296
  506    HE2  TYR  58           2HE      TYR  58  -2.726   3.744   1.153
  507    HH   TYR  58           HH       TYR  58  -5.196   3.848   2.948
  508    H    ARG  59           HN       ARG  59   2.301   3.859   6.835
  509    HA   ARG  59           HA       ARG  59   4.856   2.448   6.498
  510    HB2  ARG  59           2HB      ARG  59   5.218   4.624   7.376
  511    HB3  ARG  59           3HB      ARG  59   3.900   4.458   8.528
  512    HG2  ARG  59           2HG      ARG  59   5.133   3.007   9.899
  513    HG3  ARG  59           3HG      ARG  59   6.336   2.712   8.641
  514    HD2  ARG  59           2HD      ARG  59   7.279   4.188  10.286
  515    HD3  ARG  59           3HD      ARG  59   7.008   5.094   8.797
  516    HE   ARG  59           HE       ARG  59   4.750   5.459  10.340
  517   HH11  ARG  59          2HH1      ARG  59   8.159   6.112  10.616
  518   HH12  ARG  59          1HH1      ARG  59   7.943   7.506  11.622
  519   HH21  ARG  59          2HH2      ARG  59   4.454   7.293  11.665
  520   HH22  ARG  59          1HH2      ARG  59   5.835   8.176  12.219
  521    H    VAL  60           HN       VAL  60   5.171   0.522   7.412
  522    HA   VAL  60           HA       VAL  60   3.358  -0.332   9.568
  523    HB   VAL  60           HB       VAL  60   4.187  -1.964   7.166
  524   HG11  VAL  60          1HG1      VAL  60   3.894  -3.827   8.338
  525   HG12  VAL  60          2HG1      VAL  60   3.724  -2.852   9.799
  526   HG13  VAL  60          3HG1      VAL  60   2.298  -3.288   8.857
  527   HG21  VAL  60          3HG2      VAL  60   2.320  -1.007   6.356
  528   HG22  VAL  60          1HG2      VAL  60   1.486  -2.166   7.391
  529   HG23  VAL  60          2HG2      VAL  60   1.757  -0.517   7.954
  530    H    GLY  61           HN       GLY  61   5.043   0.154  11.052
  531    HA2  GLY  61           1HA      GLY  61   6.804  -0.421  12.407
  532    HA3  GLY  61           2HA      GLY  61   6.698  -2.026  11.700
  533    H    ASP  62           HN       ASP  62   7.975  -2.540   9.891
  534    HA   ASP  62           HA       ASP  62  10.092  -0.592   9.264
  535    HB2  ASP  62           2HB      ASP  62  10.601  -3.556   9.464
  536    HB3  ASP  62           3HB      ASP  62  11.780  -2.249   9.393
  537    H    TYR  63           HN       TYR  63   7.789  -0.921   7.737
  538    HA   TYR  63           HA       TYR  63   8.966  -1.810   5.232
  539    HB2  TYR  63           2HB      TYR  63   6.395  -2.960   6.328
  540    HB3  TYR  63           3HB      TYR  63   6.899  -3.111   4.648
  541    HD1  TYR  63           1HD      TYR  63   8.014  -3.877   8.119
  542    HD2  TYR  63           2HD      TYR  63   8.250  -4.894   3.994
  543    HE1  TYR  63           1HE      TYR  63   9.306  -5.889   8.695
  544    HE2  TYR  63           2HE      TYR  63   9.542  -6.909   4.559
  545    HH   TYR  63           HH       TYR  63  10.736  -7.925   6.217
  546    H    ARG  64           HN       ARG  64   8.393  -0.533   3.574
  547    HA   ARG  64           HA       ARG  64   6.343   1.505   4.091
  548    HB2  ARG  64           2HB      ARG  64   8.845   1.443   2.468
  549    HB3  ARG  64           3HB      ARG  64   7.535   2.489   1.937
  550    HG2  ARG  64           2HG      ARG  64   8.680   2.564   4.715
  551    HG3  ARG  64           3HG      ARG  64   9.270   3.569   3.390
  552    HD2  ARG  64           2HD      ARG  64   7.069   4.568   3.140
  553    HD3  ARG  64           3HD      ARG  64   6.431   3.521   4.407
  554    HE   ARG  64           HE       ARG  64   7.381   4.893   5.985
  555   HH11  ARG  64          2HH1      ARG  64   8.643   5.683   2.838
  556   HH12  ARG  64          1HH1      ARG  64   9.439   7.125   3.375
  557   HH21  ARG  64          2HH2      ARG  64   8.425   6.790   6.704
  558   HH22  ARG  64          1HH2      ARG  64   9.315   7.753   5.575
  559    H    LEU  65           HN       LEU  65   4.724   1.944   2.599
  560    HA   LEU  65           HA       LEU  65   4.489   0.152   0.292
  561    HB2  LEU  65           2HB      LEU  65   2.122   0.704   2.044
  562    HB3  LEU  65           3HB      LEU  65   2.317  -0.540   0.811
  563    HG   LEU  65           HG       LEU  65   3.905  -0.572   3.362
  564   HD11  LEU  65          1HD1      LEU  65   1.417  -2.184   3.008
  565   HD12  LEU  65          2HD1      LEU  65   1.319  -0.535   3.625
  566   HD13  LEU  65          3HD1      LEU  65   2.271  -1.744   4.487
  567   HD21  LEU  65          3HD2      LEU  65   4.864  -2.289   2.327
  568   HD22  LEU  65          1HD2      LEU  65   3.706  -2.213   0.998
  569   HD23  LEU  65          2HD2      LEU  65   3.323  -3.139   2.449
  570    H    ILE  66           HN       ILE  66   4.018   1.249  -1.489
  571    HA   ILE  66           HA       ILE  66   3.014   3.989  -1.230
  572    HB   ILE  66           HB       ILE  66   3.988   2.751  -3.788
  573   HG12  ILE  66          2HG1      ILE  66   5.693   2.412  -1.989
  574   HG13  ILE  66          3HG1      ILE  66   6.238   3.461  -3.294
  575   HG21  ILE  66          1HG2      ILE  66   3.152   4.780  -4.372
  576   HG22  ILE  66          2HG2      ILE  66   3.409   5.471  -2.771
  577   HG23  ILE  66          3HG2      ILE  66   4.766   5.297  -3.884
  578   HD11  ILE  66          3HD1      ILE  66   5.231   5.285  -1.582
  579   HD12  ILE  66          1HD1      ILE  66   5.788   4.047  -0.456
  580   HD13  ILE  66          2HD1      ILE  66   6.916   4.766  -1.606
  581    H    CYS  67           HN       CYS  67   0.831   3.890  -1.091
  582    HA   CYS  67           HA       CYS  67  -0.614   2.310  -3.103
  583    HB2  CYS  67           2HB      CYS  67  -1.410   3.391  -0.407
  584    HB3  CYS  67           3HB      CYS  67  -2.608   2.833  -1.568
  585    HG   CYS  67           HG       CYS  67  -0.104   0.685  -0.884
  586    H    HIS  68           HN       HIS  68  -2.648   3.302  -3.939
  587    HA   HIS  68           HA       HIS  68  -2.390   6.219  -4.247
  588    HB2  HIS  68           2HB      HIS  68  -1.571   5.008  -6.266
  589    HB3  HIS  68           3HB      HIS  68  -3.168   4.287  -6.441
  590    HD2  HIS  68           2HD      HIS  68  -2.557   8.118  -5.749
  591    HE1  HIS  68           1HE      HIS  68  -4.446   7.652  -9.519
  592    HE2  HIS  68           2HE      HIS  68  -3.551   9.291  -7.829
  593    H    ILE  69           HN       ILE  69  -4.106   7.134  -3.347
  594    HA   ILE  69           HA       ILE  69  -6.594   5.699  -3.045
  595    HB   ILE  69           HB       ILE  69  -5.885   8.538  -2.294
  596   HG12  ILE  69          2HG1      ILE  69  -6.083   6.051  -0.582
  597   HG13  ILE  69          3HG1      ILE  69  -4.577   6.796  -1.108
  598   HG21  ILE  69          1HG2      ILE  69  -7.926   8.759  -1.262
  599   HG22  ILE  69          2HG2      ILE  69  -8.365   7.797  -2.672
  600   HG23  ILE  69          3HG2      ILE  69  -8.156   7.018  -1.104
  601   HD11  ILE  69          3HD1      ILE  69  -4.926   7.505   1.102
  602   HD12  ILE  69          1HD1      ILE  69  -5.351   8.882   0.084
  603   HD13  ILE  69          2HD1      ILE  69  -6.621   7.886   0.796
  604    H    GLN  70           HN       GLN  70  -8.086   5.632  -4.579
  605    HA   GLN  70           HA       GLN  70  -8.181   7.769  -6.582
  606    HB2  GLN  70           2HB      GLN  70  -9.173   4.932  -6.541
  607    HB3  GLN  70           3HB      GLN  70  -9.768   6.085  -7.728
  608    HG2  GLN  70           2HG      GLN  70  -7.613   6.365  -8.669
  609    HG3  GLN  70           3HG      GLN  70  -6.850   5.494  -7.341
  610   HE21  GLN  70          1HE2      GLN  70  -6.001   4.452  -9.427
  611   HE22  GLN  70          2HE2      GLN  70  -6.854   3.047  -9.959
  612    H    ASP  71           HN       ASP  71  -9.334   9.368  -5.552
  613    HA   ASP  71           HA       ASP  71 -11.553   9.111  -3.931
  614    HB2  ASP  71           2HB      ASP  71 -10.568  11.272  -5.748
  615    HB3  ASP  71           3HB      ASP  71 -12.163  11.437  -5.019
  616    H    ARG  72           HN       ARG  72 -11.388   9.201  -7.456
  617    HA   ARG  72           HA       ARG  72 -13.906   9.539  -8.297
  618    HB2  ARG  72           2HB      ARG  72 -11.793   7.614  -9.150
  619    HB3  ARG  72           3HB      ARG  72 -13.396   7.452  -9.855
  620    HG2  ARG  72           2HG      ARG  72 -13.168   9.982 -10.350
  621    HG3  ARG  72           3HG      ARG  72 -11.444   9.697 -10.101
  622    HD2  ARG  72           2HD      ARG  72 -11.323   8.191 -11.898
  623    HD3  ARG  72           3HD      ARG  72 -13.075   8.000 -11.963
  624    HE   ARG  72           HE       ARG  72 -12.360  10.687 -12.474
  625   HH11  ARG  72          2HH1      ARG  72 -12.338   7.525 -13.930
  626   HH12  ARG  72          1HH1      ARG  72 -12.432   8.128 -15.552
  627   HH21  ARG  72          2HH2      ARG  72 -12.484  11.493 -14.604
  628   HH22  ARG  72          1HH2      ARG  72 -12.514  10.385 -15.934
  629    H    GLU  73           HN       GLU  73 -12.724   6.345  -7.222
  630    HA   GLU  73           HA       GLU  73 -15.495   5.695  -6.459
  631    HB2  GLU  73           2HB      GLU  73 -13.442   4.056  -7.897
  632    HB3  GLU  73           3HB      GLU  73 -14.640   3.255  -6.890
  633    HG2  GLU  73           2HG      GLU  73 -15.522   5.230  -8.942
  634    HG3  GLU  73           3HG      GLU  73 -15.074   3.596  -9.430
  635    H    ALA  74           HN       ALA  74 -13.282   6.843  -4.881
  636    HA   ALA  74           HA       ALA  74 -12.060   6.469  -2.961
  637    HB1  ALA  74           1HB      ALA  74 -13.564   5.501  -1.153
  638    HB2  ALA  74           2HB      ALA  74 -14.150   6.937  -1.994
  639    HB3  ALA  74           3HB      ALA  74 -14.792   5.348  -2.410
  640    H    THR  75           HN       THR  75 -11.050   4.700  -4.642
  641    HA   THR  75           HA       THR  75 -10.909   2.200  -3.087
  642    HB   THR  75           HB       THR  75 -10.889   2.551  -6.082
  643    HG1  THR  75           1HG      THR  75 -12.931   2.178  -5.353
  644   HG21  THR  75          3HG2      THR  75  -9.184   1.021  -5.939
  645   HG22  THR  75          1HG2      THR  75 -10.573  -0.064  -5.894
  646   HG23  THR  75          2HG2      THR  75  -9.747   0.373  -4.398
  647    H    VAL  76           HN       VAL  76  -8.940   1.613  -2.423
  648    HA   VAL  76           HA       VAL  76  -6.655   3.218  -3.295
  649    HB   VAL  76           HB       VAL  76  -6.785   1.238  -1.019
  650   HG11  VAL  76          1HG1      VAL  76  -4.874   3.396  -0.797
  651   HG12  VAL  76          2HG1      VAL  76  -4.624   1.653  -0.677
  652   HG13  VAL  76          3HG1      VAL  76  -4.605   2.442  -2.255
  653   HG21  VAL  76          3HG2      VAL  76  -8.206   3.554  -1.134
  654   HG22  VAL  76          1HG2      VAL  76  -7.624   2.806   0.353
  655   HG23  VAL  76          2HG2      VAL  76  -6.700   4.106  -0.401
  656    H    LEU  77           HN       LEU  77  -4.851   2.374  -4.244
  657    HA   LEU  77           HA       LEU  77  -4.806  -0.517  -4.769
  658    HB2  LEU  77           2HB      LEU  77  -5.643   0.328  -6.787
  659    HB3  LEU  77           3HB      LEU  77  -4.576   1.730  -6.741
  660    HG   LEU  77           HG       LEU  77  -2.714  -0.146  -6.966
  661   HD11  LEU  77          1HD1      LEU  77  -5.245  -1.465  -7.737
  662   HD12  LEU  77          2HD1      LEU  77  -3.753  -2.152  -7.096
  663   HD13  LEU  77          3HD1      LEU  77  -3.859  -1.711  -8.800
  664   HD21  LEU  77          3HD2      LEU  77  -2.734   0.246  -9.372
  665   HD22  LEU  77          1HD2      LEU  77  -3.067   1.735  -8.487
  666   HD23  LEU  77          2HD2      LEU  77  -4.385   0.861  -9.268
  667    H    VAL  78           HN       VAL  78  -2.914  -1.429  -4.312
  668    HA   VAL  78           HA       VAL  78  -0.712   0.179  -3.412
  669    HB   VAL  78           HB       VAL  78  -0.828  -2.812  -3.824
  670   HG11  VAL  78          1HG1      VAL  78   1.386  -1.283  -3.430
  671   HG12  VAL  78          2HG1      VAL  78   0.934  -1.681  -1.771
  672   HG13  VAL  78          3HG1      VAL  78   1.229  -2.970  -2.939
  673   HG21  VAL  78          3HG2      VAL  78  -0.937  -1.857  -1.087
  674   HG22  VAL  78          1HG2      VAL  78  -2.306  -1.292  -2.045
  675   HG23  VAL  78          2HG2      VAL  78  -1.971  -3.019  -1.919
  676    H    LEU  79           HN       LEU  79   0.860   0.971  -4.632
  677    HA   LEU  79           HA       LEU  79   1.178   0.038  -7.368
  678    HB2  LEU  79           2HB      LEU  79   2.154   2.400  -5.815
  679    HB3  LEU  79           3HB      LEU  79   2.919   1.965  -7.342
  680    HG   LEU  79           HG       LEU  79  -0.029   2.525  -7.077
  681   HD11  LEU  79          1HD1      LEU  79   2.271   4.364  -7.286
  682   HD12  LEU  79          2HD1      LEU  79   0.663   4.624  -6.612
  683   HD13  LEU  79          3HD1      LEU  79   0.906   4.682  -8.357
  684   HD21  LEU  79          3HD2      LEU  79  -0.110   2.468  -9.378
  685   HD22  LEU  79          1HD2      LEU  79   1.072   1.203  -9.039
  686   HD23  LEU  79          2HD2      LEU  79   1.613   2.801  -9.556
  687    H    ARG  80           HN       ARG  80   3.357   0.709  -4.621
  688    HA   ARG  80           HA       ARG  80   5.024  -1.544  -5.513
  689    HB2  ARG  80           2HB      ARG  80   5.906   0.848  -6.044
  690    HB3  ARG  80           3HB      ARG  80   6.257   0.919  -4.322
  691    HG2  ARG  80           2HG      ARG  80   8.251   0.223  -5.323
  692    HG3  ARG  80           3HG      ARG  80   7.543  -1.248  -4.653
  693    HD2  ARG  80           2HD      ARG  80   6.873  -2.020  -6.759
  694    HD3  ARG  80           3HD      ARG  80   7.052  -0.428  -7.496
  695    HE   ARG  80           HE       ARG  80   9.118  -2.392  -7.070
  696   HH11  ARG  80          2HH1      ARG  80   8.403   0.971  -7.616
  697   HH12  ARG  80          1HH1      ARG  80   9.968   1.332  -8.267
  698   HH21  ARG  80          2HH2      ARG  80  11.181  -1.929  -7.926
  699   HH22  ARG  80          1HH2      ARG  80  11.547  -0.318  -8.443
  700    H    VAL  81           HN       VAL  81   6.170  -2.637  -3.868
  701    HA   VAL  81           HA       VAL  81   5.472  -1.931  -1.106
  702    HB   VAL  81           HB       VAL  81   3.878  -3.664  -1.891
  703   HG11  VAL  81          1HG1      VAL  81   4.497  -5.519  -2.969
  704   HG12  VAL  81          2HG1      VAL  81   6.065  -4.734  -3.177
  705   HG13  VAL  81          3HG1      VAL  81   5.804  -5.845  -1.831
  706   HG21  VAL  81          3HG2      VAL  81   5.059  -5.388  -0.030
  707   HG22  VAL  81          1HG2      VAL  81   5.580  -3.766   0.427
  708   HG23  VAL  81          2HG2      VAL  81   3.861  -4.133   0.284
  709    H    GLY  82           HN       GLY  82   7.255  -1.809   0.079
  710    HA2  GLY  82           1HA      GLY  82   9.315  -3.829  -0.120
  711    HA3  GLY  82           2HA      GLY  82   9.820  -2.234  -0.661
  712    H    HIS  83           HN       HIS  83  10.948  -3.653   1.522
  713    HA   HIS  83           HA       HIS  83  10.005  -3.039   4.039
  714    HB2  HIS  83           2HB      HIS  83  12.033  -4.441   3.435
  715    HB3  HIS  83           3HB      HIS  83  12.927  -2.931   3.288
  716    HD2  HIS  83           2HD      HIS  83  11.530  -5.286   6.035
  717    HE1  HIS  83           1HE      HIS  83  13.593  -2.108   7.944
  718    HE2  HIS  83           2HE      HIS  83  12.537  -4.376   8.237
  719    H    ALA  84           HN       ALA  84  10.796  -1.408   5.587
  720    HA   ALA  84           HA       ALA  84  10.203   1.174   4.847
  721    HB1  ALA  84           1HB      ALA  84  12.170   0.596   7.039
  722    HB2  ALA  84           2HB      ALA  84  10.938   1.856   6.959
  723    HB3  ALA  84           3HB      ALA  84  10.464   0.173   7.188
  724    H    ARG  85           HN       ARG  85  13.296  -0.483   4.717
  725    HA   ARG  85           HA       ARG  85  14.622   1.962   3.809
  726    HB2  ARG  85           2HB      ARG  85  16.705   0.697   4.041
  727    HB3  ARG  85           3HB      ARG  85  15.767   0.651   5.528
  728    HG2  ARG  85           2HG      ARG  85  15.025  -1.589   5.046
  729    HG3  ARG  85           3HG      ARG  85  15.825  -1.548   3.474
  730    HD2  ARG  85           2HD      ARG  85  17.173  -1.386   6.167
  731    HD3  ARG  85           3HD      ARG  85  17.156  -2.785   5.095
  732    HE   ARG  85           HE       ARG  85  18.745  -1.767   3.768
  733   HH11  ARG  85          2HH1      ARG  85  17.553   0.474   6.151
  734   HH12  ARG  85          1HH1      ARG  85  18.787   1.652   5.850
  735   HH21  ARG  85          2HH2      ARG  85  20.374  -0.223   3.362
  736   HH22  ARG  85          1HH2      ARG  85  20.391   1.255   4.263
  737    H    ASP  86           HN       ASP  86  13.800  -1.295   2.739
  738    HA   ASP  86           HA       ASP  86  15.170  -1.361   0.322
  739    HB2  ASP  86           2HB      ASP  86  13.953  -3.281   1.352
  740    HB3  ASP  86           3HB      ASP  86  12.435  -2.538   0.855
  741    H    VAL  87           HN       VAL  87  11.739  -0.487   0.785
  742    HA   VAL  87           HA       VAL  87  10.941   0.259  -1.648
  743    HB   VAL  87           HB       VAL  87   9.603   0.581   0.416
  744   HG11  VAL  87          1HG1      VAL  87  11.026   1.688   1.907
  745   HG12  VAL  87          2HG1      VAL  87  11.429   2.942   0.732
  746   HG13  VAL  87          3HG1      VAL  87   9.827   2.904   1.468
  747   HG21  VAL  87          3HG2      VAL  87   8.482   2.706  -0.351
  748   HG22  VAL  87          1HG2      VAL  87   9.772   2.859  -1.544
  749   HG23  VAL  87          2HG2      VAL  87   8.691   1.466  -1.588
  750    H    TYR  88           HN       TYR  88  13.319   1.964   0.268
  751    HA   TYR  88           HA       TYR  88  13.777   3.772  -2.013
  752    HB2  TYR  88           2HB      TYR  88  12.818   4.702   0.279
  753    HB3  TYR  88           3HB      TYR  88  14.513   4.639   0.747
  754    HD1  TYR  88           1HD      TYR  88  16.197   5.925  -0.629
  755    HD2  TYR  88           2HD      TYR  88  11.998   6.445  -1.080
  756    HE1  TYR  88           1HE      TYR  88  16.590   8.080  -1.747
  757    HE2  TYR  88           2HE      TYR  88  12.380   8.601  -2.200
  758    HH   TYR  88           HH       TYR  88  13.902   9.992  -3.046
  759    H    ARG  89           HN       ARG  89  15.076   1.440  -2.052
  760    HA   ARG  89           HA       ARG  89  17.551   1.434  -0.648
  761    HB2  ARG  89           2HB      ARG  89  18.137  -0.450  -2.015
  762    HB3  ARG  89           3HB      ARG  89  16.439  -0.599  -1.581
  763    HG2  ARG  89           2HG      ARG  89  15.719  -0.274  -3.716
  764    HG3  ARG  89           3HG      ARG  89  17.101   0.735  -4.146
  765    HD2  ARG  89           2HD      ARG  89  17.631  -1.154  -5.311
  766    HD3  ARG  89           3HD      ARG  89  18.414  -1.526  -3.776
  767    HE   ARG  89           HE       ARG  89  16.899  -3.214  -3.446
  768   HH11  ARG  89          2HH1      ARG  89  15.782  -1.147  -6.015
  769   HH12  ARG  89          1HH1      ARG  89  14.484  -2.199  -6.473
  770   HH21  ARG  89          2HH2      ARG  89  15.193  -4.608  -4.040
  771   HH22  ARG  89          1HH2      ARG  89  14.149  -4.167  -5.348
  Start of MODEL   13
    1    H1   MET   1           HN       MET   1 -20.496   3.819   2.666
    2    HA   MET   1           HA       MET   1 -18.108   5.076   3.517
    3    HB2  MET   1           2HB      MET   1 -20.239   3.455   4.852
    4    HB3  MET   1           3HB      MET   1 -18.749   3.792   5.724
    5    HG2  MET   1           2HG      MET   1 -20.643   5.828   4.575
    6    HG3  MET   1           3HG      MET   1 -20.451   5.415   6.277
    7    HE1  MET   1           3HE      MET   1 -18.379   6.754   7.846
    8    HE2  MET   1           1HE      MET   1 -18.634   8.379   7.209
    9    HE3  MET   1           2HE      MET   1 -19.997   7.270   7.365
   10    H    GLY   2           HN       GLY   2 -16.273   4.166   2.683
   11    HA2  GLY   2           1HA      GLY   2 -14.651   2.484   3.745
   12    HA3  GLY   2           2HA      GLY   2 -15.831   1.299   3.205
   13    H    TYR   3           HN       TYR   3 -12.930   1.978   2.497
   14    HA   TYR   3           HA       TYR   3 -13.245   2.403  -0.387
   15    HB2  TYR   3           2HB      TYR   3 -10.852   2.548   1.443
   16    HB3  TYR   3           3HB      TYR   3 -10.706   2.585  -0.311
   17    HD1  TYR   3           2HD      TYR   3 -12.633   4.297   2.401
   18    HD2  TYR   3           1HD      TYR   3 -10.604   4.654  -1.322
   19    HE1  TYR   3           2HE      TYR   3 -13.025   6.725   2.426
   20    HE2  TYR   3           1HE      TYR   3 -10.989   7.083  -1.307
   21    HH   TYR   3           HH       TYR   3 -12.646   8.677  -0.258
   22    H    ARG   4           HN       ARG   4 -12.098   1.032  -1.882
   23    HA   ARG   4           HA       ARG   4 -12.179  -1.754  -1.046
   24    HB2  ARG   4           2HB      ARG   4 -13.321  -1.241  -3.100
   25    HB3  ARG   4           3HB      ARG   4 -11.894  -0.447  -3.753
   26    HG2  ARG   4           2HG      ARG   4 -10.801  -2.446  -4.151
   27    HG3  ARG   4           3HG      ARG   4 -11.791  -3.333  -2.990
   28    HD2  ARG   4           2HD      ARG   4 -12.843  -2.169  -5.562
   29    HD3  ARG   4           3HD      ARG   4 -12.290  -3.834  -5.389
   30    HE   ARG   4           HE       ARG   4 -14.790  -2.758  -4.529
   31   HH11  ARG   4          2HH1      ARG   4 -12.375  -5.165  -3.825
   32   HH12  ARG   4          1HH1      ARG   4 -13.482  -6.229  -3.021
   33   HH21  ARG   4          2HH2      ARG   4 -16.257  -4.150  -3.473
   34   HH22  ARG   4          1HH2      ARG   4 -15.690  -5.651  -2.823
   35    H    ILE   5           HN       ILE   5 -10.462  -3.217  -1.359
   36    HA   ILE   5           HA       ILE   5  -7.818  -1.939  -1.301
   37    HB   ILE   5           HB       ILE   5  -8.450  -4.766  -0.471
   38   HG12  ILE   5          2HG1      ILE   5  -9.810  -3.297   0.902
   39   HG13  ILE   5          3HG1      ILE   5  -8.463  -3.903   1.860
   40   HG21  ILE   5          1HG2      ILE   5  -6.289  -4.941   0.043
   41   HG22  ILE   5          2HG2      ILE   5  -6.052  -3.462  -0.887
   42   HG23  ILE   5          3HG2      ILE   5  -6.277  -3.378   0.860
   43   HD11  ILE   5          3HD1      ILE   5  -8.951  -1.511   2.221
   44   HD12  ILE   5          1HD1      ILE   5  -7.309  -1.814   1.654
   45   HD13  ILE   5          2HD1      ILE   5  -8.530  -1.204   0.536
   46    H    GLU   6           HN       GLU   6  -6.775  -1.964  -3.176
   47    HA   GLU   6           HA       GLU   6  -6.952  -4.388  -4.842
   48    HB2  GLU   6           2HB      GLU   6  -6.868  -1.495  -5.690
   49    HB3  GLU   6           3HB      GLU   6  -6.513  -2.818  -6.793
   50    HG2  GLU   6           2HG      GLU   6  -8.835  -3.711  -5.972
   51    HG3  GLU   6           3HG      GLU   6  -9.097  -2.018  -5.558
   52    H    PHE   7           HN       PHE   7  -5.063  -4.871  -6.120
   53    HA   PHE   7           HA       PHE   7  -2.588  -3.577  -5.225
   54    HB2  PHE   7           2HB      PHE   7  -3.285  -6.489  -5.015
   55    HB3  PHE   7           3HB      PHE   7  -1.608  -5.992  -5.220
   56    HD1  PHE   7           1HD      PHE   7  -4.579  -5.251  -3.095
   57    HD2  PHE   7           2HD      PHE   7  -0.343  -5.578  -3.347
   58    HE1  PHE   7           1HE      PHE   7  -4.408  -4.850  -0.673
   59    HE2  PHE   7           2HE      PHE   7  -0.164  -5.178  -0.925
   60    HZ   PHE   7           HZ       PHE   7  -2.198  -4.814   0.415
   61    H    ASP   8           HN       ASP   8  -1.024  -3.401  -6.759
   62    HA   ASP   8           HA       ASP   8  -1.791  -3.818  -9.482
   63    HB2  ASP   8           2HB      ASP   8   0.505  -2.589  -8.058
   64    HB3  ASP   8           3HB      ASP   8   0.809  -3.161  -9.697
   65    HA   PRO   9           HA       PRO   9  -0.003  -7.711 -10.415
   66    HB2  PRO   9           2HB      PRO   9   1.159  -7.285 -12.832
   67    HB3  PRO   9           3HB      PRO   9  -0.593  -7.363 -12.608
   68    HG2  PRO   9           2HG      PRO   9   1.182  -4.964 -12.843
   69    HG3  PRO   9           3HG      PRO   9  -0.402  -5.261 -13.583
   70    HD2  PRO   9           2HD      PRO   9  -0.091  -3.727 -11.374
   71    HD3  PRO   9           3HD      PRO   9  -1.545  -4.704 -11.661
   72    H    ARG  10           HN       ARG  10   2.011  -4.969 -10.055
   73    HA   ARG  10           HA       ARG  10   4.470  -6.542 -10.225
   74    HB2  ARG  10           2HB      ARG  10   3.845  -3.618 -10.136
   75    HB3  ARG  10           3HB      ARG  10   5.436  -4.168  -9.629
   76    HG2  ARG  10           2HG      ARG  10   4.247  -4.912 -12.284
   77    HG3  ARG  10           3HG      ARG  10   5.193  -3.442 -12.039
   78    HD2  ARG  10           2HD      ARG  10   7.142  -4.630 -11.569
   79    HD3  ARG  10           3HD      ARG  10   6.261  -6.114 -11.208
   80    HE   ARG  10           HE       ARG  10   5.879  -5.363 -13.910
   81   HH11  ARG  10          2HH1      ARG  10   8.237  -6.736 -11.749
   82   HH12  ARG  10          1HH1      ARG  10   9.044  -7.635 -12.991
   83   HH21  ARG  10          2HH2      ARG  10   6.933  -6.542 -15.554
   84   HH22  ARG  10          1HH2      ARG  10   8.302  -7.523 -15.155
   85    H    ALA  11           HN       ALA  11   2.662  -4.546  -7.916
   86    HA   ALA  11           HA       ALA  11   4.418  -4.893  -5.738
   87    HB1  ALA  11           1HB      ALA  11   2.661  -4.012  -4.370
   88    HB2  ALA  11           2HB      ALA  11   2.656  -3.141  -5.904
   89    HB3  ALA  11           3HB      ALA  11   1.450  -4.391  -5.595
   90    H    GLU  12           HN       GLU  12   1.447  -6.618  -6.659
   91    HA   GLU  12           HA       GLU  12   1.047  -8.308  -4.593
   92    HB2  GLU  12           2HB      GLU  12   0.814  -8.682  -7.545
   93    HB3  GLU  12           3HB      GLU  12   0.600 -10.085  -6.507
   94    HG2  GLU  12           2HG      GLU  12  -1.042  -8.487  -5.228
   95    HG3  GLU  12           3HG      GLU  12  -1.083  -7.650  -6.779
   96    H    LYS  13           HN       LYS  13   3.475  -8.759  -7.142
   97    HA   LYS  13           HA       LYS  13   4.491 -11.193  -6.049
   98    HB2  LYS  13           2HB      LYS  13   5.688  -9.267  -8.050
   99    HB3  LYS  13           3HB      LYS  13   6.352 -10.850  -7.665
  100    HG2  LYS  13           2HG      LYS  13   3.532 -10.579  -8.618
  101    HG3  LYS  13           3HG      LYS  13   4.877 -10.579  -9.761
  102    HD2  LYS  13           2HD      LYS  13   5.628 -12.732  -8.613
  103    HD3  LYS  13           3HD      LYS  13   4.029 -12.754  -7.866
  104    HE2  LYS  13           2HE      LYS  13   3.811 -14.087  -9.781
  105    HE3  LYS  13           3HE      LYS  13   3.109 -12.536 -10.236
  106    HZ1  LYS  13           3HZ      LYS  13   4.448 -12.752 -12.003
  107    HZ2  LYS  13           1HZ      LYS  13   5.479 -13.855 -11.242
  108    HZ3  LYS  13           2HZ      LYS  13   5.660 -12.197 -10.962
  109    H    GLU  14           HN       GLU  14   5.648  -7.830  -6.056
  110    HA   GLU  14           HA       GLU  14   8.020  -8.182  -4.673
  111    HB2  GLU  14           2HB      GLU  14   6.096  -5.854  -4.561
  112    HB3  GLU  14           3HB      GLU  14   7.742  -5.815  -3.947
  113    HG2  GLU  14           2HG      GLU  14   7.236  -6.571  -6.787
  114    HG3  GLU  14           3HG      GLU  14   7.210  -4.876  -6.305
  115    H    LEU  15           HN       LEU  15   4.747  -8.227  -3.506
  116    HA   LEU  15           HA       LEU  15   5.520  -8.026  -0.724
  117    HB2  LEU  15           2HB      LEU  15   3.346  -7.175  -1.773
  118    HB3  LEU  15           3HB      LEU  15   2.828  -8.860  -1.760
  119    HG   LEU  15           HG       LEU  15   3.500  -8.624   0.811
  120   HD11  LEU  15          1HD1      LEU  15   2.347  -6.221   1.256
  121   HD12  LEU  15          2HD1      LEU  15   3.274  -5.875  -0.204
  122   HD13  LEU  15          3HD1      LEU  15   4.089  -6.497   1.230
  123   HD21  LEU  15          3HD2      LEU  15   0.876  -7.431   0.123
  124   HD22  LEU  15          1HD2      LEU  15   1.270  -8.752   1.223
  125   HD23  LEU  15          2HD2      LEU  15   1.230  -9.036  -0.517
  126    H    GLU  16           HN       GLU  16   3.871 -10.507  -2.692
  127    HA   GLU  16           HA       GLU  16   3.794 -12.574  -0.918
  128    HB2  GLU  16           2HB      GLU  16   3.433 -13.978  -2.708
  129    HB3  GLU  16           3HB      GLU  16   3.094 -12.418  -3.443
  130    HG2  GLU  16           2HG      GLU  16   5.258 -12.363  -4.470
  131    HG3  GLU  16           3HG      GLU  16   5.748 -13.824  -3.613
  132    H    LYS  17           HN       LYS  17   6.574 -11.470  -2.774
  133    HA   LYS  17           HA       LYS  17   8.319 -13.592  -2.230
  134    HB2  LYS  17           2HB      LYS  17   8.630 -10.747  -3.042
  135    HB3  LYS  17           3HB      LYS  17  10.056 -11.572  -2.427
  136    HG2  LYS  17           2HG      LYS  17   9.649 -13.361  -4.126
  137    HG3  LYS  17           3HG      LYS  17   8.385 -12.335  -4.808
  138    HD2  LYS  17           2HD      LYS  17  10.152 -10.529  -5.008
  139    HD3  LYS  17           3HD      LYS  17  11.339 -11.781  -4.635
  140    HE2  LYS  17           2HE      LYS  17   9.400 -11.800  -6.946
  141    HE3  LYS  17           3HE      LYS  17  11.125 -11.449  -7.045
  142    HZ1  LYS  17           3HZ      LYS  17  11.597 -13.604  -7.089
  143    HZ2  LYS  17           1HZ      LYS  17   9.945 -13.908  -7.291
  144    HZ3  LYS  17           2HZ      LYS  17  10.627 -13.936  -5.744
  145    H    LEU  18           HN       LEU  18   7.640 -10.628  -0.423
  146    HA   LEU  18           HA       LEU  18   9.608 -10.750   1.506
  147    HB2  LEU  18           2HB      LEU  18   6.733  -9.908   1.841
  148    HB3  LEU  18           3HB      LEU  18   8.033  -9.546   2.975
  149    HG   LEU  18           HG       LEU  18   8.130  -8.621   0.118
  150   HD11  LEU  18          1HD1      LEU  18   6.046  -7.908   1.576
  151   HD12  LEU  18          2HD1      LEU  18   6.888  -6.758   0.538
  152   HD13  LEU  18          3HD1      LEU  18   7.219  -6.789   2.270
  153   HD21  LEU  18          3HD2      LEU  18  10.023  -7.623   0.726
  154   HD22  LEU  18          1HD2      LEU  18   9.950  -8.564   2.216
  155   HD23  LEU  18          2HD2      LEU  18   9.277  -6.934   2.168
  156    H    ASP  19           HN       ASP  19   8.923 -11.130   3.959
  157    HA   ASP  19           HA       ASP  19   8.688 -13.943   4.254
  158    HB2  ASP  19           2HB      ASP  19   9.923 -12.293   5.779
  159    HB3  ASP  19           3HB      ASP  19   8.346 -11.942   6.481
  160    H    ARG  20           HN       ARG  20   6.902 -15.121   4.227
  161    HA   ARG  20           HA       ARG  20   4.364 -14.413   3.807
  162    HB2  ARG  20           2HB      ARG  20   5.484 -16.762   4.336
  163    HB3  ARG  20           3HB      ARG  20   4.719 -16.507   5.899
  164    HG2  ARG  20           2HG      ARG  20   3.048 -17.625   4.852
  165    HG3  ARG  20           3HG      ARG  20   2.621 -15.980   4.378
  166    HD2  ARG  20           2HD      ARG  20   4.489 -17.534   2.656
  167    HD3  ARG  20           3HD      ARG  20   2.769 -17.919   2.604
  168    HE   ARG  20           HE       ARG  20   4.051 -15.605   1.511
  169   HH11  ARG  20          2HH1      ARG  20   1.077 -16.830   2.844
  170   HH12  ARG  20          1HH1      ARG  20   0.081 -15.674   2.023
  171   HH21  ARG  20          2HH2      ARG  20   2.750 -14.078   0.425
  172   HH22  ARG  20          1HH2      ARG  20   1.034 -14.109   0.647
  173    H    GLU  21           HN       GLU  21   5.955 -14.325   6.952
  174    HA   GLU  21           HA       GLU  21   3.663 -13.708   8.483
  175    HB2  GLU  21           2HB      GLU  21   6.596 -13.186   8.973
  176    HB3  GLU  21           3HB      GLU  21   5.342 -12.854  10.159
  177    HG2  GLU  21           2HG      GLU  21   6.112 -14.925  10.806
  178    HG3  GLU  21           3HG      GLU  21   4.697 -15.329   9.836
  179    H    VAL  22           HN       VAL  22   6.239 -11.616   7.186
  180    HA   VAL  22           HA       VAL  22   5.123  -9.183   8.048
  181    HB   VAL  22           HB       VAL  22   6.963  -9.721   5.713
  182   HG11  VAL  22          1HG1      VAL  22   6.599  -7.088   7.111
  183   HG12  VAL  22          2HG1      VAL  22   7.406  -7.421   5.577
  184   HG13  VAL  22          3HG1      VAL  22   5.649  -7.534   5.693
  185   HG21  VAL  22          3HG2      VAL  22   8.723  -8.963   7.261
  186   HG22  VAL  22          1HG2      VAL  22   7.522  -8.855   8.548
  187   HG23  VAL  22          2HG2      VAL  22   7.911 -10.420   7.834
  188    H    ALA  23           HN       ALA  23   4.949 -10.824   4.895
  189    HA   ALA  23           HA       ALA  23   3.419  -8.952   3.532
  190    HB1  ALA  23           1HB      ALA  23   4.373 -11.536   3.043
  191    HB2  ALA  23           2HB      ALA  23   2.629 -11.614   2.787
  192    HB3  ALA  23           3HB      ALA  23   3.599 -10.442   1.896
  193    H    ARG  24           HN       ARG  24   2.314 -11.749   5.439
  194    HA   ARG  24           HA       ARG  24  -0.424 -11.423   5.051
  195    HB2  ARG  24           2HB      ARG  24   1.217 -12.650   7.240
  196    HB3  ARG  24           3HB      ARG  24  -0.529 -12.533   7.411
  197    HG2  ARG  24           2HG      ARG  24  -0.760 -13.764   5.263
  198    HG3  ARG  24           3HG      ARG  24   0.991 -13.991   5.262
  199    HD2  ARG  24           2HD      ARG  24   0.806 -15.133   7.445
  200    HD3  ARG  24           3HD      ARG  24  -0.947 -14.968   7.357
  201    HE   ARG  24           HE       ARG  24  -0.164 -16.240   5.032
  202   HH11  ARG  24          2HH1      ARG  24  -0.019 -16.847   8.457
  203   HH12  ARG  24          1HH1      ARG  24  -0.083 -18.570   8.287
  204   HH21  ARG  24          2HH2      ARG  24  -0.249 -18.508   4.795
  205   HH22  ARG  24          1HH2      ARG  24  -0.212 -19.513   6.203
  206    H    ARG  25           HN       ARG  25   1.711 -10.006   7.494
  207    HA   ARG  25           HA       ARG  25  -0.251  -8.743   9.040
  208    HB2  ARG  25           2HB      ARG  25   1.961  -8.916   9.913
  209    HB3  ARG  25           3HB      ARG  25   2.644  -8.069   8.532
  210    HG2  ARG  25           2HG      ARG  25   1.976  -6.007   9.290
  211    HG3  ARG  25           3HG      ARG  25   0.659  -6.671  10.258
  212    HD2  ARG  25           2HD      ARG  25   3.578  -7.083  10.878
  213    HD3  ARG  25           3HD      ARG  25   2.599  -5.794  11.577
  214    HE   ARG  25           HE       ARG  25   2.607  -8.549  12.334
  215   HH11  ARG  25          2HH1      ARG  25   0.634  -5.687  12.138
  216   HH12  ARG  25          1HH1      ARG  25  -0.434  -6.179  13.410
  217   HH21  ARG  25          2HH2      ARG  25   1.207  -9.207  14.010
  218   HH22  ARG  25          1HH2      ARG  25  -0.107  -8.180  14.475
  219    H    ILE  26           HN       ILE  26   1.598  -7.561   6.250
  220    HA   ILE  26           HA       ILE  26   0.648  -4.947   6.194
  221    HB   ILE  26           HB       ILE  26   1.574  -6.772   3.990
  222   HG12  ILE  26          2HG1      ILE  26   2.831  -4.236   5.031
  223   HG13  ILE  26          3HG1      ILE  26   3.138  -5.804   5.768
  224   HG21  ILE  26          1HG2      ILE  26   0.578  -3.945   3.788
  225   HG22  ILE  26          2HG2      ILE  26   1.687  -4.641   2.609
  226   HG23  ILE  26          3HG2      ILE  26   0.090  -5.351   2.843
  227   HD11  ILE  26          3HD1      ILE  26   4.130  -4.667   3.255
  228   HD12  ILE  26          1HD1      ILE  26   4.865  -5.841   4.346
  229   HD13  ILE  26          2HD1      ILE  26   3.649  -6.362   3.179
  230    H    LEU  27           HN       LEU  27  -0.543  -7.687   4.238
  231    HA   LEU  27           HA       LEU  27  -2.713  -6.470   3.071
  232    HB2  LEU  27           2HB      LEU  27  -2.267  -9.296   3.970
  233    HB3  LEU  27           3HB      LEU  27  -3.757  -8.813   3.162
  234    HG   LEU  27           HG       LEU  27  -1.042  -8.406   1.929
  235   HD11  LEU  27          1HD1      LEU  27  -2.881 -10.714   1.360
  236   HD12  LEU  27          2HD1      LEU  27  -1.535 -10.823   2.495
  237   HD13  LEU  27          3HD1      LEU  27  -1.228 -10.464   0.796
  238   HD21  LEU  27          3HD2      LEU  27  -2.338  -7.201   0.553
  239   HD22  LEU  27          1HD2      LEU  27  -3.827  -7.931   1.155
  240   HD23  LEU  27          2HD2      LEU  27  -2.865  -8.769  -0.062
  241    H    ARG  28           HN       ARG  28  -2.792  -8.387   6.080
  242    HA   ARG  28           HA       ARG  28  -5.436  -7.947   6.761
  243    HB2  ARG  28           2HB      ARG  28  -3.760  -9.492   7.886
  244    HB3  ARG  28           3HB      ARG  28  -3.193  -8.083   8.773
  245    HG2  ARG  28           2HG      ARG  28  -5.124  -7.918  10.015
  246    HG3  ARG  28           3HG      ARG  28  -6.092  -8.778   8.817
  247    HD2  ARG  28           2HD      ARG  28  -4.930 -10.860   9.384
  248    HD3  ARG  28           3HD      ARG  28  -3.974  -9.995  10.586
  249    HE   ARG  28           HE       ARG  28  -6.728 -10.835  10.823
  250   HH11  ARG  28          2HH1      ARG  28  -4.210  -8.757  12.030
  251   HH12  ARG  28          1HH1      ARG  28  -4.948  -8.546  13.583
  252   HH21  ARG  28          2HH2      ARG  28  -7.710 -10.566  12.864
  253   HH22  ARG  28          1HH2      ARG  28  -6.939  -9.577  14.057
  254    H    PHE  29           HN       PHE  29  -2.604  -5.939   7.417
  255    HA   PHE  29           HA       PHE  29  -3.809  -4.073   9.116
  256    HB2  PHE  29           2HB      PHE  29  -1.450  -4.023   8.972
  257    HB3  PHE  29           3HB      PHE  29  -1.478  -3.886   7.217
  258    HD1  PHE  29           1HD      PHE  29  -1.985  -2.090  10.380
  259    HD2  PHE  29           2HD      PHE  29  -1.741  -1.773   6.142
  260    HE1  PHE  29           1HE      PHE  29  -1.827   0.358  10.576
  261    HE2  PHE  29           2HE      PHE  29  -1.581   0.675   6.331
  262    HZ   PHE  29           HZ       PHE  29  -1.623   1.744   8.550
  263    H    LEU  30           HN       LEU  30  -3.785  -4.339   5.620
  264    HA   LEU  30           HA       LEU  30  -5.115  -1.777   5.288
  265    HB2  LEU  30           2HB      LEU  30  -4.125  -3.884   3.395
  266    HB3  LEU  30           3HB      LEU  30  -5.155  -2.564   2.845
  267    HG   LEU  30           HG       LEU  30  -2.664  -1.892   4.335
  268   HD11  LEU  30          1HD1      LEU  30  -1.715  -1.824   1.845
  269   HD12  LEU  30          2HD1      LEU  30  -2.787  -3.215   1.691
  270   HD13  LEU  30          3HD1      LEU  30  -1.509  -3.217   2.906
  271   HD21  LEU  30          3HD2      LEU  30  -4.667  -0.497   2.964
  272   HD22  LEU  30          1HD2      LEU  30  -3.233  -0.406   1.942
  273   HD23  LEU  30          2HD2      LEU  30  -3.159   0.149   3.615
  274    H    ARG  31           HN       ARG  31  -5.927  -5.099   5.618
  275    HA   ARG  31           HA       ARG  31  -8.574  -4.764   4.452
  276    HB2  ARG  31           2HB      ARG  31  -7.250  -7.152   5.749
  277    HB3  ARG  31           3HB      ARG  31  -8.855  -7.166   5.031
  278    HG2  ARG  31           2HG      ARG  31  -7.905  -6.645   2.854
  279    HG3  ARG  31           3HG      ARG  31  -6.291  -6.578   3.565
  280    HD2  ARG  31           2HD      ARG  31  -7.982  -9.032   3.852
  281    HD3  ARG  31           3HD      ARG  31  -7.069  -8.744   2.371
  282    HE   ARG  31           HE       ARG  31  -5.288  -8.414   4.456
  283   HH11  ARG  31          2HH1      ARG  31  -7.299 -10.959   3.191
  284   HH12  ARG  31          1HH1      ARG  31  -6.242 -12.230   3.709
  285   HH21  ARG  31          2HH2      ARG  31  -3.888 -10.079   5.143
  286   HH22  ARG  31          1HH2      ARG  31  -4.302 -11.728   4.819
  287    H    GLU  32           HN       GLU  32  -7.039  -4.506   7.485
  288    HA   GLU  32           HA       GLU  32  -9.615  -4.715   8.892
  289    HB2  GLU  32           2HB      GLU  32  -6.776  -4.938   9.887
  290    HB3  GLU  32           3HB      GLU  32  -8.157  -4.794  10.965
  291    HG2  GLU  32           2HG      GLU  32  -7.490  -7.034   9.086
  292    HG3  GLU  32           3HG      GLU  32  -7.662  -7.086  10.840
  293    H    ARG  33           HN       ARG  33  -6.610  -2.918   9.530
  294    HA   ARG  33           HA       ARG  33  -7.796  -0.753  10.788
  295    HB2  ARG  33           2HB      ARG  33  -5.280  -0.661   9.116
  296    HB3  ARG  33           3HB      ARG  33  -5.720   0.439  10.416
  297    HG2  ARG  33           2HG      ARG  33  -5.515  -2.464  11.023
  298    HG3  ARG  33           3HG      ARG  33  -4.031  -1.534  10.802
  299    HD2  ARG  33           2HD      ARG  33  -4.382  -0.269  12.673
  300    HD3  ARG  33           3HD      ARG  33  -6.137  -0.406  12.568
  301    HE   ARG  33           HE       ARG  33  -4.404  -2.060  14.073
  302   HH11  ARG  33          2HH1      ARG  33  -7.279  -2.168  12.112
  303   HH12  ARG  33          1HH1      ARG  33  -7.930  -3.560  12.913
  304   HH21  ARG  33          2HH2      ARG  33  -5.251  -3.893  15.135
  305   HH22  ARG  33          1HH2      ARG  33  -6.777  -4.539  14.633
  306    H    VAL  34           HN       VAL  34  -6.336  -0.473   7.554
  307    HA   VAL  34           HA       VAL  34  -7.606   1.866   6.810
  308    HB   VAL  34           HB       VAL  34  -6.839  -0.374   4.935
  309   HG11  VAL  34          1HG1      VAL  34  -6.871   2.583   4.388
  310   HG12  VAL  34          2HG1      VAL  34  -6.714   1.260   3.232
  311   HG13  VAL  34          3HG1      VAL  34  -8.249   1.535   4.056
  312   HG21  VAL  34          3HG2      VAL  34  -4.678   0.867   4.752
  313   HG22  VAL  34          1HG2      VAL  34  -5.186   1.845   6.129
  314   HG23  VAL  34          2HG2      VAL  34  -4.948   0.108   6.321
  315    H    ALA  35           HN       ALA  35  -8.843  -1.371   6.884
  316    HA   ALA  35           HA       ALA  35 -11.033  -0.984   5.111
  317    HB1  ALA  35           1HB      ALA  35 -11.915  -3.065   6.113
  318    HB2  ALA  35           2HB      ALA  35 -10.239  -3.211   5.584
  319    HB3  ALA  35           3HB      ALA  35 -10.610  -3.016   7.297
  320    H    THR  36           HN       THR  36 -10.728  -0.901   8.650
  321    HA   THR  36           HA       THR  36 -13.481  -0.068   8.966
  322    HB   THR  36           HB       THR  36 -12.524  -1.542  10.651
  323    HG1  THR  36           1HG      THR  36 -12.882   0.008  12.516
  324   HG21  THR  36          3HG2      THR  36 -10.335  -1.256  11.072
  325   HG22  THR  36          1HG2      THR  36 -10.869  -0.039  12.229
  326   HG23  THR  36          2HG2      THR  36 -10.372   0.445  10.607
  327    H    LEU  37           HN       LEU  37 -10.436   1.423   8.530
  328    HA   LEU  37           HA       LEU  37 -10.852   3.842   9.921
  329    HB2  LEU  37           2HB      LEU  37  -9.096   3.012   7.645
  330    HB3  LEU  37           3HB      LEU  37  -9.182   4.704   8.131
  331    HG   LEU  37           HG       LEU  37  -8.329   2.420   9.910
  332   HD11  LEU  37          1HD1      LEU  37  -6.227   2.716   9.241
  333   HD12  LEU  37          2HD1      LEU  37  -6.370   4.472   9.293
  334   HD13  LEU  37          3HD1      LEU  37  -6.898   3.586   7.862
  335   HD21  LEU  37          3HD2      LEU  37  -7.462   4.891  10.899
  336   HD22  LEU  37          1HD2      LEU  37  -8.699   3.835  11.580
  337   HD23  LEU  37          2HD2      LEU  37  -9.155   5.118  10.459
  338    H    GLU  38           HN       GLU  38 -12.641   5.013   9.584
  339    HA   GLU  38           HA       GLU  38 -14.320   5.157   7.478
  340    HB2  GLU  38           2HB      GLU  38 -13.410   7.378   9.303
  341    HB3  GLU  38           3HB      GLU  38 -14.704   7.592   8.133
  342    HG2  GLU  38           2HG      GLU  38 -15.763   7.110  10.165
  343    HG3  GLU  38           3HG      GLU  38 -15.843   5.620   9.227
  344    H    ASP  39           HN       ASP  39 -11.175   6.686   7.707
  345    HA   ASP  39           HA       ASP  39 -11.376   7.385   4.860
  346    HB2  ASP  39           2HB      ASP  39  -9.822   9.388   5.584
  347    HB3  ASP  39           3HB      ASP  39 -11.574   9.524   5.699
  348    HA   PRO  40           HA       PRO  40  -7.586   5.147   4.595
  349    HB2  PRO  40           2HB      PRO  40  -6.779   6.037   2.160
  350    HB3  PRO  40           3HB      PRO  40  -8.090   4.870   2.371
  351    HG2  PRO  40           2HG      PRO  40  -8.239   7.823   1.902
  352    HG3  PRO  40           3HG      PRO  40  -9.207   6.526   1.179
  353    HD2  PRO  40           2HD      PRO  40 -10.117   8.061   3.216
  354    HD3  PRO  40           3HD      PRO  40 -10.588   6.360   3.017
  355    H    ARG  41           HN       ARG  41  -7.734   8.624   4.261
  356    HA   ARG  41           HA       ARG  41  -4.867   8.962   4.418
  357    HB2  ARG  41           2HB      ARG  41  -7.139  10.954   4.497
  358    HB3  ARG  41           3HB      ARG  41  -5.436  11.394   4.521
  359    HG2  ARG  41           2HG      ARG  41  -5.201  10.184   2.330
  360    HG3  ARG  41           3HG      ARG  41  -6.962  10.062   2.302
  361    HD2  ARG  41           2HD      ARG  41  -5.510  12.679   2.610
  362    HD3  ARG  41           3HD      ARG  41  -5.944  12.008   1.038
  363    HE   ARG  41           HE       ARG  41  -8.197  12.120   2.763
  364   HH11  ARG  41          2HH1      ARG  41  -6.143  14.090   0.757
  365   HH12  ARG  41          1HH1      ARG  41  -7.366  15.278   0.447
  366   HH21  ARG  41          2HH2      ARG  41  -9.815  13.677   2.361
  367   HH22  ARG  41          1HH2      ARG  41  -9.454  15.042   1.361
  368    H    SER  42           HN       SER  42  -5.973   7.505   6.584
  369    HA   SER  42           HA       SER  42  -5.847   9.385   8.831
  370    HB2  SER  42           2HB      SER  42  -7.710   7.601   8.548
  371    HB3  SER  42           3HB      SER  42  -6.482   6.455   9.086
  372    HG   SER  42           HG       SER  42  -7.958   7.644  10.685
  373    H    LEU  43           HN       LEU  43  -4.489   6.260   7.803
  374    HA   LEU  43           HA       LEU  43  -2.343   6.546   9.761
  375    HB2  LEU  43           2HB      LEU  43  -3.328   4.308   8.036
  376    HB3  LEU  43           3HB      LEU  43  -1.717   4.241   8.747
  377    HG   LEU  43           HG       LEU  43  -4.173   4.648  10.430
  378   HD11  LEU  43          1HD1      LEU  43  -3.934   2.461   8.876
  379   HD12  LEU  43          2HD1      LEU  43  -4.678   2.454  10.475
  380   HD13  LEU  43          3HD1      LEU  43  -2.999   1.952  10.282
  381   HD21  LEU  43          3HD2      LEU  43  -1.970   5.160  11.406
  382   HD22  LEU  43          1HD2      LEU  43  -1.446   3.515  11.045
  383   HD23  LEU  43          2HD2      LEU  43  -2.755   3.791  12.195
  384    H    GLY  44           HN       GLY  44  -2.640   5.822   6.276
  385    HA2  GLY  44           1HA      GLY  44   0.064   6.082   5.635
  386    HA3  GLY  44           2HA      GLY  44  -1.264   6.324   4.510
  387    H    GLU  45           HN       GLU  45   0.764   7.835   3.944
  388    HA   GLU  45           HA       GLU  45  -0.061  10.503   4.826
  389    HB2  GLU  45           2HB      GLU  45   2.215  11.241   5.147
  390    HB3  GLU  45           3HB      GLU  45   1.920   9.838   6.165
  391    HG2  GLU  45           2HG      GLU  45   2.956   8.480   4.255
  392    HG3  GLU  45           3HG      GLU  45   3.550  10.030   3.662
  393    HA   PRO  46           HA       PRO  46   0.166  11.528   0.564
  394    HB2  PRO  46           2HB      PRO  46   0.752  14.175   0.708
  395    HB3  PRO  46           3HB      PRO  46  -0.837  13.519   1.120
  396    HG2  PRO  46           2HG      PRO  46   1.417  14.300   2.929
  397    HG3  PRO  46           3HG      PRO  46  -0.321  14.608   3.108
  398    HD2  PRO  46           2HD      PRO  46   0.951  12.620   4.435
  399    HD3  PRO  46           3HD      PRO  46  -0.741  12.490   3.914
  400    H    LEU  47           HN       LEU  47   1.596  12.125  -1.138
  401    HA   LEU  47           HA       LEU  47   4.432  12.270  -0.356
  402    HB2  LEU  47           2HB      LEU  47   3.421  10.084  -1.430
  403    HB3  LEU  47           3HB      LEU  47   3.622  10.998  -2.924
  404    HG   LEU  47           HG       LEU  47   5.904  10.569  -1.017
  405   HD11  LEU  47          1HD1      LEU  47   6.487   8.561  -2.005
  406   HD12  LEU  47          2HD1      LEU  47   5.448   8.828  -3.404
  407   HD13  LEU  47          3HD1      LEU  47   4.737   8.413  -1.845
  408   HD21  LEU  47          3HD2      LEU  47   6.161  12.306  -2.712
  409   HD22  LEU  47          1HD2      LEU  47   5.759  11.143  -3.975
  410   HD23  LEU  47          2HD2      LEU  47   7.236  10.944  -3.032
  411    H    ARG  48           HN       ARG  48   4.261  14.571  -0.556
  412    HA   ARG  48           HA       ARG  48   3.630  15.693  -3.150
  413    HB2  ARG  48           2HB      ARG  48   3.086  16.782  -0.914
  414    HB3  ARG  48           3HB      ARG  48   4.802  17.146  -0.782
  415    HG2  ARG  48           2HG      ARG  48   4.743  18.709  -2.454
  416    HG3  ARG  48           3HG      ARG  48   3.348  17.971  -3.243
  417    HD2  ARG  48           2HD      ARG  48   1.848  18.876  -1.684
  418    HD3  ARG  48           3HD      ARG  48   3.133  19.247  -0.536
  419    HE   ARG  48           HE       ARG  48   3.607  20.707  -2.868
  420   HH11  ARG  48          2HH1      ARG  48   1.273  20.536  -0.290
  421   HH12  ARG  48          1HH1      ARG  48   0.852  22.214  -0.384
  422   HH21  ARG  48          2HH2      ARG  48   3.061  22.918  -3.001
  423   HH22  ARG  48          1HH2      ARG  48   1.870  23.568  -1.927
  424    H    GLY  49           HN       GLY  49   5.084  16.824  -4.481
  425    HA2  GLY  49           1HA      GLY  49   7.748  17.353  -4.074
  426    HA3  GLY  49           2HA      GLY  49   7.703  15.676  -4.597
  427    HA   PRO  50           HA       PRO  50   7.607  18.742  -8.225
  428    HB2  PRO  50           2HB      PRO  50  10.141  18.349  -9.115
  429    HB3  PRO  50           3HB      PRO  50   9.720  19.599  -7.939
  430    HG2  PRO  50           2HG      PRO  50  10.900  16.886  -7.480
  431    HG3  PRO  50           3HG      PRO  50  11.333  18.436  -6.734
  432    HD2  PRO  50           2HD      PRO  50   9.779  16.602  -5.487
  433    HD3  PRO  50           3HD      PRO  50   9.581  18.349  -5.238
  434    H    GLU  51           HN       GLU  51   9.389  15.662  -7.998
  435    HA   GLU  51           HA       GLU  51   8.817  14.909 -10.691
  436    HB2  GLU  51           2HB      GLU  51   9.825  13.312  -8.332
  437    HB3  GLU  51           3HB      GLU  51   9.688  12.673  -9.964
  438    HG2  GLU  51           2HG      GLU  51  11.447  13.902 -10.748
  439    HG3  GLU  51           3HG      GLU  51  11.235  15.175  -9.547
  440    H    LEU  52           HN       LEU  52   7.627  13.731  -7.544
  441    HA   LEU  52           HA       LEU  52   5.521  12.222  -8.844
  442    HB2  LEU  52           2HB      LEU  52   6.303  12.608  -5.964
  443    HB3  LEU  52           3HB      LEU  52   4.888  11.681  -6.459
  444    HG   LEU  52           HG       LEU  52   6.683  10.370  -7.889
  445   HD11  LEU  52          1HD1      LEU  52   8.349  12.139  -6.633
  446   HD12  LEU  52          2HD1      LEU  52   8.834  10.595  -7.332
  447   HD13  LEU  52          3HD1      LEU  52   8.472  10.708  -5.609
  448   HD21  LEU  52          3HD2      LEU  52   6.268   8.701  -6.453
  449   HD22  LEU  52          1HD2      LEU  52   5.245   9.875  -5.626
  450   HD23  LEU  52          2HD2      LEU  52   6.897   9.601  -5.072
  451    H    GLY  53           HN       GLY  53   3.269  12.509  -8.368
  452    HA2  GLY  53           1HA      GLY  53   2.608  15.338  -7.873
  453    HA3  GLY  53           2HA      GLY  53   1.634  14.223  -8.820
  454    H    ARG  54           HN       ARG  54   0.458  12.555  -7.702
  455    HA   ARG  54           HA       ARG  54   0.028  13.120  -4.846
  456    HB2  ARG  54           2HB      ARG  54  -1.784  14.111  -6.216
  457    HB3  ARG  54           3HB      ARG  54  -2.134  12.517  -6.871
  458    HG2  ARG  54           2HG      ARG  54  -2.958  11.730  -4.832
  459    HG3  ARG  54           3HG      ARG  54  -2.218  13.050  -3.924
  460    HD2  ARG  54           2HD      ARG  54  -4.425  13.403  -5.948
  461    HD3  ARG  54           3HD      ARG  54  -4.686  13.258  -4.210
  462    HE   ARG  54           HE       ARG  54  -2.919  15.299  -4.409
  463   HH11  ARG  54          2HH1      ARG  54  -5.995  14.633  -5.896
  464   HH12  ARG  54          1HH1      ARG  54  -6.428  16.303  -6.054
  465   HH21  ARG  54          2HH2      ARG  54  -3.477  17.502  -4.611
  466   HH22  ARG  54          1HH2      ARG  54  -4.994  17.934  -5.324
  467    H    PHE  55           HN       PHE  55   0.698  11.377  -3.784
  468    HA   PHE  55           HA       PHE  55  -0.401   8.782  -4.477
  469    HB2  PHE  55           2HB      PHE  55   2.586   9.238  -4.313
  470    HB3  PHE  55           3HB      PHE  55   1.802   7.667  -4.442
  471    HD1  PHE  55           1HD      PHE  55   0.183   7.412  -6.500
  472    HD2  PHE  55           2HD      PHE  55   3.338  10.256  -6.229
  473    HE1  PHE  55           1HE      PHE  55   0.229   7.589  -8.954
  474    HE2  PHE  55           2HE      PHE  55   3.389  10.438  -8.682
  475    HZ   PHE  55           HZ       PHE  55   1.833   9.104 -10.048
  476    H    TRP  56           HN       TRP  56  -0.970   7.725  -2.691
  477    HA   TRP  56           HA       TRP  56  -0.086   8.775  -0.115
  478    HB2  TRP  56           2HB      TRP  56  -2.556   8.195  -0.882
  479    HB3  TRP  56           3HB      TRP  56  -2.100   6.581  -0.341
  480    HD1  TRP  56           1HD      TRP  56  -2.175   6.123   2.208
  481    HE1  TRP  56           1HE      TRP  56  -2.704   7.547   4.286
  482    HE3  TRP  56           3HE      TRP  56  -2.274  10.742   0.021
  483    HZ2  TRP  56           2HZ      TRP  56  -3.110  10.269   4.914
  484    HZ3  TRP  56           3HZ      TRP  56  -2.740  12.705   1.431
  485    HH2  TRP  56           2HH      TRP  56  -3.150  12.471   3.826
  486    H    LYS  57           HN       LYS  57   0.954   7.573   1.436
  487    HA   LYS  57           HA       LYS  57   1.776   4.849   0.690
  488    HB2  LYS  57           2HB      LYS  57   3.774   5.891   0.260
  489    HB3  LYS  57           3HB      LYS  57   3.465   7.193   1.402
  490    HG2  LYS  57           2HG      LYS  57   4.134   5.895   3.235
  491    HG3  LYS  57           3HG      LYS  57   4.039   4.393   2.312
  492    HD2  LYS  57           2HD      LYS  57   6.363   5.401   2.783
  493    HD3  LYS  57           3HD      LYS  57   6.007   4.839   1.148
  494    HE2  LYS  57           2HE      LYS  57   7.122   6.996   1.082
  495    HE3  LYS  57           3HE      LYS  57   5.469   7.139   0.487
  496    HZ1  LYS  57           3HZ      LYS  57   6.435   8.840   2.200
  497    HZ2  LYS  57           1HZ      LYS  57   5.980   7.660   3.325
  498    HZ3  LYS  57           2HZ      LYS  57   4.822   8.340   2.296
  499    H    TYR  58           HN       TYR  58   1.809   3.368   2.315
  500    HA   TYR  58           HA       TYR  58   0.868   4.303   4.939
  501    HB2  TYR  58           2HB      TYR  58   0.584   1.645   3.537
  502    HB3  TYR  58           3HB      TYR  58   0.179   1.879   5.234
  503    HD1  TYR  58           1HD      TYR  58  -1.711   3.341   5.866
  504    HD2  TYR  58           2HD      TYR  58  -0.855   2.437   1.797
  505    HE1  TYR  58           1HE      TYR  58  -3.959   4.109   5.228
  506    HE2  TYR  58           2HE      TYR  58  -3.101   3.203   1.148
  507    HH   TYR  58           HH       TYR  58  -5.053   5.032   3.095
  508    H    ARG  59           HN       ARG  59   1.831   3.574   6.833
  509    HA   ARG  59           HA       ARG  59   4.503   2.385   6.480
  510    HB2  ARG  59           2HB      ARG  59   5.197   3.563   8.478
  511    HB3  ARG  59           3HB      ARG  59   4.497   4.706   7.339
  512    HG2  ARG  59           2HG      ARG  59   2.311   4.282   8.701
  513    HG3  ARG  59           3HG      ARG  59   3.435   3.739   9.948
  514    HD2  ARG  59           2HD      ARG  59   4.660   5.979   9.424
  515    HD3  ARG  59           3HD      ARG  59   3.105   6.452   8.739
  516    HE   ARG  59           HE       ARG  59   2.246   6.594  10.862
  517   HH11  ARG  59          2HH1      ARG  59   5.298   4.922  10.957
  518   HH12  ARG  59          1HH1      ARG  59   5.395   4.927  12.687
  519   HH21  ARG  59          2HH2      ARG  59   2.362   6.606  13.140
  520   HH22  ARG  59          1HH2      ARG  59   3.724   5.884  13.927
  521    H    VAL  60           HN       VAL  60   4.652   0.354   7.138
  522    HA   VAL  60           HA       VAL  60   2.996  -0.516   9.418
  523    HB   VAL  60           HB       VAL  60   3.700  -1.981   6.889
  524   HG11  VAL  60          1HG1      VAL  60   2.415  -3.879   8.272
  525   HG12  VAL  60          2HG1      VAL  60   4.173  -3.737   8.239
  526   HG13  VAL  60          3HG1      VAL  60   3.260  -3.080   9.598
  527   HG21  VAL  60          3HG2      VAL  60   1.344  -2.326   6.707
  528   HG22  VAL  60          1HG2      VAL  60   1.072  -1.717   8.339
  529   HG23  VAL  60          2HG2      VAL  60   1.604  -0.619   7.065
  530    H    GLY  61           HN       GLY  61   4.712   0.001  10.862
  531    HA2  GLY  61           1HA      GLY  61   6.418  -0.702  12.245
  532    HA3  GLY  61           2HA      GLY  61   6.511  -2.178  11.297
  533    H    ASP  62           HN       ASP  62   8.045  -2.382   9.724
  534    HA   ASP  62           HA       ASP  62   9.844  -0.079   9.342
  535    HB2  ASP  62           2HB      ASP  62  10.695  -2.979   9.411
  536    HB3  ASP  62           3HB      ASP  62  11.742  -1.565   9.318
  537    H    TYR  63           HN       TYR  63   7.539  -1.267   7.769
  538    HA   TYR  63           HA       TYR  63   9.002  -1.601   5.234
  539    HB2  TYR  63           2HB      TYR  63   6.496  -2.996   6.175
  540    HB3  TYR  63           3HB      TYR  63   7.006  -2.979   4.491
  541    HD1  TYR  63           1HD      TYR  63   8.335  -3.815   7.881
  542    HD2  TYR  63           2HD      TYR  63   8.334  -4.709   3.722
  543    HE1  TYR  63           1HE      TYR  63   9.775  -5.763   8.306
  544    HE2  TYR  63           2HE      TYR  63   9.774  -6.660   4.135
  545    HH   TYR  63           HH       TYR  63  11.360  -7.454   5.815
  546    H    ARG  64           HN       ARG  64   8.352  -0.387   3.531
  547    HA   ARG  64           HA       ARG  64   6.196   1.542   4.046
  548    HB2  ARG  64           2HB      ARG  64   8.337   1.756   1.931
  549    HB3  ARG  64           3HB      ARG  64   7.273   3.027   2.520
  550    HG2  ARG  64           2HG      ARG  64   9.229   1.668   4.337
  551    HG3  ARG  64           3HG      ARG  64   9.706   3.020   3.308
  552    HD2  ARG  64           2HD      ARG  64   7.265   3.320   4.977
  553    HD3  ARG  64           3HD      ARG  64   8.833   3.381   5.782
  554    HE   ARG  64           HE       ARG  64   7.670   5.416   4.192
  555   HH11  ARG  64          2HH1      ARG  64  10.721   3.918   4.944
  556   HH12  ARG  64          1HH1      ARG  64  11.653   5.335   4.587
  557   HH21  ARG  64          2HH2      ARG  64   8.886   7.287   3.718
  558   HH22  ARG  64          1HH2      ARG  64  10.608   7.250   3.890
  559    H    LEU  65           HN       LEU  65   4.488   1.745   2.681
  560    HA   LEU  65           HA       LEU  65   4.436   0.006   0.306
  561    HB2  LEU  65           2HB      LEU  65   1.993   0.546   1.952
  562    HB3  LEU  65           3HB      LEU  65   2.269  -0.728   0.767
  563    HG   LEU  65           HG       LEU  65   3.588  -0.591   3.477
  564   HD11  LEU  65          1HD1      LEU  65   2.048  -2.210   4.234
  565   HD12  LEU  65          2HD1      LEU  65   1.386  -2.448   2.617
  566   HD13  LEU  65          3HD1      LEU  65   1.086  -0.939   3.478
  567   HD21  LEU  65          3HD2      LEU  65   3.409  -2.955   1.636
  568   HD22  LEU  65          1HD2      LEU  65   4.471  -2.710   3.023
  569   HD23  LEU  65          2HD2      LEU  65   4.737  -1.798   1.537
  570    H    ILE  66           HN       ILE  66   4.167   1.147  -1.484
  571    HA   ILE  66           HA       ILE  66   3.102   3.852  -1.336
  572    HB   ILE  66           HB       ILE  66   4.184   2.412  -3.758
  573   HG12  ILE  66          2HG1      ILE  66   5.975   2.443  -2.200
  574   HG13  ILE  66          3HG1      ILE  66   6.252   3.814  -3.268
  575   HG21  ILE  66          1HG2      ILE  66   4.594   4.792  -4.503
  576   HG22  ILE  66          2HG2      ILE  66   2.908   4.280  -4.438
  577   HG23  ILE  66          3HG2      ILE  66   3.571   5.294  -3.157
  578   HD11  ILE  66          3HD1      ILE  66   5.395   5.330  -1.604
  579   HD12  ILE  66          1HD1      ILE  66   4.983   3.980  -0.546
  580   HD13  ILE  66          2HD1      ILE  66   6.673   4.334  -0.908
  581    H    CYS  67           HN       CYS  67   0.918   3.804  -1.200
  582    HA   CYS  67           HA       CYS  67  -0.558   2.171  -3.145
  583    HB2  CYS  67           2HB      CYS  67  -1.470   3.494  -0.582
  584    HB3  CYS  67           3HB      CYS  67  -2.530   2.618  -1.680
  585    HG   CYS  67           HG       CYS  67   0.185   1.042  -0.376
  586    H    HIS  68           HN       HIS  68  -2.675   3.217  -3.876
  587    HA   HIS  68           HA       HIS  68  -2.306   6.091  -4.377
  588    HB2  HIS  68           2HB      HIS  68  -1.620   4.548  -6.326
  589    HB3  HIS  68           3HB      HIS  68  -3.343   4.235  -6.508
  590    HD2  HIS  68           2HD      HIS  68  -2.361   7.882  -5.666
  591    HE1  HIS  68           1HE      HIS  68  -3.342   7.710  -9.790
  592    HE2  HIS  68           2HE      HIS  68  -2.730   9.205  -7.858
  593    H    ILE  69           HN       ILE  69  -3.928   6.881  -3.155
  594    HA   ILE  69           HA       ILE  69  -6.473   5.592  -2.922
  595    HB   ILE  69           HB       ILE  69  -5.597   8.359  -2.090
  596   HG12  ILE  69          2HG1      ILE  69  -6.018   5.858  -0.441
  597   HG13  ILE  69          3HG1      ILE  69  -4.448   6.451  -0.969
  598   HG21  ILE  69          1HG2      ILE  69  -8.189   7.446  -2.406
  599   HG22  ILE  69          2HG2      ILE  69  -7.870   7.236  -0.685
  600   HG23  ILE  69          3HG2      ILE  69  -7.675   8.822  -1.431
  601   HD11  ILE  69          3HD1      ILE  69  -6.342   8.024   0.754
  602   HD12  ILE  69          1HD1      ILE  69  -5.035   7.016   1.376
  603   HD13  ILE  69          2HD1      ILE  69  -4.666   8.413   0.365
  604    H    GLN  70           HN       GLN  70  -7.931   5.581  -4.494
  605    HA   GLN  70           HA       GLN  70  -8.023   7.806  -6.393
  606    HB2  GLN  70           2HB      GLN  70  -9.295   5.067  -6.473
  607    HB3  GLN  70           3HB      GLN  70  -9.494   6.292  -7.718
  608    HG2  GLN  70           2HG      GLN  70  -7.091   6.247  -8.149
  609    HG3  GLN  70           3HG      GLN  70  -6.893   5.017  -6.902
  610   HE21  GLN  70          1HE2      GLN  70  -6.183   4.808  -9.663
  611   HE22  GLN  70          2HE2      GLN  70  -7.111   3.513 -10.332
  612    H    ASP  71           HN       ASP  71  -9.227   9.423  -5.578
  613    HA   ASP  71           HA       ASP  71 -11.412   9.146  -3.844
  614    HB2  ASP  71           2HB      ASP  71 -10.067  11.246  -4.286
  615    HB3  ASP  71           3HB      ASP  71 -10.994  11.433  -5.772
  616    H    ARG  72           HN       ARG  72 -11.227   9.296  -7.360
  617    HA   ARG  72           HA       ARG  72 -13.753   9.727  -8.181
  618    HB2  ARG  72           2HB      ARG  72 -11.805   9.076  -9.625
  619    HB3  ARG  72           3HB      ARG  72 -12.112   7.400  -9.190
  620    HG2  ARG  72           2HG      ARG  72 -14.382   7.613 -10.159
  621    HG3  ARG  72           3HG      ARG  72 -13.958   9.241 -10.692
  622    HD2  ARG  72           2HD      ARG  72 -12.423   6.765 -11.461
  623    HD3  ARG  72           3HD      ARG  72 -13.714   7.463 -12.438
  624    HE   ARG  72           HE       ARG  72 -11.914   9.503 -11.946
  625   HH11  ARG  72          2HH1      ARG  72 -11.900   6.397 -13.520
  626   HH12  ARG  72          1HH1      ARG  72 -10.675   6.837 -14.664
  627   HH21  ARG  72          2HH2      ARG  72 -10.302  10.094 -13.447
  628   HH22  ARG  72          1HH2      ARG  72  -9.767   8.940 -14.621
  629    H    GLU  73           HN       GLU  73 -12.607   6.449  -7.344
  630    HA   GLU  73           HA       GLU  73 -15.385   5.778  -6.625
  631    HB2  GLU  73           2HB      GLU  73 -13.273   4.229  -8.060
  632    HB3  GLU  73           3HB      GLU  73 -14.425   3.353  -7.060
  633    HG2  GLU  73           2HG      GLU  73 -15.255   5.274  -9.214
  634    HG3  GLU  73           3HG      GLU  73 -15.002   3.553  -9.497
  635    H    ALA  74           HN       ALA  74 -13.025   6.843  -5.035
  636    HA   ALA  74           HA       ALA  74 -11.937   6.460  -3.054
  637    HB1  ALA  74           1HB      ALA  74 -14.045   4.894  -1.838
  638    HB2  ALA  74           2HB      ALA  74 -13.491   6.526  -1.462
  639    HB3  ALA  74           3HB      ALA  74 -14.685   6.271  -2.734
  640    H    THR  75           HN       THR  75 -11.067   4.633  -4.887
  641    HA   THR  75           HA       THR  75 -10.955   2.107  -3.372
  642    HB   THR  75           HB       THR  75 -10.624   2.601  -6.333
  643    HG1  THR  75           1HG      THR  75 -12.360   0.890  -6.221
  644   HG21  THR  75          3HG2      THR  75 -10.278  -0.002  -4.841
  645   HG22  THR  75          1HG2      THR  75  -8.956   0.965  -5.496
  646   HG23  THR  75          2HG2      THR  75 -10.143   0.242  -6.583
  647    H    VAL  76           HN       VAL  76  -9.080   1.612  -2.453
  648    HA   VAL  76           HA       VAL  76  -6.707   3.169  -3.130
  649    HB   VAL  76           HB       VAL  76  -7.007   1.146  -0.911
  650   HG11  VAL  76          1HG1      VAL  76  -5.068   2.115   0.028
  651   HG12  VAL  76          2HG1      VAL  76  -4.706   1.867  -1.681
  652   HG13  VAL  76          3HG1      VAL  76  -5.116   3.478  -1.090
  653   HG21  VAL  76          3HG2      VAL  76  -7.104   4.013  -0.258
  654   HG22  VAL  76          1HG2      VAL  76  -8.523   3.377  -1.088
  655   HG23  VAL  76          2HG2      VAL  76  -7.997   2.660   0.435
  656    H    LEU  77           HN       LEU  77  -5.434   2.400  -4.679
  657    HA   LEU  77           HA       LEU  77  -5.103  -0.516  -4.917
  658    HB2  LEU  77           2HB      LEU  77  -6.039   0.398  -6.911
  659    HB3  LEU  77           3HB      LEU  77  -4.835   1.685  -6.952
  660    HG   LEU  77           HG       LEU  77  -3.882  -1.126  -7.142
  661   HD11  LEU  77          1HD1      LEU  77  -5.617  -1.318  -8.704
  662   HD12  LEU  77          2HD1      LEU  77  -4.196  -0.901  -9.661
  663   HD13  LEU  77          3HD1      LEU  77  -5.398   0.333  -9.283
  664   HD21  LEU  77          3HD2      LEU  77  -2.134  -0.167  -8.396
  665   HD22  LEU  77          1HD2      LEU  77  -2.428   0.952  -7.065
  666   HD23  LEU  77          2HD2      LEU  77  -3.043   1.319  -8.677
  667    H    VAL  78           HN       VAL  78  -3.161  -1.383  -4.555
  668    HA   VAL  78           HA       VAL  78  -0.998   0.293  -3.675
  669    HB   VAL  78           HB       VAL  78  -1.054  -2.699  -4.090
  670   HG11  VAL  78          1HG1      VAL  78   1.188  -1.384  -3.964
  671   HG12  VAL  78          2HG1      VAL  78   0.805  -1.260  -2.245
  672   HG13  VAL  78          3HG1      VAL  78   0.976  -2.845  -2.999
  673   HG21  VAL  78          3HG2      VAL  78  -1.614  -2.931  -1.811
  674   HG22  VAL  78          1HG2      VAL  78  -1.317  -1.224  -1.484
  675   HG23  VAL  78          2HG2      VAL  78  -2.715  -1.708  -2.444
  676    H    LEU  79           HN       LEU  79   0.955   0.658  -4.656
  677    HA   LEU  79           HA       LEU  79   1.097  -0.047  -7.507
  678    HB2  LEU  79           2HB      LEU  79   2.287   2.219  -5.928
  679    HB3  LEU  79           3HB      LEU  79   2.792   1.837  -7.573
  680    HG   LEU  79           HG       LEU  79   0.046   2.726  -6.694
  681   HD11  LEU  79          1HD1      LEU  79   0.503   4.760  -7.795
  682   HD12  LEU  79          2HD1      LEU  79   1.974   4.122  -8.529
  683   HD13  LEU  79          3HD1      LEU  79   1.916   4.426  -6.793
  684   HD21  LEU  79          3HD2      LEU  79  -0.416   1.312  -8.469
  685   HD22  LEU  79          1HD2      LEU  79   1.096   1.688  -9.296
  686   HD23  LEU  79          2HD2      LEU  79  -0.212   2.871  -9.269
  687    H    ARG  80           HN       ARG  80   3.222   0.418  -4.681
  688    HA   ARG  80           HA       ARG  80   4.762  -1.919  -5.497
  689    HB2  ARG  80           2HB      ARG  80   5.755   0.278  -6.451
  690    HB3  ARG  80           3HB      ARG  80   6.241   0.597  -4.791
  691    HG2  ARG  80           2HG      ARG  80   8.117  -0.395  -5.713
  692    HG3  ARG  80           3HG      ARG  80   7.322  -1.737  -4.887
  693    HD2  ARG  80           2HD      ARG  80   8.020  -2.490  -7.050
  694    HD3  ARG  80           3HD      ARG  80   6.262  -2.357  -7.050
  695    HE   ARG  80           HE       ARG  80   7.316   0.047  -8.004
  696   HH11  ARG  80          2HH1      ARG  80   7.107  -3.301  -8.937
  697   HH12  ARG  80          1HH1      ARG  80   7.143  -2.964 -10.636
  698   HH21  ARG  80          2HH2      ARG  80   7.365   0.502 -10.238
  699   HH22  ARG  80          1HH2      ARG  80   7.290  -0.801 -11.375
  700    H    VAL  81           HN       VAL  81   6.023  -2.833  -3.810
  701    HA   VAL  81           HA       VAL  81   5.617  -1.710  -1.132
  702    HB   VAL  81           HB       VAL  81   4.915  -4.520  -1.970
  703   HG11  VAL  81          1HG1      VAL  81   5.820  -5.135  -0.005
  704   HG12  VAL  81          2HG1      VAL  81   5.832  -3.485   0.622
  705   HG13  VAL  81          3HG1      VAL  81   4.350  -4.441   0.680
  706   HG21  VAL  81          3HG2      VAL  81   3.231  -2.636  -2.167
  707   HG22  VAL  81          1HG2      VAL  81   2.737  -4.027  -1.202
  708   HG23  VAL  81          2HG2      VAL  81   3.269  -2.546  -0.406
  709    H    GLY  82           HN       GLY  82   7.451  -1.676  -0.008
  710    HA2  GLY  82           1HA      GLY  82   9.377  -3.821  -0.201
  711    HA3  GLY  82           2HA      GLY  82   9.932  -2.303  -0.888
  712    H    HIS  83           HN       HIS  83  11.133  -3.629   1.310
  713    HA   HIS  83           HA       HIS  83  10.322  -2.507   3.785
  714    HB2  HIS  83           2HB      HIS  83  11.686  -4.530   3.690
  715    HB3  HIS  83           3HB      HIS  83  13.000  -3.632   2.936
  716    HD2  HIS  83           2HD      HIS  83  11.144  -3.595   6.433
  717    HE1  HIS  83           1HE      HIS  83  15.148  -2.280   6.922
  718    HE2  HIS  83           2HE      HIS  83  13.011  -2.921   8.091
  719    H    ALA  84           HN       ALA  84  10.773  -0.603   4.715
  720    HA   ALA  84           HA       ALA  84  11.407   1.677   3.488
  721    HB1  ALA  84           1HB      ALA  84  12.400   0.959   6.244
  722    HB2  ALA  84           2HB      ALA  84  12.190   2.591   5.608
  723    HB3  ALA  84           3HB      ALA  84  10.786   1.551   5.849
  724    H    ARG  85           HN       ARG  85  13.731  -0.761   4.461
  725    HA   ARG  85           HA       ARG  85  16.098   0.680   4.179
  726    HB2  ARG  85           2HB      ARG  85  16.026  -1.561   5.147
  727    HB3  ARG  85           3HB      ARG  85  15.575  -2.238   3.588
  728    HG2  ARG  85           2HG      ARG  85  17.684  -2.077   2.748
  729    HG3  ARG  85           3HG      ARG  85  18.091  -0.675   3.740
  730    HD2  ARG  85           2HD      ARG  85  17.968  -2.299   5.725
  731    HD3  ARG  85           3HD      ARG  85  18.036  -3.575   4.510
  732    HE   ARG  85           HE       ARG  85  20.272  -3.194   4.368
  733   HH11  ARG  85          2HH1      ARG  85  18.738  -0.274   5.482
  734   HH12  ARG  85          1HH1      ARG  85  20.227   0.591   5.672
  735   HH21  ARG  85          2HH2      ARG  85  22.239  -2.066   4.614
  736   HH22  ARG  85          1HH2      ARG  85  22.218  -0.429   5.177
  737    H    ASP  86           HN       ASP  86  14.696  -1.542   1.762
  738    HA   ASP  86           HA       ASP  86  16.369  -0.663  -0.338
  739    HB2  ASP  86           2HB      ASP  86  15.048  -2.855  -0.166
  740    HB3  ASP  86           3HB      ASP  86  13.661  -1.927  -0.729
  741    H    VAL  87           HN       VAL  87  12.831  -0.263  -0.129
  742    HA   VAL  87           HA       VAL  87  12.347   1.515  -2.075
  743    HB   VAL  87           HB       VAL  87  10.673   0.658  -0.404
  744   HG11  VAL  87          1HG1      VAL  87  10.315   1.722   1.646
  745   HG12  VAL  87          2HG1      VAL  87  12.069   1.545   1.556
  746   HG13  VAL  87          3HG1      VAL  87  11.319   3.104   1.209
  747   HG21  VAL  87          3HG2      VAL  87  10.048   3.511  -0.504
  748   HG22  VAL  87          1HG2      VAL  87  10.588   2.846  -2.046
  749   HG23  VAL  87          2HG2      VAL  87   9.201   2.139  -1.218
  750    H    TYR  88           HN       TYR  88  13.058   3.449  -2.673
  751    HA   TYR  88           HA       TYR  88  15.052   4.865  -1.375
  752    HB2  TYR  88           2HB      TYR  88  13.952   6.833  -2.838
  753    HB3  TYR  88           3HB      TYR  88  14.933   5.553  -3.542
  754    HD1  TYR  88           1HD      TYR  88  13.860   3.689  -4.749
  755    HD2  TYR  88           2HD      TYR  88  11.598   6.976  -3.272
  756    HE1  TYR  88           1HE      TYR  88  11.985   3.045  -6.204
  757    HE2  TYR  88           2HE      TYR  88   9.716   6.340  -4.723
  758    HH   TYR  88           HH       TYR  88   8.934   4.866  -6.184
  759    H    ARG  89           HN       ARG  89  15.011   6.988  -0.385
  760    HA   ARG  89           HA       ARG  89  13.532   7.214   1.879
  761    HB2  ARG  89           2HB      ARG  89  15.496   8.667   0.991
  762    HB3  ARG  89           3HB      ARG  89  14.227   9.699   0.346
  763    HG2  ARG  89           2HG      ARG  89  13.288   9.816   2.677
  764    HG3  ARG  89           3HG      ARG  89  14.768   9.023   3.222
  765    HD2  ARG  89           2HD      ARG  89  14.730  11.576   1.624
  766    HD3  ARG  89           3HD      ARG  89  14.770  11.529   3.386
  767    HE   ARG  89           HE       ARG  89  16.864   9.949   2.494
  768   HH11  ARG  89          2HH1      ARG  89  15.888  13.285   2.306
  769   HH12  ARG  89          1HH1      ARG  89  17.509  13.889   2.213
  770   HH21  ARG  89          2HH2      ARG  89  19.002  10.732   2.372
  771   HH22  ARG  89          1HH2      ARG  89  19.280  12.436   2.250
  Start of MODEL   14
    1    H1   MET   1           HN       MET   1 -18.365  -1.590   6.490
    2    HA   MET   1           HA       MET   1 -16.683  -1.892   4.221
    3    HB2  MET   1           2HB      MET   1 -19.553  -1.017   4.532
    4    HB3  MET   1           3HB      MET   1 -18.769  -1.165   2.965
    5    HG2  MET   1           2HG      MET   1 -19.838  -3.188   3.167
    6    HG3  MET   1           3HG      MET   1 -18.215  -3.568   3.739
    7    HE1  MET   1           3HE      MET   1 -19.061  -5.569   6.619
    8    HE2  MET   1           1HE      MET   1 -18.236  -5.335   5.078
    9    HE3  MET   1           2HE      MET   1 -17.774  -4.370   6.480
   10    H    GLY   2           HN       GLY   2 -15.243  -0.403   3.630
   11    HA2  GLY   2           1HA      GLY   2 -16.130   2.412   3.563
   12    HA3  GLY   2           2HA      GLY   2 -14.539   1.974   4.167
   13    H    TYR   3           HN       TYR   3 -12.893   1.621   2.752
   14    HA   TYR   3           HA       TYR   3 -13.470   2.244  -0.051
   15    HB2  TYR   3           2HB      TYR   3 -10.983   2.398   1.634
   16    HB3  TYR   3           3HB      TYR   3 -10.896   2.451  -0.123
   17    HD1  TYR   3           2HD      TYR   3 -13.051   4.038   2.495
   18    HD2  TYR   3           1HD      TYR   3 -10.624   4.575  -0.957
   19    HE1  TYR   3           2HE      TYR   3 -13.517   6.453   2.550
   20    HE2  TYR   3           1HE      TYR   3 -11.082   6.991  -0.911
   21    HH   TYR   3           HH       TYR   3 -12.041   8.635   1.524
   22    H    ARG   4           HN       ARG   4 -12.070   1.117  -1.690
   23    HA   ARG   4           HA       ARG   4 -12.194  -1.754  -1.184
   24    HB2  ARG   4           2HB      ARG   4 -13.245  -0.766  -3.224
   25    HB3  ARG   4           3HB      ARG   4 -11.641  -0.304  -3.777
   26    HG2  ARG   4           2HG      ARG   4 -11.010  -2.489  -4.192
   27    HG3  ARG   4           3HG      ARG   4 -12.234  -3.154  -3.108
   28    HD2  ARG   4           2HD      ARG   4 -13.042  -1.633  -5.554
   29    HD3  ARG   4           3HD      ARG   4 -12.566  -3.326  -5.677
   30    HE   ARG   4           HE       ARG   4 -14.482  -3.025  -3.633
   31   HH11  ARG   4          2HH1      ARG   4 -14.184  -2.952  -7.101
   32   HH12  ARG   4          1HH1      ARG   4 -15.819  -3.453  -7.383
   33   HH21  ARG   4          2HH2      ARG   4 -16.636  -3.685  -3.991
   34   HH22  ARG   4          1HH2      ARG   4 -17.212  -3.869  -5.613
   35    H    ILE   5           HN       ILE   5 -10.460  -3.128  -1.316
   36    HA   ILE   5           HA       ILE   5  -7.819  -1.836  -1.297
   37    HB   ILE   5           HB       ILE   5  -8.512  -4.591  -0.279
   38   HG12  ILE   5          2HG1      ILE   5  -9.738  -2.996   1.051
   39   HG13  ILE   5          3HG1      ILE   5  -8.350  -3.543   1.986
   40   HG21  ILE   5          1HG2      ILE   5  -6.338  -4.856   0.102
   41   HG22  ILE   5          2HG2      ILE   5  -6.062  -3.396  -0.845
   42   HG23  ILE   5          3HG2      ILE   5  -6.228  -3.292   0.907
   43   HD11  ILE   5          3HD1      ILE   5  -8.602  -1.188   2.277
   44   HD12  ILE   5          1HD1      ILE   5  -7.157  -1.479   1.309
   45   HD13  ILE   5          2HD1      ILE   5  -8.643  -0.927   0.534
   46    H    GLU   6           HN       GLU   6  -6.833  -1.932  -3.205
   47    HA   GLU   6           HA       GLU   6  -6.943  -4.469  -4.700
   48    HB2  GLU   6           2HB      GLU   6  -7.187  -1.644  -5.649
   49    HB3  GLU   6           3HB      GLU   6  -6.442  -2.835  -6.706
   50    HG2  GLU   6           2HG      GLU   6  -9.073  -3.455  -5.462
   51    HG3  GLU   6           3HG      GLU   6  -9.005  -2.344  -6.828
   52    H    PHE   7           HN       PHE   7  -5.053  -5.023  -5.909
   53    HA   PHE   7           HA       PHE   7  -2.613  -3.578  -5.147
   54    HB2  PHE   7           2HB      PHE   7  -3.217  -6.493  -4.764
   55    HB3  PHE   7           3HB      PHE   7  -1.559  -5.958  -5.014
   56    HD1  PHE   7           1HD      PHE   7  -4.526  -5.071  -2.932
   57    HD2  PHE   7           2HD      PHE   7  -0.299  -5.516  -3.152
   58    HE1  PHE   7           1HE      PHE   7  -4.347  -4.526  -0.539
   59    HE2  PHE   7           2HE      PHE   7  -0.113  -4.973  -0.760
   60    HZ   PHE   7           HZ       PHE   7  -2.139  -4.478   0.550
   61    H    ASP   8           HN       ASP   8  -1.391  -3.109  -6.845
   62    HA   ASP   8           HA       ASP   8  -2.063  -3.752  -9.470
   63    HB2  ASP   8           2HB      ASP   8   0.299  -2.546  -8.131
   64    HB3  ASP   8           3HB      ASP   8   0.531  -3.138  -9.774
   65    HA   PRO   9           HA       PRO   9  -0.369  -7.700 -10.350
   66    HB2  PRO   9           2HB      PRO   9   0.718  -7.355 -12.814
   67    HB3  PRO   9           3HB      PRO   9  -1.026  -7.400 -12.532
   68    HG2  PRO   9           2HG      PRO   9   0.775  -5.035 -12.887
   69    HG3  PRO   9           3HG      PRO   9  -0.836  -5.327 -13.567
   70    HD2  PRO   9           2HD      PRO   9  -0.431  -3.741 -11.410
   71    HD3  PRO   9           3HD      PRO   9  -1.908  -4.703 -11.624
   72    H    ARG  10           HN       ARG  10   1.671  -5.005 -10.018
   73    HA   ARG  10           HA       ARG  10   4.119  -6.578 -10.308
   74    HB2  ARG  10           2HB      ARG  10   3.615  -3.631  -9.904
   75    HB3  ARG  10           3HB      ARG  10   5.224  -4.339  -9.845
   76    HG2  ARG  10           2HG      ARG  10   4.727  -5.253 -12.170
   77    HG3  ARG  10           3HG      ARG  10   3.356  -4.142 -12.181
   78    HD2  ARG  10           2HD      ARG  10   5.146  -3.011 -13.241
   79    HD3  ARG  10           3HD      ARG  10   4.989  -2.304 -11.633
   80    HE   ARG  10           HE       ARG  10   6.865  -4.361 -11.482
   81   HH11  ARG  10          2HH1      ARG  10   6.493  -1.250 -13.000
   82   HH12  ARG  10          1HH1      ARG  10   8.191  -0.908 -13.013
   83   HH21  ARG  10          2HH2      ARG  10   9.103  -3.922 -11.493
   84   HH22  ARG  10          1HH2      ARG  10   9.675  -2.429 -12.156
   85    H    ALA  11           HN       ALA  11   2.470  -4.557  -7.890
   86    HA   ALA  11           HA       ALA  11   4.265  -5.019  -5.782
   87    HB1  ALA  11           1HB      ALA  11   2.915  -3.660  -4.637
   88    HB2  ALA  11           2HB      ALA  11   2.003  -3.499  -6.139
   89    HB3  ALA  11           3HB      ALA  11   1.503  -4.678  -4.926
   90    H    GLU  12           HN       GLU  12   1.184  -6.625  -6.567
   91    HA   GLU  12           HA       GLU  12   0.869  -8.373  -4.541
   92    HB2  GLU  12           2HB      GLU  12   0.409  -8.607  -7.473
   93    HB3  GLU  12           3HB      GLU  12   0.273 -10.072  -6.510
   94    HG2  GLU  12           2HG      GLU  12  -1.252  -8.556  -5.005
   95    HG3  GLU  12           3HG      GLU  12  -1.416  -7.627  -6.494
   96    H    LYS  13           HN       LYS  13   3.165  -8.750  -7.210
   97    HA   LYS  13           HA       LYS  13   4.147 -11.278  -6.315
   98    HB2  LYS  13           2HB      LYS  13   5.073  -9.261  -8.340
   99    HB3  LYS  13           3HB      LYS  13   6.078 -10.643  -7.926
  100    HG2  LYS  13           2HG      LYS  13   3.230 -11.016  -8.764
  101    HG3  LYS  13           3HG      LYS  13   4.513 -10.808  -9.958
  102    HD2  LYS  13           2HD      LYS  13   4.718 -12.853  -7.769
  103    HD3  LYS  13           3HD      LYS  13   3.877 -13.200  -9.282
  104    HE2  LYS  13           2HE      LYS  13   5.846 -12.899 -10.554
  105    HE3  LYS  13           3HE      LYS  13   6.695 -12.151  -9.202
  106    HZ1  LYS  13           3HZ      LYS  13   6.977 -14.177  -8.153
  107    HZ2  LYS  13           1HZ      LYS  13   7.197 -14.585  -9.780
  108    HZ3  LYS  13           2HZ      LYS  13   5.731 -14.931  -9.012
  109    H    GLU  14           HN       GLU  14   5.424  -7.959  -6.178
  110    HA   GLU  14           HA       GLU  14   7.822  -8.481  -4.890
  111    HB2  GLU  14           2HB      GLU  14   5.986  -6.099  -4.843
  112    HB3  GLU  14           3HB      GLU  14   7.484  -6.113  -3.923
  113    HG2  GLU  14           2HG      GLU  14   7.559  -6.794  -6.820
  114    HG3  GLU  14           3HG      GLU  14   7.395  -5.108  -6.332
  115    H    LEU  15           HN       LEU  15   4.580  -8.209  -3.574
  116    HA   LEU  15           HA       LEU  15   5.387  -8.172  -0.836
  117    HB2  LEU  15           2HB      LEU  15   3.193  -7.349  -1.793
  118    HB3  LEU  15           3HB      LEU  15   2.715  -9.042  -1.909
  119    HG   LEU  15           HG       LEU  15   3.359  -8.984   0.677
  120   HD11  LEU  15          1HD1      LEU  15   2.740  -6.149  -0.068
  121   HD12  LEU  15          2HD1      LEU  15   4.032  -6.772   0.957
  122   HD13  LEU  15          3HD1      LEU  15   2.367  -6.780   1.536
  123   HD21  LEU  15          3HD2      LEU  15   0.895  -8.570  -0.855
  124   HD22  LEU  15          1HD2      LEU  15   0.811  -8.042   0.826
  125   HD23  LEU  15          2HD2      LEU  15   1.249  -9.708   0.446
  126    H    GLU  16           HN       GLU  16   3.884 -10.691  -2.867
  127    HA   GLU  16           HA       GLU  16   3.833 -12.780  -1.110
  128    HB2  GLU  16           2HB      GLU  16   4.218 -12.606  -4.060
  129    HB3  GLU  16           3HB      GLU  16   4.482 -14.162  -3.286
  130    HG2  GLU  16           2HG      GLU  16   2.145 -13.622  -2.192
  131    HG3  GLU  16           3HG      GLU  16   1.977 -12.609  -3.625
  132    H    LYS  17           HN       LYS  17   6.614 -11.495  -2.825
  133    HA   LYS  17           HA       LYS  17   8.418 -13.585  -2.221
  134    HB2  LYS  17           2HB      LYS  17   8.648 -10.770  -3.160
  135    HB3  LYS  17           3HB      LYS  17  10.092 -11.524  -2.496
  136    HG2  LYS  17           2HG      LYS  17  10.288 -12.997  -4.221
  137    HG3  LYS  17           3HG      LYS  17   8.552 -13.032  -4.537
  138    HD2  LYS  17           2HD      LYS  17   9.476 -11.890  -6.369
  139    HD3  LYS  17           3HD      LYS  17   8.821 -10.621  -5.331
  140    HE2  LYS  17           2HE      LYS  17  11.676 -11.473  -5.060
  141    HE3  LYS  17           3HE      LYS  17  11.202 -10.359  -6.341
  142    HZ1  LYS  17           3HZ      LYS  17  11.686  -9.790  -3.645
  143    HZ2  LYS  17           1HZ      LYS  17  10.050  -9.483  -3.948
  144    HZ3  LYS  17           2HZ      LYS  17  11.240  -8.720  -4.876
  145    H    LEU  18           HN       LEU  18   7.542 -10.610  -0.538
  146    HA   LEU  18           HA       LEU  18   9.511 -10.565   1.415
  147    HB2  LEU  18           2HB      LEU  18   6.618  -9.745   1.549
  148    HB3  LEU  18           3HB      LEU  18   7.786  -9.403   2.823
  149    HG   LEU  18           HG       LEU  18   8.039  -8.412  -0.014
  150   HD11  LEU  18          1HD1      LEU  18   6.526  -6.865   0.461
  151   HD12  LEU  18          2HD1      LEU  18   7.549  -6.299   1.780
  152   HD13  LEU  18          3HD1      LEU  18   6.315  -7.522   2.084
  153   HD21  LEU  18          3HD2      LEU  18   9.491  -6.740   1.504
  154   HD22  LEU  18          1HD2      LEU  18  10.157  -8.181   0.735
  155   HD23  LEU  18          2HD2      LEU  18   9.680  -8.228   2.433
  156    H    ASP  19           HN       ASP  19   9.011 -10.941   3.828
  157    HA   ASP  19           HA       ASP  19   8.821 -13.690   4.285
  158    HB2  ASP  19           2HB      ASP  19   9.887 -11.949   5.787
  159    HB3  ASP  19           3HB      ASP  19   8.264 -11.557   6.349
  160    H    ARG  20           HN       ARG  20   7.214 -14.999   5.159
  161    HA   ARG  20           HA       ARG  20   4.623 -14.644   4.247
  162    HB2  ARG  20           2HB      ARG  20   5.908 -16.435   6.250
  163    HB3  ARG  20           3HB      ARG  20   4.151 -16.350   6.240
  164    HG2  ARG  20           2HG      ARG  20   5.671 -16.852   3.712
  165    HG3  ARG  20           3HG      ARG  20   5.321 -18.163   4.840
  166    HD2  ARG  20           2HD      ARG  20   3.107 -16.358   3.990
  167    HD3  ARG  20           3HD      ARG  20   3.679 -17.592   2.867
  168    HE   ARG  20           HE       ARG  20   3.261 -18.887   5.262
  169   HH11  ARG  20          2HH1      ARG  20   1.349 -17.044   3.011
  170   HH12  ARG  20          1HH1      ARG  20  -0.121 -17.887   3.368
  171   HH21  ARG  20          2HH2      ARG  20   1.332 -20.005   5.741
  172   HH22  ARG  20          1HH2      ARG  20  -0.130 -19.571   4.922
  173    H    GLU  21           HN       GLU  21   5.932 -14.032   7.492
  174    HA   GLU  21           HA       GLU  21   3.529 -13.244   8.700
  175    HB2  GLU  21           2HB      GLU  21   6.423 -12.797   9.288
  176    HB3  GLU  21           3HB      GLU  21   5.230 -11.855  10.170
  177    HG2  GLU  21           2HG      GLU  21   4.323 -13.728  11.199
  178    HG3  GLU  21           3HG      GLU  21   5.010 -14.832  10.009
  179    H    VAL  22           HN       VAL  22   6.068 -11.299   7.147
  180    HA   VAL  22           HA       VAL  22   4.942  -8.782   7.571
  181    HB   VAL  22           HB       VAL  22   6.603  -9.680   5.213
  182   HG11  VAL  22          1HG1      VAL  22   5.259  -7.281   5.575
  183   HG12  VAL  22          2HG1      VAL  22   6.918  -6.932   6.068
  184   HG13  VAL  22          3HG1      VAL  22   6.592  -7.584   4.461
  185   HG21  VAL  22          3HG2      VAL  22   7.339  -9.755   7.829
  186   HG22  VAL  22          1HG2      VAL  22   8.452  -9.528   6.480
  187   HG23  VAL  22          2HG2      VAL  22   7.849  -8.130   7.372
  188    H    ALA  23           HN       ALA  23   4.669 -10.886   4.706
  189    HA   ALA  23           HA       ALA  23   2.999  -9.316   3.168
  190    HB1  ALA  23           1HB      ALA  23   4.010 -11.896   3.021
  191    HB2  ALA  23           2HB      ALA  23   2.259 -12.105   2.973
  192    HB3  ALA  23           3HB      ALA  23   3.055 -11.064   1.793
  193    H    ARG  24           HN       ARG  24   2.085 -11.719   5.624
  194    HA   ARG  24           HA       ARG  24  -0.709 -11.350   5.324
  195    HB2  ARG  24           2HB      ARG  24   0.342 -13.359   6.348
  196    HB3  ARG  24           3HB      ARG  24   0.795 -12.379   7.736
  197    HG2  ARG  24           2HG      ARG  24  -1.692 -11.872   7.976
  198    HG3  ARG  24           3HG      ARG  24  -1.945 -13.205   6.848
  199    HD2  ARG  24           2HD      ARG  24  -0.581 -14.637   8.398
  200    HD3  ARG  24           3HD      ARG  24  -0.628 -13.307   9.554
  201    HE   ARG  24           HE       ARG  24  -2.807 -13.839  10.031
  202   HH11  ARG  24          2HH1      ARG  24  -1.828 -15.479   7.122
  203   HH12  ARG  24          1HH1      ARG  24  -3.255 -16.458   7.037
  204   HH21  ARG  24          2HH2      ARG  24  -4.691 -15.121   9.931
  205   HH22  ARG  24          1HH2      ARG  24  -4.884 -16.252   8.635
  206    H    ARG  25           HN       ARG  25   1.706  -9.941   7.484
  207    HA   ARG  25           HA       ARG  25  -0.057  -8.543   9.164
  208    HB2  ARG  25           2HB      ARG  25   2.162  -8.748   9.921
  209    HB3  ARG  25           3HB      ARG  25   2.825  -8.139   8.411
  210    HG2  ARG  25           2HG      ARG  25   2.345  -5.935   8.937
  211    HG3  ARG  25           3HG      ARG  25   1.128  -6.383  10.133
  212    HD2  ARG  25           2HD      ARG  25   2.856  -5.774  11.509
  213    HD3  ARG  25           3HD      ARG  25   3.183  -7.498  11.330
  214    HE   ARG  25           HE       ARG  25   4.741  -5.303  10.261
  215   HH11  ARG  25          2HH1      ARG  25   4.069  -8.718  10.194
  216   HH12  ARG  25          1HH1      ARG  25   5.599  -9.138   9.497
  217   HH21  ARG  25          2HH2      ARG  25   6.758  -5.843   9.344
  218   HH22  ARG  25          1HH2      ARG  25   7.128  -7.502   9.015
  219    H    ILE  26           HN       ILE  26   1.484  -7.645   6.112
  220    HA   ILE  26           HA       ILE  26   0.651  -4.953   6.079
  221    HB   ILE  26           HB       ILE  26   1.298  -6.802   3.781
  222   HG12  ILE  26          2HG1      ILE  26   2.990  -4.610   4.982
  223   HG13  ILE  26          3HG1      ILE  26   3.089  -6.286   5.510
  224   HG21  ILE  26          1HG2      ILE  26  -0.122  -4.869   3.129
  225   HG22  ILE  26          2HG2      ILE  26   1.128  -3.794   3.752
  226   HG23  ILE  26          3HG2      ILE  26   1.478  -4.855   2.388
  227   HD11  ILE  26          3HD1      ILE  26   3.708  -5.200   2.777
  228   HD12  ILE  26          1HD1      ILE  26   4.841  -5.871   3.949
  229   HD13  ILE  26          2HD1      ILE  26   3.651  -6.917   3.175
  230    H    LEU  27           HN       LEU  27  -0.651  -7.690   4.191
  231    HA   LEU  27           HA       LEU  27  -2.913  -6.381   3.234
  232    HB2  LEU  27           2HB      LEU  27  -2.249  -9.259   3.710
  233    HB3  LEU  27           3HB      LEU  27  -3.857  -8.796   3.159
  234    HG   LEU  27           HG       LEU  27  -1.379  -7.988   1.664
  235   HD11  LEU  27          1HD1      LEU  27  -1.616  -9.926   0.265
  236   HD12  LEU  27          2HD1      LEU  27  -3.013 -10.475   1.189
  237   HD13  LEU  27          3HD1      LEU  27  -1.416 -10.450   1.937
  238   HD21  LEU  27          3HD2      LEU  27  -4.275  -7.767   1.302
  239   HD22  LEU  27          1HD2      LEU  27  -3.413  -8.372  -0.113
  240   HD23  LEU  27          2HD2      LEU  27  -2.964  -6.820   0.596
  241    H    ARG  28           HN       ARG  28  -2.319  -7.940   6.304
  242    HA   ARG  28           HA       ARG  28  -5.060  -7.985   7.130
  243    HB2  ARG  28           2HB      ARG  28  -3.368  -9.537   8.044
  244    HB3  ARG  28           3HB      ARG  28  -2.544  -8.177   8.795
  245    HG2  ARG  28           2HG      ARG  28  -4.333  -7.796  10.291
  246    HG3  ARG  28           3HG      ARG  28  -5.400  -8.884   9.400
  247    HD2  ARG  28           2HD      ARG  28  -3.721 -10.717   9.955
  248    HD3  ARG  28           3HD      ARG  28  -3.022  -9.576  11.103
  249    HE   ARG  28           HE       ARG  28  -5.674  -9.614  11.725
  250   HH11  ARG  28          2HH1      ARG  28  -3.195 -12.039  11.417
  251   HH12  ARG  28          1HH1      ARG  28  -3.895 -13.092  12.601
  252   HH21  ARG  28          2HH2      ARG  28  -6.606 -10.993  13.286
  253   HH22  ARG  28          1HH2      ARG  28  -5.836 -12.497  13.663
  254    H    PHE  29           HN       PHE  29  -2.439  -5.702   7.303
  255    HA   PHE  29           HA       PHE  29  -3.650  -4.037   9.301
  256    HB2  PHE  29           2HB      PHE  29  -1.307  -3.866   9.208
  257    HB3  PHE  29           3HB      PHE  29  -1.298  -3.727   7.453
  258    HD1  PHE  29           1HD      PHE  29  -2.077  -1.949  10.590
  259    HD2  PHE  29           2HD      PHE  29  -1.471  -1.627   6.389
  260    HE1  PHE  29           1HE      PHE  29  -2.007   0.502  10.791
  261    HE2  PHE  29           2HE      PHE  29  -1.399   0.824   6.584
  262    HZ   PHE  29           HZ       PHE  29  -1.666   1.892   8.787
  263    H    LEU  30           HN       LEU  30  -3.728  -4.262   5.829
  264    HA   LEU  30           HA       LEU  30  -5.051  -1.686   5.547
  265    HB2  LEU  30           2HB      LEU  30  -4.134  -3.782   3.602
  266    HB3  LEU  30           3HB      LEU  30  -5.148  -2.429   3.103
  267    HG   LEU  30           HG       LEU  30  -2.610  -1.832   4.541
  268   HD11  LEU  30          1HD1      LEU  30  -2.751  -3.331   2.070
  269   HD12  LEU  30          2HD1      LEU  30  -1.356  -2.929   3.070
  270   HD13  LEU  30          3HD1      LEU  30  -1.929  -1.786   1.855
  271   HD21  LEU  30          3HD2      LEU  30  -2.988   0.228   3.777
  272   HD22  LEU  30          1HD2      LEU  30  -4.597  -0.345   3.336
  273   HD23  LEU  30          2HD2      LEU  30  -3.302  -0.349   2.139
  274    H    ARG  31           HN       ARG  31  -5.786  -5.123   5.351
  275    HA   ARG  31           HA       ARG  31  -8.470  -4.745   4.427
  276    HB2  ARG  31           2HB      ARG  31  -8.673  -7.060   4.489
  277    HB3  ARG  31           3HB      ARG  31  -6.951  -6.836   4.211
  278    HG2  ARG  31           2HG      ARG  31  -6.753  -6.996   6.782
  279    HG3  ARG  31           3HG      ARG  31  -8.363  -7.714   6.694
  280    HD2  ARG  31           2HD      ARG  31  -6.008  -8.697   5.094
  281    HD3  ARG  31           3HD      ARG  31  -6.451  -9.346   6.672
  282    HE   ARG  31           HE       ARG  31  -8.728  -9.476   5.116
  283   HH11  ARG  31          2HH1      ARG  31  -5.502 -10.782   5.037
  284   HH12  ARG  31          1HH1      ARG  31  -5.967 -12.229   4.205
  285   HH21  ARG  31          2HH2      ARG  31  -9.353 -11.377   4.020
  286   HH22  ARG  31          1HH2      ARG  31  -8.158 -12.566   3.626
  287    H    GLU  32           HN       GLU  32  -6.969  -4.305   7.398
  288    HA   GLU  32           HA       GLU  32  -9.503  -4.681   8.851
  289    HB2  GLU  32           2HB      GLU  32  -6.649  -4.716   9.833
  290    HB3  GLU  32           3HB      GLU  32  -8.039  -4.671  10.908
  291    HG2  GLU  32           2HG      GLU  32  -7.524  -6.831   8.879
  292    HG3  GLU  32           3HG      GLU  32  -7.091  -6.932  10.585
  293    H    ARG  33           HN       ARG  33  -6.579  -2.680   9.258
  294    HA   ARG  33           HA       ARG  33  -7.913  -0.560  10.528
  295    HB2  ARG  33           2HB      ARG  33  -5.360  -0.334   8.933
  296    HB3  ARG  33           3HB      ARG  33  -5.881   0.685  10.269
  297    HG2  ARG  33           2HG      ARG  33  -5.560  -2.217  10.787
  298    HG3  ARG  33           3HG      ARG  33  -4.104  -1.242  10.583
  299    HD2  ARG  33           2HD      ARG  33  -4.713   0.187  12.387
  300    HD3  ARG  33           3HD      ARG  33  -6.327  -0.517  12.478
  301    HE   ARG  33           HE       ARG  33  -4.300  -2.471  12.906
  302   HH11  ARG  33          2HH1      ARG  33  -6.042   0.125  14.438
  303   HH12  ARG  33          1HH1      ARG  33  -5.840  -0.508  16.037
  304   HH21  ARG  33          2HH2      ARG  33  -4.027  -3.315  15.007
  305   HH22  ARG  33          1HH2      ARG  33  -4.693  -2.465  16.360
  306    H    VAL  34           HN       VAL  34  -6.440  -0.458   7.280
  307    HA   VAL  34           HA       VAL  34  -7.791   1.855   6.453
  308    HB   VAL  34           HB       VAL  34  -6.650  -0.368   4.753
  309   HG11  VAL  34          1HG1      VAL  34  -8.053   0.828   3.317
  310   HG12  VAL  34          2HG1      VAL  34  -7.668   2.373   4.078
  311   HG13  VAL  34          3HG1      VAL  34  -6.467   1.560   3.073
  312   HG21  VAL  34          3HG2      VAL  34  -5.445   1.753   6.320
  313   HG22  VAL  34          1HG2      VAL  34  -4.694   0.369   5.527
  314   HG23  VAL  34          2HG2      VAL  34  -4.994   1.850   4.618
  315    H    ALA  35           HN       ALA  35  -8.855  -1.392   6.713
  316    HA   ALA  35           HA       ALA  35 -10.941  -1.245   4.750
  317    HB1  ALA  35           1HB      ALA  35 -10.095  -3.404   5.245
  318    HB2  ALA  35           2HB      ALA  35 -10.370  -3.189   6.975
  319    HB3  ALA  35           3HB      ALA  35 -11.741  -3.348   5.876
  320    H    THR  36           HN       THR  36 -10.868  -1.155   8.309
  321    HA   THR  36           HA       THR  36 -13.669  -0.523   8.484
  322    HB   THR  36           HB       THR  36 -12.677  -1.810  10.276
  323    HG1  THR  36           1HG      THR  36 -13.140  -0.140  12.044
  324   HG21  THR  36          3HG2      THR  36 -11.123   0.387  11.442
  325   HG22  THR  36          1HG2      THR  36 -10.458  -0.252   9.939
  326   HG23  THR  36          2HG2      THR  36 -10.736  -1.328  11.309
  327    H    LEU  37           HN       LEU  37 -10.677   1.244   8.379
  328    HA   LEU  37           HA       LEU  37 -11.489   3.666   9.522
  329    HB2  LEU  37           2HB      LEU  37  -9.422   2.921   7.491
  330    HB3  LEU  37           3HB      LEU  37  -9.721   4.615   7.876
  331    HG   LEU  37           HG       LEU  37  -8.903   2.524   9.891
  332   HD11  LEU  37          1HD1      LEU  37  -6.819   2.755   9.182
  333   HD12  LEU  37          2HD1      LEU  37  -6.908   4.486   9.502
  334   HD13  LEU  37          3HD1      LEU  37  -7.350   3.860   7.914
  335   HD21  LEU  37          3HD2      LEU  37 -10.011   4.220  11.054
  336   HD22  LEU  37          1HD2      LEU  37  -9.365   5.486  10.010
  337   HD23  LEU  37          2HD2      LEU  37  -8.309   4.670  11.162
  338    H    GLU  38           HN       GLU  38 -13.088   4.960   8.930
  339    HA   GLU  38           HA       GLU  38 -14.677   4.775   6.717
  340    HB2  GLU  38           2HB      GLU  38 -13.963   7.155   8.415
  341    HB3  GLU  38           3HB      GLU  38 -15.123   7.279   7.101
  342    HG2  GLU  38           2HG      GLU  38 -16.435   6.929   8.982
  343    HG3  GLU  38           3HG      GLU  38 -16.339   5.338   8.229
  344    H    ASP  39           HN       ASP  39 -11.648   6.541   7.032
  345    HA   ASP  39           HA       ASP  39 -11.628   6.885   4.112
  346    HB2  ASP  39           2HB      ASP  39 -10.419   8.957   5.921
  347    HB3  ASP  39           3HB      ASP  39 -10.893   9.105   4.231
  348    HA   PRO  40           HA       PRO  40  -7.711   4.882   4.418
  349    HB2  PRO  40           2HB      PRO  40  -6.750   5.538   1.965
  350    HB3  PRO  40           3HB      PRO  40  -8.007   4.319   2.210
  351    HG2  PRO  40           2HG      PRO  40  -8.280   7.183   1.380
  352    HG3  PRO  40           3HG      PRO  40  -9.109   5.750   0.744
  353    HD2  PRO  40           2HD      PRO  40 -10.275   7.445   2.504
  354    HD3  PRO  40           3HD      PRO  40 -10.630   5.706   2.475
  355    H    ARG  41           HN       ARG  41  -8.165   8.234   4.233
  356    HA   ARG  41           HA       ARG  41  -5.324   8.873   4.243
  357    HB2  ARG  41           2HB      ARG  41  -7.850  10.481   4.123
  358    HB3  ARG  41           3HB      ARG  41  -6.344  11.255   4.598
  359    HG2  ARG  41           2HG      ARG  41  -5.396  10.223   2.431
  360    HG3  ARG  41           3HG      ARG  41  -7.090  10.034   1.975
  361    HD2  ARG  41           2HD      ARG  41  -6.181  12.675   3.001
  362    HD3  ARG  41           3HD      ARG  41  -5.723  12.210   1.363
  363    HE   ARG  41           HE       ARG  41  -8.246  13.137   2.179
  364   HH11  ARG  41          2HH1      ARG  41  -6.809  10.676   0.180
  365   HH12  ARG  41          1HH1      ARG  41  -8.155  10.588  -0.907
  366   HH21  ARG  41          2HH2      ARG  41 -10.025  13.031   0.755
  367   HH22  ARG  41          1HH2      ARG  41  -9.984  11.928  -0.579
  368    H    SER  42           HN       SER  42  -6.097   7.285   6.393
  369    HA   SER  42           HA       SER  42  -6.219   9.131   8.672
  370    HB2  SER  42           2HB      SER  42  -7.894   7.441   8.840
  371    HB3  SER  42           3HB      SER  42  -6.747   6.166   8.430
  372    HG   SER  42           HG       SER  42  -6.753   7.743  10.791
  373    H    LEU  43           HN       LEU  43  -4.416   6.296   7.508
  374    HA   LEU  43           HA       LEU  43  -2.200   7.076   9.284
  375    HB2  LEU  43           2HB      LEU  43  -3.134   4.423   8.264
  376    HB3  LEU  43           3HB      LEU  43  -1.458   4.645   8.765
  377    HG   LEU  43           HG       LEU  43  -2.245   5.285  11.014
  378   HD11  LEU  43          1HD1      LEU  43  -4.955   4.595   9.892
  379   HD12  LEU  43          2HD1      LEU  43  -4.420   6.167  10.483
  380   HD13  LEU  43          3HD1      LEU  43  -4.600   4.819  11.605
  381   HD21  LEU  43          3HD2      LEU  43  -1.599   3.014  10.705
  382   HD22  LEU  43          1HD2      LEU  43  -3.133   2.619   9.929
  383   HD23  LEU  43          2HD2      LEU  43  -3.090   3.010  11.649
  384    H    GLY  44           HN       GLY  44  -0.052   6.958   8.472
  385    HA2  GLY  44           1HA      GLY  44   1.583   6.837   6.799
  386    HA3  GLY  44           2HA      GLY  44   0.316   6.563   5.612
  387    H    GLU  45           HN       GLU  45   1.846   8.150   4.499
  388    HA   GLU  45           HA       GLU  45   0.725  10.829   4.860
  389    HB2  GLU  45           2HB      GLU  45   2.854  11.914   4.766
  390    HB3  GLU  45           3HB      GLU  45   2.934  10.703   6.037
  391    HG2  GLU  45           2HG      GLU  45   4.046   9.175   4.412
  392    HG3  GLU  45           3HG      GLU  45   4.102  10.520   3.273
  393    HA   PRO  46           HA       PRO  46   0.369  10.782   0.484
  394    HB2  PRO  46           2HB      PRO  46   0.493  13.441  -0.052
  395    HB3  PRO  46           3HB      PRO  46  -0.913  12.677   0.699
  396    HG2  PRO  46           2HG      PRO  46   1.323  14.203   1.977
  397    HG3  PRO  46           3HG      PRO  46  -0.418  14.284   2.305
  398    HD2  PRO  46           2HD      PRO  46   1.297  12.892   3.872
  399    HD3  PRO  46           3HD      PRO  46  -0.386  12.389   3.617
  400    H    LEU  47           HN       LEU  47   1.431  12.310  -1.428
  401    HA   LEU  47           HA       LEU  47   4.315  12.486  -1.040
  402    HB2  LEU  47           2HB      LEU  47   3.828  10.174  -1.791
  403    HB3  LEU  47           3HB      LEU  47   3.090  10.837  -3.247
  404    HG   LEU  47           HG       LEU  47   5.489  11.958  -3.488
  405   HD11  LEU  47          1HD1      LEU  47   6.058  10.719  -1.251
  406   HD12  LEU  47          2HD1      LEU  47   7.246  10.823  -2.550
  407   HD13  LEU  47          3HD1      LEU  47   6.315   9.343  -2.323
  408   HD21  LEU  47          3HD2      LEU  47   5.246   9.063  -4.203
  409   HD22  LEU  47          1HD2      LEU  47   5.932  10.393  -5.136
  410   HD23  LEU  47          2HD2      LEU  47   4.184  10.260  -4.945
  411    H    ARG  48           HN       ARG  48   5.360  13.850  -2.497
  412    HA   ARG  48           HA       ARG  48   3.652  15.241  -4.444
  413    HB2  ARG  48           2HB      ARG  48   3.865  16.581  -2.352
  414    HB3  ARG  48           3HB      ARG  48   5.607  16.609  -2.588
  415    HG2  ARG  48           2HG      ARG  48   5.481  18.047  -4.378
  416    HG3  ARG  48           3HG      ARG  48   3.820  17.591  -4.762
  417    HD2  ARG  48           2HD      ARG  48   3.559  19.700  -3.846
  418    HD3  ARG  48           3HD      ARG  48   3.259  18.645  -2.465
  419    HE   ARG  48           HE       ARG  48   5.953  19.215  -2.406
  420   HH11  ARG  48          2HH1      ARG  48   2.979  21.022  -2.288
  421   HH12  ARG  48          1HH1      ARG  48   3.640  22.296  -1.318
  422   HH21  ARG  48          2HH2      ARG  48   6.834  20.887  -1.129
  423   HH22  ARG  48          1HH2      ARG  48   5.833  22.219  -0.660
  424    H    GLY  49           HN       GLY  49   4.591  15.684  -6.372
  425    HA2  GLY  49           1HA      GLY  49   7.447  15.794  -6.699
  426    HA3  GLY  49           2HA      GLY  49   6.745  14.311  -7.328
  427    HA   PRO  50           HA       PRO  50   6.330  18.080 -10.271
  428    HB2  PRO  50           2HB      PRO  50   8.552  17.748 -11.794
  429    HB3  PRO  50           3HB      PRO  50   8.518  18.774 -10.355
  430    HG2  PRO  50           2HG      PRO  50   9.531  15.973 -10.662
  431    HG3  PRO  50           3HG      PRO  50  10.255  17.335  -9.787
  432    HD2  PRO  50           2HD      PRO  50   8.871  15.372  -8.538
  433    HD3  PRO  50           3HD      PRO  50   8.887  17.048  -7.955
  434    H    GLU  51           HN       GLU  51   7.437  14.766 -10.681
  435    HA   GLU  51           HA       GLU  51   5.897  14.607 -13.188
  436    HB2  GLU  51           2HB      GLU  51   8.324  13.067 -12.274
  437    HB3  GLU  51           3HB      GLU  51   7.335  12.562 -13.637
  438    HG2  GLU  51           2HG      GLU  51   7.787  14.751 -14.709
  439    HG3  GLU  51           3HG      GLU  51   8.884  15.128 -13.382
  440    H    LEU  52           HN       LEU  52   4.971  14.306 -10.377
  441    HA   LEU  52           HA       LEU  52   3.754  11.654 -10.697
  442    HB2  LEU  52           2HB      LEU  52   4.806  12.781  -8.107
  443    HB3  LEU  52           3HB      LEU  52   3.920  11.269  -8.286
  444    HG   LEU  52           HG       LEU  52   5.919  10.683  -9.905
  445   HD11  LEU  52          1HD1      LEU  52   6.751  13.153  -9.222
  446   HD12  LEU  52          2HD1      LEU  52   7.834  11.845  -9.695
  447   HD13  LEU  52          3HD1      LEU  52   7.565  12.192  -7.987
  448   HD21  LEU  52          3HD2      LEU  52   6.104   9.164  -8.299
  449   HD22  LEU  52          1HD2      LEU  52   5.323  10.239  -7.140
  450   HD23  LEU  52          2HD2      LEU  52   7.070  10.309  -7.367
  451    H    GLY  53           HN       GLY  53   1.834  11.423  -9.134
  452    HA2  GLY  53           1HA      GLY  53   0.352  13.978  -9.156
  453    HA3  GLY  53           2HA      GLY  53  -0.390  12.404  -9.399
  454    H    ARG  54           HN       ARG  54  -1.763  12.215  -7.730
  455    HA   ARG  54           HA       ARG  54  -0.852  12.926  -5.043
  456    HB2  ARG  54           2HB      ARG  54  -3.563  12.305  -6.203
  457    HB3  ARG  54           3HB      ARG  54  -3.292  12.421  -4.469
  458    HG2  ARG  54           2HG      ARG  54  -2.780  14.702  -4.586
  459    HG3  ARG  54           3HG      ARG  54  -2.537  14.644  -6.333
  460    HD2  ARG  54           2HD      ARG  54  -4.620  15.625  -6.173
  461    HD3  ARG  54           3HD      ARG  54  -5.033  13.925  -6.391
  462    HE   ARG  54           HE       ARG  54  -4.823  14.791  -3.641
  463   HH11  ARG  54          2HH1      ARG  54  -6.904  14.331  -6.394
  464   HH12  ARG  54          1HH1      ARG  54  -8.354  14.250  -5.450
  465   HH21  ARG  54          2HH2      ARG  54  -6.725  14.685  -2.386
  466   HH22  ARG  54          1HH2      ARG  54  -8.251  14.452  -3.170
  467    H    PHE  55           HN       PHE  55   0.580  11.168  -4.732
  468    HA   PHE  55           HA       PHE  55  -0.684   8.522  -4.545
  469    HB2  PHE  55           2HB      PHE  55   2.224   9.326  -4.718
  470    HB3  PHE  55           3HB      PHE  55   1.680   7.676  -4.437
  471    HD1  PHE  55           1HD      PHE  55  -0.353   7.083  -6.226
  472    HD2  PHE  55           2HD      PHE  55   2.957   9.685  -6.850
  473    HE1  PHE  55           1HE      PHE  55  -0.538   6.731  -8.654
  474    HE2  PHE  55           2HE      PHE  55   2.777   9.338  -9.279
  475    HZ   PHE  55           HZ       PHE  55   1.027   7.860 -10.184
  476    H    TRP  56           HN       TRP  56  -0.922   7.524  -2.633
  477    HA   TRP  56           HA       TRP  56   0.016   8.955  -0.246
  478    HB2  TRP  56           2HB      TRP  56  -2.470   8.385  -0.653
  479    HB3  TRP  56           3HB      TRP  56  -2.014   6.733  -0.247
  480    HD1  TRP  56           1HD      TRP  56  -1.659   6.158   2.283
  481    HE1  TRP  56           1HE      TRP  56  -1.997   7.473   4.470
  482    HE3  TRP  56           3HE      TRP  56  -2.268  10.843   0.328
  483    HZ2  TRP  56           2HZ      TRP  56  -2.461  10.142   5.261
  484    HZ3  TRP  56           3HZ      TRP  56  -2.655  12.722   1.868
  485    HH2  TRP  56           2HH      TRP  56  -2.749  12.377   4.283
  486    H    LYS  57           HN       LYS  57   1.135   7.916   1.388
  487    HA   LYS  57           HA       LYS  57   2.167   5.237   0.717
  488    HB2  LYS  57           2HB      LYS  57   3.639   7.384   2.249
  489    HB3  LYS  57           3HB      LYS  57   4.283   5.840   1.706
  490    HG2  LYS  57           2HG      LYS  57   4.492   6.531  -0.465
  491    HG3  LYS  57           3HG      LYS  57   3.203   7.728  -0.324
  492    HD2  LYS  57           2HD      LYS  57   5.187   8.982  -0.461
  493    HD3  LYS  57           3HD      LYS  57   4.767   8.981   1.254
  494    HE2  LYS  57           2HE      LYS  57   6.316   6.958   1.446
  495    HE3  LYS  57           3HE      LYS  57   6.899   7.402  -0.157
  496    HZ1  LYS  57           3HZ      LYS  57   8.223   8.884   0.784
  497    HZ2  LYS  57           1HZ      LYS  57   7.643   8.476   2.320
  498    HZ3  LYS  57           2HZ      LYS  57   6.890   9.701   1.430
  499    H    TYR  58           HN       TYR  58   2.618   3.818   2.465
  500    HA   TYR  58           HA       TYR  58   1.319   4.552   5.004
  501    HB2  TYR  58           2HB      TYR  58   1.051   2.003   3.416
  502    HB3  TYR  58           3HB      TYR  58   0.655   2.086   5.129
  503    HD1  TYR  58           1HD      TYR  58  -0.987   4.077   5.765
  504    HD2  TYR  58           2HD      TYR  58  -0.647   2.349   1.892
  505    HE1  TYR  58           1HE      TYR  58  -3.239   4.895   5.209
  506    HE2  TYR  58           2HE      TYR  58  -2.898   3.163   1.324
  507    HH   TYR  58           HH       TYR  58  -4.475   5.493   2.952
  508    H    ARG  59           HN       ARG  59   2.193   3.655   6.887
  509    HA   ARG  59           HA       ARG  59   4.870   2.469   6.550
  510    HB2  ARG  59           2HB      ARG  59   5.315   3.487   8.844
  511    HB3  ARG  59           3HB      ARG  59   5.202   4.605   7.491
  512    HG2  ARG  59           2HG      ARG  59   2.901   5.137   8.122
  513    HG3  ARG  59           3HG      ARG  59   3.023   4.022   9.485
  514    HD2  ARG  59           2HD      ARG  59   4.813   6.412   9.074
  515    HD3  ARG  59           3HD      ARG  59   3.369   6.416  10.086
  516    HE   ARG  59           HE       ARG  59   4.502   5.186  11.677
  517   HH11  ARG  59          2HH1      ARG  59   6.381   5.394   8.753
  518   HH12  ARG  59          1HH1      ARG  59   7.824   4.770   9.482
  519   HH21  ARG  59          2HH2      ARG  59   6.396   4.364  12.647
  520   HH22  ARG  59          1HH2      ARG  59   7.831   4.184  11.696
  521    H    VAL  60           HN       VAL  60   5.131   0.484   7.321
  522    HA   VAL  60           HA       VAL  60   3.364  -0.440   9.487
  523    HB   VAL  60           HB       VAL  60   4.074  -1.889   6.945
  524   HG11  VAL  60          1HG1      VAL  60   2.571  -3.668   8.366
  525   HG12  VAL  60          2HG1      VAL  60   4.327  -3.731   8.198
  526   HG13  VAL  60          3HG1      VAL  60   3.602  -2.980   9.620
  527   HG21  VAL  60          3HG2      VAL  60   1.652  -0.723   8.138
  528   HG22  VAL  60          1HG2      VAL  60   2.074  -0.984   6.446
  529   HG23  VAL  60          2HG2      VAL  60   1.442  -2.317   7.413
  530    H    GLY  61           HN       GLY  61   4.832  -0.365  11.128
  531    HA2  GLY  61           1HA      GLY  61   6.624  -0.983  12.423
  532    HA3  GLY  61           2HA      GLY  61   6.623  -2.470  11.485
  533    H    ASP  62           HN       ASP  62   8.001  -2.671   9.702
  534    HA   ASP  62           HA       ASP  62   9.971  -0.518   9.351
  535    HB2  ASP  62           2HB      ASP  62  10.590  -3.460   9.689
  536    HB3  ASP  62           3HB      ASP  62  11.764  -2.235   9.216
  537    H    TYR  63           HN       TYR  63   7.737  -1.078   7.714
  538    HA   TYR  63           HA       TYR  63   9.126  -1.695   5.219
  539    HB2  TYR  63           2HB      TYR  63   6.579  -3.044   6.128
  540    HB3  TYR  63           3HB      TYR  63   7.162  -3.074   4.467
  541    HD1  TYR  63           1HD      TYR  63   8.291  -3.882   7.934
  542    HD2  TYR  63           2HD      TYR  63   8.525  -4.820   3.790
  543    HE1  TYR  63           1HE      TYR  63   9.676  -5.845   8.463
  544    HE2  TYR  63           2HE      TYR  63   9.909  -6.786   4.308
  545    HH   TYR  63           HH       TYR  63  10.255  -8.317   6.321
  546    H    ARG  64           HN       ARG  64   8.423  -0.530   3.485
  547    HA   ARG  64           HA       ARG  64   6.366   1.490   4.047
  548    HB2  ARG  64           2HB      ARG  64   8.738   1.426   2.204
  549    HB3  ARG  64           3HB      ARG  64   7.423   2.563   1.936
  550    HG2  ARG  64           2HG      ARG  64   8.862   2.366   4.562
  551    HG3  ARG  64           3HG      ARG  64   9.420   3.402   3.246
  552    HD2  ARG  64           2HD      ARG  64   7.215   4.518   3.243
  553    HD3  ARG  64           3HD      ARG  64   6.739   3.528   4.621
  554    HE   ARG  64           HE       ARG  64   7.984   4.884   5.984
  555   HH11  ARG  64          2HH1      ARG  64   8.864   5.471   2.667
  556   HH12  ARG  64          1HH1      ARG  64   9.848   6.848   3.036
  557   HH21  ARG  64          2HH2      ARG  64   9.276   6.696   6.482
  558   HH22  ARG  64          1HH2      ARG  64  10.082   7.544   5.206
  559    H    LEU  65           HN       LEU  65   4.687   1.882   2.613
  560    HA   LEU  65           HA       LEU  65   4.392   0.043   0.348
  561    HB2  LEU  65           2HB      LEU  65   2.074   0.627   2.153
  562    HB3  LEU  65           3HB      LEU  65   2.248  -0.654   0.955
  563    HG   LEU  65           HG       LEU  65   3.885  -0.582   3.476
  564   HD11  LEU  65          1HD1      LEU  65   1.219  -1.920   3.040
  565   HD12  LEU  65          2HD1      LEU  65   1.545  -0.574   4.131
  566   HD13  LEU  65          3HD1      LEU  65   2.271  -2.151   4.437
  567   HD21  LEU  65          3HD2      LEU  65   4.900  -2.207   2.306
  568   HD22  LEU  65          1HD2      LEU  65   3.546  -2.390   1.192
  569   HD23  LEU  65          2HD2      LEU  65   3.502  -3.178   2.769
  570    H    ILE  66           HN       ILE  66   4.211   1.299  -1.380
  571    HA   ILE  66           HA       ILE  66   3.016   3.947  -1.154
  572    HB   ILE  66           HB       ILE  66   4.151   2.747  -3.667
  573   HG12  ILE  66          2HG1      ILE  66   5.760   2.572  -1.719
  574   HG13  ILE  66          3HG1      ILE  66   6.331   3.519  -3.089
  575   HG21  ILE  66          1HG2      ILE  66   4.748   5.255  -3.933
  576   HG22  ILE  66          2HG2      ILE  66   3.087   4.730  -4.204
  577   HG23  ILE  66          3HG2      ILE  66   3.530   5.500  -2.681
  578   HD11  ILE  66          3HD1      ILE  66   5.276   4.551  -0.472
  579   HD12  ILE  66          1HD1      ILE  66   6.924   4.659  -1.088
  580   HD13  ILE  66          2HD1      ILE  66   5.630   5.570  -1.867
  581    H    CYS  67           HN       CYS  67   0.839   3.830  -1.136
  582    HA   CYS  67           HA       CYS  67  -0.482   2.195  -3.191
  583    HB2  CYS  67           2HB      CYS  67  -1.370   3.218  -0.509
  584    HB3  CYS  67           3HB      CYS  67  -2.551   2.733  -1.719
  585    HG   CYS  67           HG       CYS  67  -1.073   0.866   0.445
  586    H    HIS  68           HN       HIS  68  -2.596   3.162  -3.996
  587    HA   HIS  68           HA       HIS  68  -2.295   6.061  -4.419
  588    HB2  HIS  68           2HB      HIS  68  -1.618   4.639  -6.404
  589    HB3  HIS  68           3HB      HIS  68  -3.301   4.129  -6.511
  590    HD2  HIS  68           2HD      HIS  68  -2.872   7.859  -5.696
  591    HE1  HIS  68           1HE      HIS  68  -3.712   7.554  -9.843
  592    HE2  HIS  68           2HE      HIS  68  -3.392   9.118  -7.895
  593    H    ILE  69           HN       ILE  69  -3.917   6.965  -3.325
  594    HA   ILE  69           HA       ILE  69  -6.446   5.631  -2.966
  595    HB   ILE  69           HB       ILE  69  -5.566   8.412  -2.183
  596   HG12  ILE  69          2HG1      ILE  69  -5.939   5.944  -0.476
  597   HG13  ILE  69          3HG1      ILE  69  -4.382   6.499  -1.080
  598   HG21  ILE  69          1HG2      ILE  69  -7.648   8.869  -1.558
  599   HG22  ILE  69          2HG2      ILE  69  -8.163   7.401  -2.386
  600   HG23  ILE  69          3HG2      ILE  69  -7.769   7.352  -0.668
  601   HD11  ILE  69          3HD1      ILE  69  -6.135   8.275   0.571
  602   HD12  ILE  69          1HD1      ILE  69  -5.038   7.108   1.309
  603   HD13  ILE  69          2HD1      ILE  69  -4.400   8.389   0.277
  604    H    GLN  70           HN       GLN  70  -8.020   5.661  -4.415
  605    HA   GLN  70           HA       GLN  70  -8.154   7.894  -6.322
  606    HB2  GLN  70           2HB      GLN  70  -9.159   5.055  -6.474
  607    HB3  GLN  70           3HB      GLN  70  -9.640   6.294  -7.625
  608    HG2  GLN  70           2HG      GLN  70  -7.473   6.499  -8.484
  609    HG3  GLN  70           3HG      GLN  70  -6.758   5.657  -7.110
  610   HE21  GLN  70          1HE2      GLN  70  -5.814   4.604  -9.157
  611   HE22  GLN  70          2HE2      GLN  70  -6.624   3.178  -9.698
  612    H    ASP  71           HN       ASP  71  -9.310   9.358  -5.076
  613    HA   ASP  71           HA       ASP  71 -11.536   8.877  -3.509
  614    HB2  ASP  71           2HB      ASP  71 -12.058  11.226  -3.734
  615    HB3  ASP  71           3HB      ASP  71 -10.308  11.041  -3.652
  616    H    ARG  72           HN       ARG  72 -11.340   9.391  -6.994
  617    HA   ARG  72           HA       ARG  72 -13.846   9.820  -7.821
  618    HB2  ARG  72           2HB      ARG  72 -11.926   9.320  -9.312
  619    HB3  ARG  72           3HB      ARG  72 -12.113   7.611  -8.942
  620    HG2  ARG  72           2HG      ARG  72 -13.156   7.929 -11.018
  621    HG3  ARG  72           3HG      ARG  72 -14.469   7.815  -9.845
  622    HD2  ARG  72           2HD      ARG  72 -14.477  10.326  -9.765
  623    HD3  ARG  72           3HD      ARG  72 -13.351  10.304 -11.121
  624    HE   ARG  72           HE       ARG  72 -15.433   8.772 -11.968
  625   HH11  ARG  72          2HH1      ARG  72 -15.141  12.000 -10.698
  626   HH12  ARG  72          1HH1      ARG  72 -16.502  12.611 -11.579
  627   HH21  ARG  72          2HH2      ARG  72 -17.227   9.564 -13.134
  628   HH22  ARG  72          1HH2      ARG  72 -17.688  11.224 -12.964
  629    H    GLU  73           HN       GLU  73 -12.660   6.581  -6.921
  630    HA   GLU  73           HA       GLU  73 -15.448   5.829  -6.349
  631    HB2  GLU  73           2HB      GLU  73 -13.331   4.283  -7.820
  632    HB3  GLU  73           3HB      GLU  73 -14.654   3.458  -7.009
  633    HG2  GLU  73           2HG      GLU  73 -15.251   5.666  -8.920
  634    HG3  GLU  73           3HG      GLU  73 -14.826   4.069  -9.532
  635    H    ALA  74           HN       ALA  74 -13.212   6.815  -4.648
  636    HA   ALA  74           HA       ALA  74 -12.073   6.287  -2.723
  637    HB1  ALA  74           1HB      ALA  74 -14.707   4.886  -2.284
  638    HB2  ALA  74           2HB      ALA  74 -13.538   5.261  -1.017
  639    HB3  ALA  74           3HB      ALA  74 -14.325   6.566  -1.905
  640    H    THR  75           HN       THR  75 -11.003   4.721  -4.585
  641    HA   THR  75           HA       THR  75 -10.841   2.064  -3.316
  642    HB   THR  75           HB       THR  75 -10.642   2.798  -6.235
  643    HG1  THR  75           1HG      THR  75 -12.403   1.350  -4.606
  644   HG21  THR  75          3HG2      THR  75  -9.955   0.145  -4.966
  645   HG22  THR  75          1HG2      THR  75  -8.787   1.281  -5.639
  646   HG23  THR  75          2HG2      THR  75  -9.972   0.507  -6.692
  647    H    VAL  76           HN       VAL  76  -8.913   1.498  -2.542
  648    HA   VAL  76           HA       VAL  76  -6.599   3.175  -3.215
  649    HB   VAL  76           HB       VAL  76  -6.972   1.286  -0.886
  650   HG11  VAL  76          1HG1      VAL  76  -4.931   3.179  -0.420
  651   HG12  VAL  76          2HG1      VAL  76  -4.776   1.430  -0.596
  652   HG13  VAL  76          3HG1      VAL  76  -4.632   2.476  -2.009
  653   HG21  VAL  76          3HG2      VAL  76  -7.079   4.299  -1.009
  654   HG22  VAL  76          1HG2      VAL  76  -8.438   3.215  -0.714
  655   HG23  VAL  76          2HG2      VAL  76  -7.133   3.334   0.466
  656    H    LEU  77           HN       LEU  77  -5.325   2.368  -4.743
  657    HA   LEU  77           HA       LEU  77  -4.970  -0.550  -4.893
  658    HB2  LEU  77           2HB      LEU  77  -5.870   0.235  -6.927
  659    HB3  LEU  77           3HB      LEU  77  -4.774   1.615  -6.966
  660    HG   LEU  77           HG       LEU  77  -2.945  -0.279  -7.145
  661   HD11  LEU  77          1HD1      LEU  77  -3.722  -2.180  -8.444
  662   HD12  LEU  77          2HD1      LEU  77  -5.382  -1.597  -8.333
  663   HD13  LEU  77          3HD1      LEU  77  -4.533  -2.123  -6.879
  664   HD21  LEU  77          3HD2      LEU  77  -3.492  -0.225  -9.719
  665   HD22  LEU  77          1HD2      LEU  77  -2.939   1.220  -8.873
  666   HD23  LEU  77          2HD2      LEU  77  -4.656   1.003  -9.216
  667    H    VAL  78           HN       VAL  78  -3.036  -1.395  -4.462
  668    HA   VAL  78           HA       VAL  78  -0.893   0.275  -3.573
  669    HB   VAL  78           HB       VAL  78  -0.847  -2.700  -4.095
  670   HG11  VAL  78          1HG1      VAL  78   1.349  -1.463  -3.856
  671   HG12  VAL  78          2HG1      VAL  78   0.866  -1.120  -2.193
  672   HG13  VAL  78          3HG1      VAL  78   1.075  -2.789  -2.727
  673   HG21  VAL  78          3HG2      VAL  78  -2.441  -1.353  -2.282
  674   HG22  VAL  78          1HG2      VAL  78  -1.985  -3.055  -2.210
  675   HG23  VAL  78          2HG2      VAL  78  -1.047  -1.853  -1.324
  676    H    LEU  79           HN       LEU  79   1.083   0.666  -4.514
  677    HA   LEU  79           HA       LEU  79   1.320  -0.079  -7.355
  678    HB2  LEU  79           2HB      LEU  79   1.917   2.446  -5.891
  679    HB3  LEU  79           3HB      LEU  79   2.888   2.032  -7.302
  680    HG   LEU  79           HG       LEU  79  -0.116   2.228  -7.378
  681   HD11  LEU  79          1HD1      LEU  79   0.001   4.454  -8.018
  682   HD12  LEU  79          2HD1      LEU  79   1.728   4.369  -8.364
  683   HD13  LEU  79          3HD1      LEU  79   1.162   4.363  -6.694
  684   HD21  LEU  79          3HD2      LEU  79   2.064   1.831  -9.366
  685   HD22  LEU  79          1HD2      LEU  79   0.631   2.739  -9.849
  686   HD23  LEU  79          2HD2      LEU  79   0.470   1.080  -9.269
  687    H    ARG  80           HN       ARG  80   3.324   0.903  -4.570
  688    HA   ARG  80           HA       ARG  80   5.301  -1.111  -5.415
  689    HB2  ARG  80           2HB      ARG  80   5.667   1.748  -4.665
  690    HB3  ARG  80           3HB      ARG  80   6.900   0.605  -4.151
  691    HG2  ARG  80           2HG      ARG  80   7.523   1.622  -6.249
  692    HG3  ARG  80           3HG      ARG  80   7.203  -0.098  -6.482
  693    HD2  ARG  80           2HD      ARG  80   5.274   0.282  -7.667
  694    HD3  ARG  80           3HD      ARG  80   4.979   1.839  -6.893
  695    HE   ARG  80           HE       ARG  80   6.326   1.417  -9.329
  696   HH11  ARG  80          2HH1      ARG  80   6.533   3.315  -6.418
  697   HH12  ARG  80          1HH1      ARG  80   7.355   4.635  -7.182
  698   HH21  ARG  80          2HH2      ARG  80   7.407   3.148 -10.347
  699   HH22  ARG  80          1HH2      ARG  80   7.851   4.540  -9.417
  700    H    VAL  81           HN       VAL  81   6.365  -2.246  -3.787
  701    HA   VAL  81           HA       VAL  81   5.606  -1.728  -1.015
  702    HB   VAL  81           HB       VAL  81   5.064  -4.325  -2.448
  703   HG11  VAL  81          1HG1      VAL  81   6.220  -4.715  -0.290
  704   HG12  VAL  81          2HG1      VAL  81   4.931  -3.826   0.523
  705   HG13  VAL  81          3HG1      VAL  81   4.569  -5.334  -0.319
  706   HG21  VAL  81          3HG2      VAL  81   2.798  -4.012  -1.568
  707   HG22  VAL  81          1HG2      VAL  81   3.298  -2.489  -0.832
  708   HG23  VAL  81          2HG2      VAL  81   3.290  -2.660  -2.588
  709    H    GLY  82           HN       GLY  82   7.466  -1.627   0.052
  710    HA2  GLY  82           1HA      GLY  82   9.357  -3.806  -0.110
  711    HA3  GLY  82           2HA      GLY  82   9.968  -2.284  -0.742
  712    H    HIS  83           HN       HIS  83  11.044  -3.689   1.480
  713    HA   HIS  83           HA       HIS  83  10.245  -2.910   3.990
  714    HB2  HIS  83           2HB      HIS  83  12.135  -4.456   3.481
  715    HB3  HIS  83           3HB      HIS  83  13.116  -3.059   3.049
  716    HD2  HIS  83           2HD      HIS  83  12.094  -5.060   6.146
  717    HE1  HIS  83           1HE      HIS  83  14.089  -1.576   7.516
  718    HE2  HIS  83           2HE      HIS  83  13.236  -3.864   8.134
  719    H    ALA  84           HN       ALA  84  11.238  -1.274   5.443
  720    HA   ALA  84           HA       ALA  84  10.676   1.293   4.758
  721    HB1  ALA  84           1HB      ALA  84  13.021   1.038   6.525
  722    HB2  ALA  84           2HB      ALA  84  11.487   1.870   6.782
  723    HB3  ALA  84           3HB      ALA  84  11.589   0.123   7.002
  724    H    ARG  85           HN       ARG  85  13.796  -0.337   4.355
  725    HA   ARG  85           HA       ARG  85  14.903   2.023   3.044
  726    HB2  ARG  85           2HB      ARG  85  17.025   0.877   3.121
  727    HB3  ARG  85           3HB      ARG  85  16.260   0.764   4.701
  728    HG2  ARG  85           2HG      ARG  85  15.417  -1.521   3.933
  729    HG3  ARG  85           3HG      ARG  85  16.597  -1.373   2.629
  730    HD2  ARG  85           2HD      ARG  85  17.263  -1.133   5.559
  731    HD3  ARG  85           3HD      ARG  85  17.419  -2.622   4.627
  732    HE   ARG  85           HE       ARG  85  18.834  -0.646   3.278
  733   HH11  ARG  85          2HH1      ARG  85  18.956  -2.312   6.332
  734   HH12  ARG  85          1HH1      ARG  85  20.676  -2.173   6.488
  735   HH21  ARG  85          2HH2      ARG  85  21.099  -0.456   3.472
  736   HH22  ARG  85          1HH2      ARG  85  21.894  -1.116   4.861
  737    H    ASP  86           HN       ASP  86  14.382  -1.426   2.335
  738    HA   ASP  86           HA       ASP  86  15.270  -1.603  -0.230
  739    HB2  ASP  86           2HB      ASP  86  14.207  -3.433   1.149
  740    HB3  ASP  86           3HB      ASP  86  12.640  -2.791   0.663
  741    H    VAL  87           HN       VAL  87  11.970  -0.615   0.694
  742    HA   VAL  87           HA       VAL  87  10.733  -0.139  -1.615
  743    HB   VAL  87           HB       VAL  87   9.775   0.512   0.542
  744   HG11  VAL  87          1HG1      VAL  87  10.403   2.430   1.739
  745   HG12  VAL  87          2HG1      VAL  87  11.928   1.662   1.292
  746   HG13  VAL  87          3HG1      VAL  87  11.349   3.066   0.393
  747   HG21  VAL  87          3HG2      VAL  87   9.017   2.930  -0.334
  748   HG22  VAL  87          1HG2      VAL  87   9.726   2.290  -1.817
  749   HG23  VAL  87          2HG2      VAL  87   8.413   1.423  -1.022
  750    H    TYR  88           HN       TYR  88  13.196   2.035  -0.264
  751    HA   TYR  88           HA       TYR  88  13.510   3.196  -2.953
  752    HB2  TYR  88           2HB      TYR  88  12.472   4.628  -0.967
  753    HB3  TYR  88           3HB      TYR  88  14.170   4.840  -0.554
  754    HD1  TYR  88           1HD      TYR  88  15.626   5.293  -2.873
  755    HD2  TYR  88           2HD      TYR  88  11.585   6.400  -2.131
  756    HE1  TYR  88           1HE      TYR  88  15.815   7.084  -4.548
  757    HE2  TYR  88           2HE      TYR  88  11.762   8.193  -3.805
  758    HH   TYR  88           HH       TYR  88  14.018   9.592  -4.769
  759    H    ARG  89           HN       ARG  89  15.018   1.107  -2.547
  760    HA   ARG  89           HA       ARG  89  17.301   1.056  -1.116
  761    HB2  ARG  89           2HB      ARG  89  16.815   0.295  -3.984
  762    HB3  ARG  89           3HB      ARG  89  18.389   0.055  -3.237
  763    HG2  ARG  89           2HG      ARG  89  17.061  -1.195  -1.403
  764    HG3  ARG  89           3HG      ARG  89  15.786  -1.272  -2.620
  765    HD2  ARG  89           2HD      ARG  89  17.680  -2.158  -4.164
  766    HD3  ARG  89           3HD      ARG  89  18.513  -2.501  -2.648
  767    HE   ARG  89           HE       ARG  89  15.817  -3.520  -2.801
  768   HH11  ARG  89          2HH1      ARG  89  19.189  -4.149  -3.394
  769   HH12  ARG  89          1HH1      ARG  89  19.009  -5.872  -3.354
  770   HH21  ARG  89          2HH2      ARG  89  15.567  -5.787  -2.745
  771   HH22  ARG  89          1HH2      ARG  89  16.948  -6.802  -2.986
  Start of MODEL   15
    1    H1   MET   1           HN       MET   1 -16.435  -3.603   1.587
    2    HA   MET   1           HA       MET   1 -17.918  -2.127   3.650
    3    HB2  MET   1           2HB      MET   1 -15.699  -4.126   4.086
    4    HB3  MET   1           3HB      MET   1 -16.200  -2.966   5.309
    5    HG2  MET   1           2HG      MET   1 -18.573  -4.003   4.823
    6    HG3  MET   1           3HG      MET   1 -17.602  -5.370   4.281
    7    HE1  MET   1           3HE      MET   1 -19.720  -5.468   6.316
    8    HE2  MET   1           1HE      MET   1 -18.802  -6.947   6.599
    9    HE3  MET   1           2HE      MET   1 -19.188  -5.878   7.948
   10    H    GLY   2           HN       GLY   2 -17.271  -0.083   3.712
   11    HA2  GLY   2           1HA      GLY   2 -15.984   1.800   3.444
   12    HA3  GLY   2           2HA      GLY   2 -14.656   0.799   4.010
   13    H    TYR   3           HN       TYR   3 -13.091   1.607   2.667
   14    HA   TYR   3           HA       TYR   3 -13.507   1.890  -0.156
   15    HB2  TYR   3           2HB      TYR   3 -11.115   2.146   1.649
   16    HB3  TYR   3           3HB      TYR   3 -10.940   2.202  -0.101
   17    HD1  TYR   3           2HD      TYR   3 -13.324   3.692   2.373
   18    HD2  TYR   3           1HD      TYR   3 -10.682   4.343  -0.898
   19    HE1  TYR   3           2HE      TYR   3 -13.893   6.084   2.397
   20    HE2  TYR   3           1HE      TYR   3 -11.242   6.738  -0.882
   21    HH   TYR   3           HH       TYR   3 -13.786   8.015   1.161
   22    H    ARG   4           HN       ARG   4 -12.195   0.780  -1.781
   23    HA   ARG   4           HA       ARG   4 -12.181  -2.074  -1.288
   24    HB2  ARG   4           2HB      ARG   4 -13.132  -1.266  -3.372
   25    HB3  ARG   4           3HB      ARG   4 -11.622  -0.465  -3.785
   26    HG2  ARG   4           2HG      ARG   4 -10.570  -2.428  -4.337
   27    HG3  ARG   4           3HG      ARG   4 -11.616  -3.404  -3.304
   28    HD2  ARG   4           2HD      ARG   4 -12.462  -2.053  -5.865
   29    HD3  ARG   4           3HD      ARG   4 -12.047  -3.759  -5.706
   30    HE   ARG   4           HE       ARG   4 -14.036  -3.243  -3.848
   31   HH11  ARG   4          2HH1      ARG   4 -13.655  -3.158  -7.307
   32   HH12  ARG   4          1HH1      ARG   4 -15.319  -3.517  -7.630
   33   HH21  ARG   4          2HH2      ARG   4 -16.229  -3.716  -4.260
   34   HH22  ARG   4          1HH2      ARG   4 -16.782  -3.833  -5.896
   35    H    ILE   5           HN       ILE   5 -10.370  -3.442  -1.773
   36    HA   ILE   5           HA       ILE   5  -7.778  -2.092  -1.381
   37    HB   ILE   5           HB       ILE   5  -8.414  -4.915  -0.537
   38   HG12  ILE   5          2HG1      ILE   5  -9.852  -3.404   0.725
   39   HG13  ILE   5          3HG1      ILE   5  -8.577  -4.028   1.766
   40   HG21  ILE   5          1HG2      ILE   5  -6.325  -5.006   0.352
   41   HG22  ILE   5          2HG2      ILE   5  -6.010  -3.855  -0.945
   42   HG23  ILE   5          3HG2      ILE   5  -6.277  -3.277   0.699
   43   HD11  ILE   5          3HD1      ILE   5  -8.388  -1.363   0.402
   44   HD12  ILE   5          1HD1      ILE   5  -9.125  -1.577   1.989
   45   HD13  ILE   5          2HD1      ILE   5  -7.425  -1.978   1.745
   46    H    GLU   6           HN       GLU   6  -6.826  -2.033  -3.325
   47    HA   GLU   6           HA       GLU   6  -6.772  -4.520  -4.905
   48    HB2  GLU   6           2HB      GLU   6  -6.971  -1.651  -5.721
   49    HB3  GLU   6           3HB      GLU   6  -6.170  -2.788  -6.796
   50    HG2  GLU   6           2HG      GLU   6  -8.964  -3.137  -5.739
   51    HG3  GLU   6           3HG      GLU   6  -8.568  -2.425  -7.302
   52    H    PHE   7           HN       PHE   7  -4.816  -5.009  -6.036
   53    HA   PHE   7           HA       PHE   7  -2.427  -3.592  -5.090
   54    HB2  PHE   7           2HB      PHE   7  -3.043  -6.516  -4.814
   55    HB3  PHE   7           3HB      PHE   7  -1.374  -5.977  -4.971
   56    HD1  PHE   7           1HD      PHE   7  -4.441  -5.502  -2.937
   57    HD2  PHE   7           2HD      PHE   7  -0.198  -5.220  -3.115
   58    HE1  PHE   7           1HE      PHE   7  -4.376  -5.018  -0.526
   59    HE2  PHE   7           2HE      PHE   7  -0.126  -4.737  -0.704
   60    HZ   PHE   7           HZ       PHE   7  -2.216  -4.637   0.595
   61    H    ASP   8           HN       ASP   8  -1.285  -2.951  -6.779
   62    HA   ASP   8           HA       ASP   8  -1.755  -3.511  -9.418
   63    HB2  ASP   8           2HB      ASP   8   0.770  -2.907  -9.700
   64    HB3  ASP   8           3HB      ASP   8  -0.347  -1.696  -9.075
   65    HA   PRO   9           HA       PRO   9  -0.225  -7.506 -10.379
   66    HB2  PRO   9           2HB      PRO   9   0.853  -7.127 -12.842
   67    HB3  PRO   9           3HB      PRO   9  -0.890  -7.128 -12.545
   68    HG2  PRO   9           2HG      PRO   9   0.977  -4.808 -12.852
   69    HG3  PRO   9           3HG      PRO   9  -0.647  -5.034 -13.526
   70    HD2  PRO   9           2HD      PRO   9  -0.179  -3.520 -11.331
   71    HD3  PRO   9           3HD      PRO   9  -1.685  -4.433 -11.558
   72    H    ARG  10           HN       ARG  10   1.900  -4.878 -10.009
   73    HA   ARG  10           HA       ARG  10   4.295  -6.522 -10.347
   74    HB2  ARG  10           2HB      ARG  10   3.875  -3.567  -9.918
   75    HB3  ARG  10           3HB      ARG  10   5.464  -4.314  -9.841
   76    HG2  ARG  10           2HG      ARG  10   3.674  -4.576 -12.237
   77    HG3  ARG  10           3HG      ARG  10   4.815  -3.244 -12.036
   78    HD2  ARG  10           2HD      ARG  10   6.628  -4.937 -11.767
   79    HD3  ARG  10           3HD      ARG  10   5.452  -6.187 -12.168
   80    HE   ARG  10           HE       ARG  10   5.530  -5.528 -14.375
   81   HH11  ARG  10          2HH1      ARG  10   7.220  -3.229 -12.380
   82   HH12  ARG  10          1HH1      ARG  10   7.932  -2.393 -13.720
   83   HH21  ARG  10          2HH2      ARG  10   6.461  -4.434 -16.148
   84   HH22  ARG  10          1HH2      ARG  10   7.499  -3.078 -15.862
   85    H    ALA  11           HN       ALA  11   2.631  -4.590  -7.883
   86    HA   ALA  11           HA       ALA  11   4.456  -5.079  -5.791
   87    HB1  ALA  11           1HB      ALA  11   1.511  -4.457  -5.601
   88    HB2  ALA  11           2HB      ALA  11   2.698  -4.293  -4.306
   89    HB3  ALA  11           3HB      ALA  11   2.806  -3.268  -5.737
   90    H    GLU  12           HN       GLU  12   1.438  -6.710  -6.718
   91    HA   GLU  12           HA       GLU  12   1.062  -8.481  -4.705
   92    HB2  GLU  12           2HB      GLU  12   0.677  -8.656  -7.648
   93    HB3  GLU  12           3HB      GLU  12   0.543 -10.148  -6.728
   94    HG2  GLU  12           2HG      GLU  12  -0.978  -7.693  -5.940
   95    HG3  GLU  12           3HG      GLU  12  -1.582  -8.796  -7.175
   96    H    LYS  13           HN       LYS  13   3.410  -8.826  -7.337
   97    HA   LYS  13           HA       LYS  13   4.400 -11.344  -6.411
   98    HB2  LYS  13           2HB      LYS  13   5.209  -9.373  -8.507
   99    HB3  LYS  13           3HB      LYS  13   6.363 -10.605  -8.013
  100    HG2  LYS  13           2HG      LYS  13   3.582 -11.358  -8.816
  101    HG3  LYS  13           3HG      LYS  13   4.828 -11.060 -10.031
  102    HD2  LYS  13           2HD      LYS  13   6.210 -12.698  -8.467
  103    HD3  LYS  13           3HD      LYS  13   4.590 -13.256  -8.042
  104    HE2  LYS  13           2HE      LYS  13   5.493 -12.967 -10.894
  105    HE3  LYS  13           3HE      LYS  13   5.768 -14.442  -9.968
  106    HZ1  LYS  13           3HZ      LYS  13   3.748 -15.041 -10.636
  107    HZ2  LYS  13           1HZ      LYS  13   3.369 -13.491 -11.198
  108    HZ3  LYS  13           2HZ      LYS  13   3.129 -13.882  -9.570
  109    H    GLU  14           HN       GLU  14   5.594  -8.001  -6.262
  110    HA   GLU  14           HA       GLU  14   8.011  -8.496  -4.971
  111    HB2  GLU  14           2HB      GLU  14   6.168  -6.112  -4.911
  112    HB3  GLU  14           3HB      GLU  14   7.721  -6.121  -4.088
  113    HG2  GLU  14           2HG      GLU  14   7.575  -6.817  -6.985
  114    HG3  GLU  14           3HG      GLU  14   7.515  -5.130  -6.478
  115    H    LEU  15           HN       LEU  15   4.758  -8.382  -3.727
  116    HA   LEU  15           HA       LEU  15   5.524  -8.221  -0.967
  117    HB2  LEU  15           2HB      LEU  15   3.340  -7.437  -1.887
  118    HB3  LEU  15           3HB      LEU  15   2.897  -9.125  -2.135
  119    HG   LEU  15           HG       LEU  15   3.424  -9.259   0.461
  120   HD11  LEU  15          1HD1      LEU  15   2.236  -6.537   0.421
  121   HD12  LEU  15          2HD1      LEU  15   3.982  -6.690   0.231
  122   HD13  LEU  15          3HD1      LEU  15   3.192  -7.339   1.668
  123   HD21  LEU  15          3HD2      LEU  15   0.820  -7.992  -0.018
  124   HD22  LEU  15          1HD2      LEU  15   1.211  -9.570   0.668
  125   HD23  LEU  15          2HD2      LEU  15   1.194  -9.349  -1.082
  126    H    GLU  16           HN       GLU  16   4.098 -10.814  -2.962
  127    HA   GLU  16           HA       GLU  16   4.128 -12.864  -1.136
  128    HB2  GLU  16           2HB      GLU  16   4.495 -12.813  -4.112
  129    HB3  GLU  16           3HB      GLU  16   4.617 -14.332  -3.236
  130    HG2  GLU  16           2HG      GLU  16   2.323 -13.590  -2.228
  131    HG3  GLU  16           3HG      GLU  16   2.252 -12.578  -3.670
  132    H    LYS  17           HN       LYS  17   6.812 -11.510  -2.926
  133    HA   LYS  17           HA       LYS  17   8.694 -13.553  -2.455
  134    HB2  LYS  17           2HB      LYS  17   8.881 -10.643  -3.142
  135    HB3  LYS  17           3HB      LYS  17  10.339 -11.528  -2.714
  136    HG2  LYS  17           2HG      LYS  17   9.647 -13.201  -4.508
  137    HG3  LYS  17           3HG      LYS  17   8.501 -11.969  -5.042
  138    HD2  LYS  17           2HD      LYS  17  10.550 -10.396  -5.053
  139    HD3  LYS  17           3HD      LYS  17  11.499 -11.885  -5.031
  140    HE2  LYS  17           2HE      LYS  17  10.227 -12.632  -7.046
  141    HE3  LYS  17           3HE      LYS  17   9.476 -11.039  -7.099
  142    HZ1  LYS  17           3HZ      LYS  17  11.363 -10.071  -7.838
  143    HZ2  LYS  17           1HZ      LYS  17  11.674 -11.625  -8.432
  144    HZ3  LYS  17           2HZ      LYS  17  12.386 -11.115  -6.985
  145    H    LEU  18           HN       LEU  18   7.589 -10.863  -0.513
  146    HA   LEU  18           HA       LEU  18   9.679 -10.893   1.395
  147    HB2  LEU  18           2HB      LEU  18   6.824  -9.951   1.572
  148    HB3  LEU  18           3HB      LEU  18   8.019  -9.704   2.844
  149    HG   LEU  18           HG       LEU  18   8.426  -8.665   0.053
  150   HD11  LEU  18          1HD1      LEU  18   7.570  -6.732   2.065
  151   HD12  LEU  18          2HD1      LEU  18   6.319  -7.890   1.614
  152   HD13  LEU  18          3HD1      LEU  18   7.093  -6.902   0.375
  153   HD21  LEU  18          3HD2      LEU  18  10.138  -7.407   0.949
  154   HD22  LEU  18          1HD2      LEU  18  10.262  -8.896   1.888
  155   HD23  LEU  18          2HD2      LEU  18   9.478  -7.477   2.584
  156    H    ASP  19           HN       ASP  19   9.003 -11.284   3.819
  157    HA   ASP  19           HA       ASP  19   8.738 -14.062   4.153
  158    HB2  ASP  19           2HB      ASP  19   9.749 -12.233   5.730
  159    HB3  ASP  19           3HB      ASP  19   8.112 -12.149   6.375
  160    H    ARG  20           HN       ARG  20   7.039 -15.369   4.524
  161    HA   ARG  20           HA       ARG  20   4.492 -14.774   3.730
  162    HB2  ARG  20           2HB      ARG  20   5.589 -16.842   5.597
  163    HB3  ARG  20           3HB      ARG  20   3.849 -16.705   5.384
  164    HG2  ARG  20           2HG      ARG  20   4.038 -17.153   3.038
  165    HG3  ARG  20           3HG      ARG  20   5.800 -17.103   3.129
  166    HD2  ARG  20           2HD      ARG  20   5.890 -19.101   4.382
  167    HD3  ARG  20           3HD      ARG  20   4.160 -19.057   4.717
  168    HE   ARG  20           HE       ARG  20   4.876 -19.276   1.922
  169   HH11  ARG  20          2HH1      ARG  20   4.048 -20.948   4.861
  170   HH12  ARG  20          1HH1      ARG  20   3.534 -22.390   4.050
  171   HH21  ARG  20          2HH2      ARG  20   4.201 -21.169   0.842
  172   HH22  ARG  20          1HH2      ARG  20   3.622 -22.515   1.764
  173    H    GLU  21           HN       GLU  21   5.757 -14.643   7.047
  174    HA   GLU  21           HA       GLU  21   3.366 -13.896   8.305
  175    HB2  GLU  21           2HB      GLU  21   5.088 -14.636   9.721
  176    HB3  GLU  21           3HB      GLU  21   6.264 -13.538   9.013
  177    HG2  GLU  21           2HG      GLU  21   5.428 -11.699  10.161
  178    HG3  GLU  21           3HG      GLU  21   3.890 -12.491  10.500
  179    H    VAL  22           HN       VAL  22   5.806 -12.018   6.630
  180    HA   VAL  22           HA       VAL  22   4.911  -9.461   7.492
  181    HB   VAL  22           HB       VAL  22   6.618 -10.363   5.185
  182   HG11  VAL  22          1HG1      VAL  22   7.095  -7.803   5.041
  183   HG12  VAL  22          2HG1      VAL  22   5.705  -8.490   4.197
  184   HG13  VAL  22          3HG1      VAL  22   5.481  -7.657   5.736
  185   HG21  VAL  22          3HG2      VAL  22   7.482  -8.486   7.328
  186   HG22  VAL  22          1HG2      VAL  22   7.300 -10.195   7.726
  187   HG23  VAL  22          2HG2      VAL  22   8.410  -9.700   6.447
  188    H    ALA  23           HN       ALA  23   4.421 -11.277   4.467
  189    HA   ALA  23           HA       ALA  23   2.826  -9.464   3.121
  190    HB1  ALA  23           1HB      ALA  23   3.502 -12.233   2.869
  191    HB2  ALA  23           2HB      ALA  23   1.785 -12.010   2.530
  192    HB3  ALA  23           3HB      ALA  23   2.990 -11.093   1.624
  193    H    ARG  24           HN       ARG  24   1.891 -11.880   5.530
  194    HA   ARG  24           HA       ARG  24  -0.903 -11.454   5.310
  195    HB2  ARG  24           2HB      ARG  24   0.097 -13.484   6.307
  196    HB3  ARG  24           3HB      ARG  24   0.674 -12.519   7.659
  197    HG2  ARG  24           2HG      ARG  24  -1.813 -11.892   7.970
  198    HG3  ARG  24           3HG      ARG  24  -2.122 -13.308   6.962
  199    HD2  ARG  24           2HD      ARG  24  -0.254 -13.590   9.259
  200    HD3  ARG  24           3HD      ARG  24  -1.981 -13.477   9.598
  201    HE   ARG  24           HE       ARG  24  -1.480 -15.391   7.570
  202   HH11  ARG  24          2HH1      ARG  24  -1.232 -14.893  11.006
  203   HH12  ARG  24          1HH1      ARG  24  -1.375 -16.577  11.392
  204   HH21  ARG  24          2HH2      ARG  24  -1.669 -17.609   8.064
  205   HH22  ARG  24          1HH2      ARG  24  -1.623 -18.121   9.718
  206    H    ARG  25           HN       ARG  25   1.557 -10.194   7.538
  207    HA   ARG  25           HA       ARG  25  -0.112  -8.722   9.208
  208    HB2  ARG  25           2HB      ARG  25   2.056  -8.870   9.995
  209    HB3  ARG  25           3HB      ARG  25   2.763  -8.517   8.424
  210    HG2  ARG  25           2HG      ARG  25   2.237  -6.192   8.638
  211    HG3  ARG  25           3HG      ARG  25   1.320  -6.490  10.115
  212    HD2  ARG  25           2HD      ARG  25   4.263  -7.062   9.808
  213    HD3  ARG  25           3HD      ARG  25   3.614  -5.566  10.479
  214    HE   ARG  25           HE       ARG  25   2.463  -7.622  11.918
  215   HH11  ARG  25          2HH1      ARG  25   5.674  -6.430  11.293
  216   HH12  ARG  25          1HH1      ARG  25   6.307  -6.956  12.818
  217   HH21  ARG  25          2HH2      ARG  25   3.284  -8.319  13.929
  218   HH22  ARG  25          1HH2      ARG  25   4.947  -8.031  14.316
  219    H    ILE  26           HN       ILE  26   1.516  -7.728   6.210
  220    HA   ILE  26           HA       ILE  26   0.639  -5.064   6.200
  221    HB   ILE  26           HB       ILE  26   1.348  -6.869   3.887
  222   HG12  ILE  26          2HG1      ILE  26   2.981  -4.638   5.089
  223   HG13  ILE  26          3HG1      ILE  26   3.084  -6.293   5.679
  224   HG21  ILE  26          1HG2      ILE  26   1.050  -3.868   3.903
  225   HG22  ILE  26          2HG2      ILE  26   1.551  -4.865   2.539
  226   HG23  ILE  26          3HG2      ILE  26  -0.088  -5.002   3.175
  227   HD11  ILE  26          3HD1      ILE  26   4.062  -7.059   3.732
  228   HD12  ILE  26          1HD1      ILE  26   3.478  -5.695   2.780
  229   HD13  ILE  26          2HD1      ILE  26   4.790  -5.466   3.937
  230    H    LEU  27           HN       LEU  27  -0.610  -7.744   4.198
  231    HA   LEU  27           HA       LEU  27  -2.805  -6.534   3.121
  232    HB2  LEU  27           2HB      LEU  27  -2.546  -9.366   4.113
  233    HB3  LEU  27           3HB      LEU  27  -3.866  -8.793   3.095
  234    HG   LEU  27           HG       LEU  27  -0.970  -8.706   2.265
  235   HD11  LEU  27          1HD1      LEU  27  -1.024 -10.864   1.769
  236   HD12  LEU  27          2HD1      LEU  27  -2.521 -10.657   0.862
  237   HD13  LEU  27          3HD1      LEU  27  -2.579 -10.987   2.593
  238   HD21  LEU  27          3HD2      LEU  27  -2.390  -8.792   0.001
  239   HD22  LEU  27          1HD2      LEU  27  -1.955  -7.284   0.804
  240   HD23  LEU  27          2HD2      LEU  27  -3.560  -7.976   1.038
  241    H    ARG  28           HN       ARG  28  -2.711  -8.257   6.236
  242    HA   ARG  28           HA       ARG  28  -5.375  -7.825   6.960
  243    HB2  ARG  28           2HB      ARG  28  -2.867  -8.486   8.418
  244    HB3  ARG  28           3HB      ARG  28  -4.233  -7.922   9.372
  245    HG2  ARG  28           2HG      ARG  28  -5.618  -9.712   8.411
  246    HG3  ARG  28           3HG      ARG  28  -4.210 -10.295   7.520
  247    HD2  ARG  28           2HD      ARG  28  -3.092 -10.924   9.488
  248    HD3  ARG  28           3HD      ARG  28  -4.180  -9.980  10.505
  249    HE   ARG  28           HE       ARG  28  -4.620 -12.640   9.484
  250   HH11  ARG  28          2HH1      ARG  28  -6.090  -9.763  10.782
  251   HH12  ARG  28          1HH1      ARG  28  -7.513 -10.582  11.335
  252   HH21  ARG  28          2HH2      ARG  28  -6.489 -13.730  10.208
  253   HH22  ARG  28          1HH2      ARG  28  -7.738 -12.839  11.009
  254    H    PHE  29           HN       PHE  29  -2.470  -5.940   7.784
  255    HA   PHE  29           HA       PHE  29  -3.600  -4.004   9.378
  256    HB2  PHE  29           2HB      PHE  29  -1.263  -3.940   9.196
  257    HB3  PHE  29           3HB      PHE  29  -1.309  -3.922   7.436
  258    HD1  PHE  29           1HD      PHE  29  -1.925  -1.892  10.458
  259    HD2  PHE  29           2HD      PHE  29  -1.379  -1.898   6.237
  260    HE1  PHE  29           1HE      PHE  29  -1.727   0.560  10.484
  261    HE2  PHE  29           2HE      PHE  29  -1.179   0.555   6.256
  262    HZ   PHE  29           HZ       PHE  29  -1.352   1.787   8.381
  263    H    LEU  30           HN       LEU  30  -3.712  -4.306   5.890
  264    HA   LEU  30           HA       LEU  30  -4.945  -1.710   5.540
  265    HB2  LEU  30           2HB      LEU  30  -4.167  -3.944   3.706
  266    HB3  LEU  30           3HB      LEU  30  -5.223  -2.650   3.144
  267    HG   LEU  30           HG       LEU  30  -2.620  -1.920   4.399
  268   HD11  LEU  30          1HD1      LEU  30  -2.494  -2.296   1.505
  269   HD12  LEU  30          2HD1      LEU  30  -2.617  -3.799   2.418
  270   HD13  LEU  30          3HD1      LEU  30  -1.306  -2.669   2.754
  271   HD21  LEU  30          3HD2      LEU  30  -3.724  -0.007   3.844
  272   HD22  LEU  30          1HD2      LEU  30  -4.593  -0.762   2.508
  273   HD23  LEU  30          2HD2      LEU  30  -2.900  -0.307   2.313
  274    H    ARG  31           HN       ARG  31  -5.898  -5.097   5.568
  275    HA   ARG  31           HA       ARG  31  -8.623  -4.513   4.813
  276    HB2  ARG  31           2HB      ARG  31  -7.155  -7.007   5.626
  277    HB3  ARG  31           3HB      ARG  31  -8.908  -6.993   5.482
  278    HG2  ARG  31           2HG      ARG  31  -8.852  -6.684   3.193
  279    HG3  ARG  31           3HG      ARG  31  -7.213  -6.028   3.221
  280    HD2  ARG  31           2HD      ARG  31  -6.370  -8.265   3.848
  281    HD3  ARG  31           3HD      ARG  31  -8.011  -8.895   3.714
  282    HE   ARG  31           HE       ARG  31  -7.185  -7.586   1.324
  283   HH11  ARG  31          2HH1      ARG  31  -6.888 -10.546   3.133
  284   HH12  ARG  31          1HH1      ARG  31  -6.564 -11.519   1.737
  285   HH21  ARG  31          2HH2      ARG  31  -6.759  -8.857  -0.522
  286   HH22  ARG  31          1HH2      ARG  31  -6.490 -10.557  -0.341
  287    H    GLU  32           HN       GLU  32  -6.868  -4.220   7.625
  288    HA   GLU  32           HA       GLU  32  -9.246  -4.631   9.313
  289    HB2  GLU  32           2HB      GLU  32  -6.306  -4.831   9.880
  290    HB3  GLU  32           3HB      GLU  32  -7.440  -4.512  11.186
  291    HG2  GLU  32           2HG      GLU  32  -7.604  -6.874   9.331
  292    HG3  GLU  32           3HG      GLU  32  -6.849  -6.900  10.923
  293    H    ARG  33           HN       ARG  33  -6.316  -2.592   9.347
  294    HA   ARG  33           HA       ARG  33  -7.561  -0.506  10.808
  295    HB2  ARG  33           2HB      ARG  33  -5.089  -0.314   9.081
  296    HB3  ARG  33           3HB      ARG  33  -5.541   0.756  10.401
  297    HG2  ARG  33           2HG      ARG  33  -5.145  -2.157  10.918
  298    HG3  ARG  33           3HG      ARG  33  -3.752  -1.082  10.777
  299    HD2  ARG  33           2HD      ARG  33  -4.258   0.052  12.696
  300    HD3  ARG  33           3HD      ARG  33  -5.989  -0.246  12.543
  301    HE   ARG  33           HE       ARG  33  -4.592  -2.660  13.048
  302   HH11  ARG  33          2HH1      ARG  33  -5.705   0.255  14.592
  303   HH12  ARG  33          1HH1      ARG  33  -5.831  -0.468  16.161
  304   HH21  ARG  33          2HH2      ARG  33  -4.754  -3.624  15.108
  305   HH22  ARG  33          1HH2      ARG  33  -5.289  -2.675  16.454
  306    H    VAL  34           HN       VAL  34  -6.210  -0.263   7.520
  307    HA   VAL  34           HA       VAL  34  -7.541   2.037   6.765
  308    HB   VAL  34           HB       VAL  34  -6.755  -0.261   4.968
  309   HG11  VAL  34          1HG1      VAL  34  -6.816   1.269   3.154
  310   HG12  VAL  34          2HG1      VAL  34  -8.350   1.436   4.011
  311   HG13  VAL  34          3HG1      VAL  34  -7.079   2.639   4.231
  312   HG21  VAL  34          3HG2      VAL  34  -5.236   1.947   6.244
  313   HG22  VAL  34          1HG2      VAL  34  -4.738   0.298   5.869
  314   HG23  VAL  34          2HG2      VAL  34  -4.813   1.508   4.589
  315    H    ALA  35           HN       ALA  35  -8.578  -1.332   6.410
  316    HA   ALA  35           HA       ALA  35 -10.842  -1.039   4.885
  317    HB1  ALA  35           1HB      ALA  35 -10.731  -2.852   7.282
  318    HB2  ALA  35           2HB      ALA  35 -11.607  -3.093   5.770
  319    HB3  ALA  35           3HB      ALA  35  -9.846  -3.176   5.792
  320    H    THR  36           HN       THR  36 -10.491  -0.499   8.365
  321    HA   THR  36           HA       THR  36 -13.279   0.215   8.664
  322    HB   THR  36           HB       THR  36 -12.792   0.571  10.998
  323    HG1  THR  36           1HG      THR  36 -10.553   0.325  11.700
  324   HG21  THR  36          3HG2      THR  36 -11.180  -1.690  11.140
  325   HG22  THR  36          1HG2      THR  36 -12.042  -1.862   9.611
  326   HG23  THR  36          2HG2      THR  36 -12.943  -1.656  11.114
  327    H    LEU  37           HN       LEU  37 -10.160   1.901   9.039
  328    HA   LEU  37           HA       LEU  37 -10.822   4.399   9.696
  329    HB2  LEU  37           2HB      LEU  37  -8.935   3.456   7.567
  330    HB3  LEU  37           3HB      LEU  37  -9.113   5.172   7.926
  331    HG   LEU  37           HG       LEU  37  -8.307   3.111   9.972
  332   HD11  LEU  37          1HD1      LEU  37  -6.068   4.506   9.576
  333   HD12  LEU  37          2HD1      LEU  37  -6.732   4.578   7.945
  334   HD13  LEU  37          3HD1      LEU  37  -6.433   3.016   8.706
  335   HD21  LEU  37          3HD2      LEU  37  -8.785   4.799  11.352
  336   HD22  LEU  37          1HD2      LEU  37  -8.925   5.956  10.028
  337   HD23  LEU  37          2HD2      LEU  37  -7.340   5.579  10.705
  338    H    GLU  38           HN       GLU  38 -12.687   5.374   9.163
  339    HA   GLU  38           HA       GLU  38 -14.270   5.207   7.002
  340    HB2  GLU  38           2HB      GLU  38 -14.390   6.775   9.095
  341    HB3  GLU  38           3HB      GLU  38 -13.666   7.960   8.018
  342    HG2  GLU  38           2HG      GLU  38 -15.585   7.370   6.416
  343    HG3  GLU  38           3HG      GLU  38 -16.343   6.641   7.831
  344    H    ASP  39           HN       ASP  39 -11.180   6.824   7.121
  345    HA   ASP  39           HA       ASP  39 -11.328   7.210   4.215
  346    HB2  ASP  39           2HB      ASP  39 -11.648   9.350   5.729
  347    HB3  ASP  39           3HB      ASP  39  -9.895   9.252   5.862
  348    HA   PRO  40           HA       PRO  40  -7.445   5.131   4.267
  349    HB2  PRO  40           2HB      PRO  40  -6.549   5.874   1.814
  350    HB3  PRO  40           3HB      PRO  40  -7.833   4.681   2.047
  351    HG2  PRO  40           2HG      PRO  40  -8.049   7.587   1.360
  352    HG3  PRO  40           3HG      PRO  40  -8.941   6.209   0.689
  353    HD2  PRO  40           2HD      PRO  40  -9.995   7.852   2.566
  354    HD3  PRO  40           3HD      PRO  40 -10.403   6.127   2.469
  355    H    ARG  41           HN       ARG  41  -7.743   8.558   3.894
  356    HA   ARG  41           HA       ARG  41  -4.888   9.042   4.029
  357    HB2  ARG  41           2HB      ARG  41  -7.323  10.776   3.803
  358    HB3  ARG  41           3HB      ARG  41  -5.788  11.483   4.286
  359    HG2  ARG  41           2HG      ARG  41  -4.881  10.280   2.161
  360    HG3  ARG  41           3HG      ARG  41  -6.578  10.273   1.680
  361    HD2  ARG  41           2HD      ARG  41  -5.351  12.805   2.669
  362    HD3  ARG  41           3HD      ARG  41  -5.006  12.267   1.026
  363    HE   ARG  41           HE       ARG  41  -7.794  12.222   1.550
  364   HH11  ARG  41          2HH1      ARG  41  -5.146  14.370   0.850
  365   HH12  ARG  41          1HH1      ARG  41  -6.148  15.576   0.114
  366   HH21  ARG  41          2HH2      ARG  41  -9.124  13.803   0.584
  367   HH22  ARG  41          1HH2      ARG  41  -8.411  15.253  -0.036
  368    H    SER  42           HN       SER  42  -5.993   7.579   6.216
  369    HA   SER  42           HA       SER  42  -5.915   9.512   8.424
  370    HB2  SER  42           2HB      SER  42  -7.782   7.751   8.183
  371    HB3  SER  42           3HB      SER  42  -6.566   6.582   8.696
  372    HG   SER  42           HG       SER  42  -7.880   8.522  10.149
  373    H    LEU  43           HN       LEU  43  -4.450   6.473   7.332
  374    HA   LEU  43           HA       LEU  43  -2.318   6.829   9.320
  375    HB2  LEU  43           2HB      LEU  43  -3.365   4.462   7.819
  376    HB3  LEU  43           3HB      LEU  43  -1.738   4.439   8.497
  377    HG   LEU  43           HG       LEU  43  -4.042   5.113  10.271
  378   HD11  LEU  43          1HD1      LEU  43  -4.800   2.984  10.495
  379   HD12  LEU  43          2HD1      LEU  43  -3.261   2.264  10.025
  380   HD13  LEU  43          3HD1      LEU  43  -4.337   2.926   8.794
  381   HD21  LEU  43          3HD2      LEU  43  -2.603   3.958  11.917
  382   HD22  LEU  43          1HD2      LEU  43  -1.811   5.341  11.160
  383   HD23  LEU  43          2HD2      LEU  43  -1.402   3.703  10.649
  384    H    GLY  44           HN       GLY  44  -0.110   6.565   8.684
  385    HA2  GLY  44           1HA      GLY  44   1.686   6.618   7.210
  386    HA3  GLY  44           2HA      GLY  44   0.554   6.505   5.871
  387    H    GLU  45           HN       GLU  45   2.054   8.113   4.932
  388    HA   GLU  45           HA       GLU  45   1.130  10.812   5.601
  389    HB2  GLU  45           2HB      GLU  45   3.304  11.750   5.601
  390    HB3  GLU  45           3HB      GLU  45   3.390  10.340   6.647
  391    HG2  GLU  45           2HG      GLU  45   5.294  10.056   5.440
  392    HG3  GLU  45           3HG      GLU  45   4.162   9.151   4.437
  393    HA   PRO  46           HA       PRO  46   0.573  11.128   1.247
  394    HB2  PRO  46           2HB      PRO  46   0.553  13.833   1.008
  395    HB3  PRO  46           3HB      PRO  46  -0.791  12.920   1.704
  396    HG2  PRO  46           2HG      PRO  46   1.407  14.407   3.090
  397    HG3  PRO  46           3HG      PRO  46  -0.325  14.363   3.467
  398    HD2  PRO  46           2HD      PRO  46   1.500  12.896   4.827
  399    HD3  PRO  46           3HD      PRO  46  -0.164  12.339   4.558
  400    H    LEU  47           HN       LEU  47   1.565  12.108  -0.700
  401    HA   LEU  47           HA       LEU  47   4.474  12.280  -0.368
  402    HB2  LEU  47           2HB      LEU  47   2.762  11.687  -2.775
  403    HB3  LEU  47           3HB      LEU  47   4.515  11.861  -2.831
  404    HG   LEU  47           HG       LEU  47   3.450   9.494  -2.752
  405   HD11  LEU  47          1HD1      LEU  47   5.701  10.236  -0.890
  406   HD12  LEU  47          2HD1      LEU  47   5.850   9.988  -2.629
  407   HD13  LEU  47          3HD1      LEU  47   5.396   8.643  -1.583
  408   HD21  LEU  47          3HD2      LEU  47   3.106   8.619  -0.520
  409   HD22  LEU  47          1HD2      LEU  47   2.003   9.963  -0.816
  410   HD23  LEU  47          2HD2      LEU  47   3.439  10.203   0.180
  411    H    ARG  48           HN       ARG  48   5.688  13.894  -1.420
  412    HA   ARG  48           HA       ARG  48   4.298  16.091  -2.706
  413    HB2  ARG  48           2HB      ARG  48   4.123  16.658  -0.324
  414    HB3  ARG  48           3HB      ARG  48   5.866  16.505  -0.155
  415    HG2  ARG  48           2HG      ARG  48   5.616  18.777  -0.343
  416    HG3  ARG  48           3HG      ARG  48   5.933  18.320  -2.018
  417    HD2  ARG  48           2HD      ARG  48   4.111  19.760  -2.181
  418    HD3  ARG  48           3HD      ARG  48   3.378  18.158  -2.238
  419    HE   ARG  48           HE       ARG  48   3.415  18.965   0.424
  420   HH11  ARG  48          2HH1      ARG  48   1.945  19.938  -2.579
  421   HH12  ARG  48          1HH1      ARG  48   0.535  20.604  -1.824
  422   HH21  ARG  48          2HH2      ARG  48   1.563  19.839   1.430
  423   HH22  ARG  48          1HH2      ARG  48   0.319  20.548   0.457
  424    H    GLY  49           HN       GLY  49   5.492  16.784  -4.355
  425    HA2  GLY  49           1HA      GLY  49   8.109  17.555  -4.396
  426    HA3  GLY  49           2HA      GLY  49   8.181  15.826  -4.701
  427    HA   PRO  50           HA       PRO  50   7.104  18.444  -8.570
  428    HB2  PRO  50           2HB      PRO  50   9.578  18.705  -9.657
  429    HB3  PRO  50           3HB      PRO  50   8.880  19.902  -8.560
  430    HG2  PRO  50           2HG      PRO  50  10.841  17.716  -7.978
  431    HG3  PRO  50           3HG      PRO  50  10.840  19.398  -7.415
  432    HD2  PRO  50           2HD      PRO  50   9.986  17.344  -5.871
  433    HD3  PRO  50           3HD      PRO  50   9.293  18.975  -5.759
  434    H    GLU  51           HN       GLU  51   8.425  15.538  -7.646
  435    HA   GLU  51           HA       GLU  51   8.189  14.469 -10.380
  436    HB2  GLU  51           2HB      GLU  51   9.915  12.777  -9.751
  437    HB3  GLU  51           3HB      GLU  51  10.525  14.424  -9.835
  438    HG2  GLU  51           2HG      GLU  51  10.097  14.479  -7.297
  439    HG3  GLU  51           3HG      GLU  51  10.029  12.722  -7.429
  440    H    LEU  52           HN       LEU  52   6.130  14.659  -8.403
  441    HA   LEU  52           HA       LEU  52   5.475  11.823  -8.183
  442    HB2  LEU  52           2HB      LEU  52   5.672  13.751  -5.908
  443    HB3  LEU  52           3HB      LEU  52   4.496  12.440  -5.851
  444    HG   LEU  52           HG       LEU  52   7.374  11.828  -6.381
  445   HD11  LEU  52          1HD1      LEU  52   8.073  12.340  -4.337
  446   HD12  LEU  52          2HD1      LEU  52   6.670  11.573  -3.593
  447   HD13  LEU  52          3HD1      LEU  52   6.577  13.251  -4.129
  448   HD21  LEU  52          3HD2      LEU  52   6.314   9.934  -4.716
  449   HD22  LEU  52          1HD2      LEU  52   6.392   9.820  -6.474
  450   HD23  LEU  52          2HD2      LEU  52   4.920  10.398  -5.693
  451    H    GLY  53           HN       GLY  53   3.107  11.656  -7.282
  452    HA2  GLY  53           1HA      GLY  53   1.503  13.817  -8.501
  453    HA3  GLY  53           2HA      GLY  53   1.153  12.124  -8.817
  454    H    ARG  54           HN       ARG  54  -0.744  11.734  -7.864
  455    HA   ARG  54           HA       ARG  54  -1.249  12.815  -5.190
  456    HB2  ARG  54           2HB      ARG  54  -2.896  12.936  -7.213
  457    HB3  ARG  54           3HB      ARG  54  -3.258  11.268  -6.790
  458    HG2  ARG  54           2HG      ARG  54  -4.298  11.837  -4.844
  459    HG3  ARG  54           3HG      ARG  54  -3.337  13.302  -4.630
  460    HD2  ARG  54           2HD      ARG  54  -5.236  13.120  -6.923
  461    HD3  ARG  54           3HD      ARG  54  -5.865  13.443  -5.308
  462    HE   ARG  54           HE       ARG  54  -3.848  15.242  -5.596
  463   HH11  ARG  54          2HH1      ARG  54  -6.673  14.438  -7.464
  464   HH12  ARG  54          1HH1      ARG  54  -6.878  16.041  -8.087
  465   HH21  ARG  54          2HH2      ARG  54  -4.107  17.357  -6.409
  466   HH22  ARG  54          1HH2      ARG  54  -5.417  17.701  -7.487
  467    H    PHE  55           HN       PHE  55   0.652  10.755  -5.372
  468    HA   PHE  55           HA       PHE  55  -0.628   8.265  -4.661
  469    HB2  PHE  55           2HB      PHE  55   2.296   9.033  -4.551
  470    HB3  PHE  55           3HB      PHE  55   1.647   7.402  -4.413
  471    HD1  PHE  55           1HD      PHE  55  -0.449   7.619  -6.577
  472    HD2  PHE  55           2HD      PHE  55   3.646   8.773  -6.458
  473    HE1  PHE  55           1HE      PHE  55  -0.308   7.356  -9.019
  474    HE2  PHE  55           2HE      PHE  55   3.794   8.512  -8.900
  475    HZ   PHE  55           HZ       PHE  55   1.815   7.804 -10.184
  476    H    TRP  56           HN       TRP  56  -0.005   7.126  -2.635
  477    HA   TRP  56           HA       TRP  56   0.313   8.996  -0.383
  478    HB2  TRP  56           2HB      TRP  56  -2.065   8.180  -0.723
  479    HB3  TRP  56           3HB      TRP  56  -1.480   6.568  -0.319
  480    HD1  TRP  56           1HD      TRP  56  -0.989   6.041   2.219
  481    HE1  TRP  56           1HE      TRP  56  -1.496   7.300   4.405
  482    HE3  TRP  56           3HE      TRP  56  -2.231  10.598   0.261
  483    HZ2  TRP  56           2HZ      TRP  56  -2.315   9.884   5.196
  484    HZ3  TRP  56           3HZ      TRP  56  -2.865  12.409   1.801
  485    HH2  TRP  56           2HH      TRP  56  -2.906  12.058   4.217
  486    H    LYS  57           HN       LYS  57   1.267   8.113   1.522
  487    HA   LYS  57           HA       LYS  57   2.840   5.672   1.018
  488    HB2  LYS  57           2HB      LYS  57   4.013   7.993   1.189
  489    HB3  LYS  57           3HB      LYS  57   3.722   7.824   2.915
  490    HG2  LYS  57           2HG      LYS  57   5.794   6.912   2.803
  491    HG3  LYS  57           3HG      LYS  57   4.836   5.460   2.501
  492    HD2  LYS  57           2HD      LYS  57   6.314   5.303   0.767
  493    HD3  LYS  57           3HD      LYS  57   5.062   6.276  -0.009
  494    HE2  LYS  57           2HE      LYS  57   7.002   7.429  -0.537
  495    HE3  LYS  57           3HE      LYS  57   6.416   8.292   0.884
  496    HZ1  LYS  57           3HZ      LYS  57   8.857   6.885   0.523
  497    HZ2  LYS  57           1HZ      LYS  57   8.013   6.275   1.856
  498    HZ3  LYS  57           2HZ      LYS  57   8.395   7.921   1.778
  499    H    TYR  58           HN       TYR  58   2.238   4.028   2.249
  500    HA   TYR  58           HA       TYR  58   0.948   4.578   4.829
  501    HB2  TYR  58           2HB      TYR  58   0.865   2.222   2.957
  502    HB3  TYR  58           3HB      TYR  58   0.322   2.087   4.626
  503    HD1  TYR  58           1HD      TYR  58  -1.157   4.445   5.183
  504    HD2  TYR  58           2HD      TYR  58  -0.939   2.284   1.525
  505    HE1  TYR  58           1HE      TYR  58  -3.364   5.322   4.540
  506    HE2  TYR  58           2HE      TYR  58  -3.144   3.155   0.872
  507    HH   TYR  58           HH       TYR  58  -5.248   4.055   2.248
  508    H    ARG  59           HN       ARG  59   1.843   3.970   6.708
  509    HA   ARG  59           HA       ARG  59   4.448   2.619   6.585
  510    HB2  ARG  59           2HB      ARG  59   3.912   4.957   7.750
  511    HB3  ARG  59           3HB      ARG  59   3.476   3.903   9.089
  512    HG2  ARG  59           2HG      ARG  59   6.080   3.428   7.753
  513    HG3  ARG  59           3HG      ARG  59   5.922   4.854   8.782
  514    HD2  ARG  59           2HD      ARG  59   5.318   2.015   9.602
  515    HD3  ARG  59           3HD      ARG  59   6.775   2.916  10.021
  516    HE   ARG  59           HE       ARG  59   4.543   4.385  10.859
  517   HH11  ARG  59          2HH1      ARG  59   6.217   1.425  11.605
  518   HH12  ARG  59          1HH1      ARG  59   5.749   1.428  13.274
  519   HH21  ARG  59          2HH2      ARG  59   3.920   4.400  13.053
  520   HH22  ARG  59          1HH2      ARG  59   4.442   3.120  14.096
  521    H    VAL  60           HN       VAL  60   4.684   0.623   7.355
  522    HA   VAL  60           HA       VAL  60   2.660  -0.421   9.220
  523    HB   VAL  60           HB       VAL  60   3.801  -1.842   6.813
  524   HG11  VAL  60          1HG1      VAL  60   1.780  -3.348   8.148
  525   HG12  VAL  60          2HG1      VAL  60   3.455  -3.793   7.815
  526   HG13  VAL  60          3HG1      VAL  60   3.047  -2.940   9.304
  527   HG21  VAL  60          3HG2      VAL  60   1.061  -0.865   7.561
  528   HG22  VAL  60          1HG2      VAL  60   2.001  -0.509   6.112
  529   HG23  VAL  60          2HG2      VAL  60   1.307  -2.115   6.341
  530    H    GLY  61           HN       GLY  61   4.332   0.180  10.802
  531    HA2  GLY  61           1HA      GLY  61   5.871  -0.548  12.354
  532    HA3  GLY  61           2HA      GLY  61   5.906  -2.091  11.514
  533    H    ASP  62           HN       ASP  62   7.375  -2.394   9.791
  534    HA   ASP  62           HA       ASP  62   9.471  -0.342   9.565
  535    HB2  ASP  62           2HB      ASP  62  10.007  -3.313   9.722
  536    HB3  ASP  62           3HB      ASP  62  11.200  -2.019   9.667
  537    H    TYR  63           HN       TYR  63   7.190  -1.084   7.844
  538    HA   TYR  63           HA       TYR  63   8.730  -1.591   5.399
  539    HB2  TYR  63           2HB      TYR  63   6.126  -2.932   6.149
  540    HB3  TYR  63           3HB      TYR  63   6.838  -2.983   4.540
  541    HD1  TYR  63           1HD      TYR  63   7.670  -3.767   8.094
  542    HD2  TYR  63           2HD      TYR  63   8.255  -4.733   3.992
  543    HE1  TYR  63           1HE      TYR  63   8.998  -5.730   8.752
  544    HE2  TYR  63           2HE      TYR  63   9.583  -6.700   4.639
  545    HH   TYR  63           HH       TYR  63   9.880  -8.177   6.540
  546    H    ARG  64           HN       ARG  64   8.104  -0.424   3.635
  547    HA   ARG  64           HA       ARG  64   6.032   1.601   4.111
  548    HB2  ARG  64           2HB      ARG  64   8.214   1.593   2.019
  549    HB3  ARG  64           3HB      ARG  64   7.128   2.924   2.396
  550    HG2  ARG  64           2HG      ARG  64   9.079   1.765   4.368
  551    HG3  ARG  64           3HG      ARG  64   9.438   3.139   3.321
  552    HD2  ARG  64           2HD      ARG  64   6.965   3.217   4.974
  553    HD3  ARG  64           3HD      ARG  64   8.516   3.471   5.772
  554    HE   ARG  64           HE       ARG  64   8.098   5.082   3.416
  555   HH11  ARG  64          2HH1      ARG  64   7.717   4.849   6.869
  556   HH12  ARG  64          1HH1      ARG  64   7.635   6.563   7.107
  557   HH21  ARG  64          2HH2      ARG  64   7.992   7.341   3.717
  558   HH22  ARG  64          1HH2      ARG  64   7.791   7.980   5.313
  559    H    LEU  65           HN       LEU  65   4.296   1.823   2.789
  560    HA   LEU  65           HA       LEU  65   4.132   0.083   0.426
  561    HB2  LEU  65           2HB      LEU  65   1.775   0.533   2.221
  562    HB3  LEU  65           3HB      LEU  65   1.997  -0.697   0.978
  563    HG   LEU  65           HG       LEU  65   3.650  -0.684   3.485
  564   HD11  LEU  65          1HD1      LEU  65   1.297  -0.678   4.157
  565   HD12  LEU  65          2HD1      LEU  65   2.061  -2.235   4.474
  566   HD13  LEU  65          3HD1      LEU  65   0.990  -2.045   3.086
  567   HD21  LEU  65          3HD2      LEU  65   3.579  -3.181   2.913
  568   HD22  LEU  65          1HD2      LEU  65   4.564  -2.130   1.896
  569   HD23  LEU  65          2HD2      LEU  65   2.980  -2.667   1.335
  570    H    ILE  66           HN       ILE  66   4.258   1.634  -1.113
  571    HA   ILE  66           HA       ILE  66   2.742   4.093  -0.871
  572    HB   ILE  66           HB       ILE  66   4.262   3.214  -3.312
  573   HG12  ILE  66          2HG1      ILE  66   5.329   4.433  -0.764
  574   HG13  ILE  66          3HG1      ILE  66   5.840   2.935  -1.535
  575   HG21  ILE  66          1HG2      ILE  66   2.690   5.325  -3.036
  576   HG22  ILE  66          2HG2      ILE  66   4.146   6.008  -2.316
  577   HG23  ILE  66          3HG2      ILE  66   4.184   5.396  -3.969
  578   HD11  ILE  66          3HD1      ILE  66   6.180   5.027  -3.407
  579   HD12  ILE  66          1HD1      ILE  66   6.873   5.550  -1.872
  580   HD13  ILE  66          2HD1      ILE  66   7.411   4.044  -2.616
  581    H    CYS  67           HN       CYS  67   0.608   3.879  -1.184
  582    HA   CYS  67           HA       CYS  67  -0.292   2.378  -3.554
  583    HB2  CYS  67           2HB      CYS  67  -1.901   2.975  -1.066
  584    HB3  CYS  67           3HB      CYS  67  -2.382   1.952  -2.414
  585    HG   CYS  67           HG       CYS  67   0.260   1.241  -0.360
  586    H    HIS  68           HN       HIS  68  -2.448   3.202  -4.405
  587    HA   HIS  68           HA       HIS  68  -2.385   6.147  -4.450
  588    HB2  HIS  68           2HB      HIS  68  -1.792   4.981  -6.594
  589    HB3  HIS  68           3HB      HIS  68  -3.424   4.320  -6.623
  590    HD2  HIS  68           2HD      HIS  68  -2.389   8.090  -5.994
  591    HE1  HIS  68           1HE      HIS  68  -5.064   7.866  -9.279
  592    HE2  HIS  68           2HE      HIS  68  -3.679   9.385  -7.824
  593    H    ILE  69           HN       ILE  69  -4.118   7.190  -3.725
  594    HA   ILE  69           HA       ILE  69  -6.502   5.648  -3.046
  595    HB   ILE  69           HB       ILE  69  -5.699   8.467  -2.320
  596   HG12  ILE  69          2HG1      ILE  69  -5.962   6.027  -0.557
  597   HG13  ILE  69          3HG1      ILE  69  -4.438   6.553  -1.264
  598   HG21  ILE  69          1HG2      ILE  69  -7.904   8.774  -2.050
  599   HG22  ILE  69          2HG2      ILE  69  -8.250   7.046  -2.105
  600   HG23  ILE  69          3HG2      ILE  69  -7.699   7.788  -0.603
  601   HD11  ILE  69          3HD1      ILE  69  -5.015   7.230   1.154
  602   HD12  ILE  69          1HD1      ILE  69  -4.326   8.436   0.066
  603   HD13  ILE  69          2HD1      ILE  69  -6.059   8.432   0.395
  604    H    GLN  70           HN       GLN  70  -8.176   5.601  -4.378
  605    HA   GLN  70           HA       GLN  70  -8.541   7.826  -6.269
  606    HB2  GLN  70           2HB      GLN  70  -9.119   4.893  -6.441
  607    HB3  GLN  70           3HB      GLN  70 -10.056   6.020  -7.414
  608    HG2  GLN  70           2HG      GLN  70  -7.883   6.902  -8.304
  609    HG3  GLN  70           3HG      GLN  70  -7.089   5.556  -7.488
  610   HE21  GLN  70          1HE2      GLN  70  -6.360   4.757  -9.478
  611   HE22  GLN  70          2HE2      GLN  70  -7.419   3.932 -10.565
  612    H    ASP  71           HN       ASP  71  -9.903   9.226  -5.311
  613    HA   ASP  71           HA       ASP  71 -11.980   8.527  -3.538
  614    HB2  ASP  71           2HB      ASP  71 -11.411  11.011  -5.148
  615    HB3  ASP  71           3HB      ASP  71 -12.817  10.885  -4.095
  616    H    ARG  72           HN       ARG  72 -11.899   9.037  -7.022
  617    HA   ARG  72           HA       ARG  72 -14.437   9.297  -7.810
  618    HB2  ARG  72           2HB      ARG  72 -12.374   7.373  -8.871
  619    HB3  ARG  72           3HB      ARG  72 -13.924   7.619  -9.666
  620    HG2  ARG  72           2HG      ARG  72 -12.103   9.918  -9.060
  621    HG3  ARG  72           3HG      ARG  72 -11.905   8.938 -10.514
  622    HD2  ARG  72           2HD      ARG  72 -14.522  10.214  -9.765
  623    HD3  ARG  72           3HD      ARG  72 -13.305  11.048 -10.731
  624    HE   ARG  72           HE       ARG  72 -13.643   8.709 -12.047
  625   HH11  ARG  72          2HH1      ARG  72 -15.843  11.158 -10.914
  626   HH12  ARG  72          1HH1      ARG  72 -16.999  10.888 -12.176
  627   HH21  ARG  72          2HH2      ARG  72 -15.157   8.345 -13.713
  628   HH22  ARG  72          1HH2      ARG  72 -16.608   9.287 -13.767
  629    H    GLU  73           HN       GLU  73 -13.066   6.090  -7.047
  630    HA   GLU  73           HA       GLU  73 -15.796   5.201  -6.382
  631    HB2  GLU  73           2HB      GLU  73 -13.586   3.807  -7.852
  632    HB3  GLU  73           3HB      GLU  73 -14.777   2.867  -6.963
  633    HG2  GLU  73           2HG      GLU  73 -15.317   4.784  -9.218
  634    HG3  GLU  73           3HG      GLU  73 -15.418   3.025  -9.275
  635    H    ALA  74           HN       ALA  74 -13.528   6.343  -4.743
  636    HA   ALA  74           HA       ALA  74 -12.391   5.934  -2.795
  637    HB1  ALA  74           1HB      ALA  74 -13.883   5.698  -1.143
  638    HB2  ALA  74           2HB      ALA  74 -15.080   5.631  -2.437
  639    HB3  ALA  74           3HB      ALA  74 -14.446   4.139  -1.744
  640    H    THR  75           HN       THR  75 -11.268   4.354  -4.622
  641    HA   THR  75           HA       THR  75 -10.929   1.779  -3.228
  642    HB   THR  75           HB       THR  75 -10.785   2.273  -6.209
  643    HG1  THR  75           1HG      THR  75 -12.617   0.953  -6.254
  644   HG21  THR  75          3HG2      THR  75 -10.752  -0.443  -5.819
  645   HG22  THR  75          1HG2      THR  75  -9.718   0.140  -4.515
  646   HG23  THR  75          2HG2      THR  75  -9.343   0.551  -6.189
  647    H    VAL  76           HN       VAL  76  -8.907   1.253  -2.654
  648    HA   VAL  76           HA       VAL  76  -6.747   3.067  -3.465
  649    HB   VAL  76           HB       VAL  76  -6.750   1.069  -1.201
  650   HG11  VAL  76          1HG1      VAL  76  -4.961   3.408  -1.183
  651   HG12  VAL  76          2HG1      VAL  76  -4.658   1.741  -0.690
  652   HG13  VAL  76          3HG1      VAL  76  -4.603   2.181  -2.397
  653   HG21  VAL  76          3HG2      VAL  76  -8.003   2.494  -0.046
  654   HG22  VAL  76          1HG2      VAL  76  -6.744   3.715  -0.232
  655   HG23  VAL  76          2HG2      VAL  76  -8.049   3.607  -1.413
  656    H    LEU  77           HN       LEU  77  -5.277   2.407  -4.879
  657    HA   LEU  77           HA       LEU  77  -4.917  -0.489  -5.282
  658    HB2  LEU  77           2HB      LEU  77  -5.836   0.324  -7.266
  659    HB3  LEU  77           3HB      LEU  77  -4.893   1.812  -7.199
  660    HG   LEU  77           HG       LEU  77  -2.871   0.161  -7.533
  661   HD11  LEU  77          1HD1      LEU  77  -3.315  -1.823  -8.657
  662   HD12  LEU  77          2HD1      LEU  77  -4.969  -1.351  -9.044
  663   HD13  LEU  77          3HD1      LEU  77  -4.542  -1.793  -7.391
  664   HD21  LEU  77          3HD2      LEU  77  -2.877   0.705  -9.814
  665   HD22  LEU  77          1HD2      LEU  77  -3.789   2.002  -9.042
  666   HD23  LEU  77          2HD2      LEU  77  -4.639   0.715  -9.897
  667    H    VAL  78           HN       VAL  78  -3.066  -1.172  -4.446
  668    HA   VAL  78           HA       VAL  78  -0.945   0.420  -3.607
  669    HB   VAL  78           HB       VAL  78  -0.721  -2.469  -4.455
  670   HG11  VAL  78          1HG1      VAL  78   0.898  -2.281  -2.365
  671   HG12  VAL  78          2HG1      VAL  78   1.437  -1.890  -4.000
  672   HG13  VAL  78          3HG1      VAL  78   0.973  -0.599  -2.890
  673   HG21  VAL  78          3HG2      VAL  78  -2.069  -3.043  -2.786
  674   HG22  VAL  78          1HG2      VAL  78  -1.052  -2.166  -1.644
  675   HG23  VAL  78          2HG2      VAL  78  -2.379  -1.338  -2.458
  676    H    LEU  79           HN       LEU  79   1.262   0.508  -4.417
  677    HA   LEU  79           HA       LEU  79   1.461   0.249  -7.340
  678    HB2  LEU  79           2HB      LEU  79   2.314   2.589  -5.647
  679    HB3  LEU  79           3HB      LEU  79   2.821   2.353  -7.318
  680    HG   LEU  79           HG       LEU  79  -0.089   2.491  -6.621
  681   HD11  LEU  79          1HD1      LEU  79   1.876   4.653  -6.453
  682   HD12  LEU  79          2HD1      LEU  79   0.238   4.550  -5.807
  683   HD13  LEU  79          3HD1      LEU  79   0.494   5.004  -7.492
  684   HD21  LEU  79          3HD2      LEU  79  -0.237   3.341  -8.917
  685   HD22  LEU  79          1HD2      LEU  79   0.523   1.751  -8.853
  686   HD23  LEU  79          2HD2      LEU  79   1.514   3.193  -9.079
  687    H    ARG  80           HN       ARG  80   3.321   0.825  -4.358
  688    HA   ARG  80           HA       ARG  80   5.300  -1.119  -5.299
  689    HB2  ARG  80           2HB      ARG  80   6.253   1.021  -5.895
  690    HB3  ARG  80           3HB      ARG  80   5.929   1.658  -4.289
  691    HG2  ARG  80           2HG      ARG  80   8.257   1.146  -4.462
  692    HG3  ARG  80           3HG      ARG  80   7.507  -0.011  -3.361
  693    HD2  ARG  80           2HD      ARG  80   8.774  -1.420  -4.650
  694    HD3  ARG  80           3HD      ARG  80   7.255  -1.442  -5.545
  695    HE   ARG  80           HE       ARG  80   9.755  -0.221  -6.372
  696   HH11  ARG  80          2HH1      ARG  80   6.335  -0.578  -6.915
  697   HH12  ARG  80          1HH1      ARG  80   6.409  -0.053  -8.564
  698   HH21  ARG  80          2HH2      ARG  80   9.866   0.471  -8.543
  699   HH22  ARG  80          1HH2      ARG  80   8.419   0.542  -9.489
  700    H    VAL  81           HN       VAL  81   6.078  -2.433  -3.736
  701    HA   VAL  81           HA       VAL  81   5.452  -1.767  -0.938
  702    HB   VAL  81           HB       VAL  81   5.013  -4.411  -2.322
  703   HG11  VAL  81          1HG1      VAL  81   5.676  -3.843   0.450
  704   HG12  VAL  81          2HG1      VAL  81   4.144  -4.701   0.278
  705   HG13  VAL  81          3HG1      VAL  81   5.620  -5.383  -0.407
  706   HG21  VAL  81          3HG2      VAL  81   3.171  -2.545  -0.830
  707   HG22  VAL  81          1HG2      VAL  81   3.176  -2.863  -2.565
  708   HG23  VAL  81          2HG2      VAL  81   2.718  -4.138  -1.436
  709    H    GLY  82           HN       GLY  82   7.296  -1.593   0.146
  710    HA2  GLY  82           1HA      GLY  82   9.254  -3.715   0.040
  711    HA3  GLY  82           2HA      GLY  82   9.825  -2.187  -0.612
  712    H    HIS  83           HN       HIS  83  10.915  -3.526   1.647
  713    HA   HIS  83           HA       HIS  83   9.979  -2.453   4.087
  714    HB2  HIS  83           2HB      HIS  83  11.448  -4.428   3.959
  715    HB3  HIS  83           3HB      HIS  83  12.760  -3.409   3.375
  716    HD2  HIS  83           2HD      HIS  83  11.251  -4.598   6.675
  717    HE1  HIS  83           1HE      HIS  83  14.002  -1.509   7.616
  718    HE2  HIS  83           2HE      HIS  83  12.621  -3.411   8.520
  719    H    ALA  84           HN       ALA  84  10.493  -0.626   5.197
  720    HA   ALA  84           HA       ALA  84  11.040   1.731   3.981
  721    HB1  ALA  84           1HB      ALA  84  12.292   1.891   6.522
  722    HB2  ALA  84           2HB      ALA  84  10.691   2.457   6.046
  723    HB3  ALA  84           3HB      ALA  84  10.899   0.819   6.664
  724    H    ARG  85           HN       ARG  85  13.553   0.181   5.979
  725    HA   ARG  85           HA       ARG  85  15.737   1.572   5.330
  726    HB2  ARG  85           2HB      ARG  85  16.179  -0.188   6.762
  727    HB3  ARG  85           3HB      ARG  85  15.356  -1.361   5.743
  728    HG2  ARG  85           2HG      ARG  85  17.179  -1.654   4.371
  729    HG3  ARG  85           3HG      ARG  85  17.866  -0.078   4.772
  730    HD2  ARG  85           2HD      ARG  85  18.318  -0.929   7.065
  731    HD3  ARG  85           3HD      ARG  85  17.763  -2.518   6.541
  732    HE   ARG  85           HE       ARG  85  19.768  -2.829   5.485
  733   HH11  ARG  85          2HH1      ARG  85  19.377   0.554   6.210
  734   HH12  ARG  85          1HH1      ARG  85  20.989   0.976   5.736
  735   HH21  ARG  85          2HH2      ARG  85  21.893  -2.286   4.858
  736   HH22  ARG  85          1HH2      ARG  85  22.419  -0.640   4.966
  737    H    ASP  86           HN       ASP  86  14.249  -0.862   3.245
  738    HA   ASP  86           HA       ASP  86  16.233  -0.616   1.189
  739    HB2  ASP  86           2HB      ASP  86  13.535  -1.954   1.324
  740    HB3  ASP  86           3HB      ASP  86  14.482  -1.911  -0.161
  741    H    VAL  87           HN       VAL  87  12.729  -0.009   0.968
  742    HA   VAL  87           HA       VAL  87  12.694   1.503  -1.304
  743    HB   VAL  87           HB       VAL  87  10.979   1.933   1.146
  744   HG11  VAL  87          1HG1      VAL  87   9.399   2.634  -0.901
  745   HG12  VAL  87          2HG1      VAL  87  10.397   3.788  -0.014
  746   HG13  VAL  87          3HG1      VAL  87  10.959   3.134  -1.553
  747   HG21  VAL  87          3HG2      VAL  87   9.410   0.619  -0.590
  748   HG22  VAL  87          1HG2      VAL  87  10.978  -0.049  -1.044
  749   HG23  VAL  87          2HG2      VAL  87  10.405  -0.193   0.618
  750    H    TYR  88           HN       TYR  88  12.770   3.707  -1.804
  751    HA   TYR  88           HA       TYR  88  14.774   5.196  -0.516
  752    HB2  TYR  88           2HB      TYR  88  14.543   5.851  -2.704
  753    HB3  TYR  88           3HB      TYR  88  12.787   5.728  -2.670
  754    HD1  TYR  88           1HD      TYR  88  11.423   7.585  -1.898
  755    HD2  TYR  88           2HD      TYR  88  15.667   7.879  -1.978
  756    HE1  TYR  88           1HE      TYR  88  11.254  10.023  -1.626
  757    HE2  TYR  88           2HE      TYR  88  15.509  10.318  -1.705
  758    HH   TYR  88           HH       TYR  88  13.716  12.116  -2.235
  759    H    ARG  89           HN       ARG  89  14.730   6.856   0.934
  760    HA   ARG  89           HA       ARG  89  12.307   7.109   2.519
  761    HB2  ARG  89           2HB      ARG  89  14.431   6.774   3.678
  762    HB3  ARG  89           3HB      ARG  89  15.084   8.229   2.937
  763    HG2  ARG  89           2HG      ARG  89  13.427   9.579   4.123
  764    HG3  ARG  89           3HG      ARG  89  12.776   8.117   4.868
  765    HD2  ARG  89           2HD      ARG  89  14.992   7.700   5.886
  766    HD3  ARG  89           3HD      ARG  89  15.560   9.226   5.207
  767    HE   ARG  89           HE       ARG  89  13.971   8.878   7.550
  768   HH11  ARG  89          2HH1      ARG  89  14.600  11.028   4.885
  769   HH12  ARG  89          1HH1      ARG  89  14.085  12.446   5.737
  770   HH21  ARG  89          2HH2      ARG  89  13.290  10.737   8.682
  771   HH22  ARG  89          1HH2      ARG  89  13.341  12.279   7.897
  Start of MODEL   16
    1    H1   MET   1           HN       MET   1 -17.491   0.228   7.439
    2    HA   MET   1           HA       MET   1 -15.467  -0.384   5.475
    3    HB2  MET   1           2HB      MET   1 -17.423  -0.628   3.937
    4    HB3  MET   1           3HB      MET   1 -17.506  -1.645   5.370
    5    HG2  MET   1           2HG      MET   1 -19.056  -0.089   6.407
    6    HG3  MET   1           3HG      MET   1 -18.946   0.972   5.004
    7    HE1  MET   1           3HE      MET   1 -22.317  -1.587   5.551
    8    HE2  MET   1           1HE      MET   1 -20.995  -1.589   6.719
    9    HE3  MET   1           2HE      MET   1 -21.708  -0.063   6.196
   10    H    GLY   2           HN       GLY   2 -14.751   0.891   3.839
   11    HA2  GLY   2           1HA      GLY   2 -16.075   3.430   3.292
   12    HA3  GLY   2           2HA      GLY   2 -14.442   3.527   3.934
   13    H    TYR   3           HN       TYR   3 -12.724   2.480   2.700
   14    HA   TYR   3           HA       TYR   3 -13.272   2.665  -0.179
   15    HB2  TYR   3           2HB      TYR   3 -10.811   3.101   1.482
   16    HB3  TYR   3           3HB      TYR   3 -10.669   2.748  -0.237
   17    HD1  TYR   3           2HD      TYR   3 -12.631   5.011   2.007
   18    HD2  TYR   3           1HD      TYR   3 -10.522   4.552  -1.660
   19    HE1  TYR   3           2HE      TYR   3 -13.020   7.384   1.493
   20    HE2  TYR   3           1HE      TYR   3 -10.903   6.925  -2.183
   21    HH   TYR   3           HH       TYR   3 -11.641   9.170  -0.105
   22    H    ARG   4           HN       ARG   4 -11.874   1.221  -1.567
   23    HA   ARG   4           HA       ARG   4 -12.006  -1.500  -0.487
   24    HB2  ARG   4           2HB      ARG   4 -13.268  -1.228  -2.504
   25    HB3  ARG   4           3HB      ARG   4 -11.918  -0.442  -3.311
   26    HG2  ARG   4           2HG      ARG   4 -10.817  -2.409  -3.693
   27    HG3  ARG   4           3HG      ARG   4 -11.555  -3.217  -2.309
   28    HD2  ARG   4           2HD      ARG   4 -12.971  -2.481  -4.869
   29    HD3  ARG   4           3HD      ARG   4 -12.383  -4.091  -4.454
   30    HE   ARG   4           HE       ARG   4 -14.115  -3.116  -2.439
   31   HH11  ARG   4          2HH1      ARG   4 -14.119  -4.402  -5.674
   32   HH12  ARG   4          1HH1      ARG   4 -15.717  -5.060  -5.550
   33   HH21  ARG   4          2HH2      ARG   4 -16.220  -3.977  -2.264
   34   HH22  ARG   4          1HH2      ARG   4 -16.911  -4.816  -3.610
   35    H    ILE   5           HN       ILE   5 -10.282  -2.942  -0.658
   36    HA   ILE   5           HA       ILE   5  -7.662  -1.649  -0.874
   37    HB   ILE   5           HB       ILE   5  -8.238  -4.412   0.185
   38   HG12  ILE   5          2HG1      ILE   5  -9.494  -2.737   1.484
   39   HG13  ILE   5          3HG1      ILE   5  -8.184  -3.437   2.430
   40   HG21  ILE   5          1HG2      ILE   5  -6.043  -4.581   0.482
   41   HG22  ILE   5          2HG2      ILE   5  -5.858  -3.085  -0.433
   42   HG23  ILE   5          3HG2      ILE   5  -5.986  -3.034   1.325
   43   HD11  ILE   5          3HD1      ILE   5  -7.944  -0.814   0.988
   44   HD12  ILE   5          1HD1      ILE   5  -8.502  -0.960   2.654
   45   HD13  ILE   5          2HD1      ILE   5  -6.874  -1.482   2.220
   46    H    GLU   6           HN       GLU   6  -6.813  -1.739  -2.851
   47    HA   GLU   6           HA       GLU   6  -6.981  -4.291  -4.316
   48    HB2  GLU   6           2HB      GLU   6  -7.109  -1.458  -5.313
   49    HB3  GLU   6           3HB      GLU   6  -6.621  -2.772  -6.375
   50    HG2  GLU   6           2HG      GLU   6  -8.855  -3.851  -5.456
   51    HG3  GLU   6           3HG      GLU   6  -9.273  -2.156  -5.207
   52    H    PHE   7           HN       PHE   7  -5.156  -4.756  -5.736
   53    HA   PHE   7           HA       PHE   7  -2.666  -3.393  -4.998
   54    HB2  PHE   7           2HB      PHE   7  -3.286  -6.316  -4.709
   55    HB3  PHE   7           3HB      PHE   7  -1.634  -5.786  -5.010
   56    HD1  PHE   7           1HD      PHE   7  -4.506  -5.184  -2.722
   57    HD2  PHE   7           2HD      PHE   7  -0.281  -5.210  -3.231
   58    HE1  PHE   7           1HE      PHE   7  -4.217  -4.743  -0.318
   59    HE2  PHE   7           2HE      PHE   7   0.015  -4.770  -0.828
   60    HZ   PHE   7           HZ       PHE   7  -1.955  -4.537   0.631
   61    H    ASP   8           HN       ASP   8  -1.209  -3.184  -6.623
   62    HA   ASP   8           HA       ASP   8  -2.100  -3.625  -9.291
   63    HB2  ASP   8           2HB      ASP   8   0.314  -2.462  -8.000
   64    HB3  ASP   8           3HB      ASP   8   0.476  -3.001  -9.669
   65    HA   PRO   9           HA       PRO   9  -0.445  -7.557 -10.303
   66    HB2  PRO   9           2HB      PRO   9   0.552  -7.164 -12.798
   67    HB3  PRO   9           3HB      PRO   9  -1.181  -7.215 -12.453
   68    HG2  PRO   9           2HG      PRO   9   0.606  -4.843 -12.828
   69    HG3  PRO   9           3HG      PRO   9  -1.029  -5.122 -13.454
   70    HD2  PRO   9           2HD      PRO   9  -0.545  -3.578 -11.283
   71    HD3  PRO   9           3HD      PRO   9  -2.028  -4.537 -11.462
   72    H    ARG  10           HN       ARG  10   1.613  -4.859 -10.028
   73    HA   ARG  10           HA       ARG  10   4.043  -6.438 -10.413
   74    HB2  ARG  10           2HB      ARG  10   3.420  -3.528 -10.259
   75    HB3  ARG  10           3HB      ARG  10   5.023  -4.053  -9.761
   76    HG2  ARG  10           2HG      ARG  10   3.917  -4.951 -12.383
   77    HG3  ARG  10           3HG      ARG  10   4.597  -3.331 -12.215
   78    HD2  ARG  10           2HD      ARG  10   6.675  -4.365 -11.319
   79    HD3  ARG  10           3HD      ARG  10   5.987  -5.950 -11.670
   80    HE   ARG  10           HE       ARG  10   6.090  -4.146 -13.923
   81   HH11  ARG  10          2HH1      ARG  10   7.731  -6.628 -12.116
   82   HH12  ARG  10          1HH1      ARG  10   8.747  -7.101 -13.438
   83   HH21  ARG  10          2HH2      ARG  10   7.422  -4.758 -15.670
   84   HH22  ARG  10          1HH2      ARG  10   8.571  -6.036 -15.459
   85    H    ALA  11           HN       ALA  11   2.554  -4.357  -7.936
   86    HA   ALA  11           HA       ALA  11   4.414  -4.885  -5.903
   87    HB1  ALA  11           1HB      ALA  11   1.736  -4.432  -4.891
   88    HB2  ALA  11           2HB      ALA  11   3.182  -3.432  -4.749
   89    HB3  ALA  11           3HB      ALA  11   2.159  -3.303  -6.179
   90    H    GLU  12           HN       GLU  12   1.399  -6.507  -6.792
   91    HA   GLU  12           HA       GLU  12   0.932  -8.177  -4.712
   92    HB2  GLU  12           2HB      GLU  12  -0.075  -8.036  -7.172
   93    HB3  GLU  12           3HB      GLU  12   0.943  -9.450  -7.404
   94    HG2  GLU  12           2HG      GLU  12  -0.868  -9.361  -5.047
   95    HG3  GLU  12           3HG      GLU  12  -1.552  -9.679  -6.641
   96    H    LYS  13           HN       LYS  13   3.258  -8.821  -7.328
   97    HA   LYS  13           HA       LYS  13   4.245 -11.213  -6.117
   98    HB2  LYS  13           2HB      LYS  13   5.295  -9.485  -8.360
   99    HB3  LYS  13           3HB      LYS  13   6.071 -10.978  -7.848
  100    HG2  LYS  13           2HG      LYS  13   3.184 -10.962  -8.624
  101    HG3  LYS  13           3HG      LYS  13   4.450 -11.020  -9.853
  102    HD2  LYS  13           2HD      LYS  13   4.376 -12.939  -7.540
  103    HD3  LYS  13           3HD      LYS  13   3.505 -13.248  -9.044
  104    HE2  LYS  13           2HE      LYS  13   6.397 -12.523  -9.151
  105    HE3  LYS  13           3HE      LYS  13   5.938 -14.161  -8.688
  106    HZ1  LYS  13           3HZ      LYS  13   6.344 -13.922 -11.083
  107    HZ2  LYS  13           1HZ      LYS  13   5.076 -12.808 -11.187
  108    HZ3  LYS  13           2HZ      LYS  13   4.759 -14.411 -10.752
  109    H    GLU  14           HN       GLU  14   5.373  -7.863  -6.298
  110    HA   GLU  14           HA       GLU  14   7.869  -8.189  -5.101
  111    HB2  GLU  14           2HB      GLU  14   5.991  -5.827  -4.903
  112    HB3  GLU  14           3HB      GLU  14   7.705  -5.799  -4.510
  113    HG2  GLU  14           2HG      GLU  14   6.783  -6.635  -7.227
  114    HG3  GLU  14           3HG      GLU  14   6.921  -4.929  -6.805
  115    H    LEU  15           HN       LEU  15   4.676  -8.083  -3.706
  116    HA   LEU  15           HA       LEU  15   5.715  -7.893  -0.995
  117    HB2  LEU  15           2HB      LEU  15   3.734  -6.658  -1.364
  118    HB3  LEU  15           3HB      LEU  15   2.947  -8.021  -2.157
  119    HG   LEU  15           HG       LEU  15   3.714  -8.323   0.701
  120   HD11  LEU  15          1HD1      LEU  15   2.535  -6.579   1.397
  121   HD12  LEU  15          2HD1      LEU  15   1.099  -7.327   0.699
  122   HD13  LEU  15          3HD1      LEU  15   2.050  -6.186  -0.252
  123   HD21  LEU  15          3HD2      LEU  15   1.222  -9.137  -0.779
  124   HD22  LEU  15          1HD2      LEU  15   1.815  -9.745   0.767
  125   HD23  LEU  15          2HD2      LEU  15   2.683 -10.124  -0.721
  126    H    GLU  16           HN       GLU  16   4.360 -10.262  -3.187
  127    HA   GLU  16           HA       GLU  16   3.815 -12.300  -1.331
  128    HB2  GLU  16           2HB      GLU  16   4.272 -12.171  -4.269
  129    HB3  GLU  16           3HB      GLU  16   4.381 -13.748  -3.499
  130    HG2  GLU  16           2HG      GLU  16   2.107 -13.243  -2.490
  131    HG3  GLU  16           3HG      GLU  16   2.023 -11.901  -3.630
  132    H    LYS  17           HN       LYS  17   6.750 -11.458  -3.103
  133    HA   LYS  17           HA       LYS  17   8.294 -13.693  -2.421
  134    HB2  LYS  17           2HB      LYS  17  10.208 -12.389  -3.056
  135    HB3  LYS  17           3HB      LYS  17   8.886 -11.982  -4.143
  136    HG2  LYS  17           2HG      LYS  17   9.646  -9.894  -3.693
  137    HG3  LYS  17           3HG      LYS  17   8.498 -10.063  -2.363
  138    HD2  LYS  17           2HD      LYS  17  10.387  -9.288  -1.276
  139    HD3  LYS  17           3HD      LYS  17  10.540 -11.036  -1.077
  140    HE2  LYS  17           2HE      LYS  17  12.673 -10.299  -1.737
  141    HE3  LYS  17           3HE      LYS  17  11.955 -10.997  -3.188
  142    HZ1  LYS  17           3HZ      LYS  17  12.840  -9.018  -3.939
  143    HZ2  LYS  17           1HZ      LYS  17  12.427  -8.162  -2.540
  144    HZ3  LYS  17           2HZ      LYS  17  11.229  -8.589  -3.654
  145    H    LEU  18           HN       LEU  18   7.657 -10.693  -0.694
  146    HA   LEU  18           HA       LEU  18   9.581 -10.801   1.284
  147    HB2  LEU  18           2HB      LEU  18   6.734  -9.845   1.345
  148    HB3  LEU  18           3HB      LEU  18   7.815  -9.670   2.726
  149    HG   LEU  18           HG       LEU  18   8.381  -8.503   0.006
  150   HD11  LEU  18          1HD1      LEU  18   6.325  -7.710   1.603
  151   HD12  LEU  18          2HD1      LEU  18   7.193  -6.666   0.478
  152   HD13  LEU  18          3HD1      LEU  18   7.642  -6.691   2.183
  153   HD21  LEU  18          3HD2      LEU  18  10.088  -7.270   1.089
  154   HD22  LEU  18          1HD2      LEU  18  10.278  -8.944   1.610
  155   HD23  LEU  18          2HD2      LEU  18   9.531  -7.766   2.688
  156    H    ASP  19           HN       ASP  19   9.038 -11.232   3.682
  157    HA   ASP  19           HA       ASP  19   8.740 -13.989   4.044
  158    HB2  ASP  19           2HB      ASP  19   9.737 -12.082   5.591
  159    HB3  ASP  19           3HB      ASP  19   8.126 -12.134   6.302
  160    H    ARG  20           HN       ARG  20   7.066 -15.284   4.688
  161    HA   ARG  20           HA       ARG  20   4.481 -14.664   3.880
  162    HB2  ARG  20           2HB      ARG  20   5.324 -16.713   5.939
  163    HB3  ARG  20           3HB      ARG  20   3.787 -16.687   5.084
  164    HG2  ARG  20           2HG      ARG  20   6.366 -16.819   3.576
  165    HG3  ARG  20           3HG      ARG  20   5.646 -18.272   4.273
  166    HD2  ARG  20           2HD      ARG  20   3.573 -17.818   3.035
  167    HD3  ARG  20           3HD      ARG  20   4.324 -16.392   2.320
  168    HE   ARG  20           HE       ARG  20   6.027 -18.384   1.656
  169   HH11  ARG  20          2HH1      ARG  20   2.588 -17.965   1.315
  170   HH12  ARG  20          1HH1      ARG  20   2.482 -18.922  -0.125
  171   HH21  ARG  20          2HH2      ARG  20   5.901 -19.647  -0.239
  172   HH22  ARG  20          1HH2      ARG  20   4.367 -19.880  -1.007
  173    H    GLU  21           HN       GLU  21   5.884 -14.611   7.142
  174    HA   GLU  21           HA       GLU  21   3.564 -13.925   8.541
  175    HB2  GLU  21           2HB      GLU  21   5.976 -14.583   9.359
  176    HB3  GLU  21           3HB      GLU  21   6.221 -12.842   9.388
  177    HG2  GLU  21           2HG      GLU  21   4.091 -14.354  10.883
  178    HG3  GLU  21           3HG      GLU  21   5.567 -13.678  11.571
  179    H    VAL  22           HN       VAL  22   6.130 -11.812   7.263
  180    HA   VAL  22           HA       VAL  22   5.013  -9.373   8.038
  181    HB   VAL  22           HB       VAL  22   6.732  -9.957   5.622
  182   HG11  VAL  22          1HG1      VAL  22   7.365  -7.470   6.102
  183   HG12  VAL  22          2HG1      VAL  22   5.922  -7.849   5.159
  184   HG13  VAL  22          3HG1      VAL  22   5.776  -7.415   6.863
  185   HG21  VAL  22          3HG2      VAL  22   8.116  -8.635   7.726
  186   HG22  VAL  22          1HG2      VAL  22   7.300 -10.047   8.397
  187   HG23  VAL  22          2HG2      VAL  22   8.415 -10.234   7.044
  188    H    ALA  23           HN       ALA  23   4.798 -11.006   4.875
  189    HA   ALA  23           HA       ALA  23   3.203  -9.250   3.514
  190    HB1  ALA  23           1HB      ALA  23   2.495 -12.109   3.214
  191    HB2  ALA  23           2HB      ALA  23   2.895 -10.902   1.990
  192    HB3  ALA  23           3HB      ALA  23   4.178 -11.662   2.931
  193    H    ARG  24           HN       ARG  24   2.125 -11.806   5.735
  194    HA   ARG  24           HA       ARG  24  -0.635 -11.367   5.428
  195    HB2  ARG  24           2HB      ARG  24   0.119 -13.406   6.431
  196    HB3  ARG  24           3HB      ARG  24   0.968 -12.536   7.702
  197    HG2  ARG  24           2HG      ARG  24  -1.467 -11.627   8.201
  198    HG3  ARG  24           3HG      ARG  24  -1.918 -13.142   7.415
  199    HD2  ARG  24           2HD      ARG  24  -0.654 -14.415   9.002
  200    HD3  ARG  24           3HD      ARG  24   0.037 -12.950   9.699
  201    HE   ARG  24           HE       ARG  24  -2.840 -13.092   9.827
  202   HH11  ARG  24          2HH1      ARG  24   0.164 -13.861  11.409
  203   HH12  ARG  24          1HH1      ARG  24  -0.540 -13.949  12.990
  204   HH21  ARG  24          2HH2      ARG  24  -3.779 -13.206  11.903
  205   HH22  ARG  24          1HH2      ARG  24  -2.783 -13.577  13.269
  206    H    ARG  25           HN       ARG  25   1.664 -10.136   7.845
  207    HA   ARG  25           HA       ARG  25  -0.105  -8.689   9.416
  208    HB2  ARG  25           2HB      ARG  25   2.117  -8.952  10.197
  209    HB3  ARG  25           3HB      ARG  25   2.795  -8.240   8.739
  210    HG2  ARG  25           2HG      ARG  25   2.290  -6.085   9.395
  211    HG3  ARG  25           3HG      ARG  25   1.029  -6.612  10.511
  212    HD2  ARG  25           2HD      ARG  25   2.664  -7.461  12.048
  213    HD3  ARG  25           3HD      ARG  25   3.966  -7.163  10.897
  214    HE   ARG  25           HE       ARG  25   2.952  -4.706  11.234
  215   HH11  ARG  25          2HH1      ARG  25   3.876  -7.168  13.516
  216   HH12  ARG  25          1HH1      ARG  25   4.316  -6.039  14.754
  217   HH21  ARG  25          2HH2      ARG  25   3.528  -3.210  12.856
  218   HH22  ARG  25          1HH2      ARG  25   4.117  -3.788  14.378
  219    H    ILE  26           HN       ILE  26   1.588  -7.708   6.463
  220    HA   ILE  26           HA       ILE  26   0.765  -5.026   6.435
  221    HB   ILE  26           HB       ILE  26   1.365  -6.809   4.071
  222   HG12  ILE  26          2HG1      ILE  26   3.220  -4.860   5.436
  223   HG13  ILE  26          3HG1      ILE  26   3.150  -6.563   5.875
  224   HG21  ILE  26          1HG2      ILE  26   0.140  -4.500   3.822
  225   HG22  ILE  26          2HG2      ILE  26   1.764  -3.859   4.063
  226   HG23  ILE  26          3HG2      ILE  26   1.440  -4.958   2.722
  227   HD11  ILE  26          3HD1      ILE  26   4.932  -5.737   4.194
  228   HD12  ILE  26          1HD1      ILE  26   4.077  -7.247   3.883
  229   HD13  ILE  26          2HD1      ILE  26   3.603  -5.775   3.035
  230    H    LEU  27           HN       LEU  27  -0.506  -7.648   4.372
  231    HA   LEU  27           HA       LEU  27  -2.731  -6.309   3.423
  232    HB2  LEU  27           2HB      LEU  27  -2.132  -9.206   3.866
  233    HB3  LEU  27           3HB      LEU  27  -3.717  -8.705   3.281
  234    HG   LEU  27           HG       LEU  27  -1.201  -7.891   1.861
  235   HD11  LEU  27          1HD1      LEU  27  -2.779 -10.424   1.434
  236   HD12  LEU  27          2HD1      LEU  27  -1.131 -10.317   2.053
  237   HD13  LEU  27          3HD1      LEU  27  -1.485  -9.825   0.396
  238   HD21  LEU  27          3HD2      LEU  27  -2.763  -6.737   0.749
  239   HD22  LEU  27          1HD2      LEU  27  -4.085  -7.685   1.430
  240   HD23  LEU  27          2HD2      LEU  27  -3.195  -8.291   0.034
  241    H    ARG  28           HN       ARG  28  -2.292  -8.043   6.445
  242    HA   ARG  28           HA       ARG  28  -5.031  -8.036   7.209
  243    HB2  ARG  28           2HB      ARG  28  -3.377  -9.595   8.164
  244    HB3  ARG  28           3HB      ARG  28  -2.558  -8.243   8.935
  245    HG2  ARG  28           2HG      ARG  28  -4.253  -7.925  10.477
  246    HG3  ARG  28           3HG      ARG  28  -5.447  -8.767   9.488
  247    HD2  ARG  28           2HD      ARG  28  -3.966 -10.842   9.858
  248    HD3  ARG  28           3HD      ARG  28  -3.243  -9.911  11.169
  249    HE   ARG  28           HE       ARG  28  -5.821 -11.158  11.155
  250   HH11  ARG  28          2HH1      ARG  28  -3.947  -8.537  12.475
  251   HH12  ARG  28          1HH1      ARG  28  -4.913  -8.395  13.906
  252   HH21  ARG  28          2HH2      ARG  28  -7.100 -10.981  13.035
  253   HH22  ARG  28          1HH2      ARG  28  -6.706  -9.786  14.224
  254    H    PHE  29           HN       PHE  29  -2.433  -5.739   7.454
  255    HA   PHE  29           HA       PHE  29  -3.718  -4.095   9.431
  256    HB2  PHE  29           2HB      PHE  29  -1.370  -3.934   9.435
  257    HB3  PHE  29           3HB      PHE  29  -1.291  -3.767   7.684
  258    HD1  PHE  29           1HD      PHE  29  -2.015  -2.046  10.840
  259    HD2  PHE  29           2HD      PHE  29  -1.597  -1.643   6.623
  260    HE1  PHE  29           1HE      PHE  29  -1.951   0.402  11.083
  261    HE2  PHE  29           2HE      PHE  29  -1.530   0.805   6.860
  262    HZ   PHE  29           HZ       PHE  29  -1.707   1.830   9.092
  263    H    LEU  30           HN       LEU  30  -3.504  -4.185   5.932
  264    HA   LEU  30           HA       LEU  30  -4.853  -1.642   5.623
  265    HB2  LEU  30           2HB      LEU  30  -3.903  -3.733   3.682
  266    HB3  LEU  30           3HB      LEU  30  -4.821  -2.315   3.177
  267    HG   LEU  30           HG       LEU  30  -2.338  -1.884   4.757
  268   HD11  LEU  30          1HD1      LEU  30  -1.027  -2.956   3.325
  269   HD12  LEU  30          2HD1      LEU  30  -1.558  -1.833   2.074
  270   HD13  LEU  30          3HD1      LEU  30  -2.398  -3.368   2.295
  271   HD21  LEU  30          3HD2      LEU  30  -3.126   0.163   4.259
  272   HD22  LEU  30          1HD2      LEU  30  -4.084  -0.421   2.897
  273   HD23  LEU  30          2HD2      LEU  30  -2.356  -0.127   2.698
  274    H    ARG  31           HN       ARG  31  -5.617  -5.061   5.453
  275    HA   ARG  31           HA       ARG  31  -8.244  -4.664   4.367
  276    HB2  ARG  31           2HB      ARG  31  -8.466  -6.974   4.413
  277    HB3  ARG  31           3HB      ARG  31  -6.728  -6.773   4.246
  278    HG2  ARG  31           2HG      ARG  31  -6.651  -6.954   6.798
  279    HG3  ARG  31           3HG      ARG  31  -8.297  -7.578   6.665
  280    HD2  ARG  31           2HD      ARG  31  -7.475  -9.320   5.122
  281    HD3  ARG  31           3HD      ARG  31  -5.834  -8.716   5.346
  282    HE   ARG  31           HE       ARG  31  -7.053  -9.356   7.833
  283   HH11  ARG  31          2HH1      ARG  31  -5.531 -10.769   5.040
  284   HH12  ARG  31          1HH1      ARG  31  -4.982 -12.177   5.888
  285   HH21  ARG  31          2HH2      ARG  31  -6.337 -11.204   8.962
  286   HH22  ARG  31          1HH2      ARG  31  -5.442 -12.424   8.119
  287    H    GLU  32           HN       GLU  32  -6.874  -4.292   7.426
  288    HA   GLU  32           HA       GLU  32  -9.484  -4.619   8.747
  289    HB2  GLU  32           2HB      GLU  32  -6.674  -4.703   9.840
  290    HB3  GLU  32           3HB      GLU  32  -8.091  -4.583  10.873
  291    HG2  GLU  32           2HG      GLU  32  -7.543  -6.814   8.929
  292    HG3  GLU  32           3HG      GLU  32  -7.263  -6.880  10.668
  293    H    ARG  33           HN       ARG  33  -6.581  -2.657   9.393
  294    HA   ARG  33           HA       ARG  33  -7.871  -0.541  10.619
  295    HB2  ARG  33           2HB      ARG  33  -5.385  -0.344   8.910
  296    HB3  ARG  33           3HB      ARG  33  -5.873   0.767  10.183
  297    HG2  ARG  33           2HG      ARG  33  -5.306  -2.137  10.698
  298    HG3  ARG  33           3HG      ARG  33  -4.061  -0.887  10.767
  299    HD2  ARG  33           2HD      ARG  33  -6.592  -0.948  12.408
  300    HD3  ARG  33           3HD      ARG  33  -4.984  -1.385  12.983
  301    HE   ARG  33           HE       ARG  33  -5.059   1.253  11.898
  302   HH11  ARG  33          2HH1      ARG  33  -5.792  -0.643  14.724
  303   HH12  ARG  33          1HH1      ARG  33  -5.635   0.690  15.820
  304   HH21  ARG  33          2HH2      ARG  33  -4.848   3.016  13.330
  305   HH22  ARG  33          1HH2      ARG  33  -5.099   2.771  15.026
  306    H    VAL  34           HN       VAL  34  -6.472  -0.228   7.361
  307    HA   VAL  34           HA       VAL  34  -7.869   2.020   6.590
  308    HB   VAL  34           HB       VAL  34  -7.034  -0.235   4.760
  309   HG11  VAL  34          1HG1      VAL  34  -7.166   2.674   4.052
  310   HG12  VAL  34          2HG1      VAL  34  -7.145   1.268   2.985
  311   HG13  VAL  34          3HG1      VAL  34  -8.590   1.642   3.926
  312   HG21  VAL  34          3HG2      VAL  34  -5.234   1.995   4.796
  313   HG22  VAL  34          1HG2      VAL  34  -5.445   1.372   6.433
  314   HG23  VAL  34          2HG2      VAL  34  -4.910   0.296   5.142
  315    H    ALA  35           HN       ALA  35  -8.916  -1.309   6.628
  316    HA   ALA  35           HA       ALA  35 -11.173  -1.043   4.948
  317    HB1  ALA  35           1HB      ALA  35 -11.885  -3.161   5.827
  318    HB2  ALA  35           2HB      ALA  35 -10.136  -3.203   5.600
  319    HB3  ALA  35           3HB      ALA  35 -10.811  -2.995   7.216
  320    H    THR  36           HN       THR  36 -10.861  -0.967   8.495
  321    HA   THR  36           HA       THR  36 -13.626  -0.199   8.822
  322    HB   THR  36           HB       THR  36 -12.557  -1.641  10.496
  323    HG1  THR  36           1HG      THR  36 -13.018  -0.027  12.346
  324   HG21  THR  36          3HG2      THR  36 -10.382  -1.148  10.871
  325   HG22  THR  36          1HG2      THR  36 -11.043  -0.092  12.118
  326   HG23  THR  36          2HG2      THR  36 -10.606   0.570  10.543
  327    H    LEU  37           HN       LEU  37 -10.666   1.397   8.296
  328    HA   LEU  37           HA       LEU  37 -11.243   3.828   9.675
  329    HB2  LEU  37           2HB      LEU  37  -9.276   3.049   7.548
  330    HB3  LEU  37           3HB      LEU  37  -9.433   4.719   8.088
  331    HG   LEU  37           HG       LEU  37  -8.826   2.467   9.986
  332   HD11  LEU  37          1HD1      LEU  37  -6.478   3.853   9.618
  333   HD12  LEU  37          2HD1      LEU  37  -7.106   3.679   7.980
  334   HD13  LEU  37          3HD1      LEU  37  -6.849   2.251   8.982
  335   HD21  LEU  37          3HD2      LEU  37  -8.482   5.460  10.112
  336   HD22  LEU  37          1HD2      LEU  37  -7.905   4.326  11.333
  337   HD23  LEU  37          2HD2      LEU  37  -9.635   4.486  11.025
  338    H    GLU  38           HN       GLU  38 -12.947   5.030   9.144
  339    HA   GLU  38           HA       GLU  38 -14.534   5.053   6.989
  340    HB2  GLU  38           2HB      GLU  38 -13.588   7.364   8.662
  341    HB3  GLU  38           3HB      GLU  38 -14.748   7.604   7.363
  342    HG2  GLU  38           2HG      GLU  38 -15.788   7.343   9.585
  343    HG3  GLU  38           3HG      GLU  38 -16.325   6.143   8.411
  344    H    ASP  39           HN       ASP  39 -11.370   6.581   7.165
  345    HA   ASP  39           HA       ASP  39 -11.418   6.865   4.243
  346    HB2  ASP  39           2HB      ASP  39 -11.753   9.055   5.697
  347    HB3  ASP  39           3HB      ASP  39 -10.002   8.946   5.848
  348    HA   PRO  40           HA       PRO  40  -7.561   4.753   4.486
  349    HB2  PRO  40           2HB      PRO  40  -6.578   5.410   2.042
  350    HB3  PRO  40           3HB      PRO  40  -7.881   4.238   2.270
  351    HG2  PRO  40           2HG      PRO  40  -8.043   7.123   1.487
  352    HG3  PRO  40           3HG      PRO  40  -8.928   5.734   0.830
  353    HD2  PRO  40           2HD      PRO  40 -10.025   7.444   2.619
  354    HD3  PRO  40           3HD      PRO  40 -10.448   5.721   2.562
  355    H    ARG  41           HN       ARG  41  -7.895   8.102   4.449
  356    HA   ARG  41           HA       ARG  41  -5.106   8.779   4.237
  357    HB2  ARG  41           2HB      ARG  41  -7.609  10.301   4.890
  358    HB3  ARG  41           3HB      ARG  41  -6.031  11.027   5.164
  359    HG2  ARG  41           2HG      ARG  41  -5.630  10.278   2.671
  360    HG3  ARG  41           3HG      ARG  41  -7.393  10.348   2.615
  361    HD2  ARG  41           2HD      ARG  41  -5.934  12.634   3.832
  362    HD3  ARG  41           3HD      ARG  41  -5.886  12.460   2.078
  363    HE   ARG  41           HE       ARG  41  -8.511  12.247   2.600
  364   HH11  ARG  41          2HH1      ARG  41  -6.107  14.554   3.607
  365   HH12  ARG  41          1HH1      ARG  41  -7.229  15.868   3.725
  366   HH21  ARG  41          2HH2      ARG  41  -9.999  13.969   2.751
  367   HH22  ARG  41          1HH2      ARG  41  -9.443  15.534   3.239
  368    H    SER  42           HN       SER  42  -7.435   8.269   6.825
  369    HA   SER  42           HA       SER  42  -6.367   9.279   9.047
  370    HB2  SER  42           2HB      SER  42  -8.271   7.539   8.788
  371    HB3  SER  42           3HB      SER  42  -7.007   6.338   9.056
  372    HG   SER  42           HG       SER  42  -6.515   7.599  11.009
  373    H    LEU  43           HN       LEU  43  -5.241   6.160   7.727
  374    HA   LEU  43           HA       LEU  43  -2.756   6.487   9.257
  375    HB2  LEU  43           2HB      LEU  43  -4.178   4.116   8.109
  376    HB3  LEU  43           3HB      LEU  43  -2.461   4.029   8.496
  377    HG   LEU  43           HG       LEU  43  -4.483   4.855  10.555
  378   HD11  LEU  43          1HD1      LEU  43  -5.268   2.795  10.809
  379   HD12  LEU  43          2HD1      LEU  43  -3.645   2.107  10.786
  380   HD13  LEU  43          3HD1      LEU  43  -4.506   2.382   9.272
  381   HD21  LEU  43          3HD2      LEU  43  -1.773   4.894  10.587
  382   HD22  LEU  43          1HD2      LEU  43  -2.095   3.286  11.238
  383   HD23  LEU  43          2HD2      LEU  43  -2.785   4.709  12.020
  384    H    GLY  44           HN       GLY  44  -0.795   6.617   8.280
  385    HA2  GLY  44           1HA      GLY  44   0.617   6.067   6.352
  386    HA3  GLY  44           2HA      GLY  44  -0.760   6.450   5.330
  387    H    GLU  45           HN       GLU  45   1.410   7.675   4.576
  388    HA   GLU  45           HA       GLU  45   1.027  10.439   5.489
  389    HB2  GLU  45           2HB      GLU  45   3.460  10.830   5.328
  390    HB3  GLU  45           3HB      GLU  45   3.051   9.659   6.574
  391    HG2  GLU  45           2HG      GLU  45   3.927   7.887   5.387
  392    HG3  GLU  45           3HG      GLU  45   3.795   8.722   3.841
  393    HA   PRO  46           HA       PRO  46   0.667  11.311   1.190
  394    HB2  PRO  46           2HB      PRO  46   1.225  13.967   1.241
  395    HB3  PRO  46           3HB      PRO  46  -0.301  13.295   1.828
  396    HG2  PRO  46           2HG      PRO  46   2.121  14.130   3.377
  397    HG3  PRO  46           3HG      PRO  46   0.409  14.416   3.738
  398    HD2  PRO  46           2HD      PRO  46   1.845  12.462   4.943
  399    HD3  PRO  46           3HD      PRO  46   0.109  12.303   4.607
  400    H    LEU  47           HN       LEU  47   1.905  12.393  -0.609
  401    HA   LEU  47           HA       LEU  47   4.789  11.949  -0.219
  402    HB2  LEU  47           2HB      LEU  47   3.884  10.390  -1.783
  403    HB3  LEU  47           3HB      LEU  47   3.047  11.670  -2.658
  404    HG   LEU  47           HG       LEU  47   5.538  12.527  -3.014
  405   HD11  LEU  47          1HD1      LEU  47   6.508   9.971  -3.561
  406   HD12  LEU  47          2HD1      LEU  47   5.858   9.882  -1.924
  407   HD13  LEU  47          3HD1      LEU  47   7.080  11.090  -2.323
  408   HD21  LEU  47          3HD2      LEU  47   3.774  10.694  -4.507
  409   HD22  LEU  47          1HD2      LEU  47   5.449  10.776  -5.051
  410   HD23  LEU  47          2HD2      LEU  47   4.473  12.243  -4.984
  411    H    ARG  48           HN       ARG  48   6.264  13.445  -0.953
  412    HA   ARG  48           HA       ARG  48   5.172  15.961  -2.023
  413    HB2  ARG  48           2HB      ARG  48   5.940  15.847   0.504
  414    HB3  ARG  48           3HB      ARG  48   7.540  16.016  -0.205
  415    HG2  ARG  48           2HG      ARG  48   5.392  17.910  -1.019
  416    HG3  ARG  48           3HG      ARG  48   6.179  18.114   0.548
  417    HD2  ARG  48           2HD      ARG  48   7.628  17.920  -2.089
  418    HD3  ARG  48           3HD      ARG  48   7.227  19.432  -1.276
  419    HE   ARG  48           HE       ARG  48   8.746  17.561   0.316
  420   HH11  ARG  48          2HH1      ARG  48   8.854  20.234  -1.912
  421   HH12  ARG  48          1HH1      ARG  48  10.441  20.739  -1.433
  422   HH21  ARG  48          2HH2      ARG  48  10.835  18.216   0.956
  423   HH22  ARG  48          1HH2      ARG  48  11.567  19.590   0.198
  424    H    GLY  49           HN       GLY  49   5.977  16.316  -3.979
  425    HA2  GLY  49           1HA      GLY  49   8.810  16.226  -4.458
  426    HA3  GLY  49           2HA      GLY  49   7.941  14.941  -5.283
  427    HA   PRO  50           HA       PRO  50   7.806  19.146  -7.568
  428    HB2  PRO  50           2HB      PRO  50   9.825  18.758  -9.342
  429    HB3  PRO  50           3HB      PRO  50  10.062  19.534  -7.771
  430    HG2  PRO  50           2HG      PRO  50  10.608  16.707  -8.589
  431    HG3  PRO  50           3HG      PRO  50  11.598  17.797  -7.601
  432    HD2  PRO  50           2HD      PRO  50  10.034  15.869  -6.520
  433    HD3  PRO  50           3HD      PRO  50  10.352  17.412  -5.701
  434    H    GLU  51           HN       GLU  51   8.772  15.990  -8.922
  435    HA   GLU  51           HA       GLU  51   7.005  16.408 -11.201
  436    HB2  GLU  51           2HB      GLU  51   9.169  14.454 -10.534
  437    HB3  GLU  51           3HB      GLU  51   7.971  14.021 -11.746
  438    HG2  GLU  51           2HG      GLU  51   8.604  16.405 -12.697
  439    HG3  GLU  51           3HG      GLU  51  10.105  16.075 -11.832
  440    H    LEU  52           HN       LEU  52   7.575  13.746  -8.892
  441    HA   LEU  52           HA       LEU  52   5.524  12.096  -9.324
  442    HB2  LEU  52           2HB      LEU  52   6.497  13.134  -6.676
  443    HB3  LEU  52           3HB      LEU  52   5.330  11.821  -6.810
  444    HG   LEU  52           HG       LEU  52   7.928  11.567  -8.245
  445   HD11  LEU  52          1HD1      LEU  52   8.553  12.358  -6.011
  446   HD12  LEU  52          2HD1      LEU  52   9.005  10.672  -6.262
  447   HD13  LEU  52          3HD1      LEU  52   7.587  11.069  -5.291
  448   HD21  LEU  52          3HD2      LEU  52   5.693   9.909  -7.499
  449   HD22  LEU  52          1HD2      LEU  52   7.207   9.231  -6.900
  450   HD23  LEU  52          2HD2      LEU  52   7.016   9.576  -8.619
  451    H    GLY  53           HN       GLY  53   3.335  11.946  -8.991
  452    HA2  GLY  53           1HA      GLY  53   1.935  14.480  -8.728
  453    HA3  GLY  53           2HA      GLY  53   1.227  12.937  -9.183
  454    H    ARG  54           HN       ARG  54  -0.387  12.620  -7.781
  455    HA   ARG  54           HA       ARG  54   0.115  13.104  -4.928
  456    HB2  ARG  54           2HB      ARG  54  -1.840  14.237  -5.932
  457    HB3  ARG  54           3HB      ARG  54  -2.509  12.669  -6.365
  458    HG2  ARG  54           2HG      ARG  54  -2.692  12.072  -4.021
  459    HG3  ARG  54           3HG      ARG  54  -1.959  13.610  -3.558
  460    HD2  ARG  54           2HD      ARG  54  -3.825  14.832  -4.168
  461    HD3  ARG  54           3HD      ARG  54  -4.406  13.586  -5.272
  462    HE   ARG  54           HE       ARG  54  -4.627  12.353  -2.915
  463   HH11  ARG  54          2HH1      ARG  54  -5.576  15.544  -3.933
  464   HH12  ARG  54          1HH1      ARG  54  -6.915  15.637  -2.837
  465   HH21  ARG  54          2HH2      ARG  54  -6.387  12.463  -1.467
  466   HH22  ARG  54          1HH2      ARG  54  -7.375  13.885  -1.434
  467    H    PHE  55           HN       PHE  55   1.092  11.278  -4.197
  468    HA   PHE  55           HA       PHE  55  -0.426   8.771  -4.491
  469    HB2  PHE  55           2HB      PHE  55   2.583   9.074  -4.379
  470    HB3  PHE  55           3HB      PHE  55   1.713   7.544  -4.427
  471    HD1  PHE  55           1HD      PHE  55  -0.016   7.380  -6.455
  472    HD2  PHE  55           2HD      PHE  55   3.443   9.858  -6.349
  473    HE1  PHE  55           1HE      PHE  55   0.013   7.439  -8.914
  474    HE2  PHE  55           2HE      PHE  55   3.477   9.921  -8.808
  475    HZ   PHE  55           HZ       PHE  55   1.761   8.711 -10.094
  476    H    TRP  56           HN       TRP  56  -0.997   7.807  -2.649
  477    HA   TRP  56           HA       TRP  56   0.069   8.899  -0.143
  478    HB2  TRP  56           2HB      TRP  56  -2.437   8.867  -0.643
  479    HB3  TRP  56           3HB      TRP  56  -2.350   7.121  -0.429
  480    HD1  TRP  56           1HD      TRP  56  -1.920   6.206   2.055
  481    HE1  TRP  56           1HE      TRP  56  -2.238   7.302   4.362
  482    HE3  TRP  56           3HE      TRP  56  -2.268  11.092   0.592
  483    HZ2  TRP  56           2HZ      TRP  56  -2.589   9.894   5.422
  484    HZ3  TRP  56           3HZ      TRP  56  -2.595  12.819   2.314
  485    HH2  TRP  56           2HH      TRP  56  -2.752  12.230   4.679
  486    H    LYS  57           HN       LYS  57   1.245   7.700   1.225
  487    HA   LYS  57           HA       LYS  57   1.501   4.819   0.654
  488    HB2  LYS  57           2HB      LYS  57   3.823   4.938   1.350
  489    HB3  LYS  57           3HB      LYS  57   3.531   6.094   0.057
  490    HG2  LYS  57           2HG      LYS  57   3.276   7.072   2.842
  491    HG3  LYS  57           3HG      LYS  57   4.897   6.716   2.241
  492    HD2  LYS  57           2HD      LYS  57   2.918   8.490   0.816
  493    HD3  LYS  57           3HD      LYS  57   4.169   9.084   1.911
  494    HE2  LYS  57           2HE      LYS  57   5.301   9.285  -0.050
  495    HE3  LYS  57           3HE      LYS  57   5.708   7.611   0.323
  496    HZ1  LYS  57           3HZ      LYS  57   4.578   8.480  -1.980
  497    HZ2  LYS  57           1HZ      LYS  57   3.245   7.883  -1.127
  498    HZ3  LYS  57           2HZ      LYS  57   4.572   6.880  -1.432
  499    H    TYR  58           HN       TYR  58   2.265   3.539   2.562
  500    HA   TYR  58           HA       TYR  58   1.210   4.639   5.082
  501    HB2  TYR  58           2HB      TYR  58   0.849   1.811   4.069
  502    HB3  TYR  58           3HB      TYR  58   0.288   2.429   5.618
  503    HD1  TYR  58           2HD      TYR  58  -0.269   2.440   1.994
  504    HD2  TYR  58           1HD      TYR  58  -1.662   3.857   5.756
  505    HE1  TYR  58           2HE      TYR  58  -2.390   3.116   0.948
  506    HE2  TYR  58           1HE      TYR  58  -3.787   4.536   4.721
  507    HH   TYR  58           HH       TYR  58  -4.583   5.166   2.393
  508    H    ARG  59           HN       ARG  59   2.095   3.700   7.021
  509    HA   ARG  59           HA       ARG  59   4.775   2.546   6.606
  510    HB2  ARG  59           2HB      ARG  59   4.955   4.810   7.448
  511    HB3  ARG  59           3HB      ARG  59   3.825   4.454   8.747
  512    HG2  ARG  59           2HG      ARG  59   5.375   3.326   9.979
  513    HG3  ARG  59           3HG      ARG  59   6.292   2.815   8.560
  514    HD2  ARG  59           2HD      ARG  59   6.966   5.230   8.277
  515    HD3  ARG  59           3HD      ARG  59   6.261   5.527   9.866
  516    HE   ARG  59           HE       ARG  59   8.734   4.145   9.282
  517   HH11  ARG  59          2HH1      ARG  59   6.238   4.788  11.622
  518   HH12  ARG  59          1HH1      ARG  59   7.228   4.380  12.984
  519   HH21  ARG  59          2HH2      ARG  59  10.048   3.606  11.067
  520   HH22  ARG  59          1HH2      ARG  59   9.396   3.709  12.667
  521    H    VAL  60           HN       VAL  60   5.027   0.561   7.368
  522    HA   VAL  60           HA       VAL  60   3.381  -0.296   9.657
  523    HB   VAL  60           HB       VAL  60   4.016  -1.824   7.140
  524   HG11  VAL  60          1HG1      VAL  60   4.190  -3.694   8.328
  525   HG12  VAL  60          2HG1      VAL  60   3.819  -2.839   9.826
  526   HG13  VAL  60          3HG1      VAL  60   2.513  -3.471   8.824
  527   HG21  VAL  60          3HG2      VAL  60   1.330  -1.868   8.333
  528   HG22  VAL  60          1HG2      VAL  60   1.870  -0.290   7.760
  529   HG23  VAL  60          2HG2      VAL  60   1.824  -1.663   6.653
  530    H    GLY  61           HN       GLY  61   5.126   0.169  11.065
  531    HA2  GLY  61           1HA      GLY  61   6.930  -0.451  12.344
  532    HA3  GLY  61           2HA      GLY  61   6.861  -2.012  11.540
  533    H    ASP  62           HN       ASP  62   8.142  -2.396   9.727
  534    HA   ASP  62           HA       ASP  62  10.108  -0.302   9.083
  535    HB2  ASP  62           2HB      ASP  62  10.657  -3.231   9.592
  536    HB3  ASP  62           3HB      ASP  62  11.827  -2.115   8.893
  537    H    TYR  63           HN       TYR  63   7.800  -0.778   7.606
  538    HA   TYR  63           HA       TYR  63   8.978  -1.616   5.075
  539    HB2  TYR  63           2HB      TYR  63   6.435  -2.801   6.199
  540    HB3  TYR  63           3HB      TYR  63   6.940  -2.963   4.521
  541    HD1  TYR  63           1HD      TYR  63   8.199  -3.590   7.980
  542    HD2  TYR  63           2HD      TYR  63   8.191  -4.811   3.904
  543    HE1  TYR  63           1HE      TYR  63   9.525  -5.574   8.578
  544    HE2  TYR  63           2HE      TYR  63   9.517  -6.798   4.491
  545    HH   TYR  63           HH       TYR  63  10.876  -7.681   6.147
  546    H    ARG  64           HN       ARG  64   8.265  -0.455   3.361
  547    HA   ARG  64           HA       ARG  64   6.248   1.607   3.924
  548    HB2  ARG  64           2HB      ARG  64   8.539   1.502   1.966
  549    HB3  ARG  64           3HB      ARG  64   7.273   2.719   1.873
  550    HG2  ARG  64           2HG      ARG  64   8.947   2.280   4.330
  551    HG3  ARG  64           3HG      ARG  64   9.381   3.413   3.048
  552    HD2  ARG  64           2HD      ARG  64   6.738   3.490   4.483
  553    HD3  ARG  64           3HD      ARG  64   8.153   4.388   5.030
  554    HE   ARG  64           HE       ARG  64   6.449   5.029   2.815
  555   HH11  ARG  64          2HH1      ARG  64   9.660   5.353   4.122
  556   HH12  ARG  64          1HH1      ARG  64  10.015   6.800   3.237
  557   HH21  ARG  64          2HH2      ARG  64   6.905   6.933   1.644
  558   HH22  ARG  64          1HH2      ARG  64   8.447   7.698   1.829
  559    H    LEU  65           HN       LEU  65   4.432   1.781   2.724
  560    HA   LEU  65           HA       LEU  65   4.121  -0.073   0.455
  561    HB2  LEU  65           2HB      LEU  65   1.902   0.750   2.308
  562    HB3  LEU  65           3HB      LEU  65   1.879  -0.519   1.086
  563    HG   LEU  65           HG       LEU  65   3.571  -0.624   3.578
  564   HD11  LEU  65          1HD1      LEU  65   1.063  -2.200   3.172
  565   HD12  LEU  65          2HD1      LEU  65   1.001  -0.578   3.861
  566   HD13  LEU  65          3HD1      LEU  65   1.932  -1.842   4.665
  567   HD21  LEU  65          3HD2      LEU  65   3.213  -2.324   1.214
  568   HD22  LEU  65          1HD2      LEU  65   3.124  -3.174   2.757
  569   HD23  LEU  65          2HD2      LEU  65   4.557  -2.226   2.354
  570    H    ILE  66           HN       ILE  66   4.189   1.184  -1.302
  571    HA   ILE  66           HA       ILE  66   3.015   3.842  -1.273
  572    HB   ILE  66           HB       ILE  66   4.280   2.459  -3.633
  573   HG12  ILE  66          2HG1      ILE  66   5.853   2.411  -1.748
  574   HG13  ILE  66          3HG1      ILE  66   6.390   3.539  -2.989
  575   HG21  ILE  66          1HG2      ILE  66   2.884   4.620  -3.814
  576   HG22  ILE  66          2HG2      ILE  66   4.270   5.396  -3.047
  577   HG23  ILE  66          3HG2      ILE  66   4.466   4.568  -4.592
  578   HD11  ILE  66          3HD1      ILE  66   5.742   5.406  -1.689
  579   HD12  ILE  66          1HD1      ILE  66   4.880   4.388  -0.537
  580   HD13  ILE  66          2HD1      ILE  66   6.640   4.323  -0.626
  581    H    CYS  67           HN       CYS  67   0.842   3.804  -1.377
  582    HA   CYS  67           HA       CYS  67  -0.395   2.188  -3.507
  583    HB2  CYS  67           2HB      CYS  67  -1.637   3.170  -0.928
  584    HB3  CYS  67           3HB      CYS  67  -2.458   2.226  -2.165
  585    HG   CYS  67           HG       CYS  67   0.283   0.664  -1.220
  586    H    HIS  68           HN       HIS  68  -2.427   3.137  -4.403
  587    HA   HIS  68           HA       HIS  68  -2.214   6.072  -4.581
  588    HB2  HIS  68           2HB      HIS  68  -1.490   4.789  -6.641
  589    HB3  HIS  68           3HB      HIS  68  -3.160   4.256  -6.801
  590    HD2  HIS  68           2HD      HIS  68  -2.728   7.948  -5.772
  591    HE1  HIS  68           1HE      HIS  68  -3.661   7.862  -9.910
  592    HE2  HIS  68           2HE      HIS  68  -3.293   9.321  -7.890
  593    H    ILE  69           HN       ILE  69  -3.853   6.837  -3.396
  594    HA   ILE  69           HA       ILE  69  -6.367   5.462  -3.174
  595    HB   ILE  69           HB       ILE  69  -5.587   8.221  -2.224
  596   HG12  ILE  69          2HG1      ILE  69  -5.786   5.642  -0.658
  597   HG13  ILE  69          3HG1      ILE  69  -4.274   6.312  -1.262
  598   HG21  ILE  69          1HG2      ILE  69  -8.063   6.596  -1.958
  599   HG22  ILE  69          2HG2      ILE  69  -7.562   7.597  -0.596
  600   HG23  ILE  69          3HG2      ILE  69  -7.871   8.336  -2.167
  601   HD11  ILE  69          3HD1      ILE  69  -5.022   8.429   0.061
  602   HD12  ILE  69          1HD1      ILE  69  -6.034   7.279   0.934
  603   HD13  ILE  69          2HD1      ILE  69  -4.283   7.065   0.899
  604    H    GLN  70           HN       GLN  70  -8.017   5.620  -4.529
  605    HA   GLN  70           HA       GLN  70  -8.123   7.924  -6.355
  606    HB2  GLN  70           2HB      GLN  70  -9.218   5.124  -6.628
  607    HB3  GLN  70           3HB      GLN  70  -9.603   6.428  -7.744
  608    HG2  GLN  70           2HG      GLN  70  -7.885   5.481  -8.873
  609    HG3  GLN  70           3HG      GLN  70  -6.970   6.608  -7.873
  610   HE21  GLN  70          1HE2      GLN  70  -5.136   5.281  -8.082
  611   HE22  GLN  70          2HE2      GLN  70  -4.977   3.819  -7.176
  612    H    ASP  71           HN       ASP  71  -9.546   9.423  -5.798
  613    HA   ASP  71           HA       ASP  71 -11.596   9.032  -3.894
  614    HB2  ASP  71           2HB      ASP  71 -10.913  11.245  -5.806
  615    HB3  ASP  71           3HB      ASP  71 -12.403  11.307  -4.869
  616    H    ARG  72           HN       ARG  72 -11.904   9.811  -7.365
  617    HA   ARG  72           HA       ARG  72 -14.599   9.477  -7.667
  618    HB2  ARG  72           2HB      ARG  72 -12.778  10.125  -9.397
  619    HB3  ARG  72           3HB      ARG  72 -12.715   8.403  -9.744
  620    HG2  ARG  72           2HG      ARG  72 -14.847   8.365 -10.627
  621    HG3  ARG  72           3HG      ARG  72 -15.335   9.832  -9.775
  622    HD2  ARG  72           2HD      ARG  72 -13.315   9.735 -12.012
  623    HD3  ARG  72           3HD      ARG  72 -15.016  10.153 -12.216
  624    HE   ARG  72           HE       ARG  72 -14.205  11.897 -10.332
  625   HH11  ARG  72          2HH1      ARG  72 -12.913  11.012 -13.442
  626   HH12  ARG  72          1HH1      ARG  72 -12.223  12.572 -13.745
  627   HH21  ARG  72          2HH2      ARG  72 -13.300  13.955 -10.719
  628   HH22  ARG  72          1HH2      ARG  72 -12.442  14.245 -12.195
  629    H    GLU  73           HN       GLU  73 -12.119   6.943  -7.789
  630    HA   GLU  73           HA       GLU  73 -14.173   4.888  -8.023
  631    HB2  GLU  73           2HB      GLU  73 -11.161   4.814  -8.098
  632    HB3  GLU  73           3HB      GLU  73 -12.136   3.352  -8.055
  633    HG2  GLU  73           2HG      GLU  73 -12.270   5.483 -10.176
  634    HG3  GLU  73           3HG      GLU  73 -11.444   3.933 -10.323
  635    H    ALA  74           HN       ALA  74 -12.844   6.612  -5.569
  636    HA   ALA  74           HA       ALA  74 -12.381   6.224  -3.343
  637    HB1  ALA  74           1HB      ALA  74 -14.396   4.862  -2.343
  638    HB2  ALA  74           2HB      ALA  74 -14.630   6.483  -3.000
  639    HB3  ALA  74           3HB      ALA  74 -15.054   5.070  -3.967
  640    H    THR  75           HN       THR  75 -10.788   4.531  -4.767
  641    HA   THR  75           HA       THR  75 -10.766   2.153  -3.047
  642    HB   THR  75           HB       THR  75 -10.152   2.022  -6.002
  643    HG1  THR  75           1HG      THR  75 -12.396   0.769  -4.877
  644   HG21  THR  75          3HG2      THR  75  -9.089   0.169  -5.280
  645   HG22  THR  75          1HG2      THR  75 -10.714  -0.504  -5.169
  646   HG23  THR  75          2HG2      THR  75  -9.937   0.163  -3.734
  647    H    VAL  76           HN       VAL  76  -8.719   1.317  -2.581
  648    HA   VAL  76           HA       VAL  76  -6.494   3.131  -3.238
  649    HB   VAL  76           HB       VAL  76  -6.770   1.245  -0.893
  650   HG11  VAL  76          1HG1      VAL  76  -4.516   2.790  -1.985
  651   HG12  VAL  76          2HG1      VAL  76  -4.761   2.931  -0.243
  652   HG13  VAL  76          3HG1      VAL  76  -4.520   1.345  -0.976
  653   HG21  VAL  76          3HG2      VAL  76  -6.520   3.833   0.050
  654   HG22  VAL  76          1HG2      VAL  76  -7.610   3.988  -1.328
  655   HG23  VAL  76          2HG2      VAL  76  -8.004   2.882  -0.012
  656    H    LEU  77           HN       LEU  77  -5.406   2.322  -4.925
  657    HA   LEU  77           HA       LEU  77  -4.952  -0.567  -5.089
  658    HB2  LEU  77           2HB      LEU  77  -5.816   0.382  -7.097
  659    HB3  LEU  77           3HB      LEU  77  -4.610   1.668  -7.076
  660    HG   LEU  77           HG       LEU  77  -2.916  -0.305  -7.319
  661   HD11  LEU  77          1HD1      LEU  77  -5.541  -1.561  -7.904
  662   HD12  LEU  77          2HD1      LEU  77  -4.085  -2.254  -7.191
  663   HD13  LEU  77          3HD1      LEU  77  -4.172  -1.985  -8.932
  664   HD21  LEU  77          3HD2      LEU  77  -4.619   0.380  -9.701
  665   HD22  LEU  77          1HD2      LEU  77  -2.891   0.032  -9.652
  666   HD23  LEU  77          2HD2      LEU  77  -3.508   1.533  -8.961
  667    H    VAL  78           HN       VAL  78  -3.131  -1.352  -4.287
  668    HA   VAL  78           HA       VAL  78  -0.957   0.268  -3.465
  669    HB   VAL  78           HB       VAL  78  -1.045  -2.729  -3.845
  670   HG11  VAL  78          1HG1      VAL  78   0.953  -2.903  -2.721
  671   HG12  VAL  78          2HG1      VAL  78   1.216  -1.421  -3.642
  672   HG13  VAL  78          3HG1      VAL  78   0.774  -1.334  -1.937
  673   HG21  VAL  78          3HG2      VAL  78  -1.130  -1.696  -1.127
  674   HG22  VAL  78          1HG2      VAL  78  -2.518  -1.197  -2.093
  675   HG23  VAL  78          2HG2      VAL  78  -2.142  -2.910  -1.908
  676    H    LEU  79           HN       LEU  79   0.657   1.068  -4.626
  677    HA   LEU  79           HA       LEU  79   1.039   0.202  -7.366
  678    HB2  LEU  79           2HB      LEU  79   1.926   2.497  -5.703
  679    HB3  LEU  79           3HB      LEU  79   2.914   2.059  -7.095
  680    HG   LEU  79           HG       LEU  79  -0.018   2.759  -7.221
  681   HD11  LEU  79          1HD1      LEU  79   1.368   4.705  -8.563
  682   HD12  LEU  79          2HD1      LEU  79   2.381   4.413  -7.149
  683   HD13  LEU  79          3HD1      LEU  79   0.687   4.858  -6.943
  684   HD21  LEU  79          3HD2      LEU  79   0.684   1.280  -9.012
  685   HD22  LEU  79          1HD2      LEU  79   2.053   2.333  -9.373
  686   HD23  LEU  79          2HD2      LEU  79   0.406   2.906  -9.638
  687    H    ARG  80           HN       ARG  80   3.178   0.686  -4.549
  688    HA   ARG  80           HA       ARG  80   4.747  -1.629  -5.445
  689    HB2  ARG  80           2HB      ARG  80   5.835   1.068  -4.631
  690    HB3  ARG  80           3HB      ARG  80   6.820  -0.383  -4.754
  691    HG2  ARG  80           2HG      ARG  80   5.186   0.418  -7.103
  692    HG3  ARG  80           3HG      ARG  80   6.649   1.334  -6.734
  693    HD2  ARG  80           2HD      ARG  80   6.604  -1.666  -6.966
  694    HD3  ARG  80           3HD      ARG  80   6.920  -0.602  -8.337
  695    HE   ARG  80           HE       ARG  80   8.615  -0.065  -6.092
  696   HH11  ARG  80          2HH1      ARG  80   8.168  -2.088  -8.889
  697   HH12  ARG  80          1HH1      ARG  80   9.853  -2.458  -9.053
  698   HH21  ARG  80          2HH2      ARG  80  10.836  -0.543  -6.297
  699   HH22  ARG  80          1HH2      ARG  80  11.369  -1.579  -7.578
  700    H    VAL  81           HN       VAL  81   6.140  -2.522  -3.727
  701    HA   VAL  81           HA       VAL  81   5.447  -1.800  -0.997
  702    HB   VAL  81           HB       VAL  81   4.781  -4.497  -2.174
  703   HG11  VAL  81          1HG1      VAL  81   6.001  -4.716  -0.024
  704   HG12  VAL  81          2HG1      VAL  81   4.755  -3.728   0.741
  705   HG13  VAL  81          3HG1      VAL  81   4.338  -5.297   0.049
  706   HG21  VAL  81          3HG2      VAL  81   2.583  -3.938  -0.968
  707   HG22  VAL  81          1HG2      VAL  81   3.196  -2.285  -0.912
  708   HG23  VAL  81          2HG2      VAL  81   2.945  -3.082  -2.466
  709    H    GLY  82           HN       GLY  82   7.345  -1.676  -0.005
  710    HA2  GLY  82           1HA      GLY  82   9.171  -3.915  -0.061
  711    HA3  GLY  82           2HA      GLY  82   9.797  -2.467  -0.834
  712    H    HIS  83           HN       HIS  83  10.907  -3.735   1.460
  713    HA   HIS  83           HA       HIS  83  10.225  -2.722   3.922
  714    HB2  HIS  83           2HB      HIS  83  12.062  -4.375   3.409
  715    HB3  HIS  83           3HB      HIS  83  13.075  -3.007   2.958
  716    HD2  HIS  83           2HD      HIS  83  12.012  -4.939   6.079
  717    HE1  HIS  83           1HE      HIS  83  14.033  -1.453   7.407
  718    HE2  HIS  83           2HE      HIS  83  13.155  -3.723   8.055
  719    H    ALA  84           HN       ALA  84  11.181  -0.982   5.197
  720    HA   ALA  84           HA       ALA  84  10.796   1.528   4.158
  721    HB1  ALA  84           1HB      ALA  84  11.953   0.427   6.581
  722    HB2  ALA  84           2HB      ALA  84  12.698   1.957   6.117
  723    HB3  ALA  84           3HB      ALA  84  10.953   1.863   6.355
  724    H    ARG  85           HN       ARG  85  13.955  -0.058   4.650
  725    HA   ARG  85           HA       ARG  85  15.506   1.962   3.484
  726    HB2  ARG  85           2HB      ARG  85  16.034  -1.007   3.697
  727    HB3  ARG  85           3HB      ARG  85  17.238   0.187   3.229
  728    HG2  ARG  85           2HG      ARG  85  16.567   1.303   5.502
  729    HG3  ARG  85           3HG      ARG  85  16.011  -0.327   5.889
  730    HD2  ARG  85           2HD      ARG  85  18.770   0.272   4.845
  731    HD3  ARG  85           3HD      ARG  85  18.381   0.222   6.564
  732    HE   ARG  85           HE       ARG  85  17.479  -2.158   5.698
  733   HH11  ARG  85          2HH1      ARG  85  20.509  -0.498   5.268
  734   HH12  ARG  85          1HH1      ARG  85  21.441  -1.955   5.159
  735   HH21  ARG  85          2HH2      ARG  85  18.695  -4.083   5.555
  736   HH22  ARG  85          1HH2      ARG  85  20.408  -3.993   5.321
  737    H    ASP  86           HN       ASP  86  14.511  -1.153   2.053
  738    HA   ASP  86           HA       ASP  86  15.457  -0.959  -0.461
  739    HB2  ASP  86           2HB      ASP  86  14.100  -2.847   0.317
  740    HB3  ASP  86           3HB      ASP  86  12.656  -1.839   0.271
  741    H    VAL  87           HN       VAL  87  12.289   0.378   0.496
  742    HA   VAL  87           HA       VAL  87  11.856   1.734  -1.949
  743    HB   VAL  87           HB       VAL  87  10.650   2.249   0.773
  744   HG11  VAL  87          1HG1      VAL  87  10.502   4.167  -0.822
  745   HG12  VAL  87          2HG1      VAL  87   9.600   3.115  -1.915
  746   HG13  VAL  87          3HG1      VAL  87   8.944   3.508  -0.326
  747   HG21  VAL  87          3HG2      VAL  87  10.330   0.106  -1.046
  748   HG22  VAL  87          1HG2      VAL  87   9.427   0.427   0.435
  749   HG23  VAL  87          2HG2      VAL  87   8.856   1.072  -1.104
  750    H    TYR  88           HN       TYR  88  12.023   3.925  -2.463
  751    HA   TYR  88           HA       TYR  88  14.331   5.247  -1.718
  752    HB2  TYR  88           2HB      TYR  88  13.471   6.090  -3.674
  753    HB3  TYR  88           3HB      TYR  88  11.812   6.063  -3.084
  754    HD1  TYR  88           2HD      TYR  88  15.013   7.918  -2.899
  755    HD2  TYR  88           1HD      TYR  88  10.828   7.990  -2.131
  756    HE1  TYR  88           2HE      TYR  88  15.144  10.331  -2.442
  757    HE2  TYR  88           1HE      TYR  88  10.948  10.404  -1.673
  758    HH   TYR  88           HH       TYR  88  13.905  12.228  -2.197
  759    H    ARG  89           HN       ARG  89  14.641   7.245  -0.537
  760    HA   ARG  89           HA       ARG  89  13.469   7.139   2.058
  761    HB2  ARG  89           2HB      ARG  89  15.457   8.920   0.699
  762    HB3  ARG  89           3HB      ARG  89  14.772   9.408   2.243
  763    HG2  ARG  89           2HG      ARG  89  15.519   7.173   3.143
  764    HG3  ARG  89           3HG      ARG  89  16.421   6.972   1.640
  765    HD2  ARG  89           2HD      ARG  89  18.015   7.881   3.043
  766    HD3  ARG  89           3HD      ARG  89  17.394   9.309   2.216
  767    HE   ARG  89           HE       ARG  89  15.852   9.176   4.426
  768   HH11  ARG  89          2HH1      ARG  89  19.296   9.096   3.924
  769   HH12  ARG  89          1HH1      ARG  89  19.666   9.833   5.448
  770   HH21  ARG  89          2HH2      ARG  89  16.327  10.147   6.434
  771   HH22  ARG  89          1HH2      ARG  89  17.977  10.429   6.875
  Start of MODEL   17
    1    H1   MET   1           HN       MET   1 -20.751   0.438   4.420
    2    HA   MET   1           HA       MET   1 -18.942  -0.171   2.420
    3    HB2  MET   1           2HB      MET   1 -21.157   1.803   2.693
    4    HB3  MET   1           3HB      MET   1 -20.069   1.975   1.321
    5    HG2  MET   1           2HG      MET   1 -20.726  -0.017   0.375
    6    HG3  MET   1           3HG      MET   1 -21.288  -0.680   1.908
    7    HE1  MET   1           3HE      MET   1 -23.291  -1.555   0.295
    8    HE2  MET   1           1HE      MET   1 -24.475  -0.484  -0.454
    9    HE3  MET   1           2HE      MET   1 -22.836  -0.573  -1.099
   10    H    GLY   2           HN       GLY   2 -16.845   0.359   2.464
   11    HA2  GLY   2           1HA      GLY   2 -16.173   3.197   2.948
   12    HA3  GLY   2           2HA      GLY   2 -15.173   1.881   3.545
   13    H    TYR   3           HN       TYR   3 -13.410   1.534   2.390
   14    HA   TYR   3           HA       TYR   3 -13.460   2.212  -0.476
   15    HB2  TYR   3           2HB      TYR   3 -11.268   2.365   1.579
   16    HB3  TYR   3           3HB      TYR   3 -10.901   2.314  -0.142
   17    HD1  TYR   3           2HD      TYR   3 -13.118   4.180   2.224
   18    HD2  TYR   3           1HD      TYR   3 -10.645   4.327  -1.235
   19    HE1  TYR   3           2HE      TYR   3 -13.469   6.610   2.084
   20    HE2  TYR   3           1HE      TYR   3 -10.988   6.758  -1.384
   21    HH   TYR   3           HH       TYR   3 -11.620   8.617   0.009
   22    H    ARG   4           HN       ARG   4 -12.254   0.866  -1.924
   23    HA   ARG   4           HA       ARG   4 -12.348  -1.937  -1.135
   24    HB2  ARG   4           2HB      ARG   4 -13.430  -1.364  -3.223
   25    HB3  ARG   4           3HB      ARG   4 -11.958  -0.610  -3.821
   26    HG2  ARG   4           2HG      ARG   4 -12.154  -2.725  -4.873
   27    HG3  ARG   4           3HG      ARG   4 -10.856  -2.851  -3.683
   28    HD2  ARG   4           2HD      ARG   4 -12.123  -4.159  -2.251
   29    HD3  ARG   4           3HD      ARG   4 -13.650  -3.608  -2.938
   30    HE   ARG   4           HE       ARG   4 -12.200  -5.022  -4.891
   31   HH11  ARG   4          2HH1      ARG   4 -13.955  -5.542  -1.930
   32   HH12  ARG   4          1HH1      ARG   4 -14.414  -7.163  -2.334
   33   HH21  ARG   4          2HH2      ARG   4 -12.797  -7.155  -5.434
   34   HH22  ARG   4          1HH2      ARG   4 -13.753  -8.080  -4.327
   35    H    ILE   5           HN       ILE   5 -10.608  -3.363  -1.335
   36    HA   ILE   5           HA       ILE   5  -7.974  -2.054  -1.300
   37    HB   ILE   5           HB       ILE   5  -8.635  -4.798  -0.237
   38   HG12  ILE   5          2HG1      ILE   5  -9.922  -3.026   0.943
   39   HG13  ILE   5          3HG1      ILE   5  -8.742  -3.821   1.979
   40   HG21  ILE   5          1HG2      ILE   5  -6.471  -3.742   1.127
   41   HG22  ILE   5          2HG2      ILE   5  -6.415  -4.951  -0.154
   42   HG23  ILE   5          3HG2      ILE   5  -6.209  -3.244  -0.544
   43   HD11  ILE   5          3HD1      ILE   5  -8.165  -1.227   0.590
   44   HD12  ILE   5          1HD1      ILE   5  -8.936  -1.308   2.174
   45   HD13  ILE   5          2HD1      ILE   5  -7.312  -1.961   1.948
   46    H    GLU   6           HN       GLU   6  -6.882  -2.234  -3.136
   47    HA   GLU   6           HA       GLU   6  -6.975  -4.799  -4.576
   48    HB2  GLU   6           2HB      GLU   6  -7.243  -2.013  -5.647
   49    HB3  GLU   6           3HB      GLU   6  -6.545  -3.274  -6.654
   50    HG2  GLU   6           2HG      GLU   6  -9.201  -3.628  -5.316
   51    HG3  GLU   6           3HG      GLU   6  -9.044  -2.809  -6.869
   52    H    PHE   7           HN       PHE   7  -5.073  -5.239  -5.896
   53    HA   PHE   7           HA       PHE   7  -2.672  -3.764  -5.072
   54    HB2  PHE   7           2HB      PHE   7  -3.194  -6.708  -4.808
   55    HB3  PHE   7           3HB      PHE   7  -1.551  -6.116  -5.033
   56    HD1  PHE   7           1HD      PHE   7  -4.545  -5.648  -2.875
   57    HD2  PHE   7           2HD      PHE   7  -0.305  -5.465  -3.200
   58    HE1  PHE   7           1HE      PHE   7  -4.383  -5.197  -0.461
   59    HE2  PHE   7           2HE      PHE   7  -0.136  -5.015  -0.787
   60    HZ   PHE   7           HZ       PHE   7  -2.176  -4.881   0.586
   61    H    ASP   8           HN       ASP   8  -1.418  -3.231  -6.733
   62    HA   ASP   8           HA       ASP   8  -2.086  -3.749  -9.388
   63    HB2  ASP   8           2HB      ASP   8   0.277  -2.607  -7.990
   64    HB3  ASP   8           3HB      ASP   8   0.501  -3.109  -9.664
   65    HA   PRO   9           HA       PRO   9  -0.381  -7.649 -10.443
   66    HB2  PRO   9           2HB      PRO   9   0.695  -7.191 -12.893
   67    HB3  PRO   9           3HB      PRO   9  -1.048  -7.257 -12.606
   68    HG2  PRO   9           2HG      PRO   9   0.741  -4.870 -12.863
   69    HG3  PRO   9           3HG      PRO   9  -0.872  -5.139 -13.550
   70    HD2  PRO   9           2HD      PRO   9  -0.466  -3.648 -11.327
   71    HD3  PRO   9           3HD      PRO   9  -1.939  -4.607 -11.578
   72    H    ARG  10           HN       ARG  10   1.664  -4.940 -10.078
   73    HA   ARG  10           HA       ARG  10   4.105  -6.519 -10.389
   74    HB2  ARG  10           2HB      ARG  10   3.725  -3.572  -9.827
   75    HB3  ARG  10           3HB      ARG  10   5.274  -4.365 -10.076
   76    HG2  ARG  10           2HG      ARG  10   3.206  -4.646 -12.187
   77    HG3  ARG  10           3HG      ARG  10   4.032  -3.095 -12.021
   78    HD2  ARG  10           2HD      ARG  10   5.386  -5.769 -12.360
   79    HD3  ARG  10           3HD      ARG  10   5.135  -4.586 -13.642
   80    HE   ARG  10           HE       ARG  10   6.477  -3.270 -11.616
   81   HH11  ARG  10          2HH1      ARG  10   7.042  -5.986 -13.719
   82   HH12  ARG  10          1HH1      ARG  10   8.762  -5.778 -13.741
   83   HH21  ARG  10          2HH2      ARG  10   8.740  -2.985 -11.636
   84   HH22  ARG  10          1HH2      ARG  10   9.727  -4.072 -12.555
   85    H    ALA  11           HN       ALA  11   2.438  -4.545  -7.951
   86    HA   ALA  11           HA       ALA  11   4.252  -4.988  -5.853
   87    HB1  ALA  11           1HB      ALA  11   1.423  -4.084  -6.031
   88    HB2  ALA  11           2HB      ALA  11   2.070  -4.532  -4.452
   89    HB3  ALA  11           3HB      ALA  11   2.839  -3.250  -5.388
   90    H    GLU  12           HN       GLU  12   1.286  -6.709  -6.773
   91    HA   GLU  12           HA       GLU  12   0.925  -8.455  -4.740
   92    HB2  GLU  12           2HB      GLU  12   0.665  -8.774  -7.701
   93    HB3  GLU  12           3HB      GLU  12   0.434 -10.180  -6.671
   94    HG2  GLU  12           2HG      GLU  12  -1.057  -7.607  -6.267
   95    HG3  GLU  12           3HG      GLU  12  -1.640  -8.903  -7.310
   96    H    LYS  13           HN       LYS  13   3.333  -8.787  -7.320
   97    HA   LYS  13           HA       LYS  13   4.382 -11.249  -6.301
   98    HB2  LYS  13           2HB      LYS  13   5.362  -9.288  -8.372
   99    HB3  LYS  13           3HB      LYS  13   6.269 -10.731  -7.935
  100    HG2  LYS  13           2HG      LYS  13   3.415 -10.900  -8.829
  101    HG3  LYS  13           3HG      LYS  13   4.745 -10.830  -9.987
  102    HD2  LYS  13           2HD      LYS  13   5.749 -12.809  -8.903
  103    HD3  LYS  13           3HD      LYS  13   4.360 -12.893  -7.817
  104    HE2  LYS  13           2HE      LYS  13   3.824 -14.424  -9.480
  105    HE3  LYS  13           3HE      LYS  13   2.959 -12.972  -9.981
  106    HZ1  LYS  13           3HZ      LYS  13   4.038 -13.872 -11.878
  107    HZ2  LYS  13           1HZ      LYS  13   5.519 -13.998 -11.070
  108    HZ3  LYS  13           2HZ      LYS  13   4.888 -12.475 -11.446
  109    H    GLU  14           HN       GLU  14   5.479  -7.869  -6.270
  110    HA   GLU  14           HA       GLU  14   7.911  -8.160  -5.012
  111    HB2  GLU  14           2HB      GLU  14   5.875  -5.956  -4.649
  112    HB3  GLU  14           3HB      GLU  14   7.551  -5.860  -4.128
  113    HG2  GLU  14           2HG      GLU  14   6.879  -6.452  -6.978
  114    HG3  GLU  14           3HG      GLU  14   6.864  -4.797  -6.372
  115    H    LEU  15           HN       LEU  15   4.721  -7.800  -3.486
  116    HA   LEU  15           HA       LEU  15   5.697  -7.983  -0.826
  117    HB2  LEU  15           2HB      LEU  15   3.614  -6.935  -1.117
  118    HB3  LEU  15           3HB      LEU  15   2.981  -8.277  -2.067
  119    HG   LEU  15           HG       LEU  15   3.691  -8.733   0.795
  120   HD11  LEU  15          1HD1      LEU  15   2.386  -6.699   0.883
  121   HD12  LEU  15          2HD1      LEU  15   1.415  -8.059   1.446
  122   HD13  LEU  15          3HD1      LEU  15   1.163  -7.406  -0.172
  123   HD21  LEU  15          3HD2      LEU  15   1.805  -9.891  -1.226
  124   HD22  LEU  15          1HD2      LEU  15   1.576 -10.170   0.500
  125   HD23  LEU  15          2HD2      LEU  15   3.064 -10.696  -0.288
  126    H    GLU  16           HN       GLU  16   3.929 -10.325  -2.855
  127    HA   GLU  16           HA       GLU  16   3.850 -12.488  -1.205
  128    HB2  GLU  16           2HB      GLU  16   4.205 -12.239  -4.165
  129    HB3  GLU  16           3HB      GLU  16   4.297 -13.829  -3.422
  130    HG2  GLU  16           2HG      GLU  16   2.056 -13.366  -2.393
  131    HG3  GLU  16           3HG      GLU  16   1.973 -11.926  -3.407
  132    H    LYS  17           HN       LYS  17   6.629 -11.302  -3.005
  133    HA   LYS  17           HA       LYS  17   8.340 -13.496  -2.537
  134    HB2  LYS  17           2HB      LYS  17   8.707 -10.651  -3.354
  135    HB3  LYS  17           3HB      LYS  17  10.122 -11.549  -2.821
  136    HG2  LYS  17           2HG      LYS  17   9.589 -13.282  -4.522
  137    HG3  LYS  17           3HG      LYS  17   8.295 -12.236  -5.111
  138    HD2  LYS  17           2HD      LYS  17   9.854 -10.537  -5.733
  139    HD3  LYS  17           3HD      LYS  17  11.179 -11.380  -4.927
  140    HE2  LYS  17           2HE      LYS  17  11.319 -11.710  -7.322
  141    HE3  LYS  17           3HE      LYS  17  10.942 -13.236  -6.523
  142    HZ1  LYS  17           3HZ      LYS  17   9.509 -11.945  -8.548
  143    HZ2  LYS  17           1HZ      LYS  17   8.535 -11.961  -7.164
  144    HZ3  LYS  17           2HZ      LYS  17   9.149 -13.410  -7.783
  145    H    LEU  18           HN       LEU  18   7.570 -10.632  -0.661
  146    HA   LEU  18           HA       LEU  18   9.655 -10.752   1.204
  147    HB2  LEU  18           2HB      LEU  18   6.821  -9.792   1.575
  148    HB3  LEU  18           3HB      LEU  18   8.158  -9.464   2.676
  149    HG   LEU  18           HG       LEU  18   8.242  -8.588  -0.195
  150   HD11  LEU  18          1HD1      LEU  18   7.327  -6.795   2.019
  151   HD12  LEU  18          2HD1      LEU  18   6.174  -7.774   1.113
  152   HD13  LEU  18          3HD1      LEU  18   7.171  -6.586   0.275
  153   HD21  LEU  18          3HD2      LEU  18  10.189  -8.635   1.640
  154   HD22  LEU  18          1HD2      LEU  18   9.466  -7.073   2.028
  155   HD23  LEU  18          2HD2      LEU  18  10.066  -7.387   0.399
  156    H    ASP  19           HN       ASP  19   9.234 -11.209   3.604
  157    HA   ASP  19           HA       ASP  19   8.991 -13.901   4.052
  158    HB2  ASP  19           2HB      ASP  19   9.720 -11.916   5.623
  159    HB3  ASP  19           3HB      ASP  19   8.054 -12.025   6.186
  160    H    ARG  20           HN       ARG  20   7.341 -15.124   5.247
  161    HA   ARG  20           HA       ARG  20   4.783 -14.834   4.005
  162    HB2  ARG  20           2HB      ARG  20   5.722 -16.712   6.180
  163    HB3  ARG  20           3HB      ARG  20   4.174 -16.827   5.353
  164    HG2  ARG  20           2HG      ARG  20   5.553 -16.987   3.201
  165    HG3  ARG  20           3HG      ARG  20   6.922 -17.310   4.266
  166    HD2  ARG  20           2HD      ARG  20   5.751 -19.216   5.221
  167    HD3  ARG  20           3HD      ARG  20   4.344 -18.874   4.215
  168    HE   ARG  20           HE       ARG  20   6.478 -19.177   2.488
  169   HH11  ARG  20          2HH1      ARG  20   4.808 -21.112   4.852
  170   HH12  ARG  20          1HH1      ARG  20   5.136 -22.611   4.048
  171   HH21  ARG  20          2HH2      ARG  20   6.916 -21.144   1.420
  172   HH22  ARG  20          1HH2      ARG  20   6.336 -22.629   2.096
  173    H    GLU  21           HN       GLU  21   6.131 -14.095   7.149
  174    HA   GLU  21           HA       GLU  21   3.591 -13.593   8.392
  175    HB2  GLU  21           2HB      GLU  21   5.379 -14.281   9.820
  176    HB3  GLU  21           3HB      GLU  21   6.434 -13.012   9.216
  177    HG2  GLU  21           2HG      GLU  21   5.820 -12.075  11.184
  178    HG3  GLU  21           3HG      GLU  21   4.524 -11.457  10.161
  179    H    VAL  22           HN       VAL  22   6.005 -11.713   6.701
  180    HA   VAL  22           HA       VAL  22   5.038  -9.150   7.474
  181    HB   VAL  22           HB       VAL  22   6.789 -10.058   5.197
  182   HG11  VAL  22          1HG1      VAL  22   5.674  -8.151   4.329
  183   HG12  VAL  22          2HG1      VAL  22   5.834  -7.280   5.855
  184   HG13  VAL  22          3HG1      VAL  22   7.262  -7.607   4.872
  185   HG21  VAL  22          3HG2      VAL  22   7.241  -8.716   7.842
  186   HG22  VAL  22          1HG2      VAL  22   7.984 -10.180   7.199
  187   HG23  VAL  22          2HG2      VAL  22   8.428  -8.605   6.542
  188    H    ALA  23           HN       ALA  23   4.711 -11.007   4.447
  189    HA   ALA  23           HA       ALA  23   3.082  -9.295   3.037
  190    HB1  ALA  23           1HB      ALA  23   3.204 -12.298   3.073
  191    HB2  ALA  23           2HB      ALA  23   2.170 -11.406   1.956
  192    HB3  ALA  23           3HB      ALA  23   3.919 -11.182   1.909
  193    H    ARG  24           HN       ARG  24   2.023 -11.922   5.204
  194    HA   ARG  24           HA       ARG  24  -0.726 -11.439   4.984
  195    HB2  ARG  24           2HB      ARG  24  -0.990 -13.021   6.624
  196    HB3  ARG  24           3HB      ARG  24   0.649 -13.394   6.108
  197    HG2  ARG  24           2HG      ARG  24   1.574 -12.222   7.979
  198    HG3  ARG  24           3HG      ARG  24  -0.018 -11.620   8.445
  199    HD2  ARG  24           2HD      ARG  24   0.340 -14.558   8.213
  200    HD3  ARG  24           3HD      ARG  24   1.086 -13.748   9.589
  201    HE   ARG  24           HE       ARG  24  -1.603 -12.930   9.324
  202   HH11  ARG  24          2HH1      ARG  24   0.334 -15.655  10.294
  203   HH12  ARG  24          1HH1      ARG  24  -0.852 -16.272  11.397
  204   HH21  ARG  24          2HH2      ARG  24  -3.172 -13.731  10.773
  205   HH22  ARG  24          1HH2      ARG  24  -2.846 -15.177  11.668
  206    H    ARG  25           HN       ARG  25   1.616 -10.291   7.402
  207    HA   ARG  25           HA       ARG  25  -0.112  -8.875   9.040
  208    HB2  ARG  25           2HB      ARG  25   2.149  -9.188   9.731
  209    HB3  ARG  25           3HB      ARG  25   2.768  -8.365   8.305
  210    HG2  ARG  25           2HG      ARG  25   2.229  -6.269   9.118
  211    HG3  ARG  25           3HG      ARG  25   1.027  -6.904  10.243
  212    HD2  ARG  25           2HD      ARG  25   3.940  -7.565  10.524
  213    HD3  ARG  25           3HD      ARG  25   3.267  -6.078  11.192
  214    HE   ARG  25           HE       ARG  25   3.053  -8.663  12.305
  215   HH11  ARG  25          2HH1      ARG  25   1.198  -5.765  11.777
  216   HH12  ARG  25          1HH1      ARG  25   0.172  -6.015  13.151
  217   HH21  ARG  25          2HH2      ARG  25   1.710  -9.004  14.116
  218   HH22  ARG  25          1HH2      ARG  25   0.465  -7.857  14.481
  219    H    ILE  26           HN       ILE  26   1.421  -7.891   6.017
  220    HA   ILE  26           HA       ILE  26   0.578  -5.185   6.109
  221    HB   ILE  26           HB       ILE  26   1.406  -6.924   3.787
  222   HG12  ILE  26          2HG1      ILE  26   2.909  -4.620   5.013
  223   HG13  ILE  26          3HG1      ILE  26   3.050  -6.255   5.651
  224   HG21  ILE  26          1HG2      ILE  26   1.701  -4.697   2.610
  225   HG22  ILE  26          2HG2      ILE  26   0.044  -5.263   2.819
  226   HG23  ILE  26          3HG2      ILE  26   0.686  -4.007   3.877
  227   HD11  ILE  26          3HD1      ILE  26   3.603  -5.553   2.784
  228   HD12  ILE  26          1HD1      ILE  26   4.837  -5.557   4.044
  229   HD13  ILE  26          2HD1      ILE  26   3.992  -7.050   3.631
  230    H    LEU  27           HN       LEU  27  -0.568  -7.811   3.978
  231    HA   LEU  27           HA       LEU  27  -2.764  -6.592   2.903
  232    HB2  LEU  27           2HB      LEU  27  -2.249  -9.443   3.661
  233    HB3  LEU  27           3HB      LEU  27  -3.784  -8.966   2.937
  234    HG   LEU  27           HG       LEU  27  -1.152  -8.391   1.604
  235   HD11  LEU  27          1HD1      LEU  27  -1.120 -10.747   1.889
  236   HD12  LEU  27          2HD1      LEU  27  -1.645 -10.437   0.235
  237   HD13  LEU  27          3HD1      LEU  27  -2.826 -10.888   1.463
  238   HD21  LEU  27          3HD2      LEU  27  -3.697  -7.542   1.065
  239   HD22  LEU  27          1HD2      LEU  27  -3.541  -8.955   0.022
  240   HD23  LEU  27          2HD2      LEU  27  -2.380  -7.634  -0.105
  241    H    ARG  28           HN       ARG  28  -2.457  -8.025   6.093
  242    HA   ARG  28           HA       ARG  28  -5.228  -7.882   6.746
  243    HB2  ARG  28           2HB      ARG  28  -3.876  -9.439   7.953
  244    HB3  ARG  28           3HB      ARG  28  -2.744  -8.181   8.431
  245    HG2  ARG  28           2HG      ARG  28  -5.575  -7.903   9.277
  246    HG3  ARG  28           3HG      ARG  28  -4.573  -9.111  10.084
  247    HD2  ARG  28           2HD      ARG  28  -2.892  -7.320  10.517
  248    HD3  ARG  28           3HD      ARG  28  -4.041  -6.153   9.865
  249    HE   ARG  28           HE       ARG  28  -5.118  -6.198  11.869
  250   HH11  ARG  28          2HH1      ARG  28  -3.278  -9.135  11.542
  251   HH12  ARG  28          1HH1      ARG  28  -3.656  -9.703  13.134
  252   HH21  ARG  28          2HH2      ARG  28  -5.623  -6.935  13.968
  253   HH22  ARG  28          1HH2      ARG  28  -4.991  -8.451  14.513
  254    H    PHE  29           HN       PHE  29  -2.422  -5.828   7.453
  255    HA   PHE  29           HA       PHE  29  -3.652  -3.968   9.106
  256    HB2  PHE  29           2HB      PHE  29  -1.327  -3.781   8.969
  257    HB3  PHE  29           3HB      PHE  29  -1.333  -3.807   7.208
  258    HD1  PHE  29           1HD      PHE  29  -2.085  -1.736  10.169
  259    HD2  PHE  29           2HD      PHE  29  -1.482  -1.815   5.956
  260    HE1  PHE  29           1HE      PHE  29  -1.993   0.723  10.139
  261    HE2  PHE  29           2HE      PHE  29  -1.388   0.643   5.920
  262    HZ   PHE  29           HZ       PHE  29  -1.643   1.916   8.013
  263    H    LEU  30           HN       LEU  30  -3.740  -4.295   5.626
  264    HA   LEU  30           HA       LEU  30  -5.105  -1.752   5.285
  265    HB2  LEU  30           2HB      LEU  30  -4.156  -3.888   3.403
  266    HB3  LEU  30           3HB      LEU  30  -5.218  -2.589   2.862
  267    HG   LEU  30           HG       LEU  30  -2.669  -1.888   4.245
  268   HD11  LEU  30          1HD1      LEU  30  -2.215  -1.901   1.451
  269   HD12  LEU  30          2HD1      LEU  30  -2.769  -3.509   1.914
  270   HD13  LEU  30          3HD1      LEU  30  -1.363  -2.799   2.707
  271   HD21  LEU  30          3HD2      LEU  30  -2.958  -0.172   2.210
  272   HD22  LEU  30          1HD2      LEU  30  -3.726   0.058   3.781
  273   HD23  LEU  30          2HD2      LEU  30  -4.645  -0.630   2.443
  274    H    ARG  31           HN       ARG  31  -5.847  -5.117   5.590
  275    HA   ARG  31           HA       ARG  31  -8.538  -4.824   4.547
  276    HB2  ARG  31           2HB      ARG  31  -6.897  -7.100   5.585
  277    HB3  ARG  31           3HB      ARG  31  -8.648  -7.261   5.525
  278    HG2  ARG  31           2HG      ARG  31  -8.615  -6.808   3.129
  279    HG3  ARG  31           3HG      ARG  31  -6.861  -6.627   3.186
  280    HD2  ARG  31           2HD      ARG  31  -6.689  -8.958   3.997
  281    HD3  ARG  31           3HD      ARG  31  -8.436  -9.119   3.821
  282    HE   ARG  31           HE       ARG  31  -7.349  -8.264   1.380
  283   HH11  ARG  31          2HH1      ARG  31  -7.407 -11.062   3.450
  284   HH12  ARG  31          1HH1      ARG  31  -7.196 -12.189   2.151
  285   HH21  ARG  31          2HH2      ARG  31  -7.071  -9.737  -0.339
  286   HH22  ARG  31          1HH2      ARG  31  -7.004 -11.434  -0.004
  287    H    GLU  32           HN       GLU  32  -7.007  -4.154   7.423
  288    HA   GLU  32           HA       GLU  32  -9.492  -4.528   8.963
  289    HB2  GLU  32           2HB      GLU  32  -6.607  -4.604   9.813
  290    HB3  GLU  32           3HB      GLU  32  -7.899  -4.331  10.973
  291    HG2  GLU  32           2HG      GLU  32  -7.549  -6.748   9.216
  292    HG3  GLU  32           3HG      GLU  32  -7.275  -6.658  10.955
  293    H    ARG  33           HN       ARG  33  -6.577  -2.509   9.312
  294    HA   ARG  33           HA       ARG  33  -7.861  -0.349  10.511
  295    HB2  ARG  33           2HB      ARG  33  -5.394  -0.226   8.768
  296    HB3  ARG  33           3HB      ARG  33  -5.868   0.938   9.998
  297    HG2  ARG  33           2HG      ARG  33  -5.319  -1.939  10.650
  298    HG3  ARG  33           3HG      ARG  33  -4.047  -0.716  10.610
  299    HD2  ARG  33           2HD      ARG  33  -4.642  -0.676  12.832
  300    HD3  ARG  33           3HD      ARG  33  -5.662   0.604  12.177
  301    HE   ARG  33           HE       ARG  33  -7.494  -0.645  12.719
  302   HH11  ARG  33          2HH1      ARG  33  -4.701  -2.723  12.650
  303   HH12  ARG  33          1HH1      ARG  33  -5.552  -4.104  13.259
  304   HH21  ARG  33          2HH2      ARG  33  -8.625  -2.457  13.520
  305   HH22  ARG  33          1HH2      ARG  33  -7.784  -3.952  13.752
  306    H    VAL  34           HN       VAL  34  -6.502  -0.190   7.225
  307    HA   VAL  34           HA       VAL  34  -7.937   2.021   6.381
  308    HB   VAL  34           HB       VAL  34  -7.046  -0.268   4.624
  309   HG11  VAL  34          1HG1      VAL  34  -8.612   1.475   3.665
  310   HG12  VAL  34          2HG1      VAL  34  -7.306   2.639   3.896
  311   HG13  VAL  34          3HG1      VAL  34  -7.079   1.258   2.822
  312   HG21  VAL  34          3HG2      VAL  34  -4.988   0.244   5.327
  313   HG22  VAL  34          1HG2      VAL  34  -5.173   1.744   4.419
  314   HG23  VAL  34          2HG2      VAL  34  -5.541   1.706   6.143
  315    H    ALA  35           HN       ALA  35  -8.941  -1.288   6.649
  316    HA   ALA  35           HA       ALA  35 -11.193  -1.136   4.914
  317    HB1  ALA  35           1HB      ALA  35 -10.234  -3.278   5.451
  318    HB2  ALA  35           2HB      ALA  35 -10.565  -3.038   7.167
  319    HB3  ALA  35           3HB      ALA  35 -11.899  -3.229   6.030
  320    H    THR  36           HN       THR  36 -10.795  -0.846   8.431
  321    HA   THR  36           HA       THR  36 -13.601  -0.141   8.746
  322    HB   THR  36           HB       THR  36 -12.588  -1.616  10.420
  323    HG1  THR  36           1HG      THR  36 -13.184   0.953  11.507
  324   HG21  THR  36          3HG2      THR  36 -10.472   0.316  10.315
  325   HG22  THR  36          1HG2      THR  36 -10.501  -1.257  11.111
  326   HG23  THR  36          2HG2      THR  36 -11.064   0.177  11.970
  327    H    LEU  37           HN       LEU  37 -11.040   1.506   7.698
  328    HA   LEU  37           HA       LEU  37 -11.509   3.931   9.265
  329    HB2  LEU  37           2HB      LEU  37  -9.400   3.070   7.324
  330    HB3  LEU  37           3HB      LEU  37  -9.618   4.776   7.708
  331    HG   LEU  37           HG       LEU  37  -9.036   2.648   9.763
  332   HD11  LEU  37          1HD1      LEU  37  -6.754   3.399   9.749
  333   HD12  LEU  37          2HD1      LEU  37  -7.117   4.611   8.521
  334   HD13  LEU  37          3HD1      LEU  37  -7.200   2.896   8.118
  335   HD21  LEU  37          3HD2      LEU  37  -8.553   4.505  11.221
  336   HD22  LEU  37          1HD2      LEU  37 -10.178   4.692  10.561
  337   HD23  LEU  37          2HD2      LEU  37  -8.849   5.654   9.914
  338    H    GLU  38           HN       GLU  38 -12.689   5.583   8.538
  339    HA   GLU  38           HA       GLU  38 -14.158   5.357   6.113
  340    HB2  GLU  38           2HB      GLU  38 -15.273   6.483   7.844
  341    HB3  GLU  38           3HB      GLU  38 -13.883   7.499   8.202
  342    HG2  GLU  38           2HG      GLU  38 -15.421   8.912   7.159
  343    HG3  GLU  38           3HG      GLU  38 -14.232   8.533   5.914
  344    H    ASP  39           HN       ASP  39 -11.228   7.002   7.047
  345    HA   ASP  39           HA       ASP  39 -10.920   7.919   4.267
  346    HB2  ASP  39           2HB      ASP  39 -11.425   9.734   6.067
  347    HB3  ASP  39           3HB      ASP  39  -9.753   9.473   6.556
  348    HA   PRO  40           HA       PRO  40  -7.251   5.433   4.618
  349    HB2  PRO  40           2HB      PRO  40  -6.297   5.974   2.135
  350    HB3  PRO  40           3HB      PRO  40  -7.629   4.850   2.428
  351    HG2  PRO  40           2HG      PRO  40  -7.723   7.709   1.546
  352    HG3  PRO  40           3HG      PRO  40  -8.660   6.324   0.955
  353    HD2  PRO  40           2HD      PRO  40  -9.671   8.129   2.702
  354    HD3  PRO  40           3HD      PRO  40 -10.146   6.418   2.715
  355    H    ARG  41           HN       ARG  41  -7.407   8.836   4.002
  356    HA   ARG  41           HA       ARG  41  -4.540   9.222   4.140
  357    HB2  ARG  41           2HB      ARG  41  -6.858  11.150   3.985
  358    HB3  ARG  41           3HB      ARG  41  -5.179  11.663   4.091
  359    HG2  ARG  41           2HG      ARG  41  -4.667  10.636   1.989
  360    HG3  ARG  41           3HG      ARG  41  -6.272   9.905   1.906
  361    HD2  ARG  41           2HD      ARG  41  -7.158  12.307   2.017
  362    HD3  ARG  41           3HD      ARG  41  -5.506  12.796   1.643
  363    HE   ARG  41           HE       ARG  41  -6.508  10.841  -0.185
  364   HH11  ARG  41          2HH1      ARG  41  -6.503  14.235   0.590
  365   HH12  ARG  41          1HH1      ARG  41  -6.824  14.740  -1.036
  366   HH21  ARG  41          2HH2      ARG  41  -6.931  11.493  -2.329
  367   HH22  ARG  41          1HH2      ARG  41  -7.068  13.179  -2.696
  368    H    SER  42           HN       SER  42  -5.583   7.917   6.399
  369    HA   SER  42           HA       SER  42  -5.461   9.983   8.488
  370    HB2  SER  42           2HB      SER  42  -7.447   8.404   8.408
  371    HB3  SER  42           3HB      SER  42  -6.330   7.112   8.848
  372    HG   SER  42           HG       SER  42  -6.290   7.830  10.828
  373    H    LEU  43           HN       LEU  43  -4.225   6.757   7.659
  374    HA   LEU  43           HA       LEU  43  -2.072   7.106   9.618
  375    HB2  LEU  43           2HB      LEU  43  -3.231   4.739   8.201
  376    HB3  LEU  43           3HB      LEU  43  -1.618   4.654   8.906
  377    HG   LEU  43           HG       LEU  43  -2.809   5.433  11.081
  378   HD11  LEU  43          1HD1      LEU  43  -4.959   5.978  10.293
  379   HD12  LEU  43          2HD1      LEU  43  -5.144   4.451  11.154
  380   HD13  LEU  43          3HD1      LEU  43  -5.100   4.469   9.391
  381   HD21  LEU  43          3HD2      LEU  43  -3.417   3.032  11.559
  382   HD22  LEU  43          1HD2      LEU  43  -1.775   3.306  10.975
  383   HD23  LEU  43          2HD2      LEU  43  -3.008   2.681   9.879
  384    H    GLY  44           HN       GLY  44   0.072   7.124   9.054
  385    HA2  GLY  44           1HA      GLY  44   1.927   6.954   7.629
  386    HA3  GLY  44           2HA      GLY  44   0.836   6.689   6.277
  387    H    GLU  45           HN       GLU  45   2.390   8.227   5.262
  388    HA   GLU  45           HA       GLU  45   1.483  10.987   5.731
  389    HB2  GLU  45           2HB      GLU  45   3.743  11.788   5.181
  390    HB3  GLU  45           3HB      GLU  45   3.740  10.773   6.616
  391    HG2  GLU  45           2HG      GLU  45   4.693   8.954   5.449
  392    HG3  GLU  45           3HG      GLU  45   4.421   9.725   3.887
  393    HA   PRO  46           HA       PRO  46   0.543  11.142   1.445
  394    HB2  PRO  46           2HB      PRO  46   0.925  13.782   0.941
  395    HB3  PRO  46           3HB      PRO  46  -0.450  13.170   1.868
  396    HG2  PRO  46           2HG      PRO  46   2.112  14.369   2.847
  397    HG3  PRO  46           3HG      PRO  46   0.456  14.650   3.415
  398    HD2  PRO  46           2HD      PRO  46   2.180  13.009   4.706
  399    HD3  PRO  46           3HD      PRO  46   0.428  12.723   4.679
  400    H    LEU  47           HN       LEU  47   1.624  10.672  -0.370
  401    HA   LEU  47           HA       LEU  47   4.433  10.652  -0.478
  402    HB2  LEU  47           2HB      LEU  47   2.721   9.248  -1.782
  403    HB3  LEU  47           3HB      LEU  47   2.674  10.605  -2.907
  404    HG   LEU  47           HG       LEU  47   5.095  10.314  -3.307
  405   HD11  LEU  47          1HD1      LEU  47   4.806   8.479  -1.078
  406   HD12  LEU  47          2HD1      LEU  47   6.256   9.216  -1.759
  407   HD13  LEU  47          3HD1      LEU  47   5.606   7.736  -2.463
  408   HD21  LEU  47          3HD2      LEU  47   3.731   7.685  -3.772
  409   HD22  LEU  47          1HD2      LEU  47   4.853   8.557  -4.816
  410   HD23  LEU  47          2HD2      LEU  47   3.205   9.148  -4.605
  411    H    ARG  48           HN       ARG  48   5.872  12.150  -1.044
  412    HA   ARG  48           HA       ARG  48   4.938  14.773  -1.841
  413    HB2  ARG  48           2HB      ARG  48   7.774  13.830  -1.385
  414    HB3  ARG  48           3HB      ARG  48   7.220  15.497  -1.474
  415    HG2  ARG  48           2HG      ARG  48   6.037  13.711   0.589
  416    HG3  ARG  48           3HG      ARG  48   7.671  14.334   0.831
  417    HD2  ARG  48           2HD      ARG  48   5.184  15.970   0.342
  418    HD3  ARG  48           3HD      ARG  48   6.029  15.791   1.879
  419    HE   ARG  48           HE       ARG  48   7.820  16.765  -0.056
  420   HH11  ARG  48          2HH1      ARG  48   5.041  17.766   1.785
  421   HH12  ARG  48          1HH1      ARG  48   5.481  19.442   1.784
  422   HH21  ARG  48          2HH2      ARG  48   8.411  18.968  -0.065
  423   HH22  ARG  48          1HH2      ARG  48   7.398  20.125   0.730
  424    H    GLY  49           HN       GLY  49   6.027  15.958  -3.613
  425    HA2  GLY  49           1HA      GLY  49   7.573  15.307  -5.618
  426    HA3  GLY  49           2HA      GLY  49   6.246  14.205  -5.954
  427    HA   PRO  50           HA       PRO  50   5.518  18.729  -7.456
  428    HB2  PRO  50           2HB      PRO  50   6.689  18.681  -9.905
  429    HB3  PRO  50           3HB      PRO  50   7.532  19.218  -8.447
  430    HG2  PRO  50           2HG      PRO  50   7.644  16.566  -9.832
  431    HG3  PRO  50           3HG      PRO  50   8.967  17.527  -9.146
  432    HD2  PRO  50           2HD      PRO  50   7.885  15.407  -7.855
  433    HD3  PRO  50           3HD      PRO  50   8.536  16.818  -6.996
  434    H    GLU  51           HN       GLU  51   5.505  15.590  -9.017
  435    HA   GLU  51           HA       GLU  51   3.083  16.364 -10.504
  436    HB2  GLU  51           2HB      GLU  51   5.294  14.440 -11.102
  437    HB3  GLU  51           3HB      GLU  51   3.693  14.136 -11.761
  438    HG2  GLU  51           2HG      GLU  51   4.810  15.297 -13.440
  439    HG3  GLU  51           3HG      GLU  51   3.792  16.511 -12.667
  440    H    LEU  52           HN       LEU  52   3.253  15.522  -7.687
  441    HA   LEU  52           HA       LEU  52   1.335  13.318  -7.853
  442    HB2  LEU  52           2HB      LEU  52   3.619  13.381  -5.887
  443    HB3  LEU  52           3HB      LEU  52   2.361  12.150  -5.994
  444    HG   LEU  52           HG       LEU  52   3.333  11.857  -8.431
  445   HD11  LEU  52          1HD1      LEU  52   5.434  12.577  -8.832
  446   HD12  LEU  52          2HD1      LEU  52   5.927  12.425  -7.146
  447   HD13  LEU  52          3HD1      LEU  52   4.989  13.825  -7.667
  448   HD21  LEU  52          3HD2      LEU  52   4.952  10.758  -6.160
  449   HD22  LEU  52          1HD2      LEU  52   4.476   9.976  -7.667
  450   HD23  LEU  52          2HD2      LEU  52   3.275  10.270  -6.410
  451    H    GLY  53           HN       GLY  53   0.289  12.973  -5.618
  452    HA2  GLY  53           1HA      GLY  53   0.273  14.864  -3.602
  453    HA3  GLY  53           2HA      GLY  53  -0.846  15.460  -4.818
  454    H    ARG  54           HN       ARG  54  -1.816  12.915  -5.674
  455    HA   ARG  54           HA       ARG  54  -3.793  12.496  -3.643
  456    HB2  ARG  54           2HB      ARG  54  -3.972  12.329  -6.264
  457    HB3  ARG  54           3HB      ARG  54  -3.480  10.664  -5.985
  458    HG2  ARG  54           2HG      ARG  54  -5.440  10.105  -4.968
  459    HG3  ARG  54           3HG      ARG  54  -5.721  11.739  -4.365
  460    HD2  ARG  54           2HD      ARG  54  -7.342  11.269  -6.066
  461    HD3  ARG  54           3HD      ARG  54  -6.198  12.453  -6.698
  462    HE   ARG  54           HE       ARG  54  -5.289   9.928  -7.438
  463   HH11  ARG  54          2HH1      ARG  54  -8.015  12.008  -8.043
  464   HH12  ARG  54          1HH1      ARG  54  -8.305  11.383  -9.633
  465   HH21  ARG  54          2HH2      ARG  54  -5.661   9.097  -9.530
  466   HH22  ARG  54          1HH2      ARG  54  -6.966   9.727 -10.477
  467    H    PHE  55           HN       PHE  55  -1.301  10.426  -5.125
  468    HA   PHE  55           HA       PHE  55  -1.648   8.091  -3.789
  469    HB2  PHE  55           2HB      PHE  55   1.081   9.332  -4.161
  470    HB3  PHE  55           3HB      PHE  55   0.677   7.619  -4.126
  471    HD1  PHE  55           2HD      PHE  55   0.434  10.717  -6.099
  472    HD2  PHE  55           1HD      PHE  55  -0.099   6.494  -6.064
  473    HE1  PHE  55           2HE      PHE  55   0.189  10.731  -8.547
  474    HE2  PHE  55           1HE      PHE  55  -0.343   6.501  -8.513
  475    HZ   PHE  55           HZ       PHE  55  -0.201   8.621  -9.757
  476    H    TRP  56           HN       TRP  56  -0.551   7.145  -1.919
  477    HA   TRP  56           HA       TRP  56   0.116   9.075   0.187
  478    HB2  TRP  56           2HB      TRP  56  -2.319   8.249   0.290
  479    HB3  TRP  56           3HB      TRP  56  -1.638   6.695   0.761
  480    HD1  TRP  56           1HD      TRP  56  -0.736   6.449   3.221
  481    HE1  TRP  56           1HE      TRP  56  -0.871   7.950   5.308
  482    HE3  TRP  56           3HE      TRP  56  -2.317  10.777   1.006
  483    HZ2  TRP  56           2HZ      TRP  56  -1.556  10.616   5.932
  484    HZ3  TRP  56           3HZ      TRP  56  -2.689  12.757   2.419
  485    HH2  TRP  56           2HH      TRP  56  -2.317  12.676   4.830
  486    H    LYS  57           HN       LYS  57   0.974   7.843   2.180
  487    HA   LYS  57           HA       LYS  57   2.509   5.477   1.359
  488    HB2  LYS  57           2HB      LYS  57   3.870   7.613   1.210
  489    HB3  LYS  57           3HB      LYS  57   3.711   7.737   2.958
  490    HG2  LYS  57           2HG      LYS  57   4.904   5.682   3.272
  491    HG3  LYS  57           3HG      LYS  57   4.926   5.379   1.534
  492    HD2  LYS  57           2HD      LYS  57   6.381   7.522   3.067
  493    HD3  LYS  57           3HD      LYS  57   7.070   6.219   2.094
  494    HE2  LYS  57           2HE      LYS  57   5.881   7.275   0.114
  495    HE3  LYS  57           3HE      LYS  57   5.594   8.667   1.157
  496    HZ1  LYS  57           3HZ      LYS  57   8.321   7.843   1.224
  497    HZ2  LYS  57           1HZ      LYS  57   7.667   9.361   0.862
  498    HZ3  LYS  57           2HZ      LYS  57   7.828   8.197  -0.355
  499    H    TYR  58           HN       TYR  58   1.870   3.897   2.664
  500    HA   TYR  58           HA       TYR  58   1.047   4.510   5.398
  501    HB2  TYR  58           2HB      TYR  58   0.826   1.983   3.752
  502    HB3  TYR  58           3HB      TYR  58   0.272   2.131   5.416
  503    HD1  TYR  58           1HD      TYR  58  -1.070   4.672   5.524
  504    HD2  TYR  58           2HD      TYR  58  -1.017   1.818   2.369
  505    HE1  TYR  58           1HE      TYR  58  -3.238   5.519   4.730
  506    HE2  TYR  58           2HE      TYR  58  -3.185   2.657   1.566
  507    HH   TYR  58           HH       TYR  58  -4.411   5.314   2.016
  508    H    ARG  59           HN       ARG  59   2.105   3.835   7.191
  509    HA   ARG  59           HA       ARG  59   4.730   2.586   6.770
  510    HB2  ARG  59           2HB      ARG  59   4.324   4.877   7.994
  511    HB3  ARG  59           3HB      ARG  59   3.912   3.846   9.358
  512    HG2  ARG  59           2HG      ARG  59   6.126   2.752   9.134
  513    HG3  ARG  59           3HG      ARG  59   6.528   3.920   7.873
  514    HD2  ARG  59           2HD      ARG  59   6.000   5.723   9.574
  515    HD3  ARG  59           3HD      ARG  59   5.975   4.440  10.784
  516    HE   ARG  59           HE       ARG  59   8.372   4.444   9.219
  517   HH11  ARG  59          2HH1      ARG  59   6.772   5.889  11.953
  518   HH12  ARG  59          1HH1      ARG  59   8.247   6.333  12.747
  519   HH21  ARG  59          2HH2      ARG  59  10.320   5.024  10.254
  520   HH22  ARG  59          1HH2      ARG  59  10.264   5.841  11.779
  521    H    VAL  60           HN       VAL  60   4.993   0.533   7.322
  522    HA   VAL  60           HA       VAL  60   3.236  -0.608   9.396
  523    HB   VAL  60           HB       VAL  60   4.132  -1.827   6.794
  524   HG11  VAL  60          1HG1      VAL  60   2.668  -3.773   8.073
  525   HG12  VAL  60          2HG1      VAL  60   4.422  -3.762   7.874
  526   HG13  VAL  60          3HG1      VAL  60   3.698  -3.140   9.357
  527   HG21  VAL  60          3HG2      VAL  60   1.662  -2.377   6.705
  528   HG22  VAL  60          1HG2      VAL  60   1.470  -1.313   8.099
  529   HG23  VAL  60          2HG2      VAL  60   2.081  -0.669   6.575
  530    H    GLY  61           HN       GLY  61   4.761  -0.335  11.037
  531    HA2  GLY  61           1HA      GLY  61   6.535  -0.931  12.365
  532    HA3  GLY  61           2HA      GLY  61   6.547  -2.441  11.465
  533    H    ASP  62           HN       ASP  62   8.161  -2.831  10.054
  534    HA   ASP  62           HA       ASP  62  10.104  -0.656   9.631
  535    HB2  ASP  62           2HB      ASP  62  10.694  -3.619   9.577
  536    HB3  ASP  62           3HB      ASP  62  11.856  -2.296   9.582
  537    H    TYR  63           HN       TYR  63   7.822  -1.085   7.964
  538    HA   TYR  63           HA       TYR  63   9.209  -1.547   5.434
  539    HB2  TYR  63           2HB      TYR  63   6.645  -2.923   6.251
  540    HB3  TYR  63           3HB      TYR  63   7.230  -2.852   4.593
  541    HD1  TYR  63           1HD      TYR  63   8.394  -3.864   7.997
  542    HD2  TYR  63           2HD      TYR  63   8.524  -4.599   3.808
  543    HE1  TYR  63           1HE      TYR  63   9.755  -5.873   8.398
  544    HE2  TYR  63           2HE      TYR  63   9.884  -6.611   4.198
  545    HH   TYR  63           HH       TYR  63  10.679  -7.684   7.482
  546    H    ARG  64           HN       ARG  64   8.424  -0.355   3.718
  547    HA   ARG  64           HA       ARG  64   6.359   1.629   4.409
  548    HB2  ARG  64           2HB      ARG  64   8.854   1.808   2.752
  549    HB3  ARG  64           3HB      ARG  64   7.517   2.911   2.455
  550    HG2  ARG  64           2HG      ARG  64   8.817   2.562   5.144
  551    HG3  ARG  64           3HG      ARG  64   9.306   3.783   3.967
  552    HD2  ARG  64           2HD      ARG  64   6.841   4.491   3.974
  553    HD3  ARG  64           3HD      ARG  64   6.706   3.530   5.446
  554    HE   ARG  64           HE       ARG  64   8.853   5.186   5.861
  555   HH11  ARG  64          2HH1      ARG  64   5.480   5.603   5.108
  556   HH12  ARG  64          1HH1      ARG  64   5.353   7.127   5.922
  557   HH21  ARG  64          2HH2      ARG  64   8.699   7.192   6.935
  558   HH22  ARG  64          1HH2      ARG  64   7.184   8.031   6.960
  559    H    LEU  65           HN       LEU  65   4.617   1.868   3.117
  560    HA   LEU  65           HA       LEU  65   4.560   0.362   0.589
  561    HB2  LEU  65           2HB      LEU  65   2.154   0.635   2.356
  562    HB3  LEU  65           3HB      LEU  65   2.421  -0.484   1.021
  563    HG   LEU  65           HG       LEU  65   3.841  -0.619   3.679
  564   HD11  LEU  65          1HD1      LEU  65   1.207  -1.172   3.270
  565   HD12  LEU  65          2HD1      LEU  65   2.220  -1.926   4.500
  566   HD13  LEU  65          3HD1      LEU  65   1.956  -2.737   2.957
  567   HD21  LEU  65          3HD2      LEU  65   4.007  -2.133   1.138
  568   HD22  LEU  65          1HD2      LEU  65   4.086  -3.057   2.638
  569   HD23  LEU  65          2HD2      LEU  65   5.256  -1.774   2.331
  570    H    ILE  66           HN       ILE  66   3.399   1.271  -1.094
  571    HA   ILE  66           HA       ILE  66   2.231   3.927  -0.614
  572    HB   ILE  66           HB       ILE  66   3.847   3.329  -3.079
  573   HG12  ILE  66          2HG1      ILE  66   4.780   4.536  -0.470
  574   HG13  ILE  66          3HG1      ILE  66   5.396   3.083  -1.249
  575   HG21  ILE  66          1HG2      ILE  66   2.095   5.256  -2.771
  576   HG22  ILE  66          2HG2      ILE  66   3.417   6.029  -1.898
  577   HG23  ILE  66          3HG2      ILE  66   3.631   5.557  -3.584
  578   HD11  ILE  66          3HD1      ILE  66   6.730   4.239  -2.627
  579   HD12  ILE  66          1HD1      ILE  66   5.545   5.521  -2.872
  580   HD13  ILE  66          2HD1      ILE  66   6.547   5.512  -1.421
  581    H    CYS  67           HN       CYS  67   0.172   3.891  -1.196
  582    HA   CYS  67           HA       CYS  67  -0.614   2.218  -3.492
  583    HB2  CYS  67           2HB      CYS  67  -2.500   3.036  -1.296
  584    HB3  CYS  67           3HB      CYS  67  -2.671   1.726  -2.457
  585    HG   CYS  67           HG       CYS  67  -1.792   1.421   0.560
  586    H    HIS  68           HN       HIS  68  -2.610   3.004  -4.614
  587    HA   HIS  68           HA       HIS  68  -2.526   5.940  -4.823
  588    HB2  HIS  68           2HB      HIS  68  -1.818   4.577  -6.830
  589    HB3  HIS  68           3HB      HIS  68  -3.480   4.007  -6.939
  590    HD2  HIS  68           2HD      HIS  68  -2.680   7.780  -6.244
  591    HE1  HIS  68           1HE      HIS  68  -4.406   7.425 -10.103
  592    HE2  HIS  68           2HE      HIS  68  -3.529   9.011  -8.355
  593    H    ILE  69           HN       ILE  69  -4.161   6.773  -3.685
  594    HA   ILE  69           HA       ILE  69  -6.650   5.392  -3.316
  595    HB   ILE  69           HB       ILE  69  -5.919   8.240  -2.625
  596   HG12  ILE  69          2HG1      ILE  69  -6.062   5.885  -0.748
  597   HG13  ILE  69          3HG1      ILE  69  -4.571   6.334  -1.568
  598   HG21  ILE  69          1HG2      ILE  69  -8.039   8.518  -2.037
  599   HG22  ILE  69          2HG2      ILE  69  -8.415   6.888  -2.593
  600   HG23  ILE  69          3HG2      ILE  69  -7.912   7.156  -0.924
  601   HD11  ILE  69          3HD1      ILE  69  -6.147   8.030   0.351
  602   HD12  ILE  69          1HD1      ILE  69  -4.592   7.254   0.650
  603   HD13  ILE  69          2HD1      ILE  69  -4.714   8.562  -0.527
  604    H    GLN  70           HN       GLN  70  -8.419   5.501  -4.534
  605    HA   GLN  70           HA       GLN  70  -8.569   7.616  -6.579
  606    HB2  GLN  70           2HB      GLN  70  -9.460   4.744  -6.613
  607    HB3  GLN  70           3HB      GLN  70 -10.133   5.922  -7.731
  608    HG2  GLN  70           2HG      GLN  70  -7.667   6.429  -8.309
  609    HG3  GLN  70           3HG      GLN  70  -7.344   4.871  -7.552
  610   HE21  GLN  70          1HE2      GLN  70  -6.635   5.015 -10.066
  611   HE22  GLN  70          2HE2      GLN  70  -7.742   4.196 -11.108
  612    H    ASP  71           HN       ASP  71  -9.805   9.149  -5.624
  613    HA   ASP  71           HA       ASP  71 -11.934   8.718  -3.865
  614    HB2  ASP  71           2HB      ASP  71 -11.476  11.047  -5.742
  615    HB3  ASP  71           3HB      ASP  71 -12.587  11.045  -4.375
  616    H    ARG  72           HN       ARG  72 -11.836   8.877  -7.375
  617    HA   ARG  72           HA       ARG  72 -14.395   9.217  -8.143
  618    HB2  ARG  72           2HB      ARG  72 -12.481   7.104  -9.143
  619    HB3  ARG  72           3HB      ARG  72 -13.972   7.548  -9.964
  620    HG2  ARG  72           2HG      ARG  72 -12.041   9.708  -9.316
  621    HG3  ARG  72           3HG      ARG  72 -11.646   8.596 -10.629
  622    HD2  ARG  72           2HD      ARG  72 -13.570   9.190 -11.849
  623    HD3  ARG  72           3HD      ARG  72 -14.307   9.977 -10.454
  624    HE   ARG  72           HE       ARG  72 -12.016  11.390 -10.907
  625   HH11  ARG  72          2HH1      ARG  72 -14.798  10.527 -12.813
  626   HH12  ARG  72          1HH1      ARG  72 -14.727  11.950 -13.799
  627   HH21  ARG  72          2HH2      ARG  72 -11.911  13.267 -12.199
  628   HH22  ARG  72          1HH2      ARG  72 -13.084  13.508 -13.449
  629    H    GLU  73           HN       GLU  73 -13.084   6.025  -7.227
  630    HA   GLU  73           HA       GLU  73 -15.823   5.236  -6.476
  631    HB2  GLU  73           2HB      GLU  73 -13.683   3.734  -7.935
  632    HB3  GLU  73           3HB      GLU  73 -14.841   2.850  -6.951
  633    HG2  GLU  73           2HG      GLU  73 -15.609   4.752  -9.150
  634    HG3  GLU  73           3HG      GLU  73 -15.434   3.011  -9.360
  635    H    ALA  74           HN       ALA  74 -13.342   6.338  -5.014
  636    HA   ALA  74           HA       ALA  74 -12.221   6.013  -3.050
  637    HB1  ALA  74           1HB      ALA  74 -13.686   5.948  -1.366
  638    HB2  ALA  74           2HB      ALA  74 -14.921   5.786  -2.614
  639    HB3  ALA  74           3HB      ALA  74 -14.274   4.349  -1.823
  640    H    THR  75           HN       THR  75 -11.224   4.295  -4.838
  641    HA   THR  75           HA       THR  75 -10.982   1.755  -3.360
  642    HB   THR  75           HB       THR  75 -10.770   2.228  -6.337
  643    HG1  THR  75           1HG      THR  75 -12.707   1.332  -6.405
  644   HG21  THR  75          3HG2      THR  75 -10.705  -0.486  -5.958
  645   HG22  THR  75          1HG2      THR  75  -9.694   0.102  -4.638
  646   HG23  THR  75          2HG2      THR  75  -9.303   0.527  -6.304
  647    H    VAL  76           HN       VAL  76  -9.020   1.236  -2.630
  648    HA   VAL  76           HA       VAL  76  -6.755   2.915  -3.438
  649    HB   VAL  76           HB       VAL  76  -6.893   1.012  -1.099
  650   HG11  VAL  76          1HG1      VAL  76  -4.678   1.386  -1.183
  651   HG12  VAL  76          2HG1      VAL  76  -4.855   2.817  -2.201
  652   HG13  VAL  76          3HG1      VAL  76  -5.095   2.938  -0.458
  653   HG21  VAL  76          3HG2      VAL  76  -8.104   2.491   0.033
  654   HG22  VAL  76          1HG2      VAL  76  -6.935   3.762  -0.325
  655   HG23  VAL  76          2HG2      VAL  76  -8.268   3.452  -1.436
  656    H    LEU  77           HN       LEU  77  -5.270   2.135  -4.771
  657    HA   LEU  77           HA       LEU  77  -4.975  -0.789  -4.993
  658    HB2  LEU  77           2HB      LEU  77  -5.895   0.016  -7.024
  659    HB3  LEU  77           3HB      LEU  77  -4.764   1.367  -7.078
  660    HG   LEU  77           HG       LEU  77  -2.997  -0.610  -7.229
  661   HD11  LEU  77          1HD1      LEU  77  -4.411  -2.134  -9.010
  662   HD12  LEU  77          2HD1      LEU  77  -5.579  -1.879  -7.714
  663   HD13  LEU  77          3HD1      LEU  77  -4.008  -2.597  -7.357
  664   HD21  LEU  77          3HD2      LEU  77  -3.323   1.221  -8.841
  665   HD22  LEU  77          1HD2      LEU  77  -4.652   0.321  -9.573
  666   HD23  LEU  77          2HD2      LEU  77  -3.012  -0.324  -9.636
  667    H    VAL  78           HN       VAL  78  -3.127  -1.489  -4.174
  668    HA   VAL  78           HA       VAL  78  -0.986   0.149  -3.404
  669    HB   VAL  78           HB       VAL  78  -0.903  -2.820  -3.954
  670   HG11  VAL  78          1HG1      VAL  78   0.768  -1.590  -1.856
  671   HG12  VAL  78          2HG1      VAL  78   1.132  -2.905  -2.976
  672   HG13  VAL  78          3HG1      VAL  78   1.221  -1.230  -3.522
  673   HG21  VAL  78          3HG2      VAL  78  -2.588  -2.647  -2.384
  674   HG22  VAL  78          1HG2      VAL  78  -1.161  -2.808  -1.360
  675   HG23  VAL  78          2HG2      VAL  78  -1.880  -1.220  -1.626
  676    H    LEU  79           HN       LEU  79   0.928   0.693  -4.342
  677    HA   LEU  79           HA       LEU  79   1.228   0.000  -7.186
  678    HB2  LEU  79           2HB      LEU  79   1.949   2.429  -5.595
  679    HB3  LEU  79           3HB      LEU  79   2.790   2.069  -7.102
  680    HG   LEU  79           HG       LEU  79  -0.200   2.386  -6.908
  681   HD11  LEU  79          1HD1      LEU  79   1.811   4.453  -7.779
  682   HD12  LEU  79          2HD1      LEU  79   0.989   4.451  -6.218
  683   HD13  LEU  79          3HD1      LEU  79   0.058   4.633  -7.705
  684   HD21  LEU  79          3HD2      LEU  79  -0.107   2.589  -9.296
  685   HD22  LEU  79          1HD2      LEU  79   0.729   1.109  -8.828
  686   HD23  LEU  79          2HD2      LEU  79   1.657   2.540  -9.278
  687    H    ARG  80           HN       ARG  80   3.166   0.714  -4.281
  688    HA   ARG  80           HA       ARG  80   5.087  -1.323  -5.165
  689    HB2  ARG  80           2HB      ARG  80   5.790   1.140  -5.599
  690    HB3  ARG  80           3HB      ARG  80   6.034   1.208  -3.859
  691    HG2  ARG  80           2HG      ARG  80   8.117   0.732  -4.985
  692    HG3  ARG  80           3HG      ARG  80   7.617  -0.655  -4.016
  693    HD2  ARG  80           2HD      ARG  80   7.081  -1.923  -5.870
  694    HD3  ARG  80           3HD      ARG  80   6.839  -0.509  -6.894
  695    HE   ARG  80           HE       ARG  80   9.554  -0.828  -6.025
  696   HH11  ARG  80          2HH1      ARG  80   7.190  -1.783  -8.396
  697   HH12  ARG  80          1HH1      ARG  80   8.369  -2.179  -9.603
  698   HH21  ARG  80          2HH2      ARG  80  11.115  -1.346  -7.605
  699   HH22  ARG  80          1HH2      ARG  80  10.602  -1.931  -9.151
  700    H    VAL  81           HN       VAL  81   6.274  -2.333  -3.482
  701    HA   VAL  81           HA       VAL  81   5.523  -1.723  -0.733
  702    HB   VAL  81           HB       VAL  81   4.993  -4.403  -2.019
  703   HG11  VAL  81          1HG1      VAL  81   4.097  -4.466   0.617
  704   HG12  VAL  81          2HG1      VAL  81   5.482  -5.328  -0.055
  705   HG13  VAL  81          3HG1      VAL  81   5.706  -3.750   0.702
  706   HG21  VAL  81          3HG2      VAL  81   3.181  -2.890  -2.380
  707   HG22  VAL  81          1HG2      VAL  81   2.701  -3.996  -1.093
  708   HG23  VAL  81          2HG2      VAL  81   3.216  -2.356  -0.699
  709    H    GLY  82           HN       GLY  82   7.390  -1.597   0.317
  710    HA2  GLY  82           1HA      GLY  82   9.282  -3.783   0.191
  711    HA3  GLY  82           2HA      GLY  82   9.884  -2.270  -0.468
  712    H    HIS  83           HN       HIS  83  10.988  -3.625   1.762
  713    HA   HIS  83           HA       HIS  83  10.219  -2.861   4.272
  714    HB2  HIS  83           2HB      HIS  83  12.198  -4.297   3.668
  715    HB3  HIS  83           3HB      HIS  83  13.089  -2.817   3.326
  716    HD2  HIS  83           2HD      HIS  83  12.210  -5.060   6.287
  717    HE1  HIS  83           1HE      HIS  83  13.880  -1.504   7.886
  718    HE2  HIS  83           2HE      HIS  83  13.225  -3.890   8.358
  719    H    ALA  84           HN       ALA  84  11.057  -1.163   5.705
  720    HA   ALA  84           HA       ALA  84  10.413   1.378   4.928
  721    HB1  ALA  84           1HB      ALA  84  11.835   0.190   7.177
  722    HB2  ALA  84           2HB      ALA  84  12.331   1.848   6.837
  723    HB3  ALA  84           3HB      ALA  84  10.634   1.482   7.148
  724    H    ARG  85           HN       ARG  85  13.717   0.046   5.103
  725    HA   ARG  85           HA       ARG  85  14.791   2.365   3.740
  726    HB2  ARG  85           2HB      ARG  85  16.962   1.228   4.002
  727    HB3  ARG  85           3HB      ARG  85  16.096   1.358   5.526
  728    HG2  ARG  85           2HG      ARG  85  16.738  -0.799   5.700
  729    HG3  ARG  85           3HG      ARG  85  15.251  -1.057   4.785
  730    HD2  ARG  85           2HD      ARG  85  17.747  -0.538   3.263
  731    HD3  ARG  85           3HD      ARG  85  17.575  -2.109   4.044
  732    HE   ARG  85           HE       ARG  85  15.226  -1.544   2.620
  733   HH11  ARG  85          2HH1      ARG  85  18.580  -2.289   2.056
  734   HH12  ARG  85          1HH1      ARG  85  18.290  -3.042   0.522
  735   HH21  ARG  85          2HH2      ARG  85  14.831  -2.532   0.603
  736   HH22  ARG  85          1HH2      ARG  85  16.157  -3.179  -0.304
  737    H    ASP  86           HN       ASP  86  12.880   0.483   2.407
  738    HA   ASP  86           HA       ASP  86  14.584  -0.424   0.185
  739    HB2  ASP  86           2HB      ASP  86  13.135  -2.126   1.347
  740    HB3  ASP  86           3HB      ASP  86  11.731  -1.245   0.751
  741    H    VAL  87           HN       VAL  87  11.655   1.377   0.983
  742    HA   VAL  87           HA       VAL  87  11.161   2.120  -1.760
  743    HB   VAL  87           HB       VAL  87   9.912   3.201   0.770
  744   HG11  VAL  87          1HG1      VAL  87   9.791   4.579  -1.381
  745   HG12  VAL  87          2HG1      VAL  87   8.746   3.296  -1.994
  746   HG13  VAL  87          3HG1      VAL  87   8.273   4.211  -0.562
  747   HG21  VAL  87          3HG2      VAL  87   7.996   1.681  -0.333
  748   HG22  VAL  87          1HG2      VAL  87   9.422   0.777  -0.844
  749   HG23  VAL  87          2HG2      VAL  87   9.135   1.077   0.870
  750    H    TYR  88           HN       TYR  88  12.121   3.730  -2.795
  751    HA   TYR  88           HA       TYR  88  14.148   5.301  -1.951
  752    HB2  TYR  88           2HB      TYR  88  13.796   5.495  -4.216
  753    HB3  TYR  88           3HB      TYR  88  12.055   5.683  -4.040
  754    HD1  TYR  88           1HD      TYR  88  11.193   7.908  -3.109
  755    HD2  TYR  88           2HD      TYR  88  15.165   7.365  -4.535
  756    HE1  TYR  88           1HE      TYR  88  11.425  10.342  -3.372
  757    HE2  TYR  88           2HE      TYR  88  15.409   9.798  -4.800
  758    HH   TYR  88           HH       TYR  88  14.465  11.786  -4.510
  759    H    ARG  89           HN       ARG  89  14.421   7.386  -1.121
  760    HA   ARG  89           HA       ARG  89  12.254   8.248   0.632
  761    HB2  ARG  89           2HB      ARG  89  14.571   7.927   1.513
  762    HB3  ARG  89           3HB      ARG  89  15.098   9.258   0.492
  763    HG2  ARG  89           2HG      ARG  89  13.468  10.721   1.687
  764    HG3  ARG  89           3HG      ARG  89  13.166   9.379   2.793
  765    HD2  ARG  89           2HD      ARG  89  14.787  10.474   3.965
  766    HD3  ARG  89           3HD      ARG  89  15.801   9.414   2.987
  767    HE   ARG  89           HE       ARG  89  15.468  11.744   1.534
  768   HH11  ARG  89          2HH1      ARG  89  16.822  10.806   4.601
  769   HH12  ARG  89          1HH1      ARG  89  18.006  12.071   4.613
  770   HH21  ARG  89          2HH2      ARG  89  17.023  13.413   1.538
  771   HH22  ARG  89          1HH2      ARG  89  18.118  13.554   2.871
  Start of MODEL   18
    1    H1   MET   1           HN       MET   1 -15.948  -2.608   3.347
    2    HA   MET   1           HA       MET   1 -17.619  -0.399   4.152
    3    HB2  MET   1           2HB      MET   1 -15.483  -2.007   5.538
    4    HB3  MET   1           3HB      MET   1 -16.217  -0.595   6.287
    5    HG2  MET   1           2HG      MET   1 -18.450  -1.733   5.887
    6    HG3  MET   1           3HG      MET   1 -17.520  -3.185   5.523
    7    HE1  MET   1           3HE      MET   1 -19.611  -3.158   8.557
    8    HE2  MET   1           1HE      MET   1 -19.180  -4.022   7.081
    9    HE3  MET   1           2HE      MET   1 -18.538  -4.557   8.634
   10    H    GLY   2           HN       GLY   2 -17.019   1.369   2.917
   11    HA2  GLY   2           1HA      GLY   2 -15.849   3.426   2.987
   12    HA3  GLY   2           2HA      GLY   2 -14.482   2.595   3.715
   13    H    TYR   3           HN       TYR   3 -12.788   2.223   2.451
   14    HA   TYR   3           HA       TYR   3 -13.109   2.594  -0.436
   15    HB2  TYR   3           2HB      TYR   3 -10.723   2.709   1.401
   16    HB3  TYR   3           3HB      TYR   3 -10.547   2.657  -0.350
   17    HD1  TYR   3           2HD      TYR   3 -12.494   4.562   2.217
   18    HD2  TYR   3           1HD      TYR   3 -10.308   4.675  -1.432
   19    HE1  TYR   3           2HE      TYR   3 -12.794   7.001   2.119
   20    HE2  TYR   3           1HE      TYR   3 -10.601   7.115  -1.539
   21    HH   TYR   3           HH       TYR   3 -11.959   8.845  -0.689
   22    H    ARG   4           HN       ARG   4 -12.135   1.147  -1.934
   23    HA   ARG   4           HA       ARG   4 -12.273  -1.616  -1.062
   24    HB2  ARG   4           2HB      ARG   4 -13.394  -0.995  -3.132
   25    HB3  ARG   4           3HB      ARG   4 -11.881  -0.400  -3.802
   26    HG2  ARG   4           2HG      ARG   4 -12.076  -2.466  -4.795
   27    HG3  ARG   4           3HG      ARG   4 -11.045  -2.821  -3.408
   28    HD2  ARG   4           2HD      ARG   4 -12.722  -4.523  -3.549
   29    HD3  ARG   4           3HD      ARG   4 -13.081  -3.509  -2.152
   30    HE   ARG   4           HE       ARG   4 -14.527  -2.445  -4.238
   31   HH11  ARG   4          2HH1      ARG   4 -14.336  -5.511  -2.600
   32   HH12  ARG   4          1HH1      ARG   4 -15.996  -5.915  -2.886
   33   HH21  ARG   4          2HH2      ARG   4 -16.714  -2.966  -4.621
   34   HH22  ARG   4          1HH2      ARG   4 -17.348  -4.467  -4.036
   35    H    ILE   5           HN       ILE   5 -10.617  -3.142  -1.320
   36    HA   ILE   5           HA       ILE   5  -7.925  -1.976  -1.292
   37    HB   ILE   5           HB       ILE   5  -8.656  -4.778  -0.463
   38   HG12  ILE   5          2HG1      ILE   5  -9.988  -3.319   0.917
   39   HG13  ILE   5          3HG1      ILE   5  -8.627  -3.889   1.877
   40   HG21  ILE   5          1HG2      ILE   5  -6.507  -5.014   0.082
   41   HG22  ILE   5          2HG2      ILE   5  -6.218  -3.552  -0.860
   42   HG23  ILE   5          3HG2      ILE   5  -6.456  -3.444   0.884
   43   HD11  ILE   5          3HD1      ILE   5  -7.471  -1.750   1.404
   44   HD12  ILE   5          1HD1      ILE   5  -8.932  -1.188   0.591
   45   HD13  ILE   5          2HD1      ILE   5  -8.970  -1.566   2.314
   46    H    GLU   6           HN       GLU   6  -6.943  -2.011  -3.204
   47    HA   GLU   6           HA       GLU   6  -7.159  -4.457  -4.832
   48    HB2  GLU   6           2HB      GLU   6  -7.257  -1.576  -5.651
   49    HB3  GLU   6           3HB      GLU   6  -6.640  -2.782  -6.771
   50    HG2  GLU   6           2HG      GLU   6  -9.359  -2.841  -5.482
   51    HG3  GLU   6           3HG      GLU   6  -9.016  -2.288  -7.121
   52    H    PHE   7           HN       PHE   7  -5.298  -5.084  -5.997
   53    HA   PHE   7           HA       PHE   7  -2.803  -3.721  -5.263
   54    HB2  PHE   7           2HB      PHE   7  -3.504  -6.610  -4.849
   55    HB3  PHE   7           3HB      PHE   7  -1.830  -6.134  -5.116
   56    HD1  PHE   7           1HD      PHE   7  -4.764  -5.299  -2.979
   57    HD2  PHE   7           2HD      PHE   7  -0.527  -5.546  -3.310
   58    HE1  PHE   7           1HE      PHE   7  -4.548  -4.741  -0.593
   59    HE2  PHE   7           2HE      PHE   7  -0.305  -4.989  -0.924
   60    HZ   PHE   7           HZ       PHE   7  -2.317  -4.586   0.439
   61    H    ASP   8           HN       ASP   8  -1.438  -3.443  -6.915
   62    HA   ASP   8           HA       ASP   8  -2.211  -4.146  -9.552
   63    HB2  ASP   8           2HB      ASP   8   0.098  -2.754  -8.296
   64    HB3  ASP   8           3HB      ASP   8   0.332  -3.395  -9.920
   65    HA   PRO   9           HA       PRO   9  -0.303  -8.032 -10.247
   66    HB2  PRO   9           2HB      PRO   9   0.732  -7.755 -12.741
   67    HB3  PRO   9           3HB      PRO   9  -1.003  -7.887 -12.430
   68    HG2  PRO   9           2HG      PRO   9   0.651  -5.443 -12.936
   69    HG3  PRO   9           3HG      PRO   9  -0.949  -5.863 -13.575
   70    HD2  PRO   9           2HD      PRO   9  -0.611  -4.145 -11.510
   71    HD3  PRO   9           3HD      PRO   9  -2.031  -5.201 -11.651
   72    H    ARG  10           HN       ARG  10   1.570  -5.220 -10.036
   73    HA   ARG  10           HA       ARG  10   4.110  -6.636 -10.327
   74    HB2  ARG  10           2HB      ARG  10   3.399  -3.726  -9.998
   75    HB3  ARG  10           3HB      ARG  10   5.056  -4.306  -9.889
   76    HG2  ARG  10           2HG      ARG  10   5.188  -4.774 -12.122
   77    HG3  ARG  10           3HG      ARG  10   3.452  -5.045 -12.279
   78    HD2  ARG  10           2HD      ARG  10   3.132  -2.585 -11.907
   79    HD3  ARG  10           3HD      ARG  10   4.883  -2.408 -12.014
   80    HE   ARG  10           HE       ARG  10   4.264  -3.707 -14.298
   81   HH11  ARG  10          2HH1      ARG  10   3.035  -0.819 -12.793
   82   HH12  ARG  10          1HH1      ARG  10   2.621  -0.057 -14.293
   83   HH21  ARG  10          2HH2      ARG  10   3.724  -2.714 -16.280
   84   HH22  ARG  10          1HH2      ARG  10   3.013  -1.136 -16.275
   85    H    ALA  11           HN       ALA  11   2.419  -4.624  -7.925
   86    HA   ALA  11           HA       ALA  11   4.266  -5.002  -5.840
   87    HB1  ALA  11           1HB      ALA  11   2.852  -3.232  -5.453
   88    HB2  ALA  11           2HB      ALA  11   1.421  -4.118  -5.981
   89    HB3  ALA  11           3HB      ALA  11   2.143  -4.466  -4.410
   90    H    GLU  12           HN       GLU  12   1.302  -6.755  -6.691
   91    HA   GLU  12           HA       GLU  12   0.922  -8.421  -4.600
   92    HB2  GLU  12           2HB      GLU  12  -0.098  -8.357  -7.057
   93    HB3  GLU  12           3HB      GLU  12   0.978  -9.731  -7.274
   94    HG2  GLU  12           2HG      GLU  12  -0.849  -9.670  -4.924
   95    HG3  GLU  12           3HG      GLU  12  -1.492 -10.077  -6.514
   96    H    LYS  13           HN       LYS  13   3.357  -8.873  -7.141
   97    HA   LYS  13           HA       LYS  13   4.416 -11.258  -5.943
   98    HB2  LYS  13           2HB      LYS  13   5.166  -9.524  -8.264
   99    HB3  LYS  13           3HB      LYS  13   6.338 -10.678  -7.642
  100    HG2  LYS  13           2HG      LYS  13   3.589 -11.640  -8.236
  101    HG3  LYS  13           3HG      LYS  13   4.681 -11.309  -9.583
  102    HD2  LYS  13           2HD      LYS  13   6.370 -12.779  -8.449
  103    HD3  LYS  13           3HD      LYS  13   5.112 -13.224  -7.294
  104    HE2  LYS  13           2HE      LYS  13   4.605 -13.488 -10.228
  105    HE3  LYS  13           3HE      LYS  13   5.555 -14.714  -9.389
  106    HZ1  LYS  13           3HZ      LYS  13   2.866 -13.864  -8.477
  107    HZ2  LYS  13           1HZ      LYS  13   3.749 -15.220  -7.983
  108    HZ3  LYS  13           2HZ      LYS  13   3.107 -15.153  -9.546
  109    H    GLU  14           HN       GLU  14   5.384  -7.856  -6.109
  110    HA   GLU  14           HA       GLU  14   7.870  -8.084  -4.853
  111    HB2  GLU  14           2HB      GLU  14   5.888  -5.807  -4.904
  112    HB3  GLU  14           3HB      GLU  14   7.504  -5.667  -4.226
  113    HG2  GLU  14           2HG      GLU  14   8.487  -6.160  -6.379
  114    HG3  GLU  14           3HG      GLU  14   6.888  -6.408  -7.077
  115    H    LEU  15           HN       LEU  15   4.671  -8.257  -3.575
  116    HA   LEU  15           HA       LEU  15   5.543  -7.820  -0.835
  117    HB2  LEU  15           2HB      LEU  15   3.441  -6.886  -1.283
  118    HB3  LEU  15           3HB      LEU  15   2.889  -8.326  -2.136
  119    HG   LEU  15           HG       LEU  15   3.498  -8.544   0.772
  120   HD11  LEU  15          1HD1      LEU  15   2.195  -6.627   0.940
  121   HD12  LEU  15          2HD1      LEU  15   1.023  -7.933   1.111
  122   HD13  LEU  15          3HD1      LEU  15   1.174  -7.080  -0.425
  123   HD21  LEU  15          3HD2      LEU  15   2.739 -10.575   0.243
  124   HD22  LEU  15          1HD2      LEU  15   2.087 -10.024  -1.300
  125   HD23  LEU  15          2HD2      LEU  15   1.140  -9.832   0.175
  126    H    GLU  16           HN       GLU  16   3.909 -10.426  -2.644
  127    HA   GLU  16           HA       GLU  16   3.906 -12.392  -0.736
  128    HB2  GLU  16           2HB      GLU  16   3.557 -13.930  -2.445
  129    HB3  GLU  16           3HB      GLU  16   3.037 -12.419  -3.177
  130    HG2  GLU  16           2HG      GLU  16   5.197 -12.221  -4.303
  131    HG3  GLU  16           3HG      GLU  16   5.711 -13.741  -3.575
  132    H    LYS  17           HN       LYS  17   6.583 -11.373  -2.785
  133    HA   LYS  17           HA       LYS  17   8.375 -13.445  -2.189
  134    HB2  LYS  17           2HB      LYS  17  10.051 -12.098  -3.142
  135    HB3  LYS  17           3HB      LYS  17   8.576 -11.624  -3.973
  136    HG2  LYS  17           2HG      LYS  17   9.425  -9.568  -3.534
  137    HG3  LYS  17           3HG      LYS  17   8.506  -9.811  -2.047
  138    HD2  LYS  17           2HD      LYS  17  10.383 -10.127  -0.778
  139    HD3  LYS  17           3HD      LYS  17  11.317 -10.778  -2.127
  140    HE2  LYS  17           2HE      LYS  17  10.474  -7.924  -2.216
  141    HE3  LYS  17           3HE      LYS  17  11.801  -8.377  -1.148
  142    HZ1  LYS  17           3HZ      LYS  17  12.943  -7.948  -3.051
  143    HZ2  LYS  17           1HZ      LYS  17  11.674  -8.407  -4.071
  144    HZ3  LYS  17           2HZ      LYS  17  12.618  -9.588  -3.312
  145    H    LEU  18           HN       LEU  18   7.570 -10.494  -0.468
  146    HA   LEU  18           HA       LEU  18   9.695 -10.421   1.342
  147    HB2  LEU  18           2HB      LEU  18   6.826  -9.577   1.712
  148    HB3  LEU  18           3HB      LEU  18   8.142  -9.161   2.808
  149    HG   LEU  18           HG       LEU  18   8.170  -8.367  -0.092
  150   HD11  LEU  18          1HD1      LEU  18   6.976  -6.461   0.300
  151   HD12  LEU  18          2HD1      LEU  18   7.344  -6.448   2.024
  152   HD13  LEU  18          3HD1      LEU  18   6.141  -7.569   1.388
  153   HD21  LEU  18          3HD2      LEU  18   9.406  -6.616   1.856
  154   HD22  LEU  18          1HD2      LEU  18  10.087  -7.351   0.404
  155   HD23  LEU  18          2HD2      LEU  18  10.071  -8.249   1.922
  156    H    ASP  19           HN       ASP  19   9.281 -10.725   3.802
  157    HA   ASP  19           HA       ASP  19   9.178 -13.438   4.361
  158    HB2  ASP  19           2HB      ASP  19   9.969 -11.350   5.785
  159    HB3  ASP  19           3HB      ASP  19   8.359 -11.503   6.483
  160    H    ARG  20           HN       ARG  20   7.578 -14.860   4.502
  161    HA   ARG  20           HA       ARG  20   5.014 -14.582   3.800
  162    HB2  ARG  20           2HB      ARG  20   6.101 -16.329   6.008
  163    HB3  ARG  20           3HB      ARG  20   4.462 -16.474   5.388
  164    HG2  ARG  20           2HG      ARG  20   6.793 -16.617   3.525
  165    HG3  ARG  20           3HG      ARG  20   6.313 -18.026   4.472
  166    HD2  ARG  20           2HD      ARG  20   4.323 -16.495   2.833
  167    HD3  ARG  20           3HD      ARG  20   5.335 -17.744   2.109
  168    HE   ARG  20           HE       ARG  20   3.071 -18.135   3.812
  169   HH11  ARG  20          2HH1      ARG  20   6.117 -19.489   2.805
  170   HH12  ARG  20          1HH1      ARG  20   5.665 -21.119   3.181
  171   HH21  ARG  20          2HH2      ARG  20   2.465 -20.277   4.310
  172   HH22  ARG  20          1HH2      ARG  20   3.587 -21.566   4.036
  173    H    GLU  21           HN       GLU  21   6.067 -14.309   7.199
  174    HA   GLU  21           HA       GLU  21   3.633 -13.595   8.309
  175    HB2  GLU  21           2HB      GLU  21   5.950 -14.081   9.411
  176    HB3  GLU  21           3HB      GLU  21   6.175 -12.342   9.286
  177    HG2  GLU  21           2HG      GLU  21   3.831 -12.263  10.446
  178    HG3  GLU  21           3HG      GLU  21   4.265 -13.893  10.959
  179    H    VAL  22           HN       VAL  22   6.213 -11.415   7.171
  180    HA   VAL  22           HA       VAL  22   5.011  -8.988   7.666
  181    HB   VAL  22           HB       VAL  22   6.699  -9.680   5.258
  182   HG11  VAL  22          1HG1      VAL  22   5.348  -7.466   5.353
  183   HG12  VAL  22          2HG1      VAL  22   6.556  -6.984   6.546
  184   HG13  VAL  22          3HG1      VAL  22   7.054  -7.420   4.911
  185   HG21  VAL  22          3HG2      VAL  22   7.534 -10.125   7.698
  186   HG22  VAL  22          1HG2      VAL  22   8.594  -9.348   6.521
  187   HG23  VAL  22          2HG2      VAL  22   7.751  -8.375   7.727
  188    H    ALA  23           HN       ALA  23   4.823 -10.848   4.628
  189    HA   ALA  23           HA       ALA  23   3.166  -9.237   3.165
  190    HB1  ALA  23           1HB      ALA  23   2.211 -11.627   2.407
  191    HB2  ALA  23           2HB      ALA  23   3.783 -11.006   1.901
  192    HB3  ALA  23           3HB      ALA  23   3.675 -12.144   3.244
  193    H    ARG  24           HN       ARG  24   2.109 -11.814   5.393
  194    HA   ARG  24           HA       ARG  24  -0.643 -11.359   5.124
  195    HB2  ARG  24           2HB      ARG  24   0.250 -13.399   6.121
  196    HB3  ARG  24           3HB      ARG  24   0.898 -12.478   7.472
  197    HG2  ARG  24           2HG      ARG  24  -1.430 -11.827   8.061
  198    HG3  ARG  24           3HG      ARG  24  -2.000 -12.919   6.798
  199    HD2  ARG  24           2HD      ARG  24  -0.427 -14.620   8.090
  200    HD3  ARG  24           3HD      ARG  24  -0.766 -13.526   9.430
  201    HE   ARG  24           HE       ARG  24  -3.209 -14.092   8.306
  202   HH11  ARG  24          2HH1      ARG  24  -0.614 -15.918   9.740
  203   HH12  ARG  24          1HH1      ARG  24  -1.651 -17.173  10.332
  204   HH21  ARG  24          2HH2      ARG  24  -4.584 -15.739   9.081
  205   HH22  ARG  24          1HH2      ARG  24  -3.908 -17.072   9.956
  206    H    ARG  25           HN       ARG  25   1.760  -9.932   7.269
  207    HA   ARG  25           HA       ARG  25  -0.025  -8.558   8.962
  208    HB2  ARG  25           2HB      ARG  25   2.239  -8.832   9.669
  209    HB3  ARG  25           3HB      ARG  25   2.854  -8.048   8.220
  210    HG2  ARG  25           2HG      ARG  25   2.354  -5.941   8.978
  211    HG3  ARG  25           3HG      ARG  25   1.075  -6.514  10.050
  212    HD2  ARG  25           2HD      ARG  25   3.889  -7.347  10.574
  213    HD3  ARG  25           3HD      ARG  25   3.388  -5.713  11.007
  214    HE   ARG  25           HE       ARG  25   2.729  -8.117  12.376
  215   HH11  ARG  25          2HH1      ARG  25   1.495  -4.975  11.525
  216   HH12  ARG  25          1HH1      ARG  25   0.428  -4.881  12.886
  217   HH21  ARG  25          2HH2      ARG  25   1.327  -8.005  14.172
  218   HH22  ARG  25          1HH2      ARG  25   0.334  -6.605  14.392
  219    H    ILE  26           HN       ILE  26   1.453  -7.715   5.881
  220    HA   ILE  26           HA       ILE  26   0.678  -4.995   5.857
  221    HB   ILE  26           HB       ILE  26   1.286  -6.866   3.567
  222   HG12  ILE  26          2HG1      ILE  26   2.979  -4.688   4.806
  223   HG13  ILE  26          3HG1      ILE  26   3.122  -6.395   5.213
  224   HG21  ILE  26          1HG2      ILE  26   0.141  -4.247   3.543
  225   HG22  ILE  26          2HG2      ILE  26   1.755  -4.190   2.836
  226   HG23  ILE  26          3HG2      ILE  26   0.546  -5.296   2.185
  227   HD11  ILE  26          3HD1      ILE  26   4.642  -5.202   3.386
  228   HD12  ILE  26          1HD1      ILE  26   4.182  -6.901   3.287
  229   HD13  ILE  26          2HD1      ILE  26   3.301  -5.693   2.352
  230    H    LEU  27           HN       LEU  27  -0.667  -7.699   3.952
  231    HA   LEU  27           HA       LEU  27  -2.881  -6.457   2.929
  232    HB2  LEU  27           2HB      LEU  27  -2.622  -9.298   3.900
  233    HB3  LEU  27           3HB      LEU  27  -3.952  -8.705   2.906
  234    HG   LEU  27           HG       LEU  27  -1.093  -8.552   1.991
  235   HD11  LEU  27          1HD1      LEU  27  -2.877 -10.738   1.062
  236   HD12  LEU  27          2HD1      LEU  27  -2.071 -10.922   2.619
  237   HD13  LEU  27          3HD1      LEU  27  -1.116 -10.674   1.157
  238   HD21  LEU  27          3HD2      LEU  27  -2.356  -8.706  -0.239
  239   HD22  LEU  27          1HD2      LEU  27  -2.435  -7.189   0.658
  240   HD23  LEU  27          2HD2      LEU  27  -3.793  -8.315   0.708
  241    H    ARG  28           HN       ARG  28  -2.934  -8.467   5.881
  242    HA   ARG  28           HA       ARG  28  -5.484  -7.955   6.727
  243    HB2  ARG  28           2HB      ARG  28  -3.903  -9.528   7.815
  244    HB3  ARG  28           3HB      ARG  28  -3.059  -8.156   8.520
  245    HG2  ARG  28           2HG      ARG  28  -4.694  -7.754  10.051
  246    HG3  ARG  28           3HG      ARG  28  -5.973  -8.392   9.016
  247    HD2  ARG  28           2HD      ARG  28  -3.875 -10.230  10.083
  248    HD3  ARG  28           3HD      ARG  28  -5.198  -9.718  11.130
  249    HE   ARG  28           HE       ARG  28  -6.176 -10.666   8.640
  250   HH11  ARG  28          2HH1      ARG  28  -4.866 -11.732  11.685
  251   HH12  ARG  28          1HH1      ARG  28  -5.662 -13.270  11.637
  252   HH21  ARG  28          2HH2      ARG  28  -7.229 -12.689   8.566
  253   HH22  ARG  28          1HH2      ARG  28  -7.004 -13.814   9.863
  254    H    PHE  29           HN       PHE  29  -2.592  -6.018   7.444
  255    HA   PHE  29           HA       PHE  29  -3.713  -4.114   9.099
  256    HB2  PHE  29           2HB      PHE  29  -1.383  -4.013   8.871
  257    HB3  PHE  29           3HB      PHE  29  -1.463  -3.996   7.112
  258    HD1  PHE  29           1HD      PHE  29  -2.115  -1.970  10.139
  259    HD2  PHE  29           2HD      PHE  29  -1.518  -1.976   5.924
  260    HE1  PHE  29           1HE      PHE  29  -1.951   0.485  10.162
  261    HE2  PHE  29           2HE      PHE  29  -1.351   0.478   5.941
  262    HZ   PHE  29           HZ       PHE  29  -1.567   1.712   8.061
  263    H    LEU  30           HN       LEU  30  -3.780  -4.312   5.584
  264    HA   LEU  30           HA       LEU  30  -5.151  -1.774   5.330
  265    HB2  LEU  30           2HB      LEU  30  -4.346  -3.893   3.353
  266    HB3  LEU  30           3HB      LEU  30  -5.279  -2.468   2.900
  267    HG   LEU  30           HG       LEU  30  -2.643  -2.140   4.273
  268   HD11  LEU  30          1HD1      LEU  30  -1.846  -3.498   2.601
  269   HD12  LEU  30          2HD1      LEU  30  -1.792  -1.921   1.814
  270   HD13  LEU  30          3HD1      LEU  30  -3.116  -3.034   1.467
  271   HD21  LEU  30          3HD2      LEU  30  -3.018  -0.291   2.221
  272   HD22  LEU  30          1HD2      LEU  30  -3.216  -0.017   3.952
  273   HD23  LEU  30          2HD2      LEU  30  -4.605  -0.478   2.968
  274    H    ARG  31           HN       ARG  31  -5.962  -5.090   5.698
  275    HA   ARG  31           HA       ARG  31  -8.653  -4.757   4.645
  276    HB2  ARG  31           2HB      ARG  31  -7.301  -7.133   5.938
  277    HB3  ARG  31           3HB      ARG  31  -8.924  -7.145   5.259
  278    HG2  ARG  31           2HG      ARG  31  -7.979  -6.595   3.053
  279    HG3  ARG  31           3HG      ARG  31  -6.360  -6.668   3.754
  280    HD2  ARG  31           2HD      ARG  31  -8.158  -9.002   4.140
  281    HD3  ARG  31           3HD      ARG  31  -7.465  -8.749   2.538
  282    HE   ARG  31           HE       ARG  31  -5.389  -8.551   4.373
  283   HH11  ARG  31          2HH1      ARG  31  -7.653 -10.950   3.260
  284   HH12  ARG  31          1HH1      ARG  31  -6.591 -12.284   3.568
  285   HH21  ARG  31          2HH2      ARG  31  -3.982 -10.298   4.783
  286   HH22  ARG  31          1HH2      ARG  31  -4.504 -11.912   4.435
  287    H    GLU  32           HN       GLU  32  -7.014  -4.377   7.588
  288    HA   GLU  32           HA       GLU  32  -9.529  -4.576   9.107
  289    HB2  GLU  32           2HB      GLU  32  -6.653  -4.802   9.990
  290    HB3  GLU  32           3HB      GLU  32  -7.985  -4.614  11.123
  291    HG2  GLU  32           2HG      GLU  32  -8.992  -6.680  10.030
  292    HG3  GLU  32           3HG      GLU  32  -7.411  -6.911   9.285
  293    H    ARG  33           HN       ARG  33  -6.495  -2.787   9.611
  294    HA   ARG  33           HA       ARG  33  -7.631  -0.588  10.857
  295    HB2  ARG  33           2HB      ARG  33  -5.157  -0.561   9.121
  296    HB3  ARG  33           3HB      ARG  33  -5.557   0.583  10.396
  297    HG2  ARG  33           2HG      ARG  33  -5.276  -2.332  11.000
  298    HG3  ARG  33           3HG      ARG  33  -3.857  -1.290  10.879
  299    HD2  ARG  33           2HD      ARG  33  -4.421  -1.299  13.160
  300    HD3  ARG  33           3HD      ARG  33  -5.029   0.236  12.540
  301    HE   ARG  33           HE       ARG  33  -6.952  -1.920  12.555
  302   HH11  ARG  33          2HH1      ARG  33  -5.585   0.765  14.298
  303   HH12  ARG  33          1HH1      ARG  33  -6.967   0.973  15.322
  304   HH21  ARG  33          2HH2      ARG  33  -8.777  -1.657  13.896
  305   HH22  ARG  33          1HH2      ARG  33  -8.782  -0.406  15.093
  306    H    VAL  34           HN       VAL  34  -6.245  -0.374   7.586
  307    HA   VAL  34           HA       VAL  34  -7.550   1.953   6.837
  308    HB   VAL  34           HB       VAL  34  -6.768  -0.291   4.972
  309   HG11  VAL  34          1HG1      VAL  34  -8.203   1.752   4.218
  310   HG12  VAL  34          2HG1      VAL  34  -6.668   2.619   4.308
  311   HG13  VAL  34          3HG1      VAL  34  -6.834   1.227   3.238
  312   HG21  VAL  34          3HG2      VAL  34  -5.162   1.722   6.453
  313   HG22  VAL  34          1HG2      VAL  34  -4.764   0.064   6.002
  314   HG23  VAL  34          2HG2      VAL  34  -4.693   1.348   4.795
  315    H    ALA  35           HN       ALA  35  -8.699  -1.336   6.853
  316    HA   ALA  35           HA       ALA  35 -10.904  -1.018   5.118
  317    HB1  ALA  35           1HB      ALA  35 -10.461  -2.964   7.378
  318    HB2  ALA  35           2HB      ALA  35 -11.770  -3.071   6.200
  319    HB3  ALA  35           3HB      ALA  35 -10.093  -3.217   5.672
  320    H    THR  36           HN       THR  36 -10.671  -0.891   8.669
  321    HA   THR  36           HA       THR  36 -13.419  -0.053   8.930
  322    HB   THR  36           HB       THR  36 -12.409  -1.463  10.663
  323    HG1  THR  36           1HG      THR  36 -13.624  -0.471  12.089
  324   HG21  THR  36          3HG2      THR  36 -10.266  -1.054  11.175
  325   HG22  THR  36          1HG2      THR  36 -10.884   0.227  12.217
  326   HG23  THR  36          2HG2      THR  36 -10.353   0.603  10.578
  327    H    LEU  37           HN       LEU  37 -10.353   1.462   8.567
  328    HA   LEU  37           HA       LEU  37 -10.857   3.923   9.835
  329    HB2  LEU  37           2HB      LEU  37  -9.014   3.041   7.649
  330    HB3  LEU  37           3HB      LEU  37  -9.139   4.747   8.073
  331    HG   LEU  37           HG       LEU  37  -8.381   2.577  10.025
  332   HD11  LEU  37          1HD1      LEU  37  -6.130   4.020   9.663
  333   HD12  LEU  37          2HD1      LEU  37  -6.796   4.048   8.031
  334   HD13  LEU  37          3HD1      LEU  37  -6.479   2.507   8.827
  335   HD21  LEU  37          3HD2      LEU  37  -8.274   5.588  10.148
  336   HD22  LEU  37          1HD2      LEU  37  -7.561   4.506  11.344
  337   HD23  LEU  37          2HD2      LEU  37  -9.308   4.522  11.100
  338    H    GLU  38           HN       GLU  38 -12.583   5.137   9.398
  339    HA   GLU  38           HA       GLU  38 -14.245   5.172   7.276
  340    HB2  GLU  38           2HB      GLU  38 -14.186   6.635   9.455
  341    HB3  GLU  38           3HB      GLU  38 -13.433   7.824   8.401
  342    HG2  GLU  38           2HG      GLU  38 -15.423   7.498   6.861
  343    HG3  GLU  38           3HG      GLU  38 -16.178   6.636   8.200
  344    H    ASP  39           HN       ASP  39 -11.130   6.810   7.465
  345    HA   ASP  39           HA       ASP  39 -11.269   7.247   4.559
  346    HB2  ASP  39           2HB      ASP  39 -10.110   9.165   6.593
  347    HB3  ASP  39           3HB      ASP  39 -10.051   9.369   4.844
  348    HA   PRO  40           HA       PRO  40  -7.443   5.072   4.458
  349    HB2  PRO  40           2HB      PRO  40  -6.518   5.952   2.062
  350    HB3  PRO  40           3HB      PRO  40  -7.840   4.788   2.212
  351    HG2  PRO  40           2HG      PRO  40  -7.962   7.739   1.726
  352    HG3  PRO  40           3HG      PRO  40  -8.896   6.440   0.962
  353    HD2  PRO  40           2HD      PRO  40  -9.901   7.983   2.946
  354    HD3  PRO  40           3HD      PRO  40 -10.364   6.283   2.732
  355    H    ARG  41           HN       ARG  41  -7.604   8.539   4.218
  356    HA   ARG  41           HA       ARG  41  -4.806   9.043   4.242
  357    HB2  ARG  41           2HB      ARG  41  -7.198  10.747   4.929
  358    HB3  ARG  41           3HB      ARG  41  -5.549  11.352   5.006
  359    HG2  ARG  41           2HG      ARG  41  -5.378  10.559   2.561
  360    HG3  ARG  41           3HG      ARG  41  -7.141  10.523   2.615
  361    HD2  ARG  41           2HD      ARG  41  -5.428  12.916   3.277
  362    HD3  ARG  41           3HD      ARG  41  -6.251  12.653   1.740
  363    HE   ARG  41           HE       ARG  41  -8.175  12.486   3.732
  364   HH11  ARG  41          2HH1      ARG  41  -5.979  14.861   2.443
  365   HH12  ARG  41          1HH1      ARG  41  -7.000  16.206   2.831
  366   HH21  ARG  41          2HH2      ARG  41  -9.528  14.249   4.248
  367   HH22  ARG  41          1HH2      ARG  41  -9.018  15.857   3.858
  368    H    SER  42           HN       SER  42  -7.151   8.312   6.684
  369    HA   SER  42           HA       SER  42  -6.208   9.379   8.985
  370    HB2  SER  42           2HB      SER  42  -8.106   7.672   8.645
  371    HB3  SER  42           3HB      SER  42  -6.864   6.440   8.867
  372    HG   SER  42           HG       SER  42  -7.720   8.419  10.700
  373    H    LEU  43           HN       LEU  43  -4.958   6.389   7.507
  374    HA   LEU  43           HA       LEU  43  -2.531   6.695   9.147
  375    HB2  LEU  43           2HB      LEU  43  -3.933   4.288   8.046
  376    HB3  LEU  43           3HB      LEU  43  -2.224   4.219   8.473
  377    HG   LEU  43           HG       LEU  43  -4.420   4.967  10.400
  378   HD11  LEU  43          1HD1      LEU  43  -4.260   2.534   9.359
  379   HD12  LEU  43          2HD1      LEU  43  -4.629   2.803  11.062
  380   HD13  LEU  43          3HD1      LEU  43  -2.989   2.376  10.572
  381   HD21  LEU  43          3HD2      LEU  43  -2.192   5.840  10.945
  382   HD22  LEU  43          1HD2      LEU  43  -1.535   4.206  10.846
  383   HD23  LEU  43          2HD2      LEU  43  -2.715   4.607  12.094
  384    H    GLY  44           HN       GLY  44  -0.545   6.727   8.187
  385    HA2  GLY  44           1HA      GLY  44   0.832   6.082   6.244
  386    HA3  GLY  44           2HA      GLY  44  -0.516   6.584   5.235
  387    H    GLU  45           HN       GLU  45   1.705   7.683   4.480
  388    HA   GLU  45           HA       GLU  45   1.669  10.395   5.632
  389    HB2  GLU  45           2HB      GLU  45   3.798   9.803   6.217
  390    HB3  GLU  45           3HB      GLU  45   3.942   8.623   4.922
  391    HG2  GLU  45           2HG      GLU  45   4.691  10.153   3.415
  392    HG3  GLU  45           3HG      GLU  45   3.828  11.490   4.175
  393    HA   PRO  46           HA       PRO  46   0.497  11.704   1.586
  394    HB2  PRO  46           2HB      PRO  46   1.069  14.344   1.859
  395    HB3  PRO  46           3HB      PRO  46  -0.338  13.583   2.611
  396    HG2  PRO  46           2HG      PRO  46   2.316  14.266   3.816
  397    HG3  PRO  46           3HG      PRO  46   0.691  14.481   4.493
  398    HD2  PRO  46           2HD      PRO  46   2.301  12.420   5.196
  399    HD3  PRO  46           3HD      PRO  46   0.533  12.275   5.142
  400    H    LEU  47           HN       LEU  47   1.396  12.595  -0.354
  401    HA   LEU  47           HA       LEU  47   4.275  12.181  -0.533
  402    HB2  LEU  47           2HB      LEU  47   2.009  12.239  -2.453
  403    HB3  LEU  47           3HB      LEU  47   3.612  12.651  -3.058
  404    HG   LEU  47           HG       LEU  47   2.924  10.266  -3.390
  405   HD11  LEU  47          1HD1      LEU  47   5.388  10.951  -1.812
  406   HD12  LEU  47          2HD1      LEU  47   5.225  10.747  -3.556
  407   HD13  LEU  47          3HD1      LEU  47   5.103   9.347  -2.490
  408   HD21  LEU  47          3HD2      LEU  47   3.566   9.695  -0.555
  409   HD22  LEU  47          1HD2      LEU  47   2.506   8.839  -1.676
  410   HD23  LEU  47          2HD2      LEU  47   1.957  10.329  -0.907
  411    H    ARG  48           HN       ARG  48   5.542  13.675  -1.947
  412    HA   ARG  48           HA       ARG  48   4.606  16.454  -1.777
  413    HB2  ARG  48           2HB      ARG  48   7.219  15.340  -0.777
  414    HB3  ARG  48           3HB      ARG  48   7.031  17.041  -1.184
  415    HG2  ARG  48           2HG      ARG  48   5.244  15.641   0.782
  416    HG3  ARG  48           3HG      ARG  48   6.756  16.424   1.247
  417    HD2  ARG  48           2HD      ARG  48   4.730  17.931  -0.350
  418    HD3  ARG  48           3HD      ARG  48   4.502  17.732   1.387
  419    HE   ARG  48           HE       ARG  48   7.007  18.656   1.275
  420   HH11  ARG  48          2HH1      ARG  48   4.084  19.729  -0.282
  421   HH12  ARG  48          1HH1      ARG  48   4.569  21.392  -0.336
  422   HH21  ARG  48          2HH2      ARG  48   7.657  20.841   1.210
  423   HH22  ARG  48          1HH2      ARG  48   6.602  22.023   0.512
  424    H    GLY  49           HN       GLY  49   4.635  17.329  -3.734
  425    HA2  GLY  49           1HA      GLY  49   6.833  17.534  -5.403
  426    HA3  GLY  49           2HA      GLY  49   5.956  16.109  -5.940
  427    HA   PRO  50           HA       PRO  50   4.077  20.277  -7.439
  428    HB2  PRO  50           2HB      PRO  50   5.400  20.618  -9.785
  429    HB3  PRO  50           3HB      PRO  50   5.948  21.327  -8.261
  430    HG2  PRO  50           2HG      PRO  50   6.892  18.845  -9.645
  431    HG3  PRO  50           3HG      PRO  50   7.843  20.113  -8.850
  432    HD2  PRO  50           2HD      PRO  50   7.291  17.744  -7.660
  433    HD3  PRO  50           3HD      PRO  50   7.460  19.256  -6.745
  434    H    GLU  51           HN       GLU  51   4.954  17.231  -8.873
  435    HA   GLU  51           HA       GLU  51   2.748  17.429 -10.797
  436    HB2  GLU  51           2HB      GLU  51   5.231  15.786 -10.633
  437    HB3  GLU  51           3HB      GLU  51   3.841  15.101 -11.463
  438    HG2  GLU  51           2HG      GLU  51   5.120  16.127 -13.130
  439    HG3  GLU  51           3HG      GLU  51   3.777  17.229 -12.828
  440    H    LEU  52           HN       LEU  52   4.111  14.996  -8.568
  441    HA   LEU  52           HA       LEU  52   1.479  13.747  -8.363
  442    HB2  LEU  52           2HB      LEU  52   2.673  11.963  -7.154
  443    HB3  LEU  52           3HB      LEU  52   3.313  12.254  -8.770
  444    HG   LEU  52           HG       LEU  52   5.046  13.742  -7.474
  445   HD11  LEU  52          1HD1      LEU  52   5.577  12.901  -5.274
  446   HD12  LEU  52          2HD1      LEU  52   4.239  11.756  -5.355
  447   HD13  LEU  52          3HD1      LEU  52   3.914  13.488  -5.300
  448   HD21  LEU  52          3HD2      LEU  52   5.894  11.078  -6.926
  449   HD22  LEU  52          1HD2      LEU  52   6.379  12.146  -8.243
  450   HD23  LEU  52          2HD2      LEU  52   4.984  11.084  -8.438
  451    H    GLY  53           HN       GLY  53   0.615  13.160  -6.254
  452    HA2  GLY  53           1HA      GLY  53   1.597  14.201  -3.829
  453    HA3  GLY  53           2HA      GLY  53   0.443  15.341  -4.504
  454    H    ARG  54           HN       ARG  54  -1.347  13.510  -5.671
  455    HA   ARG  54           HA       ARG  54  -3.087  12.995  -3.580
  456    HB2  ARG  54           2HB      ARG  54  -2.877  11.849  -6.354
  457    HB3  ARG  54           3HB      ARG  54  -4.144  11.336  -5.248
  458    HG2  ARG  54           2HG      ARG  54  -3.673  14.209  -5.996
  459    HG3  ARG  54           3HG      ARG  54  -4.779  13.143  -6.864
  460    HD2  ARG  54           2HD      ARG  54  -4.934  13.796  -3.924
  461    HD3  ARG  54           3HD      ARG  54  -5.924  14.535  -5.182
  462    HE   ARG  54           HE       ARG  54  -6.360  11.866  -5.482
  463   HH11  ARG  54          2HH1      ARG  54  -6.609  14.093  -2.817
  464   HH12  ARG  54          1HH1      ARG  54  -7.891  13.224  -2.042
  465   HH21  ARG  54          2HH2      ARG  54  -8.048  10.714  -4.471
  466   HH22  ARG  54          1HH2      ARG  54  -8.708  11.301  -2.982
  467    H    PHE  55           HN       PHE  55  -0.939  10.701  -5.252
  468    HA   PHE  55           HA       PHE  55  -1.499   8.337  -4.125
  469    HB2  PHE  55           2HB      PHE  55   1.349   9.332  -4.186
  470    HB3  PHE  55           3HB      PHE  55   0.775   7.681  -4.401
  471    HD1  PHE  55           2HD      PHE  55   1.038  10.997  -5.968
  472    HD2  PHE  55           1HD      PHE  55   0.002   6.904  -6.513
  473    HE1  PHE  55           2HE      PHE  55   0.986  11.338  -8.404
  474    HE2  PHE  55           1HE      PHE  55  -0.050   7.239  -8.950
  475    HZ   PHE  55           HZ       PHE  55   0.441   9.458  -9.898
  476    H    TRP  56           HN       TRP  56  -1.315   7.287  -2.202
  477    HA   TRP  56           HA       TRP  56  -0.271   8.841   0.074
  478    HB2  TRP  56           2HB      TRP  56  -2.829   8.586  -0.102
  479    HB3  TRP  56           3HB      TRP  56  -2.557   6.898   0.320
  480    HD1  TRP  56           1HD      TRP  56  -2.003   6.339   2.829
  481    HE1  TRP  56           1HE      TRP  56  -2.008   7.734   4.992
  482    HE3  TRP  56           3HE      TRP  56  -2.319  11.013   0.781
  483    HZ2  TRP  56           2HZ      TRP  56  -2.129  10.455   5.733
  484    HZ3  TRP  56           3HZ      TRP  56  -2.375  12.959   2.287
  485    HH2  TRP  56           2HH      TRP  56  -2.282  12.683   4.711
  486    H    LYS  57           HN       LYS  57   1.156   7.834   1.356
  487    HA   LYS  57           HA       LYS  57   1.727   5.009   0.790
  488    HB2  LYS  57           2HB      LYS  57   3.495   6.969   2.253
  489    HB3  LYS  57           3HB      LYS  57   3.947   5.400   1.599
  490    HG2  LYS  57           2HG      LYS  57   3.858   6.176  -0.615
  491    HG3  LYS  57           3HG      LYS  57   2.984   7.638  -0.152
  492    HD2  LYS  57           2HD      LYS  57   5.262   8.235  -0.602
  493    HD3  LYS  57           3HD      LYS  57   4.995   8.350   1.139
  494    HE2  LYS  57           2HE      LYS  57   6.963   7.202   1.147
  495    HE3  LYS  57           3HE      LYS  57   5.845   5.842   1.058
  496    HZ1  LYS  57           3HZ      LYS  57   6.235   6.512  -1.542
  497    HZ2  LYS  57           1HZ      LYS  57   7.009   5.247  -0.727
  498    HZ3  LYS  57           2HZ      LYS  57   7.767   6.753  -0.866
  499    H    TYR  58           HN       TYR  58   2.068   3.531   2.486
  500    HA   TYR  58           HA       TYR  58   0.991   4.381   5.094
  501    HB2  TYR  58           2HB      TYR  58   0.549   1.772   3.633
  502    HB3  TYR  58           3HB      TYR  58   0.087   2.053   5.308
  503    HD1  TYR  58           2HD      TYR  58  -0.638   2.897   1.807
  504    HD2  TYR  58           1HD      TYR  58  -1.829   3.409   5.860
  505    HE1  TYR  58           2HE      TYR  58  -2.789   3.820   1.053
  506    HE2  TYR  58           1HE      TYR  58  -3.984   4.333   5.116
  507    HH   TYR  58           HH       TYR  58  -5.258   4.869   3.385
  508    H    ARG  59           HN       ARG  59   2.005   3.652   6.919
  509    HA   ARG  59           HA       ARG  59   4.590   2.326   6.489
  510    HB2  ARG  59           2HB      ARG  59   5.166   4.206   7.642
  511    HB3  ARG  59           3HB      ARG  59   3.589   4.348   8.408
  512    HG2  ARG  59           2HG      ARG  59   5.312   2.086   9.239
  513    HG3  ARG  59           3HG      ARG  59   5.774   3.708   9.760
  514    HD2  ARG  59           2HD      ARG  59   2.934   2.905  10.080
  515    HD3  ARG  59           3HD      ARG  59   4.117   2.183  11.169
  516    HE   ARG  59           HE       ARG  59   3.128   4.842  11.258
  517   HH11  ARG  59          2HH1      ARG  59   5.990   2.934  11.794
  518   HH12  ARG  59          1HH1      ARG  59   6.660   4.029  12.958
  519   HH21  ARG  59          2HH2      ARG  59   4.000   6.292  12.789
  520   HH22  ARG  59          1HH2      ARG  59   5.527   5.938  13.523
  521    H    VAL  60           HN       VAL  60   5.042   0.388   7.365
  522    HA   VAL  60           HA       VAL  60   3.124  -0.749   9.288
  523    HB   VAL  60           HB       VAL  60   4.349  -2.177   6.924
  524   HG11  VAL  60          1HG1      VAL  60   3.962  -4.127   7.920
  525   HG12  VAL  60          2HG1      VAL  60   3.661  -3.237   9.414
  526   HG13  VAL  60          3HG1      VAL  60   2.319  -3.648   8.345
  527   HG21  VAL  60          3HG2      VAL  60   1.681  -2.546   6.726
  528   HG22  VAL  60          1HG2      VAL  60   1.729  -0.941   7.454
  529   HG23  VAL  60          2HG2      VAL  60   2.555  -1.241   5.925
  530    H    GLY  61           HN       GLY  61   4.565  -0.281  10.991
  531    HA2  GLY  61           1HA      GLY  61   6.285  -0.717  12.447
  532    HA3  GLY  61           2HA      GLY  61   6.308  -2.320  11.728
  533    H    ASP  62           HN       ASP  62   7.635  -2.657   9.833
  534    HA   ASP  62           HA       ASP  62   9.773  -0.665   9.506
  535    HB2  ASP  62           2HB      ASP  62  10.019  -3.561  10.211
  536    HB3  ASP  62           3HB      ASP  62  11.261  -2.822   9.203
  537    H    TYR  63           HN       TYR  63   7.513  -1.069   7.841
  538    HA   TYR  63           HA       TYR  63   8.889  -1.765   5.361
  539    HB2  TYR  63           2HB      TYR  63   6.277  -2.984   6.261
  540    HB3  TYR  63           3HB      TYR  63   6.828  -3.010   4.590
  541    HD1  TYR  63           1HD      TYR  63   7.876  -4.006   8.025
  542    HD2  TYR  63           2HD      TYR  63   8.183  -4.750   3.848
  543    HE1  TYR  63           1HE      TYR  63   9.164  -6.049   8.490
  544    HE2  TYR  63           2HE      TYR  63   9.471  -6.796   4.301
  545    HH   TYR  63           HH       TYR  63  11.042  -7.464   6.797
  546    H    ARG  64           HN       ARG  64   8.366  -0.466   3.687
  547    HA   ARG  64           HA       ARG  64   6.313   1.576   4.189
  548    HB2  ARG  64           2HB      ARG  64   8.776   1.578   2.446
  549    HB3  ARG  64           3HB      ARG  64   7.537   2.823   2.343
  550    HG2  ARG  64           2HG      ARG  64   8.917   2.170   4.924
  551    HG3  ARG  64           3HG      ARG  64   9.585   3.319   3.764
  552    HD2  ARG  64           2HD      ARG  64   7.777   4.788   4.009
  553    HD3  ARG  64           3HD      ARG  64   6.766   3.556   4.763
  554    HE   ARG  64           HE       ARG  64   7.754   4.018   6.789
  555   HH11  ARG  64          2HH1      ARG  64   9.533   5.568   4.230
  556   HH12  ARG  64          1HH1      ARG  64  10.508   6.515   5.304
  557   HH21  ARG  64          2HH2      ARG  64   9.031   5.259   8.214
  558   HH22  ARG  64          1HH2      ARG  64  10.222   6.338   7.570
  559    H    LEU  65           HN       LEU  65   4.617   1.836   2.843
  560    HA   LEU  65           HA       LEU  65   4.560   0.243   0.369
  561    HB2  LEU  65           2HB      LEU  65   2.153   0.642   2.120
  562    HB3  LEU  65           3HB      LEU  65   2.351  -0.476   0.772
  563    HG   LEU  65           HG       LEU  65   3.877  -0.732   3.356
  564   HD11  LEU  65          1HD1      LEU  65   1.387  -2.240   2.596
  565   HD12  LEU  65          2HD1      LEU  65   1.391  -0.845   3.674
  566   HD13  LEU  65          3HD1      LEU  65   2.273  -2.305   4.120
  567   HD21  LEU  65          3HD2      LEU  65   3.753  -3.192   2.374
  568   HD22  LEU  65          1HD2      LEU  65   5.013  -2.056   1.894
  569   HD23  LEU  65          2HD2      LEU  65   3.611  -2.307   0.854
  570    H    ILE  66           HN       ILE  66   3.846   1.284  -1.397
  571    HA   ILE  66           HA       ILE  66   2.792   4.009  -1.024
  572    HB   ILE  66           HB       ILE  66   4.238   2.876  -3.422
  573   HG12  ILE  66          2HG1      ILE  66   6.067   4.400  -2.737
  574   HG13  ILE  66          3HG1      ILE  66   5.158   4.816  -1.288
  575   HG21  ILE  66          1HG2      ILE  66   2.488   4.702  -3.769
  576   HG22  ILE  66          2HG2      ILE  66   3.598   5.762  -2.903
  577   HG23  ILE  66          3HG2      ILE  66   4.104   4.997  -4.409
  578   HD11  ILE  66          3HD1      ILE  66   5.714   2.912  -0.238
  579   HD12  ILE  66          1HD1      ILE  66   5.634   1.947  -1.712
  580   HD13  ILE  66          2HD1      ILE  66   7.060   2.929  -1.377
  581    H    CYS  67           HN       CYS  67   0.623   3.830  -1.100
  582    HA   CYS  67           HA       CYS  67  -0.570   2.250  -3.273
  583    HB2  CYS  67           2HB      CYS  67  -2.060   3.386  -0.914
  584    HB3  CYS  67           3HB      CYS  67  -2.540   2.068  -1.976
  585    HG   CYS  67           HG       CYS  67   0.298   1.528  -0.268
  586    H    HIS  68           HN       HIS  68  -2.653   3.181  -4.152
  587    HA   HIS  68           HA       HIS  68  -2.433   6.105  -4.433
  588    HB2  HIS  68           2HB      HIS  68  -1.641   5.204  -6.490
  589    HB3  HIS  68           3HB      HIS  68  -2.948   4.025  -6.557
  590    HD2  HIS  68           2HD      HIS  68  -3.890   7.735  -5.871
  591    HE1  HIS  68           1HE      HIS  68  -5.007   6.789  -9.853
  592    HE2  HIS  68           2HE      HIS  68  -5.057   8.533  -8.037
  593    H    ILE  69           HN       ILE  69  -4.141   7.016  -3.511
  594    HA   ILE  69           HA       ILE  69  -6.626   5.579  -3.195
  595    HB   ILE  69           HB       ILE  69  -5.875   8.400  -2.420
  596   HG12  ILE  69          2HG1      ILE  69  -6.238   5.960  -0.673
  597   HG13  ILE  69          3HG1      ILE  69  -4.674   6.512  -1.262
  598   HG21  ILE  69          1HG2      ILE  69  -8.428   7.247  -2.671
  599   HG22  ILE  69          2HG2      ILE  69  -8.076   7.321  -0.945
  600   HG23  ILE  69          3HG2      ILE  69  -8.003   8.787  -1.923
  601   HD11  ILE  69          3HD1      ILE  69  -5.219   7.204   1.062
  602   HD12  ILE  69          1HD1      ILE  69  -4.846   8.539  -0.027
  603   HD13  ILE  69          2HD1      ILE  69  -6.521   8.196   0.406
  604    H    GLN  70           HN       GLN  70  -8.123   5.516  -4.725
  605    HA   GLN  70           HA       GLN  70  -8.223   7.646  -6.730
  606    HB2  GLN  70           2HB      GLN  70  -9.189   4.812  -6.642
  607    HB3  GLN  70           3HB      GLN  70  -9.919   5.946  -7.771
  608    HG2  GLN  70           2HG      GLN  70  -8.296   5.106  -9.104
  609    HG3  GLN  70           3HG      GLN  70  -7.390   6.425  -8.364
  610   HE21  GLN  70          1HE2      GLN  70  -7.977   2.975  -8.309
  611   HE22  GLN  70          2HE2      GLN  70  -6.502   2.543  -7.520
  612    H    ASP  71           HN       ASP  71  -9.312   9.276  -5.668
  613    HA   ASP  71           HA       ASP  71 -11.518   9.078  -4.022
  614    HB2  ASP  71           2HB      ASP  71 -11.990  11.402  -4.577
  615    HB3  ASP  71           3HB      ASP  71 -10.252  11.165  -4.418
  616    H    ARG  72           HN       ARG  72 -11.399   9.178  -7.551
  617    HA   ARG  72           HA       ARG  72 -13.929   9.573  -8.343
  618    HB2  ARG  72           2HB      ARG  72 -12.063   7.384  -9.259
  619    HB3  ARG  72           3HB      ARG  72 -13.565   7.778 -10.085
  620    HG2  ARG  72           2HG      ARG  72 -12.763   9.751 -10.906
  621    HG3  ARG  72           3HG      ARG  72 -11.623   9.967  -9.575
  622    HD2  ARG  72           2HD      ARG  72 -10.363   7.981 -10.523
  623    HD3  ARG  72           3HD      ARG  72 -11.386   8.138 -11.951
  624    HE   ARG  72           HE       ARG  72 -10.378  10.625 -11.646
  625   HH11  ARG  72          2HH1      ARG  72  -8.925   7.465 -11.781
  626   HH12  ARG  72          1HH1      ARG  72  -7.444   8.033 -12.480
  627   HH21  ARG  72          2HH2      ARG  72  -8.434  11.385 -12.565
  628   HH22  ARG  72          1HH2      ARG  72  -7.166  10.263 -12.925
  629    H    GLU  73           HN       GLU  73 -12.755   6.396  -7.222
  630    HA   GLU  73           HA       GLU  73 -15.519   5.767  -6.427
  631    HB2  GLU  73           2HB      GLU  73 -13.562   4.085  -7.961
  632    HB3  GLU  73           3HB      GLU  73 -14.799   3.326  -6.968
  633    HG2  GLU  73           2HG      GLU  73 -16.509   4.619  -8.241
  634    HG3  GLU  73           3HG      GLU  73 -15.218   5.163  -9.311
  635    H    ALA  74           HN       ALA  74 -13.185   6.806  -4.931
  636    HA   ALA  74           HA       ALA  74 -11.910   6.361  -3.066
  637    HB1  ALA  74           1HB      ALA  74 -13.275   6.210  -1.274
  638    HB2  ALA  74           2HB      ALA  74 -14.533   6.399  -2.496
  639    HB3  ALA  74           3HB      ALA  74 -14.119   4.793  -1.898
  640    H    THR  75           HN       THR  75 -11.057   4.614  -4.899
  641    HA   THR  75           HA       THR  75 -10.944   2.027  -3.489
  642    HB   THR  75           HB       THR  75 -10.659   2.617  -6.438
  643    HG1  THR  75           1HG      THR  75 -12.742   2.235  -6.243
  644   HG21  THR  75          3HG2      THR  75 -10.368  -0.055  -5.066
  645   HG22  THR  75          1HG2      THR  75  -9.012   0.920  -5.629
  646   HG23  THR  75          2HG2      THR  75 -10.183   0.288  -6.786
  647    H    VAL  76           HN       VAL  76  -9.043   1.438  -2.676
  648    HA   VAL  76           HA       VAL  76  -6.683   3.036  -3.310
  649    HB   VAL  76           HB       VAL  76  -7.003   0.908  -1.191
  650   HG11  VAL  76          1HG1      VAL  76  -4.736   2.322  -2.185
  651   HG12  VAL  76          2HG1      VAL  76  -5.054   2.844  -0.529
  652   HG13  VAL  76          3HG1      VAL  76  -4.816   1.133  -0.885
  653   HG21  VAL  76          3HG2      VAL  76  -7.918   2.402   0.206
  654   HG22  VAL  76          1HG2      VAL  76  -6.851   3.698  -0.336
  655   HG23  VAL  76          2HG2      VAL  76  -8.309   3.313  -1.252
  656    H    LEU  77           HN       LEU  77  -4.939   2.287  -4.373
  657    HA   LEU  77           HA       LEU  77  -4.795  -0.586  -4.976
  658    HB2  LEU  77           2HB      LEU  77  -5.753   0.659  -6.890
  659    HB3  LEU  77           3HB      LEU  77  -4.284   1.631  -6.954
  660    HG   LEU  77           HG       LEU  77  -4.103  -1.341  -7.218
  661   HD11  LEU  77          1HD1      LEU  77  -5.538   0.404  -9.011
  662   HD12  LEU  77          2HD1      LEU  77  -5.356  -1.350  -9.051
  663   HD13  LEU  77          3HD1      LEU  77  -4.139  -0.320  -9.806
  664   HD21  LEU  77          3HD2      LEU  77  -2.484   0.367  -8.921
  665   HD22  LEU  77          1HD2      LEU  77  -1.997  -0.913  -7.810
  666   HD23  LEU  77          2HD2      LEU  77  -2.271   0.722  -7.206
  667    H    VAL  78           HN       VAL  78  -2.887  -1.432  -4.479
  668    HA   VAL  78           HA       VAL  78  -0.709   0.275  -3.664
  669    HB   VAL  78           HB       VAL  78  -0.756  -2.739  -3.854
  670   HG11  VAL  78          1HG1      VAL  78   1.160  -0.744  -2.774
  671   HG12  VAL  78          2HG1      VAL  78   0.953  -2.257  -1.890
  672   HG13  VAL  78          3HG1      VAL  78   1.462  -2.283  -3.580
  673   HG21  VAL  78          3HG2      VAL  78  -1.495  -0.913  -1.572
  674   HG22  VAL  78          1HG2      VAL  78  -2.546  -2.052  -2.412
  675   HG23  VAL  78          2HG2      VAL  78  -1.224  -2.648  -1.409
  676    H    LEU  79           HN       LEU  79   1.109   0.733  -4.759
  677    HA   LEU  79           HA       LEU  79   1.405  -0.449  -7.438
  678    HB2  LEU  79           2HB      LEU  79   2.493   2.161  -6.394
  679    HB3  LEU  79           3HB      LEU  79   2.636   1.558  -8.043
  680    HG   LEU  79           HG       LEU  79  -0.062   2.047  -6.839
  681   HD11  LEU  79          1HD1      LEU  79   1.900   4.039  -7.105
  682   HD12  LEU  79          2HD1      LEU  79   0.175   4.249  -6.806
  683   HD13  LEU  79          3HD1      LEU  79   0.789   4.246  -8.459
  684   HD21  LEU  79          3HD2      LEU  79   0.806   2.454  -9.676
  685   HD22  LEU  79          1HD2      LEU  79  -0.802   2.107  -9.039
  686   HD23  LEU  79          2HD2      LEU  79   0.427   0.842  -9.068
  687    H    ARG  80           HN       ARG  80   3.376   0.848  -4.763
  688    HA   ARG  80           HA       ARG  80   5.449  -1.124  -5.470
  689    HB2  ARG  80           2HB      ARG  80   5.625   1.725  -4.612
  690    HB3  ARG  80           3HB      ARG  80   6.891   0.624  -4.085
  691    HG2  ARG  80           2HG      ARG  80   6.098   0.844  -6.967
  692    HG3  ARG  80           3HG      ARG  80   7.273   1.938  -6.235
  693    HD2  ARG  80           2HD      ARG  80   8.801   0.229  -5.838
  694    HD3  ARG  80           3HD      ARG  80   7.571  -1.028  -5.962
  695    HE   ARG  80           HE       ARG  80   7.912  -1.083  -8.222
  696   HH11  ARG  80          2HH1      ARG  80   9.276   1.852  -6.940
  697   HH12  ARG  80          1HH1      ARG  80  10.030   2.308  -8.432
  698   HH21  ARG  80          2HH2      ARG  80   8.900  -0.495 -10.192
  699   HH22  ARG  80          1HH2      ARG  80   9.815   0.972 -10.281
  700    H    VAL  81           HN       VAL  81   6.563  -2.157  -3.766
  701    HA   VAL  81           HA       VAL  81   5.623  -1.768  -1.044
  702    HB   VAL  81           HB       VAL  81   4.023  -3.390  -2.072
  703   HG11  VAL  81          1HG1      VAL  81   4.656  -5.283  -3.108
  704   HG12  VAL  81          2HG1      VAL  81   6.196  -4.445  -3.307
  705   HG13  VAL  81          3HG1      VAL  81   5.975  -5.582  -1.977
  706   HG21  VAL  81          3HG2      VAL  81   5.180  -5.188  -0.175
  707   HG22  VAL  81          1HG2      VAL  81   5.391  -3.530   0.389
  708   HG23  VAL  81          2HG2      VAL  81   3.778  -4.134   0.007
  709    H    GLY  82           HN       GLY  82   7.436  -1.653   0.098
  710    HA2  GLY  82           1HA      GLY  82   9.377  -3.790  -0.029
  711    HA3  GLY  82           2HA      GLY  82   9.981  -2.244  -0.607
  712    H    HIS  83           HN       HIS  83  11.005  -3.662   1.624
  713    HA   HIS  83           HA       HIS  83  10.039  -2.823   4.101
  714    HB2  HIS  83           2HB      HIS  83  11.767  -4.572   3.788
  715    HB3  HIS  83           3HB      HIS  83  12.924  -3.323   3.336
  716    HD2  HIS  83           2HD      HIS  83  11.700  -5.112   6.446
  717    HE1  HIS  83           1HE      HIS  83  13.758  -1.653   7.787
  718    HE2  HIS  83           2HE      HIS  83  12.810  -3.893   8.439
  719    H    ALA  84           HN       ALA  84  10.904  -1.213   5.568
  720    HA   ALA  84           HA       ALA  84  10.744   1.360   4.770
  721    HB1  ALA  84           1HB      ALA  84  10.907   1.453   6.995
  722    HB2  ALA  84           2HB      ALA  84  11.912   0.005   7.070
  723    HB3  ALA  84           3HB      ALA  84  12.648   1.573   6.737
  724    H    ARG  85           HN       ARG  85  13.880  -0.288   5.228
  725    HA   ARG  85           HA       ARG  85  15.451   1.746   4.123
  726    HB2  ARG  85           2HB      ARG  85  17.206   0.038   3.918
  727    HB3  ARG  85           3HB      ARG  85  16.401  -0.044   5.479
  728    HG2  ARG  85           2HG      ARG  85  14.978  -1.890   4.505
  729    HG3  ARG  85           3HG      ARG  85  16.094  -1.898   3.139
  730    HD2  ARG  85           2HD      ARG  85  16.917  -2.264   6.016
  731    HD3  ARG  85           3HD      ARG  85  16.616  -3.589   4.892
  732    HE   ARG  85           HE       ARG  85  18.460  -2.001   3.637
  733   HH11  ARG  85          2HH1      ARG  85  18.283  -3.681   6.681
  734   HH12  ARG  85          1HH1      ARG  85  19.992  -3.948   6.782
  735   HH21  ARG  85          2HH2      ARG  85  20.711  -2.347   3.758
  736   HH22  ARG  85          1HH2      ARG  85  21.372  -3.188   5.119
  737    H    ASP  86           HN       ASP  86  14.340  -1.288   2.615
  738    HA   ASP  86           HA       ASP  86  15.362  -1.035   0.105
  739    HB2  ASP  86           2HB      ASP  86  12.646  -2.049   0.949
  740    HB3  ASP  86           3HB      ASP  86  13.261  -2.211  -0.694
  741    H    VAL  87           HN       VAL  87  12.143   0.189   1.046
  742    HA   VAL  87           HA       VAL  87  11.818   1.680  -1.362
  743    HB   VAL  87           HB       VAL  87  10.319   2.004   1.241
  744   HG11  VAL  87          1HG1      VAL  87   8.596   3.030  -0.054
  745   HG12  VAL  87          2HG1      VAL  87  10.112   3.843  -0.445
  746   HG13  VAL  87          3HG1      VAL  87   9.431   2.660  -1.562
  747   HG21  VAL  87          3HG2      VAL  87  10.399  -0.329   0.143
  748   HG22  VAL  87          1HG2      VAL  87   8.828   0.346   0.575
  749   HG23  VAL  87          2HG2      VAL  87   9.375   0.389  -1.101
  750    H    TYR  88           HN       TYR  88  12.428   3.694  -1.844
  751    HA   TYR  88           HA       TYR  88  14.364   5.124  -0.669
  752    HB2  TYR  88           2HB      TYR  88  13.702   6.031  -2.684
  753    HB3  TYR  88           3HB      TYR  88  11.992   5.975  -2.271
  754    HD1  TYR  88           2HD      TYR  88  15.140   7.724  -1.287
  755    HD2  TYR  88           1HD      TYR  88  10.911   7.943  -1.702
  756    HE1  TYR  88           2HE      TYR  88  15.211  10.110  -0.695
  757    HE2  TYR  88           1HE      TYR  88  10.971  10.330  -1.111
  758    HH   TYR  88           HH       TYR  88  13.864  12.121  -0.992
  759    H    ARG  89           HN       ARG  89  14.667   5.839   1.324
  760    HA   ARG  89           HA       ARG  89  12.634   6.085   3.252
  761    HB2  ARG  89           2HB      ARG  89  14.329   6.969   4.710
  762    HB3  ARG  89           3HB      ARG  89  15.044   5.684   3.746
  763    HG2  ARG  89           2HG      ARG  89  15.280   8.511   2.828
  764    HG3  ARG  89           3HG      ARG  89  16.324   7.918   4.122
  765    HD2  ARG  89           2HD      ARG  89  16.671   5.921   2.414
  766    HD3  ARG  89           3HD      ARG  89  16.235   7.170   1.248
  767    HE   ARG  89           HE       ARG  89  18.125   8.410   2.664
  768   HH11  ARG  89          2HH1      ARG  89  18.026   5.215   1.284
  769   HH12  ARG  89          1HH1      ARG  89  19.738   5.130   1.031
  770   HH21  ARG  89          2HH2      ARG  89  20.380   8.310   2.336
  771   HH22  ARG  89          1HH2      ARG  89  21.076   6.891   1.630
  Start of MODEL   19
    1    H1   MET   1           HN       MET   1 -19.954   0.291   3.180
    2    HA   MET   1           HA       MET   1 -19.792   3.035   2.649
    3    HB2  MET   1           2HB      MET   1 -19.495   3.301   5.082
    4    HB3  MET   1           3HB      MET   1 -20.794   2.180   4.694
    5    HG2  MET   1           2HG      MET   1 -19.023   0.346   4.995
    6    HG3  MET   1           3HG      MET   1 -18.076   1.597   5.798
    7    HE1  MET   1           3HE      MET   1 -21.820  -0.255   6.188
    8    HE2  MET   1           1HE      MET   1 -20.290  -1.106   5.971
    9    HE3  MET   1           2HE      MET   1 -21.070  -1.084   7.553
   10    H    GLY   2           HN       GLY   2 -17.314   0.760   3.795
   11    HA2  GLY   2           1HA      GLY   2 -15.261   2.738   3.962
   12    HA3  GLY   2           2HA      GLY   2 -15.032   0.997   4.012
   13    H    TYR   3           HN       TYR   3 -13.128   1.353   2.722
   14    HA   TYR   3           HA       TYR   3 -13.709   1.967  -0.098
   15    HB2  TYR   3           2HB      TYR   3 -11.192   2.222   1.538
   16    HB3  TYR   3           3HB      TYR   3 -11.157   2.229  -0.222
   17    HD1  TYR   3           2HD      TYR   3 -13.249   3.858   2.423
   18    HD2  TYR   3           1HD      TYR   3 -10.949   4.332  -1.125
   19    HE1  TYR   3           2HE      TYR   3 -13.748   6.266   2.428
   20    HE2  TYR   3           1HE      TYR   3 -11.440   6.742  -1.129
   21    HH   TYR   3           HH       TYR   3 -12.543   8.396   1.448
   22    H    ARG   4           HN       ARG   4 -12.057   0.803  -1.601
   23    HA   ARG   4           HA       ARG   4 -12.230  -2.051  -0.959
   24    HB2  ARG   4           2HB      ARG   4 -13.300  -1.362  -3.039
   25    HB3  ARG   4           3HB      ARG   4 -11.795  -0.642  -3.598
   26    HG2  ARG   4           2HG      ARG   4 -10.773  -2.734  -3.888
   27    HG3  ARG   4           3HG      ARG   4 -12.012  -3.560  -2.940
   28    HD2  ARG   4           2HD      ARG   4 -12.440  -2.223  -5.610
   29    HD3  ARG   4           3HD      ARG   4 -12.271  -3.959  -5.349
   30    HE   ARG   4           HE       ARG   4 -14.397  -2.700  -3.851
   31   HH11  ARG   4          2HH1      ARG   4 -13.483  -4.335  -6.785
   32   HH12  ARG   4          1HH1      ARG   4 -15.095  -4.851  -7.154
   33   HH21  ARG   4          2HH2      ARG   4 -16.524  -3.374  -4.325
   34   HH22  ARG   4          1HH2      ARG   4 -16.824  -4.303  -5.754
   35    H    ILE   5           HN       ILE   5 -10.455  -3.460  -1.411
   36    HA   ILE   5           HA       ILE   5  -7.844  -2.103  -1.254
   37    HB   ILE   5           HB       ILE   5  -8.481  -4.869  -0.231
   38   HG12  ILE   5          2HG1      ILE   5  -9.753  -3.226   1.050
   39   HG13  ILE   5          3HG1      ILE   5  -8.430  -3.859   2.023
   40   HG21  ILE   5          1HG2      ILE   5  -6.296  -5.081   0.090
   41   HG22  ILE   5          2HG2      ILE   5  -6.055  -3.547  -0.746
   42   HG23  ILE   5          3HG2      ILE   5  -6.249  -3.575   1.007
   43   HD11  ILE   5          3HD1      ILE   5  -7.126  -1.841   1.517
   44   HD12  ILE   5          1HD1      ILE   5  -8.499  -1.204   0.612
   45   HD13  ILE   5          2HD1      ILE   5  -8.640  -1.484   2.348
   46    H    GLU   6           HN       GLU   6  -6.862  -2.181  -3.166
   47    HA   GLU   6           HA       GLU   6  -6.924  -4.724  -4.655
   48    HB2  GLU   6           2HB      GLU   6  -6.905  -1.901  -5.729
   49    HB3  GLU   6           3HB      GLU   6  -6.616  -3.324  -6.720
   50    HG2  GLU   6           2HG      GLU   6  -8.891  -4.136  -5.825
   51    HG3  GLU   6           3HG      GLU   6  -9.135  -2.450  -5.371
   52    H    PHE   7           HN       PHE   7  -5.024  -5.085  -6.047
   53    HA   PHE   7           HA       PHE   7  -2.603  -3.707  -5.130
   54    HB2  PHE   7           2HB      PHE   7  -3.172  -6.650  -4.989
   55    HB3  PHE   7           3HB      PHE   7  -1.520  -6.077  -5.192
   56    HD1  PHE   7           1HD      PHE   7  -4.505  -5.606  -3.019
   57    HD2  PHE   7           2HD      PHE   7  -0.261  -5.565  -3.328
   58    HE1  PHE   7           1HE      PHE   7  -4.335  -5.258  -0.589
   59    HE2  PHE   7           2HE      PHE   7  -0.084  -5.218  -0.899
   60    HZ   PHE   7           HZ       PHE   7  -2.122  -5.064   0.474
   61    H    ASP   8           HN       ASP   8  -1.264  -3.190  -6.740
   62    HA   ASP   8           HA       ASP   8  -1.953  -3.558  -9.427
   63    HB2  ASP   8           2HB      ASP   8   0.419  -2.520  -7.968
   64    HB3  ASP   8           3HB      ASP   8   0.653  -2.967  -9.656
   65    HA   PRO   9           HA       PRO   9  -0.320  -7.442 -10.640
   66    HB2  PRO   9           2HB      PRO   9   0.802  -6.901 -13.053
   67    HB3  PRO   9           3HB      PRO   9  -0.946  -6.937 -12.793
   68    HG2  PRO   9           2HG      PRO   9   0.902  -4.585 -12.918
   69    HG3  PRO   9           3HG      PRO   9  -0.707  -4.784 -13.638
   70    HD2  PRO   9           2HD      PRO   9  -0.298  -3.405 -11.344
   71    HD3  PRO   9           3HD      PRO   9  -1.789  -4.315 -11.657
   72    H    ARG  10           HN       ARG  10   1.786  -4.799 -10.139
   73    HA   ARG  10           HA       ARG  10   4.191  -6.427 -10.478
   74    HB2  ARG  10           2HB      ARG  10   3.672  -3.496 -10.137
   75    HB3  ARG  10           3HB      ARG  10   5.261  -4.148  -9.760
   76    HG2  ARG  10           2HG      ARG  10   5.666  -4.772 -11.964
   77    HG3  ARG  10           3HG      ARG  10   3.956  -4.701 -12.395
   78    HD2  ARG  10           2HD      ARG  10   3.945  -2.360 -12.430
   79    HD3  ARG  10           3HD      ARG  10   5.453  -2.253 -11.524
   80    HE   ARG  10           HE       ARG  10   5.152  -2.671 -14.370
   81   HH11  ARG  10          2HH1      ARG  10   7.260  -2.854 -11.605
   82   HH12  ARG  10          1HH1      ARG  10   8.714  -2.799 -12.546
   83   HH21  ARG  10          2HH2      ARG  10   7.059  -2.599 -15.619
   84   HH22  ARG  10          1HH2      ARG  10   8.598  -2.654 -14.829
   85    H    ALA  11           HN       ALA  11   2.568  -4.474  -7.990
   86    HA   ALA  11           HA       ALA  11   4.324  -5.012  -5.884
   87    HB1  ALA  11           1HB      ALA  11   2.745  -3.255  -5.639
   88    HB2  ALA  11           2HB      ALA  11   1.387  -4.353  -5.886
   89    HB3  ALA  11           3HB      ALA  11   2.357  -4.467  -4.417
   90    H    GLU  12           HN       GLU  12   1.334  -6.691  -6.834
   91    HA   GLU  12           HA       GLU  12   1.000  -8.528  -4.893
   92    HB2  GLU  12           2HB      GLU  12   0.689  -8.673  -7.851
   93    HB3  GLU  12           3HB      GLU  12   0.558 -10.172  -6.942
   94    HG2  GLU  12           2HG      GLU  12  -1.144  -8.965  -5.494
   95    HG3  GLU  12           3HG      GLU  12  -1.152  -7.718  -6.740
   96    H    LYS  13           HN       LYS  13   3.393  -8.759  -7.500
   97    HA   LYS  13           HA       LYS  13   4.455 -11.254  -6.588
   98    HB2  LYS  13           2HB      LYS  13   5.454  -9.198  -8.558
   99    HB3  LYS  13           3HB      LYS  13   6.328 -10.683  -8.203
  100    HG2  LYS  13           2HG      LYS  13   3.468 -10.790  -9.062
  101    HG3  LYS  13           3HG      LYS  13   4.756 -10.587 -10.252
  102    HD2  LYS  13           2HD      LYS  13   5.797 -12.643  -9.544
  103    HD3  LYS  13           3HD      LYS  13   4.640 -12.817  -8.222
  104    HE2  LYS  13           2HE      LYS  13   3.686 -14.208  -9.765
  105    HE3  LYS  13           3HE      LYS  13   2.894 -12.693 -10.194
  106    HZ1  LYS  13           3HZ      LYS  13   5.352 -12.937 -11.572
  107    HZ2  LYS  13           1HZ      LYS  13   3.790 -12.783 -12.202
  108    HZ3  LYS  13           2HZ      LYS  13   4.408 -14.315 -11.841
  109    H    GLU  14           HN       GLU  14   5.412  -7.862  -6.278
  110    HA   GLU  14           HA       GLU  14   7.891  -8.215  -5.064
  111    HB2  GLU  14           2HB      GLU  14   5.860  -6.020  -4.621
  112    HB3  GLU  14           3HB      GLU  14   7.541  -5.950  -4.109
  113    HG2  GLU  14           2HG      GLU  14   8.015  -6.426  -6.636
  114    HG3  GLU  14           3HG      GLU  14   6.384  -5.793  -6.846
  115    H    LEU  15           HN       LEU  15   4.654  -8.297  -3.697
  116    HA   LEU  15           HA       LEU  15   5.535  -8.387  -0.974
  117    HB2  LEU  15           2HB      LEU  15   3.248  -7.656  -1.941
  118    HB3  LEU  15           3HB      LEU  15   2.873  -9.378  -1.922
  119    HG   LEU  15           HG       LEU  15   3.422  -9.325   0.556
  120   HD11  LEU  15          1HD1      LEU  15   3.134  -7.073   1.603
  121   HD12  LEU  15          2HD1      LEU  15   3.322  -6.368  -0.002
  122   HD13  LEU  15          3HD1      LEU  15   4.644  -7.287   0.717
  123   HD21  LEU  15          3HD2      LEU  15   1.190  -9.525   0.367
  124   HD22  LEU  15          1HD2      LEU  15   1.071  -8.243  -0.838
  125   HD23  LEU  15          2HD2      LEU  15   1.181  -7.836   0.875
  126    H    GLU  16           HN       GLU  16   4.146 -10.814  -3.185
  127    HA   GLU  16           HA       GLU  16   4.168 -13.034  -1.605
  128    HB2  GLU  16           2HB      GLU  16   4.593 -12.597  -4.517
  129    HB3  GLU  16           3HB      GLU  16   4.963 -14.191  -3.875
  130    HG2  GLU  16           2HG      GLU  16   2.649 -14.188  -2.871
  131    HG3  GLU  16           3HG      GLU  16   2.329 -12.752  -3.842
  132    H    LYS  17           HN       LYS  17   6.925 -11.535  -3.201
  133    HA   LYS  17           HA       LYS  17   8.813 -13.559  -2.685
  134    HB2  LYS  17           2HB      LYS  17   9.084 -10.595  -3.160
  135    HB3  LYS  17           3HB      LYS  17  10.480 -11.635  -2.912
  136    HG2  LYS  17           2HG      LYS  17   9.694 -13.010  -4.847
  137    HG3  LYS  17           3HG      LYS  17   8.467 -11.775  -5.142
  138    HD2  LYS  17           2HD      LYS  17  10.185 -10.101  -5.476
  139    HD3  LYS  17           3HD      LYS  17  11.442 -11.272  -5.071
  140    HE2  LYS  17           2HE      LYS  17  11.116 -12.478  -7.045
  141    HE3  LYS  17           3HE      LYS  17   9.528 -11.767  -7.325
  142    HZ1  LYS  17           3HZ      LYS  17  11.552  -9.771  -7.248
  143    HZ2  LYS  17           1HZ      LYS  17  10.436 -10.118  -8.471
  144    HZ3  LYS  17           2HZ      LYS  17  11.911 -10.944  -8.413
  145    H    LEU  18           HN       LEU  18   7.808 -10.731  -0.816
  146    HA   LEU  18           HA       LEU  18   9.730 -10.860   1.205
  147    HB2  LEU  18           2HB      LEU  18   6.866  -9.932   1.303
  148    HB3  LEU  18           3HB      LEU  18   8.033  -9.675   2.598
  149    HG   LEU  18           HG       LEU  18   8.433  -8.619  -0.193
  150   HD11  LEU  18          1HD1      LEU  18   6.416  -7.823   1.533
  151   HD12  LEU  18          2HD1      LEU  18   7.065  -6.906   0.174
  152   HD13  LEU  18          3HD1      LEU  18   7.706  -6.649   1.797
  153   HD21  LEU  18          3HD2      LEU  18  10.275  -8.907   1.688
  154   HD22  LEU  18          1HD2      LEU  18   9.569  -7.396   2.263
  155   HD23  LEU  18          2HD2      LEU  18  10.234  -7.494   0.632
  156    H    ASP  19           HN       ASP  19   8.888 -11.248   3.607
  157    HA   ASP  19           HA       ASP  19   8.574 -14.057   3.856
  158    HB2  ASP  19           2HB      ASP  19   9.690 -12.326   5.469
  159    HB3  ASP  19           3HB      ASP  19   8.066 -12.174   6.133
  160    H    ARG  20           HN       ARG  20   6.858 -15.172   4.998
  161    HA   ARG  20           HA       ARG  20   4.308 -14.583   3.964
  162    HB2  ARG  20           2HB      ARG  20   5.257 -16.479   6.104
  163    HB3  ARG  20           3HB      ARG  20   3.561 -16.355   5.656
  164    HG2  ARG  20           2HG      ARG  20   4.235 -18.101   4.344
  165    HG3  ARG  20           3HG      ARG  20   4.476 -16.746   3.240
  166    HD2  ARG  20           2HD      ARG  20   6.825 -16.700   3.711
  167    HD3  ARG  20           3HD      ARG  20   6.638 -17.890   4.998
  168    HE   ARG  20           HE       ARG  20   5.717 -18.942   2.540
  169   HH11  ARG  20          2HH1      ARG  20   8.639 -18.129   4.248
  170   HH12  ARG  20          1HH1      ARG  20   9.605 -19.308   3.422
  171   HH21  ARG  20          2HH2      ARG  20   6.977 -20.498   1.447
  172   HH22  ARG  20          1HH2      ARG  20   8.658 -20.654   1.829
  173    H    GLU  21           HN       GLU  21   5.655 -14.214   7.230
  174    HA   GLU  21           HA       GLU  21   3.340 -13.260   8.478
  175    HB2  GLU  21           2HB      GLU  21   6.270 -12.982   9.049
  176    HB3  GLU  21           3HB      GLU  21   5.101 -12.087  10.010
  177    HG2  GLU  21           2HG      GLU  21   4.061 -14.104  10.752
  178    HG3  GLU  21           3HG      GLU  21   5.027 -15.070   9.639
  179    H    VAL  22           HN       VAL  22   5.950 -11.524   6.825
  180    HA   VAL  22           HA       VAL  22   5.092  -8.917   7.374
  181    HB   VAL  22           HB       VAL  22   6.568  -9.932   4.941
  182   HG11  VAL  22          1HG1      VAL  22   6.330  -7.128   6.027
  183   HG12  VAL  22          2HG1      VAL  22   7.322  -7.630   4.657
  184   HG13  VAL  22          3HG1      VAL  22   5.564  -7.734   4.560
  185   HG21  VAL  22          3HG2      VAL  22   7.845  -8.516   7.237
  186   HG22  VAL  22          1HG2      VAL  22   7.490 -10.239   7.366
  187   HG23  VAL  22          2HG2      VAL  22   8.549  -9.650   6.084
  188    H    ALA  23           HN       ALA  23   4.564 -10.842   4.415
  189    HA   ALA  23           HA       ALA  23   2.922  -9.091   3.058
  190    HB1  ALA  23           1HB      ALA  23   3.886 -11.329   2.289
  191    HB2  ALA  23           2HB      ALA  23   2.448 -12.054   3.010
  192    HB3  ALA  23           3HB      ALA  23   2.283 -10.887   1.699
  193    H    ARG  24           HN       ARG  24   1.934 -11.657   5.322
  194    HA   ARG  24           HA       ARG  24  -0.821 -11.204   5.189
  195    HB2  ARG  24           2HB      ARG  24   0.999 -12.453   7.205
  196    HB3  ARG  24           3HB      ARG  24  -0.678 -12.158   7.641
  197    HG2  ARG  24           2HG      ARG  24  -1.371 -13.464   5.649
  198    HG3  ARG  24           3HG      ARG  24   0.328 -13.846   5.363
  199    HD2  ARG  24           2HD      ARG  24   0.488 -15.128   7.309
  200    HD3  ARG  24           3HD      ARG  24  -0.967 -14.417   8.005
  201    HE   ARG  24           HE       ARG  24  -1.667 -15.770   5.654
  202   HH11  ARG  24          2HH1      ARG  24  -0.520 -16.438   8.872
  203   HH12  ARG  24          1HH1      ARG  24  -1.260 -18.002   8.952
  204   HH21  ARG  24          2HH2      ARG  24  -2.646 -17.828   5.746
  205   HH22  ARG  24          1HH2      ARG  24  -2.469 -18.792   7.173
  206    H    ARG  25           HN       ARG  25   1.591  -9.910   7.460
  207    HA   ARG  25           HA       ARG  25  -0.135  -8.406   9.047
  208    HB2  ARG  25           2HB      ARG  25   2.116  -8.742   9.771
  209    HB3  ARG  25           3HB      ARG  25   2.762  -7.990   8.319
  210    HG2  ARG  25           2HG      ARG  25   1.964  -5.832   9.021
  211    HG3  ARG  25           3HG      ARG  25   1.155  -6.549  10.416
  212    HD2  ARG  25           2HD      ARG  25   4.126  -6.496   9.899
  213    HD3  ARG  25           3HD      ARG  25   3.254  -5.520  11.080
  214    HE   ARG  25           HE       ARG  25   3.111  -7.358  12.468
  215   HH11  ARG  25          2HH1      ARG  25   4.330  -8.300   9.346
  216   HH12  ARG  25          1HH1      ARG  25   4.808  -9.882   9.865
  217   HH21  ARG  25          2HH2      ARG  25   3.736  -9.438  13.164
  218   HH22  ARG  25          1HH2      ARG  25   4.469 -10.529  12.037
  219    H    ILE  26           HN       ILE  26   1.502  -7.565   6.027
  220    HA   ILE  26           HA       ILE  26   0.759  -4.852   5.959
  221    HB   ILE  26           HB       ILE  26   1.502  -6.795   3.785
  222   HG12  ILE  26          2HG1      ILE  26   2.927  -4.321   4.770
  223   HG13  ILE  26          3HG1      ILE  26   3.209  -5.924   5.440
  224   HG21  ILE  26          1HG2      ILE  26   0.333  -5.445   2.406
  225   HG22  ILE  26          2HG2      ILE  26   0.328  -4.103   3.549
  226   HG23  ILE  26          3HG2      ILE  26   1.754  -4.412   2.560
  227   HD11  ILE  26          3HD1      ILE  26   3.555  -5.285   2.527
  228   HD12  ILE  26          1HD1      ILE  26   4.853  -5.146   3.712
  229   HD13  ILE  26          2HD1      ILE  26   4.105  -6.713   3.403
  230    H    LEU  27           HN       LEU  27  -0.628  -7.562   4.092
  231    HA   LEU  27           HA       LEU  27  -2.788  -6.250   3.004
  232    HB2  LEU  27           2HB      LEU  27  -2.681  -9.100   3.979
  233    HB3  LEU  27           3HB      LEU  27  -3.882  -8.447   2.867
  234    HG   LEU  27           HG       LEU  27  -0.947  -8.444   2.220
  235   HD11  LEU  27          1HD1      LEU  27  -2.248 -10.753   2.718
  236   HD12  LEU  27          2HD1      LEU  27  -0.961 -10.583   1.525
  237   HD13  LEU  27          3HD1      LEU  27  -2.648 -10.520   1.016
  238   HD21  LEU  27          3HD2      LEU  27  -3.266  -7.412   0.978
  239   HD22  LEU  27          1HD2      LEU  27  -2.710  -8.774   0.007
  240   HD23  LEU  27          2HD2      LEU  27  -1.614  -7.438   0.360
  241    H    ARG  28           HN       ARG  28  -2.598  -7.882   6.150
  242    HA   ARG  28           HA       ARG  28  -5.261  -7.516   6.925
  243    HB2  ARG  28           2HB      ARG  28  -3.416  -8.933   8.028
  244    HB3  ARG  28           3HB      ARG  28  -2.956  -7.452   8.858
  245    HG2  ARG  28           2HG      ARG  28  -4.881  -7.399  10.118
  246    HG3  ARG  28           3HG      ARG  28  -5.789  -8.376   8.963
  247    HD2  ARG  28           2HD      ARG  28  -3.443  -9.574  10.363
  248    HD3  ARG  28           3HD      ARG  28  -4.965  -9.397  11.235
  249    HE   ARG  28           HE       ARG  28  -5.255 -10.652   8.669
  250   HH11  ARG  28          2HH1      ARG  28  -4.519 -11.165  12.033
  251   HH12  ARG  28          1HH1      ARG  28  -4.990 -12.832  12.017
  252   HH21  ARG  28          2HH2      ARG  28  -5.878 -12.846   8.635
  253   HH22  ARG  28          1HH2      ARG  28  -5.762 -13.788  10.083
  254    H    PHE  29           HN       PHE  29  -2.409  -5.473   7.466
  255    HA   PHE  29           HA       PHE  29  -3.589  -3.516   9.048
  256    HB2  PHE  29           2HB      PHE  29  -1.238  -3.449   8.845
  257    HB3  PHE  29           3HB      PHE  29  -1.308  -3.423   7.086
  258    HD1  PHE  29           1HD      PHE  29  -1.962  -1.422  10.124
  259    HD2  PHE  29           2HD      PHE  29  -1.406  -1.396   5.904
  260    HE1  PHE  29           1HE      PHE  29  -1.819   1.034  10.162
  261    HE2  PHE  29           2HE      PHE  29  -1.262   1.060   5.935
  262    HZ   PHE  29           HZ       PHE  29  -1.467   2.278   8.066
  263    H    LEU  30           HN       LEU  30  -3.628  -3.945   5.564
  264    HA   LEU  30           HA       LEU  30  -5.020  -1.426   5.153
  265    HB2  LEU  30           2HB      LEU  30  -4.043  -3.583   3.303
  266    HB3  LEU  30           3HB      LEU  30  -5.046  -2.246   2.745
  267    HG   LEU  30           HG       LEU  30  -2.518  -1.633   4.203
  268   HD11  LEU  30          1HD1      LEU  30  -1.529  -1.584   1.779
  269   HD12  LEU  30          2HD1      LEU  30  -2.733  -2.838   1.487
  270   HD13  LEU  30          3HD1      LEU  30  -1.505  -3.069   2.731
  271   HD21  LEU  30          3HD2      LEU  30  -2.859  -0.012   1.971
  272   HD22  LEU  30          1HD2      LEU  30  -3.232   0.398   3.645
  273   HD23  LEU  30          2HD2      LEU  30  -4.490  -0.259   2.598
  274    H    ARG  31           HN       ARG  31  -5.743  -4.749   5.622
  275    HA   ARG  31           HA       ARG  31  -8.423  -4.497   4.495
  276    HB2  ARG  31           2HB      ARG  31  -6.856  -6.811   5.620
  277    HB3  ARG  31           3HB      ARG  31  -8.574  -6.936   5.267
  278    HG2  ARG  31           2HG      ARG  31  -8.184  -6.488   2.939
  279    HG3  ARG  31           3HG      ARG  31  -6.476  -6.172   3.249
  280    HD2  ARG  31           2HD      ARG  31  -6.543  -8.362   2.409
  281    HD3  ARG  31           3HD      ARG  31  -6.369  -8.549   4.153
  282    HE   ARG  31           HE       ARG  31  -8.393  -9.599   4.189
  283   HH11  ARG  31          2HH1      ARG  31  -8.146  -7.754   1.247
  284   HH12  ARG  31          1HH1      ARG  31  -9.631  -8.358   0.590
  285   HH21  ARG  31          2HH2      ARG  31 -10.350 -10.401   3.334
  286   HH22  ARG  31          1HH2      ARG  31 -10.884  -9.863   1.778
  287    H    GLU  32           HN       GLU  32  -6.888  -3.897   7.394
  288    HA   GLU  32           HA       GLU  32  -9.390  -4.275   8.905
  289    HB2  GLU  32           2HB      GLU  32  -6.522  -4.585   9.718
  290    HB3  GLU  32           3HB      GLU  32  -7.731  -4.161  10.921
  291    HG2  GLU  32           2HG      GLU  32  -8.214  -6.494   9.136
  292    HG3  GLU  32           3HG      GLU  32  -7.093  -6.653  10.487
  293    H    ARG  33           HN       ARG  33  -6.420  -2.413   9.503
  294    HA   ARG  33           HA       ARG  33  -7.608  -0.262  10.752
  295    HB2  ARG  33           2HB      ARG  33  -5.160  -0.130   8.984
  296    HB3  ARG  33           3HB      ARG  33  -5.581   0.986  10.276
  297    HG2  ARG  33           2HG      ARG  33  -5.264  -1.904  10.917
  298    HG3  ARG  33           3HG      ARG  33  -3.825  -0.916  10.654
  299    HD2  ARG  33           2HD      ARG  33  -4.258   0.433  12.485
  300    HD3  ARG  33           3HD      ARG  33  -5.978   0.041  12.493
  301    HE   ARG  33           HE       ARG  33  -4.551  -2.296  13.041
  302   HH11  ARG  33          2HH1      ARG  33  -5.202   0.801  14.489
  303   HH12  ARG  33          1HH1      ARG  33  -5.050   0.220  16.114
  304   HH21  ARG  33          2HH2      ARG  33  -4.348  -3.074  15.175
  305   HH22  ARG  33          1HH2      ARG  33  -4.564  -1.985  16.503
  306    H    VAL  34           HN       VAL  34  -6.295   0.010   7.454
  307    HA   VAL  34           HA       VAL  34  -7.691   2.309   6.758
  308    HB   VAL  34           HB       VAL  34  -6.846   0.130   4.846
  309   HG11  VAL  34          1HG1      VAL  34  -8.351   2.126   4.134
  310   HG12  VAL  34          2HG1      VAL  34  -6.860   3.062   4.259
  311   HG13  VAL  34          3HG1      VAL  34  -6.955   1.695   3.148
  312   HG21  VAL  34          3HG2      VAL  34  -4.887   2.041   4.778
  313   HG22  VAL  34          1HG2      VAL  34  -5.286   1.971   6.494
  314   HG23  VAL  34          2HG2      VAL  34  -4.787   0.509   5.644
  315    H    ALA  35           HN       ALA  35  -8.710  -1.018   6.764
  316    HA   ALA  35           HA       ALA  35 -10.940  -0.778   5.044
  317    HB1  ALA  35           1HB      ALA  35 -11.730  -2.857   6.215
  318    HB2  ALA  35           2HB      ALA  35 -10.114  -2.954   5.514
  319    HB3  ALA  35           3HB      ALA  35 -10.309  -2.724   7.252
  320    H    THR  36           HN       THR  36 -10.635  -0.567   8.578
  321    HA   THR  36           HA       THR  36 -13.429   0.123   8.879
  322    HB   THR  36           HB       THR  36 -12.364  -1.240  10.604
  323    HG1  THR  36           1HG      THR  36 -13.804   0.932  11.012
  324   HG21  THR  36          3HG2      THR  36 -10.196  -0.764  10.991
  325   HG22  THR  36          1HG2      THR  36 -10.835   0.403  12.148
  326   HG23  THR  36          2HG2      THR  36 -10.382   0.926  10.526
  327    H    LEU  37           HN       LEU  37 -10.451   1.763   8.429
  328    HA   LEU  37           HA       LEU  37 -11.001   4.199   9.723
  329    HB2  LEU  37           2HB      LEU  37  -9.218   3.399   7.457
  330    HB3  LEU  37           3HB      LEU  37  -9.393   5.097   7.897
  331    HG   LEU  37           HG       LEU  37  -8.501   2.975   9.840
  332   HD11  LEU  37          1HD1      LEU  37  -7.062   4.139   7.638
  333   HD12  LEU  37          2HD1      LEU  37  -6.551   2.901   8.785
  334   HD13  LEU  37          3HD1      LEU  37  -6.336   4.607   9.176
  335   HD21  LEU  37          3HD2      LEU  37  -8.416   5.988   9.856
  336   HD22  LEU  37          1HD2      LEU  37  -7.607   4.960  11.039
  337   HD23  LEU  37          2HD2      LEU  37  -9.366   4.940  10.910
  338    H    GLU  38           HN       GLU  38 -12.727   5.423   9.357
  339    HA   GLU  38           HA       GLU  38 -14.512   5.377   7.323
  340    HB2  GLU  38           2HB      GLU  38 -13.546   7.810   8.832
  341    HB3  GLU  38           3HB      GLU  38 -14.989   7.781   7.828
  342    HG2  GLU  38           2HG      GLU  38 -14.595   5.904  10.136
  343    HG3  GLU  38           3HG      GLU  38 -15.320   7.500  10.319
  344    H    ASP  39           HN       ASP  39 -11.347   6.846   7.269
  345    HA   ASP  39           HA       ASP  39 -11.687   7.352   4.398
  346    HB2  ASP  39           2HB      ASP  39 -10.077   9.401   4.946
  347    HB3  ASP  39           3HB      ASP  39 -11.831   9.554   5.011
  348    HA   PRO  40           HA       PRO  40  -7.887   5.144   4.106
  349    HB2  PRO  40           2HB      PRO  40  -7.138   5.943   1.622
  350    HB3  PRO  40           3HB      PRO  40  -8.444   4.787   1.906
  351    HG2  PRO  40           2HG      PRO  40  -8.603   7.721   1.333
  352    HG3  PRO  40           3HG      PRO  40  -9.589   6.398   0.681
  353    HD2  PRO  40           2HD      PRO  40 -10.450   8.008   2.681
  354    HD3  PRO  40           3HD      PRO  40 -10.925   6.302   2.556
  355    H    ARG  41           HN       ARG  41  -8.093   8.585   3.908
  356    HA   ARG  41           HA       ARG  41  -5.194   8.918   3.942
  357    HB2  ARG  41           2HB      ARG  41  -7.491  10.864   3.768
  358    HB3  ARG  41           3HB      ARG  41  -5.826  11.387   3.987
  359    HG2  ARG  41           2HG      ARG  41  -5.345   9.981   1.879
  360    HG3  ARG  41           3HG      ARG  41  -7.090  10.063   1.625
  361    HD2  ARG  41           2HD      ARG  41  -5.270  12.441   1.984
  362    HD3  ARG  41           3HD      ARG  41  -5.861  11.842   0.434
  363    HE   ARG  41           HE       ARG  41  -8.055  12.330   2.108
  364   HH11  ARG  41          2HH1      ARG  41  -5.561  14.061   0.405
  365   HH12  ARG  41          1HH1      ARG  41  -6.514  15.492   0.196
  366   HH21  ARG  41          2HH2      ARG  41  -9.321  14.209   1.840
  367   HH22  ARG  41          1HH2      ARG  41  -8.653  15.575   1.014
  368    H    SER  42           HN       SER  42  -6.339   7.598   6.172
  369    HA   SER  42           HA       SER  42  -6.234   9.605   8.308
  370    HB2  SER  42           2HB      SER  42  -8.111   7.842   8.118
  371    HB3  SER  42           3HB      SER  42  -6.903   6.694   8.695
  372    HG   SER  42           HG       SER  42  -7.786   9.046  10.017
  373    H    LEU  43           HN       LEU  43  -4.914   6.385   7.543
  374    HA   LEU  43           HA       LEU  43  -2.708   6.898   9.406
  375    HB2  LEU  43           2HB      LEU  43  -3.800   4.400   8.149
  376    HB3  LEU  43           3HB      LEU  43  -2.223   4.430   8.935
  377    HG   LEU  43           HG       LEU  43  -4.695   5.284  10.403
  378   HD11  LEU  43          1HD1      LEU  43  -5.489   3.220  10.548
  379   HD12  LEU  43          2HD1      LEU  43  -3.912   2.600  11.036
  380   HD13  LEU  43          3HD1      LEU  43  -4.319   2.724   9.325
  381   HD21  LEU  43          3HD2      LEU  43  -2.045   4.134  11.273
  382   HD22  LEU  43          1HD2      LEU  43  -3.371   4.590  12.343
  383   HD23  LEU  43          2HD2      LEU  43  -2.539   5.823  11.396
  384    H    GLY  44           HN       GLY  44  -0.609   7.011   8.759
  385    HA2  GLY  44           1HA      GLY  44   1.153   6.510   7.188
  386    HA3  GLY  44           2HA      GLY  44  -0.041   6.570   5.900
  387    H    GLU  45           HN       GLU  45   1.977   7.962   5.218
  388    HA   GLU  45           HA       GLU  45   1.360  10.755   5.929
  389    HB2  GLU  45           2HB      GLU  45   3.491  10.643   6.742
  390    HB3  GLU  45           3HB      GLU  45   3.951   9.336   5.660
  391    HG2  GLU  45           2HG      GLU  45   4.586  10.746   3.993
  392    HG3  GLU  45           3HG      GLU  45   3.440  11.999   4.464
  393    HA   PRO  46           HA       PRO  46   0.397  11.319   1.665
  394    HB2  PRO  46           2HB      PRO  46   0.588  14.025   1.569
  395    HB3  PRO  46           3HB      PRO  46  -0.763  13.184   2.337
  396    HG2  PRO  46           2HG      PRO  46   1.666  14.405   3.589
  397    HG3  PRO  46           3HG      PRO  46  -0.023  14.479   4.122
  398    HD2  PRO  46           2HD      PRO  46   1.781  12.792   5.230
  399    HD3  PRO  46           3HD      PRO  46   0.058  12.388   5.088
  400    H    LEU  47           HN       LEU  47   1.341  11.975  -0.326
  401    HA   LEU  47           HA       LEU  47   4.250  11.988  -0.253
  402    HB2  LEU  47           2HB      LEU  47   3.395  10.439  -1.786
  403    HB3  LEU  47           3HB      LEU  47   2.205  11.582  -2.407
  404    HG   LEU  47           HG       LEU  47   4.306  12.884  -3.246
  405   HD11  LEU  47          1HD1      LEU  47   6.196  11.500  -3.781
  406   HD12  LEU  47          2HD1      LEU  47   5.411  10.085  -3.083
  407   HD13  LEU  47          3HD1      LEU  47   5.903  11.421  -2.044
  408   HD21  LEU  47          3HD2      LEU  47   2.658  10.798  -4.355
  409   HD22  LEU  47          1HD2      LEU  47   4.261  10.791  -5.092
  410   HD23  LEU  47          2HD2      LEU  47   3.285  12.260  -5.118
  411    H    ARG  48           HN       ARG  48   5.534  13.527  -1.342
  412    HA   ARG  48           HA       ARG  48   4.204  16.012  -2.147
  413    HB2  ARG  48           2HB      ARG  48   4.919  16.199   0.241
  414    HB3  ARG  48           3HB      ARG  48   6.578  15.936  -0.279
  415    HG2  ARG  48           2HG      ARG  48   6.773  18.014  -1.189
  416    HG3  ARG  48           3HG      ARG  48   5.053  18.129  -1.570
  417    HD2  ARG  48           2HD      ARG  48   4.521  18.512   0.752
  418    HD3  ARG  48           3HD      ARG  48   6.202  18.252   1.215
  419    HE   ARG  48           HE       ARG  48   6.111  20.336  -0.649
  420   HH11  ARG  48          2HH1      ARG  48   5.113  19.648   2.615
  421   HH12  ARG  48          1HH1      ARG  48   5.225  21.297   3.135
  422   HH21  ARG  48          2HH2      ARG  48   6.263  22.511   0.025
  423   HH22  ARG  48          1HH2      ARG  48   5.879  22.924   1.661
  424    H    GLY  49           HN       GLY  49   4.792  16.261  -4.203
  425    HA2  GLY  49           1HA      GLY  49   7.489  16.692  -4.943
  426    HA3  GLY  49           2HA      GLY  49   6.989  15.087  -5.454
  427    HA   PRO  50           HA       PRO  50   5.421  18.665  -8.281
  428    HB2  PRO  50           2HB      PRO  50   7.520  18.979  -9.973
  429    HB3  PRO  50           3HB      PRO  50   7.316  19.944  -8.506
  430    HG2  PRO  50           2HG      PRO  50   9.041  17.541  -8.968
  431    HG3  PRO  50           3HG      PRO  50   9.424  19.045  -8.110
  432    HD2  PRO  50           2HD      PRO  50   8.744  16.764  -6.819
  433    HD3  PRO  50           3HD      PRO  50   8.339  18.374  -6.190
  434    H    GLU  51           HN       GLU  51   7.700  16.092  -9.237
  435    HA   GLU  51           HA       GLU  51   6.012  15.459 -11.536
  436    HB2  GLU  51           2HB      GLU  51   8.644  15.631 -11.474
  437    HB3  GLU  51           3HB      GLU  51   8.525  13.972 -10.905
  438    HG2  GLU  51           2HG      GLU  51   7.246  14.952 -13.441
  439    HG3  GLU  51           3HG      GLU  51   8.856  14.239 -13.367
  440    H    LEU  52           HN       LEU  52   4.795  14.894  -9.130
  441    HA   LEU  52           HA       LEU  52   4.476  12.016  -9.356
  442    HB2  LEU  52           2HB      LEU  52   5.522  13.407  -6.937
  443    HB3  LEU  52           3HB      LEU  52   4.452  12.023  -6.725
  444    HG   LEU  52           HG       LEU  52   6.928  11.829  -8.410
  445   HD11  LEU  52          1HD1      LEU  52   6.826  12.301  -5.586
  446   HD12  LEU  52          2HD1      LEU  52   8.228  12.076  -6.632
  447   HD13  LEU  52          3HD1      LEU  52   7.439  10.678  -5.903
  448   HD21  LEU  52          3HD2      LEU  52   5.981   9.582  -6.779
  449   HD22  LEU  52          1HD2      LEU  52   6.493   9.628  -8.466
  450   HD23  LEU  52          2HD2      LEU  52   4.854  10.113  -8.029
  451    H    GLY  53           HN       GLY  53   2.380  11.530  -9.343
  452    HA2  GLY  53           1HA      GLY  53   0.393  13.513  -8.959
  453    HA3  GLY  53           2HA      GLY  53   0.103  11.793  -9.175
  454    H    ARG  54           HN       ARG  54  -1.639  12.154  -7.622
  455    HA   ARG  54           HA       ARG  54  -0.874  12.706  -4.882
  456    HB2  ARG  54           2HB      ARG  54  -3.094  13.348  -6.126
  457    HB3  ARG  54           3HB      ARG  54  -3.588  11.723  -5.672
  458    HG2  ARG  54           2HG      ARG  54  -3.007  12.332  -3.298
  459    HG3  ARG  54           3HG      ARG  54  -2.840  13.997  -3.859
  460    HD2  ARG  54           2HD      ARG  54  -5.325  12.373  -4.330
  461    HD3  ARG  54           3HD      ARG  54  -5.087  13.335  -2.872
  462    HE   ARG  54           HE       ARG  54  -5.809  14.297  -5.449
  463   HH11  ARG  54          2HH1      ARG  54  -4.011  15.106  -2.580
  464   HH12  ARG  54          1HH1      ARG  54  -4.171  16.817  -2.804
  465   HH21  ARG  54          2HH2      ARG  54  -6.028  16.547  -5.755
  466   HH22  ARG  54          1HH2      ARG  54  -5.319  17.635  -4.610
  467    H    PHE  55           HN       PHE  55   0.456  10.990  -4.305
  468    HA   PHE  55           HA       PHE  55  -0.897   8.380  -4.094
  469    HB2  PHE  55           2HB      PHE  55   2.077   8.841  -4.395
  470    HB3  PHE  55           3HB      PHE  55   1.256   7.284  -4.336
  471    HD1  PHE  55           1HD      PHE  55  -0.901   7.416  -6.137
  472    HD2  PHE  55           2HD      PHE  55   2.920   9.260  -6.479
  473    HE1  PHE  55           1HE      PHE  55  -1.139   7.449  -8.586
  474    HE2  PHE  55           2HE      PHE  55   2.688   9.296  -8.928
  475    HZ   PHE  55           HZ       PHE  55   0.656   8.391  -9.985
  476    H    TRP  56           HN       TRP  56  -1.190   7.656  -2.095
  477    HA   TRP  56           HA       TRP  56   0.083   9.069   0.116
  478    HB2  TRP  56           2HB      TRP  56  -2.434   8.541  -0.041
  479    HB3  TRP  56           3HB      TRP  56  -1.980   6.892   0.379
  480    HD1  TRP  56           1HD      TRP  56  -1.063   6.464   2.867
  481    HE1  TRP  56           1HE      TRP  56  -1.314   7.825   5.037
  482    HE3  TRP  56           3HE      TRP  56  -2.581  10.916   0.863
  483    HZ2  TRP  56           2HZ      TRP  56  -2.057  10.439   5.799
  484    HZ3  TRP  56           3HZ      TRP  56  -3.042  12.797   2.381
  485    HH2  TRP  56           2HH      TRP  56  -2.785  12.561   4.798
  486    H    LYS  57           HN       LYS  57   1.266   8.052   1.742
  487    HA   LYS  57           HA       LYS  57   2.265   5.365   1.054
  488    HB2  LYS  57           2HB      LYS  57   3.666   7.823   2.011
  489    HB3  LYS  57           3HB      LYS  57   4.293   6.254   2.501
  490    HG2  LYS  57           2HG      LYS  57   5.499   6.546   0.606
  491    HG3  LYS  57           3HG      LYS  57   4.075   5.772  -0.094
  492    HD2  LYS  57           2HD      LYS  57   4.248   7.567  -1.493
  493    HD3  LYS  57           3HD      LYS  57   3.236   8.282  -0.236
  494    HE2  LYS  57           2HE      LYS  57   5.017   9.808  -0.799
  495    HE3  LYS  57           3HE      LYS  57   5.270   9.190   0.833
  496    HZ1  LYS  57           3HZ      LYS  57   7.243   9.281  -0.799
  497    HZ2  LYS  57           1HZ      LYS  57   6.570   7.877  -1.460
  498    HZ3  LYS  57           2HZ      LYS  57   7.043   7.904   0.163
  499    H    TYR  58           HN       TYR  58   2.027   3.815   2.534
  500    HA   TYR  58           HA       TYR  58   1.100   4.602   5.211
  501    HB2  TYR  58           2HB      TYR  58   0.732   2.032   3.664
  502    HB3  TYR  58           3HB      TYR  58   0.232   2.251   5.337
  503    HD1  TYR  58           1HD      TYR  58  -1.495   4.044   5.847
  504    HD2  TYR  58           2HD      TYR  58  -0.656   2.711   1.895
  505    HE1  TYR  58           1HE      TYR  58  -3.648   4.959   5.087
  506    HE2  TYR  58           2HE      TYR  58  -2.806   3.623   1.124
  507    HH   TYR  58           HH       TYR  58  -5.265   4.241   2.850
  508    H    ARG  59           HN       ARG  59   2.122   3.907   7.029
  509    HA   ARG  59           HA       ARG  59   4.706   2.570   6.627
  510    HB2  ARG  59           2HB      ARG  59   5.252   4.483   7.757
  511    HB3  ARG  59           3HB      ARG  59   3.688   4.586   8.556
  512    HG2  ARG  59           2HG      ARG  59   5.640   2.444   9.296
  513    HG3  ARG  59           3HG      ARG  59   5.780   4.072   9.963
  514    HD2  ARG  59           2HD      ARG  59   3.186   3.664  10.419
  515    HD3  ARG  59           3HD      ARG  59   3.727   1.986  10.436
  516    HE   ARG  59           HE       ARG  59   4.699   2.374  12.462
  517   HH11  ARG  59          2HH1      ARG  59   4.159   5.428  10.880
  518   HH12  ARG  59          1HH1      ARG  59   4.652   6.372  12.247
  519   HH21  ARG  59          2HH2      ARG  59   5.350   3.606  14.269
  520   HH22  ARG  59          1HH2      ARG  59   5.329   5.334  14.174
  521    H    VAL  60           HN       VAL  60   5.202   0.681   7.620
  522    HA   VAL  60           HA       VAL  60   3.377  -0.406   9.629
  523    HB   VAL  60           HB       VAL  60   3.996  -1.714   6.991
  524   HG11  VAL  60          1HG1      VAL  60   4.280  -3.646   8.076
  525   HG12  VAL  60          2HG1      VAL  60   3.718  -2.967   9.605
  526   HG13  VAL  60          3HG1      VAL  60   2.553  -3.567   8.424
  527   HG21  VAL  60          3HG2      VAL  60   1.400  -2.202   7.511
  528   HG22  VAL  60          1HG2      VAL  60   1.608  -0.680   8.378
  529   HG23  VAL  60          2HG2      VAL  60   1.970  -0.770   6.654
  530    H    GLY  61           HN       GLY  61   4.757  -0.651  11.281
  531    HA2  GLY  61           1HA      GLY  61   6.651  -1.222  12.464
  532    HA3  GLY  61           2HA      GLY  61   6.558  -2.693  11.508
  533    H    ASP  62           HN       ASP  62   8.154  -3.125  10.113
  534    HA   ASP  62           HA       ASP  62  10.108  -0.982   9.590
  535    HB2  ASP  62           2HB      ASP  62  10.785  -3.904   9.445
  536    HB3  ASP  62           3HB      ASP  62  11.858  -2.530   9.700
  537    H    TYR  63           HN       TYR  63   7.814  -1.350   7.981
  538    HA   TYR  63           HA       TYR  63   9.116  -1.943   5.437
  539    HB2  TYR  63           2HB      TYR  63   6.535  -3.215   6.357
  540    HB3  TYR  63           3HB      TYR  63   7.068  -3.197   4.680
  541    HD1  TYR  63           1HD      TYR  63   8.114  -4.296   8.080
  542    HD2  TYR  63           2HD      TYR  63   8.477  -4.878   3.881
  543    HE1  TYR  63           1HE      TYR  63   9.424  -6.338   8.482
  544    HE2  TYR  63           2HE      TYR  63   9.787  -6.922   4.271
  545    HH   TYR  63           HH       TYR  63  10.396  -8.448   5.837
  546    H    ARG  64           HN       ARG  64   8.429  -0.683   3.763
  547    HA   ARG  64           HA       ARG  64   6.409   1.352   4.426
  548    HB2  ARG  64           2HB      ARG  64   8.932   1.415   2.836
  549    HB3  ARG  64           3HB      ARG  64   7.619   2.480   2.351
  550    HG2  ARG  64           2HG      ARG  64   8.550   2.416   5.191
  551    HG3  ARG  64           3HG      ARG  64   9.419   3.356   3.975
  552    HD2  ARG  64           2HD      ARG  64   7.324   4.533   3.430
  553    HD3  ARG  64           3HD      ARG  64   6.503   3.625   4.699
  554    HE   ARG  64           HE       ARG  64   8.688   4.876   5.869
  555   HH11  ARG  64          2HH1      ARG  64   5.728   5.778   4.274
  556   HH12  ARG  64          1HH1      ARG  64   5.557   7.264   5.147
  557   HH21  ARG  64          2HH2      ARG  64   8.474   6.831   7.025
  558   HH22  ARG  64          1HH2      ARG  64   7.120   7.863   6.712
  559    H    LEU  65           HN       LEU  65   4.671   1.659   3.133
  560    HA   LEU  65           HA       LEU  65   4.510   0.076   0.657
  561    HB2  LEU  65           2HB      LEU  65   2.128   0.547   2.411
  562    HB3  LEU  65           3HB      LEU  65   2.344  -0.650   1.135
  563    HG   LEU  65           HG       LEU  65   3.918  -0.772   3.691
  564   HD11  LEU  65          1HD1      LEU  65   1.085  -1.513   3.196
  565   HD12  LEU  65          2HD1      LEU  65   1.866  -0.932   4.666
  566   HD13  LEU  65          3HD1      LEU  65   2.076  -2.608   4.160
  567   HD21  LEU  65          3HD2      LEU  65   3.502  -2.461   1.314
  568   HD22  LEU  65          1HD2      LEU  65   3.495  -3.305   2.863
  569   HD23  LEU  65          2HD2      LEU  65   4.892  -2.336   2.394
  570    H    ILE  66           HN       ILE  66   3.585   1.056  -1.081
  571    HA   ILE  66           HA       ILE  66   2.579   3.798  -0.681
  572    HB   ILE  66           HB       ILE  66   3.955   2.899  -3.197
  573   HG12  ILE  66          2HG1      ILE  66   5.149   3.864  -0.624
  574   HG13  ILE  66          3HG1      ILE  66   5.713   2.594  -1.704
  575   HG21  ILE  66          1HG2      ILE  66   2.452   5.023  -2.889
  576   HG22  ILE  66          2HG2      ILE  66   3.905   5.684  -2.140
  577   HG23  ILE  66          3HG2      ILE  66   3.955   5.112  -3.808
  578   HD11  ILE  66          3HD1      ILE  66   6.183   4.480  -3.364
  579   HD12  ILE  66          1HD1      ILE  66   6.006   5.558  -1.979
  580   HD13  ILE  66          2HD1      ILE  66   7.254   4.312  -1.973
  581    H    CYS  67           HN       CYS  67   0.424   3.586  -0.864
  582    HA   CYS  67           HA       CYS  67  -0.641   2.002  -3.099
  583    HB2  CYS  67           2HB      CYS  67  -2.190   3.069  -0.738
  584    HB3  CYS  67           3HB      CYS  67  -2.700   1.841  -1.890
  585    HG   CYS  67           HG       CYS  67  -0.058   1.363   0.224
  586    H    HIS  68           HN       HIS  68  -2.695   2.893  -4.069
  587    HA   HIS  68           HA       HIS  68  -2.482   5.818  -4.363
  588    HB2  HIS  68           2HB      HIS  68  -1.729   4.470  -6.358
  589    HB3  HIS  68           3HB      HIS  68  -3.386   3.894  -6.510
  590    HD2  HIS  68           2HD      HIS  68  -3.221   7.609  -5.615
  591    HE1  HIS  68           1HE      HIS  68  -3.800   7.362  -9.810
  592    HE2  HIS  68           2HE      HIS  68  -3.697   8.890  -7.811
  593    H    ILE  69           HN       ILE  69  -4.170   6.772  -3.448
  594    HA   ILE  69           HA       ILE  69  -6.662   5.379  -3.046
  595    HB   ILE  69           HB       ILE  69  -5.868   8.224  -2.417
  596   HG12  ILE  69          2HG1      ILE  69  -6.346   5.981  -0.466
  597   HG13  ILE  69          3HG1      ILE  69  -4.766   6.237  -1.200
  598   HG21  ILE  69          1HG2      ILE  69  -8.436   6.779  -2.192
  599   HG22  ILE  69          2HG2      ILE  69  -7.964   7.774  -0.816
  600   HG23  ILE  69          3HG2      ILE  69  -8.115   8.499  -2.416
  601   HD11  ILE  69          3HD1      ILE  69  -4.506   7.426   0.715
  602   HD12  ILE  69          1HD1      ILE  69  -5.153   8.694  -0.325
  603   HD13  ILE  69          2HD1      ILE  69  -6.212   7.860   0.812
  604    H    GLN  70           HN       GLN  70  -8.267   5.314  -4.461
  605    HA   GLN  70           HA       GLN  70  -8.391   7.374  -6.554
  606    HB2  GLN  70           2HB      GLN  70  -9.444   4.547  -6.470
  607    HB3  GLN  70           3HB      GLN  70  -9.846   5.689  -7.746
  608    HG2  GLN  70           2HG      GLN  70  -7.569   5.820  -8.445
  609    HG3  GLN  70           3HG      GLN  70  -7.035   4.878  -7.053
  610   HE21  GLN  70          1HE2      GLN  70  -7.163   4.603 -10.157
  611   HE22  GLN  70          2HE2      GLN  70  -7.656   2.961 -10.365
  612    H    ASP  71           HN       ASP  71  -9.531   8.931  -5.385
  613    HA   ASP  71           HA       ASP  71 -11.778   8.568  -3.817
  614    HB2  ASP  71           2HB      ASP  71 -11.274  10.916  -5.656
  615    HB3  ASP  71           3HB      ASP  71 -12.282  10.909  -4.211
  616    H    ARG  72           HN       ARG  72 -11.593   9.070  -7.324
  617    HA   ARG  72           HA       ARG  72 -14.131   9.384  -8.114
  618    HB2  ARG  72           2HB      ARG  72 -13.641   7.968 -10.092
  619    HB3  ARG  72           3HB      ARG  72 -12.350   9.103  -9.721
  620    HG2  ARG  72           2HG      ARG  72 -11.113   7.281  -8.607
  621    HG3  ARG  72           3HG      ARG  72 -12.386   6.160  -9.094
  622    HD2  ARG  72           2HD      ARG  72 -10.882   7.854 -11.070
  623    HD3  ARG  72           3HD      ARG  72 -10.315   6.263 -10.565
  624    HE   ARG  72           HE       ARG  72 -13.036   6.340 -11.534
  625   HH11  ARG  72          2HH1      ARG  72  -9.679   5.880 -12.331
  626   HH12  ARG  72          1HH1      ARG  72 -10.010   4.973 -13.769
  627   HH21  ARG  72          2HH2      ARG  72 -13.485   5.147 -13.425
  628   HH22  ARG  72          1HH2      ARG  72 -12.175   4.557 -14.391
  629    H    GLU  73           HN       GLU  73 -12.757   6.295  -7.043
  630    HA   GLU  73           HA       GLU  73 -15.497   5.328  -6.600
  631    HB2  GLU  73           2HB      GLU  73 -13.235   3.901  -7.977
  632    HB3  GLU  73           3HB      GLU  73 -14.547   3.014  -7.214
  633    HG2  GLU  73           2HG      GLU  73 -16.160   4.058  -8.663
  634    HG3  GLU  73           3HG      GLU  73 -14.912   5.086  -9.365
  635    H    ALA  74           HN       ALA  74 -13.278   6.465  -4.903
  636    HA   ALA  74           HA       ALA  74 -12.126   6.007  -2.964
  637    HB1  ALA  74           1HB      ALA  74 -13.755   4.660  -1.370
  638    HB2  ALA  74           2HB      ALA  74 -14.075   6.333  -1.830
  639    HB3  ALA  74           3HB      ALA  74 -14.908   5.016  -2.657
  640    H    THR  75           HN       THR  75 -11.131   4.326  -4.822
  641    HA   THR  75           HA       THR  75 -10.942   1.741  -3.417
  642    HB   THR  75           HB       THR  75 -10.670   2.302  -6.375
  643    HG1  THR  75           1HG      THR  75 -12.506   0.694  -4.896
  644   HG21  THR  75          3HG2      THR  75 -10.314  -0.312  -4.905
  645   HG22  THR  75          1HG2      THR  75  -9.011   0.644  -5.608
  646   HG23  THR  75          2HG2      THR  75 -10.239  -0.075  -6.650
  647    H    VAL  76           HN       VAL  76  -9.004   1.188  -2.657
  648    HA   VAL  76           HA       VAL  76  -6.699   2.846  -3.395
  649    HB   VAL  76           HB       VAL  76  -6.989   0.937  -1.071
  650   HG11  VAL  76          1HG1      VAL  76  -4.916   1.626  -0.323
  651   HG12  VAL  76          2HG1      VAL  76  -4.667   1.569  -2.069
  652   HG13  VAL  76          3HG1      VAL  76  -4.953   3.115  -1.268
  653   HG21  VAL  76          3HG2      VAL  76  -6.814   3.485  -0.050
  654   HG22  VAL  76          1HG2      VAL  76  -7.856   3.692  -1.458
  655   HG23  VAL  76          2HG2      VAL  76  -8.292   2.534  -0.201
  656    H    LEU  77           HN       LEU  77  -5.021   2.051  -4.500
  657    HA   LEU  77           HA       LEU  77  -4.812  -0.869  -4.815
  658    HB2  LEU  77           2HB      LEU  77  -5.740   0.079  -6.842
  659    HB3  LEU  77           3HB      LEU  77  -4.423   1.247  -6.926
  660    HG   LEU  77           HG       LEU  77  -2.972  -0.981  -7.019
  661   HD11  LEU  77          1HD1      LEU  77  -4.495  -2.691  -6.932
  662   HD12  LEU  77          2HD1      LEU  77  -4.359  -2.464  -8.676
  663   HD13  LEU  77          3HD1      LEU  77  -5.732  -1.784  -7.803
  664   HD21  LEU  77          3HD2      LEU  77  -4.451   0.191  -9.373
  665   HD22  LEU  77          1HD2      LEU  77  -2.966  -0.757  -9.448
  666   HD23  LEU  77          2HD2      LEU  77  -2.964   0.824  -8.667
  667    H    VAL  78           HN       VAL  78  -2.906  -1.667  -4.237
  668    HA   VAL  78           HA       VAL  78  -0.792  -0.007  -3.335
  669    HB   VAL  78           HB       VAL  78  -0.729  -2.968  -3.934
  670   HG11  VAL  78          1HG1      VAL  78   0.995  -1.787  -1.852
  671   HG12  VAL  78          2HG1      VAL  78   1.325  -3.086  -3.001
  672   HG13  VAL  78          3HG1      VAL  78   1.419  -1.403  -3.520
  673   HG21  VAL  78          3HG2      VAL  78  -2.364  -2.834  -2.323
  674   HG22  VAL  78          1HG2      VAL  78  -0.920  -2.953  -1.318
  675   HG23  VAL  78          2HG2      VAL  78  -1.677  -1.384  -1.591
  676    H    LEU  79           HN       LEU  79   0.978   0.736  -4.339
  677    HA   LEU  79           HA       LEU  79   1.319   0.053  -7.172
  678    HB2  LEU  79           2HB      LEU  79   1.888   2.446  -5.515
  679    HB3  LEU  79           3HB      LEU  79   2.967   2.124  -6.871
  680    HG   LEU  79           HG       LEU  79  -0.023   2.398  -7.139
  681   HD11  LEU  79          1HD1      LEU  79   1.872   4.420  -6.593
  682   HD12  LEU  79          2HD1      LEU  79   0.174   4.601  -7.033
  683   HD13  LEU  79          3HD1      LEU  79   1.413   4.571  -8.289
  684   HD21  LEU  79          3HD2      LEU  79   1.986   2.789  -9.313
  685   HD22  LEU  79          1HD2      LEU  79   0.291   2.312  -9.419
  686   HD23  LEU  79          2HD2      LEU  79   1.498   1.155  -8.857
  687    H    ARG  80           HN       ARG  80   3.363   0.788  -4.339
  688    HA   ARG  80           HA       ARG  80   5.251  -1.257  -5.295
  689    HB2  ARG  80           2HB      ARG  80   5.873   1.307  -5.532
  690    HB3  ARG  80           3HB      ARG  80   6.280   1.130  -3.830
  691    HG2  ARG  80           2HG      ARG  80   8.294   0.696  -4.840
  692    HG3  ARG  80           3HG      ARG  80   7.639  -0.931  -4.647
  693    HD2  ARG  80           2HD      ARG  80   8.346  -0.978  -6.838
  694    HD3  ARG  80           3HD      ARG  80   6.656  -0.511  -7.025
  695    HE   ARG  80           HE       ARG  80   7.344   1.517  -7.829
  696   HH11  ARG  80          2HH1      ARG  80  10.018  -0.044  -6.239
  697   HH12  ARG  80          1HH1      ARG  80  11.181   1.132  -6.755
  698   HH21  ARG  80          2HH2      ARG  80   8.865   3.072  -8.515
  699   HH22  ARG  80          1HH2      ARG  80  10.524   2.905  -8.049
  700    H    VAL  81           HN       VAL  81   6.452  -2.343  -3.672
  701    HA   VAL  81           HA       VAL  81   5.657  -1.888  -0.895
  702    HB   VAL  81           HB       VAL  81   4.071  -3.560  -1.745
  703   HG11  VAL  81          1HG1      VAL  81   5.906  -5.772  -1.992
  704   HG12  VAL  81          2HG1      VAL  81   4.656  -5.218  -3.108
  705   HG13  VAL  81          3HG1      VAL  81   6.271  -4.511  -3.169
  706   HG21  VAL  81          3HG2      VAL  81   5.156  -5.488  -0.134
  707   HG22  VAL  81          1HG2      VAL  81   5.977  -4.028   0.420
  708   HG23  VAL  81          2HG2      VAL  81   4.215  -4.105   0.424
  709    H    GLY  82           HN       GLY  82   7.501  -1.679   0.183
  710    HA2  GLY  82           1HA      GLY  82   9.535  -3.732  -0.017
  711    HA3  GLY  82           2HA      GLY  82  10.044  -2.146  -0.577
  712    H    HIS  83           HN       HIS  83  11.151  -3.602   1.623
  713    HA   HIS  83           HA       HIS  83  10.266  -2.955   4.139
  714    HB2  HIS  83           2HB      HIS  83  12.311  -4.339   3.458
  715    HB3  HIS  83           3HB      HIS  83  13.183  -2.810   3.394
  716    HD2  HIS  83           2HD      HIS  83  11.656  -5.240   6.035
  717    HE1  HIS  83           1HE      HIS  83  13.872  -2.250   8.072
  718    HE2  HIS  83           2HE      HIS  83  12.687  -4.463   8.277
  719    H    ALA  84           HN       ALA  84  10.904  -1.296   5.652
  720    HA   ALA  84           HA       ALA  84  10.360   1.271   4.899
  721    HB1  ALA  84           1HB      ALA  84  12.351   0.918   7.078
  722    HB2  ALA  84           2HB      ALA  84  10.886   1.900   7.030
  723    HB3  ALA  84           3HB      ALA  84  10.771   0.155   7.256
  724    H    ARG  85           HN       ARG  85  13.414  -0.408   4.677
  725    HA   ARG  85           HA       ARG  85  14.877   2.010   4.017
  726    HB2  ARG  85           2HB      ARG  85  16.819   0.536   3.821
  727    HB3  ARG  85           3HB      ARG  85  15.975   0.265   5.340
  728    HG2  ARG  85           2HG      ARG  85  15.248  -1.819   4.727
  729    HG3  ARG  85           3HG      ARG  85  15.306  -1.450   3.002
  730    HD2  ARG  85           2HD      ARG  85  17.835  -1.331   3.280
  731    HD3  ARG  85           3HD      ARG  85  17.586  -2.079   4.857
  732    HE   ARG  85           HE       ARG  85  17.379  -3.346   2.279
  733   HH11  ARG  85          2HH1      ARG  85  16.460  -3.477   5.635
  734   HH12  ARG  85          1HH1      ARG  85  16.176  -5.186   5.625
  735   HH21  ARG  85          2HH2      ARG  85  17.007  -5.597   2.253
  736   HH22  ARG  85          1HH2      ARG  85  16.488  -6.391   3.701
  737    H    ASP  86           HN       ASP  86  13.303  -0.627   2.404
  738    HA   ASP  86           HA       ASP  86  14.601  -0.379  -0.109
  739    HB2  ASP  86           2HB      ASP  86  12.113  -1.703   0.882
  740    HB3  ASP  86           3HB      ASP  86  12.316  -1.489  -0.855
  741    H    VAL  87           HN       VAL  87  12.158   1.442   1.475
  742    HA   VAL  87           HA       VAL  87  11.398   2.761  -1.040
  743    HB   VAL  87           HB       VAL  87  10.077   2.814   1.676
  744   HG11  VAL  87          1HG1      VAL  87   9.071   4.707   1.102
  745   HG12  VAL  87          2HG1      VAL  87   9.982   4.746  -0.409
  746   HG13  VAL  87          3HG1      VAL  87   8.422   3.925  -0.340
  747   HG21  VAL  87          3HG2      VAL  87   8.210   1.941  -0.077
  748   HG22  VAL  87          1HG2      VAL  87   9.676   1.278  -0.801
  749   HG23  VAL  87          2HG2      VAL  87   9.256   0.878   0.865
  750    H    TYR  88           HN       TYR  88  11.891   4.846  -1.428
  751    HA   TYR  88           HA       TYR  88  13.925   6.117   0.040
  752    HB2  TYR  88           2HB      TYR  88  13.894   7.728  -1.598
  753    HB3  TYR  88           3HB      TYR  88  13.062   6.429  -2.446
  754    HD1  TYR  88           2HD      TYR  88  12.251   9.293  -0.180
  755    HD2  TYR  88           1HD      TYR  88  11.116   6.968  -3.558
  756    HE1  TYR  88           2HE      TYR  88  10.323  10.776  -0.546
  757    HE2  TYR  88           1HE      TYR  88   9.186   8.444  -3.934
  758    HH   TYR  88           HH       TYR  88   8.178  10.775  -1.624
  759    H    ARG  89           HN       ARG  89  13.892   7.461   1.729
  760    HA   ARG  89           HA       ARG  89  11.853   7.742   3.487
  761    HB2  ARG  89           2HB      ARG  89  12.987   9.688   4.400
  762    HB3  ARG  89           3HB      ARG  89  14.166   8.478   3.915
  763    HG2  ARG  89           2HG      ARG  89  14.986   9.753   2.212
  764    HG3  ARG  89           3HG      ARG  89  13.458  10.602   1.966
  765    HD2  ARG  89           2HD      ARG  89  13.889  11.658   4.255
  766    HD3  ARG  89           3HD      ARG  89  15.537  11.054   4.086
  767    HE   ARG  89           HE       ARG  89  14.618  12.592   1.834
  768   HH11  ARG  89          2HH1      ARG  89  16.127  12.708   4.969
  769   HH12  ARG  89          1HH1      ARG  89  16.922  14.219   4.675
  770   HH21  ARG  89          2HH2      ARG  89  15.660  14.582   1.435
  771   HH22  ARG  89          1HH2      ARG  89  16.655  15.285   2.664
  Start of MODEL   20
    1    H1   MET   1           HN       MET   1 -19.064   5.630   2.703
    2    HA   MET   1           HA       MET   1 -16.539   5.402   4.094
    3    HB2  MET   1           2HB      MET   1 -17.769   4.117   5.738
    4    HB3  MET   1           3HB      MET   1 -18.682   5.562   5.324
    5    HG2  MET   1           2HG      MET   1 -20.309   4.381   4.209
    6    HG3  MET   1           3HG      MET   1 -19.249   3.009   3.897
    7    HE1  MET   1           3HE      MET   1 -20.436   0.548   6.302
    8    HE2  MET   1           1HE      MET   1 -21.150   1.131   4.798
    9    HE3  MET   1           2HE      MET   1 -19.399   0.977   4.940
   10    H    GLY   2           HN       GLY   2 -15.391   3.465   4.441
   11    HA2  GLY   2           1HA      GLY   2 -14.611   1.347   3.956
   12    HA3  GLY   2           2HA      GLY   2 -16.140   1.019   3.153
   13    H    TYR   3           HN       TYR   3 -12.950   1.095   2.633
   14    HA   TYR   3           HA       TYR   3 -13.252   1.955  -0.170
   15    HB2  TYR   3           2HB      TYR   3 -10.918   2.178   1.716
   16    HB3  TYR   3           3HB      TYR   3 -10.689   2.227  -0.029
   17    HD1  TYR   3           2HD      TYR   3 -12.945   3.802   2.511
   18    HD2  TYR   3           1HD      TYR   3 -10.543   4.323  -0.962
   19    HE1  TYR   3           2HE      TYR   3 -13.470   6.204   2.516
   20    HE2  TYR   3           1HE      TYR   3 -11.061   6.728  -0.966
   21    HH   TYR   3           HH       TYR   3 -12.072   8.396   0.096
   22    H    ARG   4           HN       ARG   4 -12.118   0.747  -1.771
   23    HA   ARG   4           HA       ARG   4 -12.063  -2.081  -1.190
   24    HB2  ARG   4           2HB      ARG   4 -13.050  -1.243  -3.282
   25    HB3  ARG   4           3HB      ARG   4 -11.485  -0.599  -3.761
   26    HG2  ARG   4           2HG      ARG   4 -10.644  -2.646  -4.290
   27    HG3  ARG   4           3HG      ARG   4 -11.652  -3.488  -3.111
   28    HD2  ARG   4           2HD      ARG   4 -12.961  -2.156  -5.432
   29    HD3  ARG   4           3HD      ARG   4 -12.115  -3.680  -5.698
   30    HE   ARG   4           HE       ARG   4 -14.650  -3.362  -4.508
   31   HH11  ARG   4          2HH1      ARG   4 -11.700  -5.177  -4.159
   32   HH12  ARG   4          1HH1      ARG   4 -12.473  -6.541  -3.420
   33   HH21  ARG   4          2HH2      ARG   4 -15.680  -5.151  -3.536
   34   HH22  ARG   4          1HH2      ARG   4 -14.737  -6.525  -3.067
   35    H    ILE   5           HN       ILE   5 -10.280  -3.468  -1.533
   36    HA   ILE   5           HA       ILE   5  -7.679  -2.124  -1.225
   37    HB   ILE   5           HB       ILE   5  -8.357  -4.955  -0.433
   38   HG12  ILE   5          2HG1      ILE   5  -9.690  -3.528   0.954
   39   HG13  ILE   5          3HG1      ILE   5  -8.301  -4.031   1.911
   40   HG21  ILE   5          1HG2      ILE   5  -6.257  -5.093   0.510
   41   HG22  ILE   5          2HG2      ILE   5  -5.939  -4.126  -0.930
   42   HG23  ILE   5          3HG2      ILE   5  -6.086  -3.343   0.643
   43   HD11  ILE   5          3HD1      ILE   5  -7.221  -1.865   1.366
   44   HD12  ILE   5          1HD1      ILE   5  -8.718  -1.371   0.574
   45   HD13  ILE   5          2HD1      ILE   5  -8.707  -1.715   2.304
   46    H    GLU   6           HN       GLU   6  -6.867  -1.967  -3.248
   47    HA   GLU   6           HA       GLU   6  -6.805  -4.409  -4.890
   48    HB2  GLU   6           2HB      GLU   6  -6.832  -1.493  -5.595
   49    HB3  GLU   6           3HB      GLU   6  -6.173  -2.669  -6.724
   50    HG2  GLU   6           2HG      GLU   6  -8.464  -3.883  -6.273
   51    HG3  GLU   6           3HG      GLU   6  -8.974  -2.255  -5.832
   52    H    PHE   7           HN       PHE   7  -4.862  -4.918  -6.029
   53    HA   PHE   7           HA       PHE   7  -2.429  -3.614  -5.039
   54    HB2  PHE   7           2HB      PHE   7  -3.146  -6.518  -4.812
   55    HB3  PHE   7           3HB      PHE   7  -1.459  -6.036  -4.961
   56    HD1  PHE   7           1HD      PHE   7  -4.463  -5.846  -2.855
   57    HD2  PHE   7           2HD      PHE   7  -0.304  -4.991  -3.157
   58    HE1  PHE   7           1HE      PHE   7  -4.381  -5.405  -0.436
   59    HE2  PHE   7           2HE      PHE   7  -0.216  -4.549  -0.738
   60    HZ   PHE   7           HZ       PHE   7  -2.256  -4.757   0.626
   61    H    ASP   8           HN       ASP   8  -1.351  -2.924  -6.753
   62    HA   ASP   8           HA       ASP   8  -1.819  -3.493  -9.389
   63    HB2  ASP   8           2HB      ASP   8   0.695  -2.853  -9.681
   64    HB3  ASP   8           3HB      ASP   8  -0.434  -1.658  -9.048
   65    HA   PRO   9           HA       PRO   9  -0.235  -7.465 -10.357
   66    HB2  PRO   9           2HB      PRO   9   0.834  -7.069 -12.821
   67    HB3  PRO   9           3HB      PRO   9  -0.908  -7.094 -12.523
   68    HG2  PRO   9           2HG      PRO   9   0.927  -4.749 -12.830
   69    HG3  PRO   9           3HG      PRO   9  -0.695  -4.996 -13.502
   70    HD2  PRO   9           2HD      PRO   9  -0.244  -3.478 -11.305
   71    HD3  PRO   9           3HD      PRO   9  -1.738  -4.410 -11.531
   72    H    ARG  10           HN       ARG  10   1.852  -4.814  -9.970
   73    HA   ARG  10           HA       ARG  10   4.270  -6.418 -10.326
   74    HB2  ARG  10           2HB      ARG  10   3.757  -3.480  -9.952
   75    HB3  ARG  10           3HB      ARG  10   5.365  -4.153  -9.724
   76    HG2  ARG  10           2HG      ARG  10   5.064  -5.149 -12.070
   77    HG3  ARG  10           3HG      ARG  10   3.732  -4.001 -12.226
   78    HD2  ARG  10           2HD      ARG  10   5.547  -2.301 -11.356
   79    HD3  ARG  10           3HD      ARG  10   6.660  -3.505 -12.003
   80    HE   ARG  10           HE       ARG  10   4.797  -3.032 -13.984
   81   HH11  ARG  10          2HH1      ARG  10   7.167  -1.192 -12.218
   82   HH12  ARG  10          1HH1      ARG  10   7.461  -0.081 -13.514
   83   HH21  ARG  10          2HH2      ARG  10   5.175  -1.574 -15.698
   84   HH22  ARG  10          1HH2      ARG  10   6.327  -0.298 -15.492
   85    H    ALA  11           HN       ALA  11   2.659  -4.450  -7.843
   86    HA   ALA  11           HA       ALA  11   4.472  -4.981  -5.764
   87    HB1  ALA  11           1HB      ALA  11   2.811  -3.163  -5.719
   88    HB2  ALA  11           2HB      ALA  11   1.531  -4.361  -5.524
   89    HB3  ALA  11           3HB      ALA  11   2.755  -4.165  -4.269
   90    H    GLU  12           HN       GLU  12   1.467  -6.610  -6.717
   91    HA   GLU  12           HA       GLU  12   1.060  -8.377  -4.706
   92    HB2  GLU  12           2HB      GLU  12   0.783  -8.646  -7.672
   93    HB3  GLU  12           3HB      GLU  12   0.500 -10.052  -6.656
   94    HG2  GLU  12           2HG      GLU  12  -1.236  -8.875  -5.453
   95    HG3  GLU  12           3HG      GLU  12  -0.918  -7.412  -6.383
   96    H    LYS  13           HN       LYS  13   3.379  -8.815  -7.363
   97    HA   LYS  13           HA       LYS  13   4.380 -11.294  -6.376
   98    HB2  LYS  13           2HB      LYS  13   5.629  -9.347  -8.324
   99    HB3  LYS  13           3HB      LYS  13   6.148 -11.007  -8.061
  100    HG2  LYS  13           2HG      LYS  13   3.361 -10.342  -8.947
  101    HG3  LYS  13           3HG      LYS  13   4.690 -10.536 -10.092
  102    HD2  LYS  13           2HD      LYS  13   4.962 -12.793  -9.580
  103    HD3  LYS  13           3HD      LYS  13   4.114 -12.643  -8.039
  104    HE2  LYS  13           2HE      LYS  13   2.603 -13.756  -9.440
  105    HE3  LYS  13           3HE      LYS  13   2.048 -12.083  -9.428
  106    HZ1  LYS  13           3HZ      LYS  13   2.006 -12.830 -11.659
  107    HZ2  LYS  13           1HZ      LYS  13   3.574 -13.458 -11.566
  108    HZ3  LYS  13           2HZ      LYS  13   3.330 -11.785 -11.532
  109    H    GLU  14           HN       GLU  14   5.529  -7.942  -6.228
  110    HA   GLU  14           HA       GLU  14   7.960  -8.444  -4.926
  111    HB2  GLU  14           2HB      GLU  14   6.160  -6.022  -4.925
  112    HB3  GLU  14           3HB      GLU  14   7.736  -6.043  -4.147
  113    HG2  GLU  14           2HG      GLU  14   7.348  -6.693  -7.052
  114    HG3  GLU  14           3HG      GLU  14   7.637  -5.057  -6.464
  115    H    LEU  15           HN       LEU  15   4.705  -8.387  -3.756
  116    HA   LEU  15           HA       LEU  15   5.512  -8.203  -0.971
  117    HB2  LEU  15           2HB      LEU  15   3.460  -7.099  -1.756
  118    HB3  LEU  15           3HB      LEU  15   2.795  -8.672  -2.192
  119    HG   LEU  15           HG       LEU  15   3.239  -9.151   0.382
  120   HD11  LEU  15          1HD1      LEU  15   3.434  -7.383   1.743
  121   HD12  LEU  15          2HD1      LEU  15   2.330  -6.396   0.786
  122   HD13  LEU  15          3HD1      LEU  15   4.020  -6.547   0.305
  123   HD21  LEU  15          3HD2      LEU  15   1.078  -9.050  -1.058
  124   HD22  LEU  15          1HD2      LEU  15   0.852  -7.481  -0.285
  125   HD23  LEU  15          2HD2      LEU  15   0.961  -8.941   0.699
  126    H    GLU  16           HN       GLU  16   4.530 -10.611  -3.301
  127    HA   GLU  16           HA       GLU  16   3.989 -12.698  -1.458
  128    HB2  GLU  16           2HB      GLU  16   4.648 -12.651  -4.394
  129    HB3  GLU  16           3HB      GLU  16   4.424 -14.163  -3.525
  130    HG2  GLU  16           2HG      GLU  16   2.327 -12.052  -3.362
  131    HG3  GLU  16           3HG      GLU  16   2.440 -13.064  -4.801
  132    H    LYS  17           HN       LYS  17   6.897 -11.494  -2.968
  133    HA   LYS  17           HA       LYS  17   8.541 -13.737  -2.343
  134    HB2  LYS  17           2HB      LYS  17  10.343 -12.463  -3.149
  135    HB3  LYS  17           3HB      LYS  17   8.965 -11.922  -4.099
  136    HG2  LYS  17           2HG      LYS  17   9.862  -9.907  -3.579
  137    HG3  LYS  17           3HG      LYS  17   8.813 -10.113  -2.174
  138    HD2  LYS  17           2HD      LYS  17  10.863  -9.461  -1.259
  139    HD3  LYS  17           3HD      LYS  17  10.850 -11.215  -1.064
  140    HE2  LYS  17           2HE      LYS  17  12.051 -11.191  -3.381
  141    HE3  LYS  17           3HE      LYS  17  12.427  -9.522  -2.957
  142    HZ1  LYS  17           3HZ      LYS  17  13.764 -10.164  -1.235
  143    HZ2  LYS  17           1HZ      LYS  17  14.028 -11.452  -2.300
  144    HZ3  LYS  17           2HZ      LYS  17  12.968 -11.637  -0.995
  145    H    LEU  18           HN       LEU  18   7.385 -11.036  -0.556
  146    HA   LEU  18           HA       LEU  18   9.442 -10.905   1.396
  147    HB2  LEU  18           2HB      LEU  18   6.568 -10.019   1.395
  148    HB3  LEU  18           3HB      LEU  18   7.648  -9.754   2.762
  149    HG   LEU  18           HG       LEU  18   8.063  -8.655  -0.017
  150   HD11  LEU  18          1HD1      LEU  18   7.564  -6.475   1.125
  151   HD12  LEU  18          2HD1      LEU  18   6.961  -7.412   2.492
  152   HD13  LEU  18          3HD1      LEU  18   6.182  -7.551   0.916
  153   HD21  LEU  18          3HD2      LEU  18  10.132  -8.189   0.631
  154   HD22  LEU  18          1HD2      LEU  18   9.839  -9.001   2.169
  155   HD23  LEU  18          2HD2      LEU  18   9.502  -7.278   2.005
  156    H    ASP  19           HN       ASP  19   8.977 -11.355   3.757
  157    HA   ASP  19           HA       ASP  19   8.601 -14.105   4.140
  158    HB2  ASP  19           2HB      ASP  19   9.774 -12.283   5.629
  159    HB3  ASP  19           3HB      ASP  19   8.190 -12.175   6.393
  160    H    ARG  20           HN       ARG  20   6.883 -15.338   4.672
  161    HA   ARG  20           HA       ARG  20   4.326 -14.729   4.004
  162    HB2  ARG  20           2HB      ARG  20   5.461 -16.946   4.925
  163    HB3  ARG  20           3HB      ARG  20   4.678 -16.444   6.418
  164    HG2  ARG  20           2HG      ARG  20   3.031 -17.742   5.552
  165    HG3  ARG  20           3HG      ARG  20   2.589 -16.199   4.820
  166    HD2  ARG  20           2HD      ARG  20   3.580 -16.796   2.751
  167    HD3  ARG  20           3HD      ARG  20   4.379 -18.197   3.461
  168    HE   ARG  20           HE       ARG  20   1.590 -18.452   3.752
  169   HH11  ARG  20          2HH1      ARG  20   4.078 -18.561   1.319
  170   HH12  ARG  20          1HH1      ARG  20   3.206 -19.649   0.291
  171   HH21  ARG  20          2HH2      ARG  20   0.432 -19.884   2.406
  172   HH22  ARG  20          1HH2      ARG  20   1.132 -20.400   0.909
  173    H    GLU  21           HN       GLU  21   5.513 -14.666   7.372
  174    HA   GLU  21           HA       GLU  21   3.268 -13.584   8.561
  175    HB2  GLU  21           2HB      GLU  21   6.184 -13.235   9.262
  176    HB3  GLU  21           3HB      GLU  21   4.870 -12.682  10.291
  177    HG2  GLU  21           2HG      GLU  21   4.079 -14.927  10.586
  178    HG3  GLU  21           3HG      GLU  21   5.252 -15.535   9.418
  179    H    VAL  22           HN       VAL  22   5.870 -11.960   6.842
  180    HA   VAL  22           HA       VAL  22   5.095  -9.312   7.539
  181    HB   VAL  22           HB       VAL  22   6.718 -10.263   5.175
  182   HG11  VAL  22          1HG1      VAL  22   6.925  -8.145   4.525
  183   HG12  VAL  22          2HG1      VAL  22   5.634  -7.744   5.659
  184   HG13  VAL  22          3HG1      VAL  22   7.320  -7.618   6.161
  185   HG21  VAL  22          3HG2      VAL  22   7.860  -9.036   7.649
  186   HG22  VAL  22          1HG2      VAL  22   7.468 -10.755   7.619
  187   HG23  VAL  22          2HG2      VAL  22   8.628 -10.095   6.465
  188    H    ALA  23           HN       ALA  23   4.367 -11.451   4.828
  189    HA   ALA  23           HA       ALA  23   2.991  -9.534   3.262
  190    HB1  ALA  23           1HB      ALA  23   3.594 -12.342   3.117
  191    HB2  ALA  23           2HB      ALA  23   1.918 -12.044   2.653
  192    HB3  ALA  23           3HB      ALA  23   3.226 -11.205   1.819
  193    H    ARG  24           HN       ARG  24   1.840 -12.048   5.504
  194    HA   ARG  24           HA       ARG  24  -0.901 -11.490   5.227
  195    HB2  ARG  24           2HB      ARG  24  -1.238 -12.873   7.122
  196    HB3  ARG  24           3HB      ARG  24   0.155 -13.540   6.279
  197    HG2  ARG  24           2HG      ARG  24   1.646 -12.436   7.873
  198    HG3  ARG  24           3HG      ARG  24   0.245 -11.779   8.720
  199    HD2  ARG  24           2HD      ARG  24   0.349 -14.713   8.279
  200    HD3  ARG  24           3HD      ARG  24   1.438 -14.025   9.483
  201    HE   ARG  24           HE       ARG  24  -0.903 -12.947  10.193
  202   HH11  ARG  24          2HH1      ARG  24  -0.020 -16.219   9.399
  203   HH12  ARG  24          1HH1      ARG  24  -1.211 -16.931  10.437
  204   HH21  ARG  24          2HH2      ARG  24  -2.475 -13.871  11.563
  205   HH22  ARG  24          1HH2      ARG  24  -2.608 -15.594  11.666
  206    H    ARG  25           HN       ARG  25   1.462 -10.384   7.644
  207    HA   ARG  25           HA       ARG  25  -0.209  -8.886   9.256
  208    HB2  ARG  25           2HB      ARG  25   2.038  -9.215   9.952
  209    HB3  ARG  25           3HB      ARG  25   2.676  -8.485   8.484
  210    HG2  ARG  25           2HG      ARG  25   2.194  -6.330   9.192
  211    HG3  ARG  25           3HG      ARG  25   1.010  -6.882  10.379
  212    HD2  ARG  25           2HD      ARG  25   3.870  -7.696  10.655
  213    HD3  ARG  25           3HD      ARG  25   3.377  -6.075  11.144
  214    HE   ARG  25           HE       ARG  25   2.949  -8.457  12.587
  215   HH11  ARG  25          2HH1      ARG  25   1.346  -5.493  11.712
  216   HH12  ARG  25          1HH1      ARG  25   0.341  -5.468  13.124
  217   HH21  ARG  25          2HH2      ARG  25   1.632  -8.435  14.449
  218   HH22  ARG  25          1HH2      ARG  25   0.505  -7.141  14.680
  219    H    ILE  26           HN       ILE  26   1.556  -7.814   6.358
  220    HA   ILE  26           HA       ILE  26   0.714  -5.157   6.354
  221    HB   ILE  26           HB       ILE  26   1.422  -6.961   4.043
  222   HG12  ILE  26          2HG1      ILE  26   3.017  -4.715   5.278
  223   HG13  ILE  26          3HG1      ILE  26   3.156  -6.387   5.812
  224   HG21  ILE  26          1HG2      ILE  26   0.159  -4.415   3.978
  225   HG22  ILE  26          2HG2      ILE  26   1.811  -4.234   3.391
  226   HG23  ILE  26          3HG2      ILE  26   0.728  -5.399   2.630
  227   HD11  ILE  26          3HD1      ILE  26   3.556  -5.636   2.944
  228   HD12  ILE  26          1HD1      ILE  26   4.858  -5.503   4.125
  229   HD13  ILE  26          2HD1      ILE  26   4.112  -7.070   3.806
  230    H    LEU  27           HN       LEU  27  -0.582  -7.747   4.266
  231    HA   LEU  27           HA       LEU  27  -2.734  -6.476   3.199
  232    HB2  LEU  27           2HB      LEU  27  -2.618  -9.321   4.189
  233    HB3  LEU  27           3HB      LEU  27  -3.856  -8.685   3.107
  234    HG   LEU  27           HG       LEU  27  -0.917  -8.772   2.438
  235   HD11  LEU  27          1HD1      LEU  27  -3.070 -10.649   1.487
  236   HD12  LEU  27          2HD1      LEU  27  -1.931 -11.030   2.778
  237   HD13  LEU  27          3HD1      LEU  27  -1.342 -10.727   1.144
  238   HD21  LEU  27          3HD2      LEU  27  -2.254  -8.721   0.098
  239   HD22  LEU  27          1HD2      LEU  27  -1.665  -7.279   0.925
  240   HD23  LEU  27          2HD2      LEU  27  -3.348  -7.774   1.107
  241    H    ARG  28           HN       ARG  28  -2.686  -8.170   6.327
  242    HA   ARG  28           HA       ARG  28  -5.346  -7.722   7.039
  243    HB2  ARG  28           2HB      ARG  28  -2.839  -8.192   8.620
  244    HB3  ARG  28           3HB      ARG  28  -4.354  -7.846   9.443
  245    HG2  ARG  28           2HG      ARG  28  -5.346  -9.816   8.715
  246    HG3  ARG  28           3HG      ARG  28  -4.183 -10.028   7.404
  247    HD2  ARG  28           2HD      ARG  28  -3.381 -11.570   8.885
  248    HD3  ARG  28           3HD      ARG  28  -2.473 -10.152   9.408
  249    HE   ARG  28           HE       ARG  28  -3.514 -10.355  11.417
  250   HH11  ARG  28          2HH1      ARG  28  -5.580 -11.736   8.980
  251   HH12  ARG  28          1HH1      ARG  28  -6.800 -12.229  10.107
  252   HH21  ARG  28          2HH2      ARG  28  -5.113 -10.999  12.912
  253   HH22  ARG  28          1HH2      ARG  28  -6.534 -11.808  12.343
  254    H    PHE  29           HN       PHE  29  -2.466  -5.736   7.578
  255    HA   PHE  29           HA       PHE  29  -3.604  -3.775   9.199
  256    HB2  PHE  29           2HB      PHE  29  -1.251  -3.757   8.990
  257    HB3  PHE  29           3HB      PHE  29  -1.325  -3.706   7.232
  258    HD1  PHE  29           1HD      PHE  29  -1.994  -1.728  10.290
  259    HD2  PHE  29           2HD      PHE  29  -1.325  -1.666   6.087
  260    HE1  PHE  29           1HE      PHE  29  -1.804   0.724  10.359
  261    HE2  PHE  29           2HE      PHE  29  -1.132   0.786   6.150
  262    HZ   PHE  29           HZ       PHE  29  -1.371   1.984   8.288
  263    H    LEU  30           HN       LEU  30  -3.587  -4.124   5.695
  264    HA   LEU  30           HA       LEU  30  -4.968  -1.596   5.324
  265    HB2  LEU  30           2HB      LEU  30  -3.981  -3.722   3.445
  266    HB3  LEU  30           3HB      LEU  30  -4.976  -2.374   2.898
  267    HG   LEU  30           HG       LEU  30  -2.448  -1.814   4.387
  268   HD11  LEU  30          1HD1      LEU  30  -2.683  -2.919   1.633
  269   HD12  LEU  30          2HD1      LEU  30  -1.438  -3.181   2.854
  270   HD13  LEU  30          3HD1      LEU  30  -1.482  -1.667   1.950
  271   HD21  LEU  30          3HD2      LEU  30  -3.289   0.217   3.958
  272   HD22  LEU  30          1HD2      LEU  30  -4.381  -0.390   2.714
  273   HD23  LEU  30          2HD2      LEU  30  -2.696  -0.052   2.318
  274    H    ARG  31           HN       ARG  31  -5.719  -4.931   5.690
  275    HA   ARG  31           HA       ARG  31  -8.377  -4.646   4.532
  276    HB2  ARG  31           2HB      ARG  31  -6.700  -6.918   5.472
  277    HB3  ARG  31           3HB      ARG  31  -8.446  -7.116   5.536
  278    HG2  ARG  31           2HG      ARG  31  -8.641  -6.758   3.181
  279    HG3  ARG  31           3HG      ARG  31  -6.938  -6.314   3.060
  280    HD2  ARG  31           2HD      ARG  31  -7.026  -8.531   2.309
  281    HD3  ARG  31           3HD      ARG  31  -6.445  -8.646   3.969
  282    HE   ARG  31           HE       ARG  31  -8.983  -9.577   2.940
  283   HH11  ARG  31          2HH1      ARG  31  -7.102  -8.755   5.752
  284   HH12  ARG  31          1HH1      ARG  31  -8.067  -9.702   6.835
  285   HH21  ARG  31          2HH2      ARG  31 -10.261 -10.827   4.356
  286   HH22  ARG  31          1HH2      ARG  31  -9.863 -10.881   6.040
  287    H    GLU  32           HN       GLU  32  -6.906  -4.054   7.462
  288    HA   GLU  32           HA       GLU  32  -9.447  -4.404   8.914
  289    HB2  GLU  32           2HB      GLU  32  -6.603  -4.715   9.836
  290    HB3  GLU  32           3HB      GLU  32  -7.896  -4.383  10.980
  291    HG2  GLU  32           2HG      GLU  32  -8.255  -6.632   9.078
  292    HG3  GLU  32           3HG      GLU  32  -7.127  -6.839  10.417
  293    H    ARG  33           HN       ARG  33  -6.460  -2.612   9.618
  294    HA   ARG  33           HA       ARG  33  -7.603  -0.451  10.864
  295    HB2  ARG  33           2HB      ARG  33  -5.165  -0.354   9.078
  296    HB3  ARG  33           3HB      ARG  33  -5.565   0.784  10.358
  297    HG2  ARG  33           2HG      ARG  33  -5.248  -2.116  10.992
  298    HG3  ARG  33           3HG      ARG  33  -3.827  -1.090  10.787
  299    HD2  ARG  33           2HD      ARG  33  -4.271   0.137  12.664
  300    HD3  ARG  33           3HD      ARG  33  -6.013  -0.113  12.545
  301    HE   ARG  33           HE       ARG  33  -4.100  -1.793  13.901
  302   HH11  ARG  33          2HH1      ARG  33  -7.271  -1.584  12.480
  303   HH12  ARG  33          1HH1      ARG  33  -7.914  -2.904  13.400
  304   HH21  ARG  33          2HH2      ARG  33  -4.934  -3.532  15.119
  305   HH22  ARG  33          1HH2      ARG  33  -6.584  -4.011  14.902
  306    H    VAL  34           HN       VAL  34  -6.398  -0.277   7.511
  307    HA   VAL  34           HA       VAL  34  -7.784   2.082   6.876
  308    HB   VAL  34           HB       VAL  34  -6.883  -0.043   4.929
  309   HG11  VAL  34          1HG1      VAL  34  -8.374   2.153   4.410
  310   HG12  VAL  34          2HG1      VAL  34  -6.746   2.813   4.235
  311   HG13  VAL  34          3HG1      VAL  34  -7.247   1.428   3.263
  312   HG21  VAL  34          3HG2      VAL  34  -4.822   0.363   5.685
  313   HG22  VAL  34          1HG2      VAL  34  -4.981   1.959   4.952
  314   HG23  VAL  34          2HG2      VAL  34  -5.363   1.730   6.658
  315    H    ALA  35           HN       ALA  35  -8.732  -1.267   6.795
  316    HA   ALA  35           HA       ALA  35 -10.928  -1.087   5.052
  317    HB1  ALA  35           1HB      ALA  35 -10.442  -2.952   7.371
  318    HB2  ALA  35           2HB      ALA  35 -11.718  -3.151   6.169
  319    HB3  ALA  35           3HB      ALA  35 -10.025  -3.229   5.679
  320    H    THR  36           HN       THR  36 -10.758  -0.817   8.596
  321    HA   THR  36           HA       THR  36 -13.555  -0.159   8.810
  322    HB   THR  36           HB       THR  36 -12.514  -1.379  10.631
  323    HG1  THR  36           1HG      THR  36 -14.124  -0.156  11.444
  324   HG21  THR  36          3HG2      THR  36 -10.536   0.801  10.452
  325   HG22  THR  36          1HG2      THR  36 -10.328  -0.882  10.933
  326   HG23  THR  36          2HG2      THR  36 -10.964   0.292  12.085
  327    H    LEU  37           HN       LEU  37 -10.556   1.565   8.521
  328    HA   LEU  37           HA       LEU  37 -11.339   4.050   9.574
  329    HB2  LEU  37           2HB      LEU  37  -9.276   3.193   7.582
  330    HB3  LEU  37           3HB      LEU  37  -9.553   4.903   7.904
  331    HG   LEU  37           HG       LEU  37  -8.802   2.900  10.028
  332   HD11  LEU  37          1HD1      LEU  37  -7.177   4.231   8.013
  333   HD12  LEU  37          2HD1      LEU  37  -6.776   2.900   9.097
  334   HD13  LEU  37          3HD1      LEU  37  -6.649   4.566   9.662
  335   HD21  LEU  37          3HD2      LEU  37  -9.836   5.485  10.190
  336   HD22  LEU  37          1HD2      LEU  37  -8.106   5.659  10.486
  337   HD23  LEU  37          2HD2      LEU  37  -9.064   4.561  11.480
  338    H    GLU  38           HN       GLU  38 -12.720   5.530   8.859
  339    HA   GLU  38           HA       GLU  38 -14.351   5.180   6.630
  340    HB2  GLU  38           2HB      GLU  38 -14.545   6.763   8.727
  341    HB3  GLU  38           3HB      GLU  38 -13.793   7.934   7.652
  342    HG2  GLU  38           2HG      GLU  38 -16.309   6.422   6.999
  343    HG3  GLU  38           3HG      GLU  38 -16.275   8.030   7.718
  344    H    ASP  39           HN       ASP  39 -11.245   6.730   6.946
  345    HA   ASP  39           HA       ASP  39 -11.195   7.118   4.039
  346    HB2  ASP  39           2HB      ASP  39 -11.629   9.274   5.463
  347    HB3  ASP  39           3HB      ASP  39  -9.906   9.162   5.812
  348    HA   PRO  40           HA       PRO  40  -7.342   5.011   4.387
  349    HB2  PRO  40           2HB      PRO  40  -6.288   5.698   1.982
  350    HB3  PRO  40           3HB      PRO  40  -7.590   4.516   2.158
  351    HG2  PRO  40           2HG      PRO  40  -7.746   7.407   1.398
  352    HG3  PRO  40           3HG      PRO  40  -8.602   6.020   0.700
  353    HD2  PRO  40           2HD      PRO  40  -9.763   7.706   2.472
  354    HD3  PRO  40           3HD      PRO  40 -10.174   5.981   2.385
  355    H    ARG  41           HN       ARG  41  -7.524   8.437   3.716
  356    HA   ARG  41           HA       ARG  41  -4.784   9.055   3.841
  357    HB2  ARG  41           2HB      ARG  41  -7.243  10.696   4.450
  358    HB3  ARG  41           3HB      ARG  41  -5.616  11.364   4.474
  359    HG2  ARG  41           2HG      ARG  41  -6.516   9.910   2.042
  360    HG3  ARG  41           3HG      ARG  41  -7.136  11.535   2.341
  361    HD2  ARG  41           2HD      ARG  41  -4.649  12.147   2.723
  362    HD3  ARG  41           3HD      ARG  41  -4.318  10.641   1.870
  363    HE   ARG  41           HE       ARG  41  -4.783  11.746  -0.060
  364   HH11  ARG  41          2HH1      ARG  41  -6.496  13.316   2.532
  365   HH12  ARG  41          1HH1      ARG  41  -7.154  14.558   1.519
  366   HH21  ARG  41          2HH2      ARG  41  -5.644  13.375  -1.404
  367   HH22  ARG  41          1HH2      ARG  41  -6.670  14.590  -0.720
  368    H    SER  42           HN       SER  42  -7.060   8.219   6.281
  369    HA   SER  42           HA       SER  42  -6.184   9.472   8.546
  370    HB2  SER  42           2HB      SER  42  -8.058   7.779   8.353
  371    HB3  SER  42           3HB      SER  42  -6.829   6.519   8.460
  372    HG   SER  42           HG       SER  42  -6.831   8.526  10.403
  373    H    LEU  43           HN       LEU  43  -4.885   6.411   7.260
  374    HA   LEU  43           HA       LEU  43  -2.468   6.852   8.881
  375    HB2  LEU  43           2HB      LEU  43  -3.769   4.363   7.826
  376    HB3  LEU  43           3HB      LEU  43  -2.086   4.372   8.350
  377    HG   LEU  43           HG       LEU  43  -4.460   5.044  10.089
  378   HD11  LEU  43          1HD1      LEU  43  -2.889   2.537   9.655
  379   HD12  LEU  43          2HD1      LEU  43  -4.634   2.758   9.785
  380   HD13  LEU  43          3HD1      LEU  43  -3.622   2.874  11.224
  381   HD21  LEU  43          3HD2      LEU  43  -1.636   5.510  10.375
  382   HD22  LEU  43          1HD2      LEU  43  -2.211   4.400  11.620
  383   HD23  LEU  43          2HD2      LEU  43  -2.965   5.984  11.435
  384    H    GLY  44           HN       GLY  44  -0.823   7.672   7.774
  385    HA2  GLY  44           1HA      GLY  44   0.798   6.853   5.977
  386    HA3  GLY  44           2HA      GLY  44  -0.589   7.009   4.909
  387    H    GLU  45           HN       GLU  45   1.642   8.356   4.243
  388    HA   GLU  45           HA       GLU  45   0.878  11.143   4.779
  389    HB2  GLU  45           2HB      GLU  45   3.148  11.834   4.995
  390    HB3  GLU  45           3HB      GLU  45   2.925  10.465   6.076
  391    HG2  GLU  45           2HG      GLU  45   3.871   9.025   4.220
  392    HG3  GLU  45           3HG      GLU  45   4.344  10.531   3.434
  393    HA   PRO  46           HA       PRO  46   0.882  11.592   0.407
  394    HB2  PRO  46           2HB      PRO  46   1.335  14.262   0.217
  395    HB3  PRO  46           3HB      PRO  46  -0.207  13.585   0.753
  396    HG2  PRO  46           2HG      PRO  46   2.049  14.685   2.385
  397    HG3  PRO  46           3HG      PRO  46   0.304  14.929   2.581
  398    HD2  PRO  46           2HD      PRO  46   1.709  13.177   4.094
  399    HD3  PRO  46           3HD      PRO  46   0.013  12.905   3.645
  400    H    LEU  47           HN       LEU  47   2.531  10.743  -0.717
  401    HA   LEU  47           HA       LEU  47   5.226  10.976  -0.274
  402    HB2  LEU  47           2HB      LEU  47   4.370   9.351  -1.804
  403    HB3  LEU  47           3HB      LEU  47   3.742  10.608  -2.867
  404    HG   LEU  47           HG       LEU  47   6.681  10.472  -2.375
  405   HD11  LEU  47          1HD1      LEU  47   7.064   8.745  -3.864
  406   HD12  LEU  47          2HD1      LEU  47   5.443   8.838  -4.551
  407   HD13  LEU  47          3HD1      LEU  47   5.680   8.152  -2.944
  408   HD21  LEU  47          3HD2      LEU  47   6.616  11.159  -4.815
  409   HD22  LEU  47          1HD2      LEU  47   5.980  12.324  -3.653
  410   HD23  LEU  47          2HD2      LEU  47   4.872  11.343  -4.614
  411    H    ARG  48           HN       ARG  48   6.817  12.399  -0.744
  412    HA   ARG  48           HA       ARG  48   6.099  14.795  -2.295
  413    HB2  ARG  48           2HB      ARG  48   6.222  15.037   0.293
  414    HB3  ARG  48           3HB      ARG  48   7.962  14.944   0.054
  415    HG2  ARG  48           2HG      ARG  48   7.994  16.926  -1.221
  416    HG3  ARG  48           3HG      ARG  48   6.238  16.926  -1.399
  417    HD2  ARG  48           2HD      ARG  48   5.885  17.716   0.720
  418    HD3  ARG  48           3HD      ARG  48   7.372  17.005   1.347
  419    HE   ARG  48           HE       ARG  48   8.041  19.025  -0.476
  420   HH11  ARG  48          2HH1      ARG  48   6.603  18.644   2.671
  421   HH12  ARG  48          1HH1      ARG  48   7.121  20.196   3.240
  422   HH21  ARG  48          2HH2      ARG  48   8.729  21.071   0.261
  423   HH22  ARG  48          1HH2      ARG  48   8.330  21.576   1.868
  424    H    GLY  49           HN       GLY  49   7.693  15.660  -3.598
  425    HA2  GLY  49           1HA      GLY  49  10.422  14.851  -3.482
  426    HA3  GLY  49           2HA      GLY  49   9.562  13.970  -4.735
  427    HA   PRO  50           HA       PRO  50  11.178  17.823  -6.677
  428    HB2  PRO  50           2HB      PRO  50  11.888  16.613  -9.001
  429    HB3  PRO  50           3HB      PRO  50  12.941  16.661  -7.582
  430    HG2  PRO  50           2HG      PRO  50  11.162  14.455  -8.547
  431    HG3  PRO  50           3HG      PRO  50  12.817  14.363  -7.918
  432    HD2  PRO  50           2HD      PRO  50  10.650  13.768  -6.408
  433    HD3  PRO  50           3HD      PRO  50  12.124  14.481  -5.723
  434    H    GLU  51           HN       GLU  51   8.923  15.352  -7.680
  435    HA   GLU  51           HA       GLU  51   7.056  17.239  -8.659
  436    HB2  GLU  51           2HB      GLU  51   7.040  16.587 -11.028
  437    HB3  GLU  51           3HB      GLU  51   8.560  17.344 -10.573
  438    HG2  GLU  51           2HG      GLU  51   9.378  14.912 -10.223
  439    HG3  GLU  51           3HG      GLU  51   7.994  14.488 -11.229
  440    H    LEU  52           HN       LEU  52   5.278  16.326  -7.880
  441    HA   LEU  52           HA       LEU  52   4.675  13.560  -8.616
  442    HB2  LEU  52           2HB      LEU  52   4.023  12.942  -6.409
  443    HB3  LEU  52           3HB      LEU  52   5.670  13.566  -6.342
  444    HG   LEU  52           HG       LEU  52   4.555  14.385  -4.425
  445   HD11  LEU  52          1HD1      LEU  52   5.853  16.012  -6.013
  446   HD12  LEU  52          2HD1      LEU  52   4.989  16.629  -4.605
  447   HD13  LEU  52          3HD1      LEU  52   4.265  16.755  -6.208
  448   HD21  LEU  52          3HD2      LEU  52   2.249  14.007  -5.648
  449   HD22  LEU  52          1HD2      LEU  52   2.400  15.735  -5.968
  450   HD23  LEU  52          2HD2      LEU  52   2.402  15.143  -4.307
  451    H    GLY  53           HN       GLY  53   2.340  13.023  -8.066
  452    HA2  GLY  53           1HA      GLY  53   0.683  15.420  -8.561
  453    HA3  GLY  53           2HA      GLY  53   0.339  13.836  -9.242
  454    H    ARG  54           HN       ARG  54  -0.249  12.111  -7.734
  455    HA   ARG  54           HA       ARG  54  -1.174  12.960  -5.110
  456    HB2  ARG  54           2HB      ARG  54  -2.973  12.241  -7.384
  457    HB3  ARG  54           3HB      ARG  54  -3.429  11.745  -5.759
  458    HG2  ARG  54           2HG      ARG  54  -3.286  14.092  -5.029
  459    HG3  ARG  54           3HG      ARG  54  -2.906  14.561  -6.688
  460    HD2  ARG  54           2HD      ARG  54  -5.045  13.766  -7.454
  461    HD3  ARG  54           3HD      ARG  54  -5.415  13.110  -5.860
  462    HE   ARG  54           HE       ARG  54  -5.774  15.794  -6.720
  463   HH11  ARG  54          2HH1      ARG  54  -4.933  13.855  -3.954
  464   HH12  ARG  54          1HH1      ARG  54  -5.489  15.024  -2.802
  465   HH21  ARG  54          2HH2      ARG  54  -6.509  17.341  -5.214
  466   HH22  ARG  54          1HH2      ARG  54  -6.386  17.006  -3.520
  467    H    PHE  55           HN       PHE  55  -0.129  11.485  -3.923
  468    HA   PHE  55           HA       PHE  55  -0.759   8.674  -4.365
  469    HB2  PHE  55           2HB      PHE  55   2.072   9.720  -4.162
  470    HB3  PHE  55           3HB      PHE  55   1.624   8.019  -4.084
  471    HD1  PHE  55           1HD      PHE  55   0.244   7.128  -6.114
  472    HD2  PHE  55           2HD      PHE  55   2.649  10.640  -6.190
  473    HE1  PHE  55           1HE      PHE  55   0.378   6.980  -8.567
  474    HE2  PHE  55           2HE      PHE  55   2.785  10.498  -8.642
  475    HZ   PHE  55           HZ       PHE  55   1.648   8.667  -9.834
  476    H    TRP  56           HN       TRP  56  -0.100   7.313  -2.503
  477    HA   TRP  56           HA       TRP  56   0.171   8.831  -0.004
  478    HB2  TRP  56           2HB      TRP  56  -2.251   7.993  -0.679
  479    HB3  TRP  56           3HB      TRP  56  -1.651   6.466  -0.040
  480    HD1  TRP  56           1HD      TRP  56  -2.027   6.137   2.467
  481    HE1  TRP  56           1HE      TRP  56  -2.498   7.670   4.480
  482    HE3  TRP  56           3HE      TRP  56  -1.651  10.673   0.138
  483    HZ2  TRP  56           2HZ      TRP  56  -2.686  10.436   5.010
  484    HZ3  TRP  56           3HZ      TRP  56  -1.991  12.714   1.470
  485    HH2  TRP  56           2HH      TRP  56  -2.498  12.596   3.855
  486    H    LYS  57           HN       LYS  57   1.370   7.856   1.577
  487    HA   LYS  57           HA       LYS  57   2.475   5.198   0.944
  488    HB2  LYS  57           2HB      LYS  57   3.884   7.600   2.117
  489    HB3  LYS  57           3HB      LYS  57   4.573   5.982   2.084
  490    HG2  LYS  57           2HG      LYS  57   4.065   6.161  -0.484
  491    HG3  LYS  57           3HG      LYS  57   4.106   7.893  -0.147
  492    HD2  LYS  57           2HD      LYS  57   6.306   6.094   0.805
  493    HD3  LYS  57           3HD      LYS  57   6.292   6.703  -0.852
  494    HE2  LYS  57           2HE      LYS  57   5.966   9.016   0.244
  495    HE3  LYS  57           3HE      LYS  57   6.516   8.226   1.721
  496    HZ1  LYS  57           3HZ      LYS  57   8.021   9.047  -0.582
  497    HZ2  LYS  57           1HZ      LYS  57   8.351   7.455  -0.115
  498    HZ3  LYS  57           2HZ      LYS  57   8.548   8.719   0.992
  499    H    TYR  58           HN       TYR  58   1.983   3.721   2.414
  500    HA   TYR  58           HA       TYR  58   1.097   4.576   5.064
  501    HB2  TYR  58           2HB      TYR  58   0.928   1.907   3.652
  502    HB3  TYR  58           3HB      TYR  58   0.347   2.199   5.288
  503    HD1  TYR  58           1HD      TYR  58  -1.636   3.576   5.678
  504    HD2  TYR  58           2HD      TYR  58  -0.278   2.742   1.733
  505    HE1  TYR  58           1HE      TYR  58  -3.802   4.320   4.782
  506    HE2  TYR  58           2HE      TYR  58  -2.440   3.485   0.826
  507    HH   TYR  58           HH       TYR  58  -5.124   4.340   2.940
  508    H    ARG  59           HN       ARG  59   1.879   3.550   6.983
  509    HA   ARG  59           HA       ARG  59   4.605   2.464   6.707
  510    HB2  ARG  59           2HB      ARG  59   4.991   3.498   9.001
  511    HB3  ARG  59           3HB      ARG  59   4.878   4.612   7.646
  512    HG2  ARG  59           2HG      ARG  59   2.629   5.201   8.244
  513    HG3  ARG  59           3HG      ARG  59   2.604   3.970   9.509
  514    HD2  ARG  59           2HD      ARG  59   4.465   5.166  10.634
  515    HD3  ARG  59           3HD      ARG  59   4.341   6.433   9.413
  516    HE   ARG  59           HE       ARG  59   2.559   5.974  11.638
  517   HH11  ARG  59          2HH1      ARG  59   2.981   7.474   8.525
  518   HH12  ARG  59          1HH1      ARG  59   1.746   8.661   8.784
  519   HH21  ARG  59          2HH2      ARG  59   0.931   7.532  11.991
  520   HH22  ARG  59          1HH2      ARG  59   0.581   8.693  10.756
  521    H    VAL  60           HN       VAL  60   4.793   0.444   7.391
  522    HA   VAL  60           HA       VAL  60   3.050  -0.478   9.580
  523    HB   VAL  60           HB       VAL  60   3.702  -1.873   6.997
  524   HG11  VAL  60          1HG1      VAL  60   2.314  -3.740   8.397
  525   HG12  VAL  60          2HG1      VAL  60   4.069  -3.731   8.207
  526   HG13  VAL  60          3HG1      VAL  60   3.334  -3.052   9.660
  527   HG21  VAL  60          3HG2      VAL  60   1.485  -1.767   6.564
  528   HG22  VAL  60          1HG2      VAL  60   1.035  -1.994   8.254
  529   HG23  VAL  60          2HG2      VAL  60   1.555  -0.408   7.685
  530    H    GLY  61           HN       GLY  61   4.560  -0.382  11.194
  531    HA2  GLY  61           1HA      GLY  61   6.341  -1.048  12.480
  532    HA3  GLY  61           2HA      GLY  61   6.333  -2.521  11.520
  533    H    ASP  62           HN       ASP  62   7.730  -2.722   9.767
  534    HA   ASP  62           HA       ASP  62   9.687  -0.556   9.416
  535    HB2  ASP  62           2HB      ASP  62  11.331  -2.604   9.068
  536    HB3  ASP  62           3HB      ASP  62  11.022  -1.944  10.671
  537    H    TYR  63           HN       TYR  63   7.471  -1.065   7.769
  538    HA   TYR  63           HA       TYR  63   8.853  -1.686   5.274
  539    HB2  TYR  63           2HB      TYR  63   6.300  -3.028   6.175
  540    HB3  TYR  63           3HB      TYR  63   6.877  -3.046   4.512
  541    HD1  TYR  63           1HD      TYR  63   7.826  -4.022   7.973
  542    HD2  TYR  63           2HD      TYR  63   8.416  -4.663   3.808
  543    HE1  TYR  63           1HE      TYR  63   9.201  -5.997   8.478
  544    HE2  TYR  63           2HE      TYR  63   9.792  -6.641   4.302
  545    HH   TYR  63           HH       TYR  63   9.779  -8.296   6.874
  546    H    ARG  64           HN       ARG  64   8.185  -0.477   3.565
  547    HA   ARG  64           HA       ARG  64   6.112   1.526   4.129
  548    HB2  ARG  64           2HB      ARG  64   8.549   1.510   2.384
  549    HB3  ARG  64           3HB      ARG  64   7.224   2.608   2.023
  550    HG2  ARG  64           2HG      ARG  64   8.564   2.483   4.710
  551    HG3  ARG  64           3HG      ARG  64   9.087   3.558   3.411
  552    HD2  ARG  64           2HD      ARG  64   6.769   4.486   3.355
  553    HD3  ARG  64           3HD      ARG  64   6.404   3.520   4.784
  554    HE   ARG  64           HE       ARG  64   7.874   5.972   4.692
  555   HH11  ARG  64          2HH1      ARG  64   7.482   2.975   6.419
  556   HH12  ARG  64          1HH1      ARG  64   8.085   3.608   7.915
  557   HH21  ARG  64          2HH2      ARG  64   8.669   6.816   6.656
  558   HH22  ARG  64          1HH2      ARG  64   8.759   5.793   8.049
  559    H    LEU  65           HN       LEU  65   4.336   1.732   2.870
  560    HA   LEU  65           HA       LEU  65   4.136   0.020   0.485
  561    HB2  LEU  65           2HB      LEU  65   1.807   0.512   2.306
  562    HB3  LEU  65           3HB      LEU  65   1.994  -0.722   1.062
  563    HG   LEU  65           HG       LEU  65   3.581  -0.697   3.623
  564   HD11  LEU  65          1HD1      LEU  65   1.068  -2.239   3.000
  565   HD12  LEU  65          2HD1      LEU  65   1.181  -0.874   4.109
  566   HD13  LEU  65          3HD1      LEU  65   2.044  -2.370   4.463
  567   HD21  LEU  65          3HD2      LEU  65   4.649  -1.982   1.926
  568   HD22  LEU  65          1HD2      LEU  65   3.127  -2.738   1.455
  569   HD23  LEU  65          2HD2      LEU  65   3.852  -3.114   3.019
  570    H    ILE  66           HN       ILE  66   4.184   1.493  -1.110
  571    HA   ILE  66           HA       ILE  66   2.726   3.998  -0.846
  572    HB   ILE  66           HB       ILE  66   4.305   3.046  -3.233
  573   HG12  ILE  66          2HG1      ILE  66   5.206   4.511  -0.751
  574   HG13  ILE  66          3HG1      ILE  66   5.839   3.003  -1.403
  575   HG21  ILE  66          1HG2      ILE  66   4.011   5.900  -2.481
  576   HG22  ILE  66          2HG2      ILE  66   4.117   5.153  -4.074
  577   HG23  ILE  66          3HG2      ILE  66   2.607   5.083  -3.166
  578   HD11  ILE  66          3HD1      ILE  66   7.379   4.807  -1.820
  579   HD12  ILE  66          1HD1      ILE  66   6.702   4.233  -3.344
  580   HD13  ILE  66          2HD1      ILE  66   6.117   5.736  -2.629
  581    H    CYS  67           HN       CYS  67   0.591   3.806  -1.155
  582    HA   CYS  67           HA       CYS  67  -0.333   2.281  -3.501
  583    HB2  CYS  67           2HB      CYS  67  -2.018   2.985  -1.099
  584    HB3  CYS  67           3HB      CYS  67  -2.373   1.816  -2.365
  585    HG   CYS  67           HG       CYS  67   0.445   0.964  -0.927
  586    H    HIS  68           HN       HIS  68  -2.482   3.123  -4.361
  587    HA   HIS  68           HA       HIS  68  -2.353   6.064  -4.488
  588    HB2  HIS  68           2HB      HIS  68  -1.849   4.718  -6.595
  589    HB3  HIS  68           3HB      HIS  68  -3.551   4.267  -6.595
  590    HD2  HIS  68           2HD      HIS  68  -2.722   7.942  -5.679
  591    HE1  HIS  68           1HE      HIS  68  -4.256   7.882  -9.634
  592    HE2  HIS  68           2HE      HIS  68  -3.481   9.331  -7.725
  593    H    ILE  69           HN       ILE  69  -4.012   7.133  -3.654
  594    HA   ILE  69           HA       ILE  69  -6.428   5.688  -2.920
  595    HB   ILE  69           HB       ILE  69  -5.557   8.517  -2.320
  596   HG12  ILE  69          2HG1      ILE  69  -5.709   6.047  -0.579
  597   HG13  ILE  69          3HG1      ILE  69  -4.233   6.790  -1.183
  598   HG21  ILE  69          1HG2      ILE  69  -7.876   7.054  -1.087
  599   HG22  ILE  69          2HG2      ILE  69  -7.458   8.760  -0.940
  600   HG23  ILE  69          3HG2      ILE  69  -8.053   8.127  -2.475
  601   HD11  ILE  69          3HD1      ILE  69  -4.945   7.264   1.228
  602   HD12  ILE  69          1HD1      ILE  69  -4.437   8.623   0.226
  603   HD13  ILE  69          2HD1      ILE  69  -6.153   8.331   0.513
  604    H    GLN  70           HN       GLN  70  -7.944   5.502  -4.436
  605    HA   GLN  70           HA       GLN  70  -8.335   7.662  -6.368
  606    HB2  GLN  70           2HB      GLN  70  -9.181   4.782  -6.266
  607    HB3  GLN  70           3HB      GLN  70  -9.962   5.910  -7.367
  608    HG2  GLN  70           2HG      GLN  70  -7.609   6.459  -8.189
  609    HG3  GLN  70           3HG      GLN  70  -7.109   5.001  -7.334
  610   HE21  GLN  70          1HE2      GLN  70  -6.984   5.523 -10.158
  611   HE22  GLN  70          2HE2      GLN  70  -7.955   4.324 -10.933
  612    H    ASP  71           HN       ASP  71  -9.475   9.213  -5.277
  613    HA   ASP  71           HA       ASP  71 -11.544   8.825  -3.462
  614    HB2  ASP  71           2HB      ASP  71 -12.156  11.137  -3.871
  615    HB3  ASP  71           3HB      ASP  71 -10.400  10.991  -3.865
  616    H    ARG  72           HN       ARG  72 -11.643   9.078  -6.985
  617    HA   ARG  72           HA       ARG  72 -14.230   9.361  -7.615
  618    HB2  ARG  72           2HB      ARG  72 -12.231   7.402  -8.720
  619    HB3  ARG  72           3HB      ARG  72 -13.846   7.546  -9.401
  620    HG2  ARG  72           2HG      ARG  72 -13.423   9.933  -9.836
  621    HG3  ARG  72           3HG      ARG  72 -11.781   9.729  -9.221
  622    HD2  ARG  72           2HD      ARG  72 -12.840   8.030 -11.456
  623    HD3  ARG  72           3HD      ARG  72 -12.153   9.625 -11.762
  624    HE   ARG  72           HE       ARG  72 -10.212   8.479 -10.333
  625   HH11  ARG  72          2HH1      ARG  72 -12.066   7.306 -13.036
  626   HH12  ARG  72          1HH1      ARG  72 -10.793   6.296 -13.638
  627   HH21  ARG  72          2HH2      ARG  72  -8.529   7.154 -11.116
  628   HH22  ARG  72          1HH2      ARG  72  -8.782   6.210 -12.545
  629    H    GLU  73           HN       GLU  73 -12.878   6.130  -6.915
  630    HA   GLU  73           HA       GLU  73 -15.544   5.347  -5.932
  631    HB2  GLU  73           2HB      GLU  73 -13.583   3.881  -7.654
  632    HB3  GLU  73           3HB      GLU  73 -14.654   2.971  -6.600
  633    HG2  GLU  73           2HG      GLU  73 -16.574   4.177  -7.668
  634    HG3  GLU  73           3HG      GLU  73 -15.423   4.827  -8.833
  635    H    ALA  74           HN       ALA  74 -13.349   6.487  -4.410
  636    HA   ALA  74           HA       ALA  74 -11.922   6.027  -2.645
  637    HB1  ALA  74           1HB      ALA  74 -14.661   5.096  -2.072
  638    HB2  ALA  74           2HB      ALA  74 -13.411   4.579  -0.939
  639    HB3  ALA  74           3HB      ALA  74 -13.670   6.297  -1.243
  640    H    THR  75           HN       THR  75 -11.059   4.386  -4.574
  641    HA   THR  75           HA       THR  75 -10.797   1.748  -3.286
  642    HB   THR  75           HB       THR  75 -10.486   2.487  -6.202
  643    HG1  THR  75           1HG      THR  75 -12.447   1.091  -4.703
  644   HG21  THR  75          3HG2      THR  75 -10.551  -0.347  -5.510
  645   HG22  THR  75          1HG2      THR  75  -9.134   0.488  -4.877
  646   HG23  THR  75          2HG2      THR  75  -9.480   0.524  -6.606
  647    H    VAL  76           HN       VAL  76  -8.899   1.340  -2.380
  648    HA   VAL  76           HA       VAL  76  -6.598   3.009  -3.031
  649    HB   VAL  76           HB       VAL  76  -6.860   0.896  -0.887
  650   HG11  VAL  76          1HG1      VAL  76  -4.944   3.091  -0.565
  651   HG12  VAL  76          2HG1      VAL  76  -4.759   1.365  -0.248
  652   HG13  VAL  76          3HG1      VAL  76  -4.576   1.986  -1.889
  653   HG21  VAL  76          3HG2      VAL  76  -7.805   2.390   0.496
  654   HG22  VAL  76          1HG2      VAL  76  -6.797   3.713  -0.091
  655   HG23  VAL  76          2HG2      VAL  76  -8.245   3.245  -0.982
  656    H    LEU  77           HN       LEU  77  -5.566   2.324  -4.817
  657    HA   LEU  77           HA       LEU  77  -5.044  -0.547  -5.132
  658    HB2  LEU  77           2HB      LEU  77  -6.041   0.302  -7.076
  659    HB3  LEU  77           3HB      LEU  77  -5.059   1.765  -7.042
  660    HG   LEU  77           HG       LEU  77  -3.100   0.023  -7.426
  661   HD11  LEU  77          1HD1      LEU  77  -4.148  -2.028  -7.442
  662   HD12  LEU  77          2HD1      LEU  77  -4.098  -1.639  -9.161
  663   HD13  LEU  77          3HD1      LEU  77  -5.589  -1.407  -8.248
  664   HD21  LEU  77          3HD2      LEU  77  -4.815   0.659  -9.792
  665   HD22  LEU  77          1HD2      LEU  77  -3.059   0.709  -9.634
  666   HD23  LEU  77          2HD2      LEU  77  -4.048   1.956  -8.874
  667    H    VAL  78           HN       VAL  78  -3.163  -1.221  -4.358
  668    HA   VAL  78           HA       VAL  78  -1.036   0.373  -3.553
  669    HB   VAL  78           HB       VAL  78  -0.723  -2.472  -4.500
  670   HG11  VAL  78          1HG1      VAL  78   0.837  -0.598  -2.822
  671   HG12  VAL  78          2HG1      VAL  78   0.788  -2.286  -2.308
  672   HG13  VAL  78          3HG1      VAL  78   1.385  -1.868  -3.915
  673   HG21  VAL  78          3HG2      VAL  78  -2.363  -1.420  -2.348
  674   HG22  VAL  78          1HG2      VAL  78  -2.287  -3.049  -3.018
  675   HG23  VAL  78          2HG2      VAL  78  -1.146  -2.556  -1.767
  676    H    LEU  79           HN       LEU  79   1.111   0.595  -4.425
  677    HA   LEU  79           HA       LEU  79   1.259   0.352  -7.353
  678    HB2  LEU  79           2HB      LEU  79   2.264   2.698  -5.750
  679    HB3  LEU  79           3HB      LEU  79   2.349   2.506  -7.500
  680    HG   LEU  79           HG       LEU  79  -0.280   2.620  -6.051
  681   HD11  LEU  79          1HD1      LEU  79   0.321   5.091  -7.321
  682   HD12  LEU  79          2HD1      LEU  79   1.621   4.711  -6.192
  683   HD13  LEU  79          3HD1      LEU  79  -0.048   4.780  -5.625
  684   HD21  LEU  79          3HD2      LEU  79  -1.117   3.296  -8.218
  685   HD22  LEU  79          1HD2      LEU  79  -0.230   1.779  -8.366
  686   HD23  LEU  79          2HD2      LEU  79   0.517   3.291  -8.882
  687    H    ARG  80           HN       ARG  80   3.064   0.791  -4.333
  688    HA   ARG  80           HA       ARG  80   5.139  -0.981  -5.369
  689    HB2  ARG  80           2HB      ARG  80   5.838   1.377  -5.851
  690    HB3  ARG  80           3HB      ARG  80   5.812   1.686  -4.120
  691    HG2  ARG  80           2HG      ARG  80   8.059   1.279  -4.684
  692    HG3  ARG  80           3HG      ARG  80   7.485  -0.184  -3.881
  693    HD2  ARG  80           2HD      ARG  80   8.806  -0.744  -5.845
  694    HD3  ARG  80           3HD      ARG  80   7.126  -1.235  -6.064
  695    HE   ARG  80           HE       ARG  80   6.965   0.235  -7.809
  696   HH11  ARG  80          2HH1      ARG  80   9.784   1.017  -5.922
  697   HH12  ARG  80          1HH1      ARG  80  10.369   2.199  -7.046
  698   HH21  ARG  80          2HH2      ARG  80   7.724   1.788  -9.296
  699   HH22  ARG  80          1HH2      ARG  80   9.196   2.637  -8.965
  700    H    VAL  81           HN       VAL  81   6.134  -2.208  -3.817
  701    HA   VAL  81           HA       VAL  81   5.477  -1.663  -1.007
  702    HB   VAL  81           HB       VAL  81   5.054  -4.272  -2.456
  703   HG11  VAL  81          1HG1      VAL  81   5.662  -5.371  -0.624
  704   HG12  VAL  81          2HG1      VAL  81   5.955  -3.859   0.238
  705   HG13  VAL  81          3HG1      VAL  81   4.344  -4.578   0.239
  706   HG21  VAL  81          3HG2      VAL  81   3.199  -2.702  -0.673
  707   HG22  VAL  81          1HG2      VAL  81   3.225  -2.574  -2.432
  708   HG23  VAL  81          2HG2      VAL  81   2.801  -4.105  -1.665
  709    H    GLY  82           HN       GLY  82   7.339  -1.460   0.042
  710    HA2  GLY  82           1HA      GLY  82   9.358  -3.520  -0.168
  711    HA3  GLY  82           2HA      GLY  82   9.867  -1.951  -0.774
  712    H    HIS  83           HN       HIS  83  11.022  -3.355   1.426
  713    HA   HIS  83           HA       HIS  83  10.159  -2.574   3.941
  714    HB2  HIS  83           2HB      HIS  83  12.025  -4.177   3.433
  715    HB3  HIS  83           3HB      HIS  83  13.051  -2.789   3.085
  716    HD2  HIS  83           2HD      HIS  83  12.259  -5.006   5.988
  717    HE1  HIS  83           1HE      HIS  83  13.569  -1.350   7.696
  718    HE2  HIS  83           2HE      HIS  83  13.134  -3.797   8.101
  719    H    ALA  84           HN       ALA  84  10.770  -0.870   5.340
  720    HA   ALA  84           HA       ALA  84  10.595   1.688   4.320
  721    HB1  ALA  84           1HB      ALA  84  12.140   1.455   6.815
  722    HB2  ALA  84           2HB      ALA  84  10.674   2.371   6.465
  723    HB3  ALA  84           3HB      ALA  84  10.574   0.644   6.808
  724    H    ARG  85           HN       ARG  85  13.569   0.416   5.826
  725    HA   ARG  85           HA       ARG  85  15.387   2.259   5.194
  726    HB2  ARG  85           2HB      ARG  85  15.798  -0.705   4.755
  727    HB3  ARG  85           3HB      ARG  85  17.078   0.485   4.955
  728    HG2  ARG  85           2HG      ARG  85  15.011   0.246   7.080
  729    HG3  ARG  85           3HG      ARG  85  16.263  -0.992   6.962
  730    HD2  ARG  85           2HD      ARG  85  17.949   0.466   7.503
  731    HD3  ARG  85           3HD      ARG  85  17.078   1.869   6.884
  732    HE   ARG  85           HE       ARG  85  15.929   0.648   9.240
  733   HH11  ARG  85          2HH1      ARG  85  18.094   3.062   7.973
  734   HH12  ARG  85          1HH1      ARG  85  18.041   4.045   9.399
  735   HH21  ARG  85          2HH2      ARG  85  15.852   1.934  11.123
  736   HH22  ARG  85          1HH2      ARG  85  16.766   3.402  11.190
  737    H    ASP  86           HN       ASP  86  14.379  -0.275   2.904
  738    HA   ASP  86           HA       ASP  86  15.920   0.663   0.739
  739    HB2  ASP  86           2HB      ASP  86  14.729  -1.616   1.057
  740    HB3  ASP  86           3HB      ASP  86  13.318  -0.801   0.387
  741    H    VAL  87           HN       VAL  87  12.364   0.768   0.972
  742    HA   VAL  87           HA       VAL  87  11.845   2.537  -1.040
  743    HB   VAL  87           HB       VAL  87  10.419   2.399   1.621
  744   HG11  VAL  87          1HG1      VAL  87   9.840   3.851  -0.909
  745   HG12  VAL  87          2HG1      VAL  87   8.489   3.148  -0.017
  746   HG13  VAL  87          3HG1      VAL  87   9.543   4.328   0.762
  747   HG21  VAL  87          3HG2      VAL  87  10.424   0.246   0.587
  748   HG22  VAL  87          1HG2      VAL  87   8.830   0.957   0.329
  749   HG23  VAL  87          2HG2      VAL  87  10.010   0.935  -0.982
  750    H    TYR  88           HN       TYR  88  11.658   4.760  -1.263
  751    HA   TYR  88           HA       TYR  88  13.580   6.394  -0.238
  752    HB2  TYR  88           2HB      TYR  88  10.833   7.456  -0.867
  753    HB3  TYR  88           3HB      TYR  88  12.390   8.237  -1.120
  754    HD1  TYR  88           1HD      TYR  88  14.009   6.916  -2.762
  755    HD2  TYR  88           2HD      TYR  88   9.772   6.533  -2.697
  756    HE1  TYR  88           1HE      TYR  88  14.055   6.084  -5.076
  757    HE2  TYR  88           2HE      TYR  88   9.806   5.699  -5.011
  758    HH   TYR  88           HH       TYR  88  11.062   5.374  -6.832
  759    H    ARG  89           HN       ARG  89  13.892   7.643   1.532
  760    HA   ARG  89           HA       ARG  89  12.518   7.017   3.915
  761    HB2  ARG  89           2HB      ARG  89  13.920   8.651   4.975
  762    HB3  ARG  89           3HB      ARG  89  14.885   7.802   3.775
  763    HG2  ARG  89           2HG      ARG  89  15.033   9.631   2.395
  764    HG3  ARG  89           3HG      ARG  89  13.552  10.357   3.023
  765    HD2  ARG  89           2HD      ARG  89  14.611  11.153   4.939
  766    HD3  ARG  89           3HD      ARG  89  15.960  10.030   4.773
  767    HE   ARG  89           HE       ARG  89  17.011  11.569   3.459
  768   HH11  ARG  89          2HH1      ARG  89  13.611  12.314   3.548
  769   HH12  ARG  89          1HH1      ARG  89  13.780  13.797   2.670
  770   HH21  ARG  89          2HH2      ARG  89  17.246  13.520   2.301
  771   HH22  ARG  89          1HH2      ARG  89  15.848  14.482   1.960