*HEADER    METAL BINDING PROTEIN                   30-SEP-11   2LJX              
*TITLE     STRUCTURE OF THE MONOMERIC N-TERMINAL DOMAIN OF HPV16 E6 ONCOPROTEIN  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEIN E6;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZINC FINGER CONTAINING RESIDUES 7-89;                      
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HUMAN PAPILLOMAVIRUS;                           
*SOURCE   3 ORGANISM_TAXID: 333760;                                              
*SOURCE   4 STRAIN: TYPE 16;                                                     
*SOURCE   5 GENE: E6;                                                            
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 511693;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PETM41                                     
*KEYWDS    METAL BINDING PROTEIN                                                 
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    K.ZANIER, A.MUHAMED SIDI, C.BOULADE-LADAME, V.RYBIN, A.CHAPPELLE,     
*AUTHOR   2 A.ATKINSON, B.KIEFFER, G.TRAVE                                       
*REVDAT   1   04-APR-12 2LJX    0                                                


assign  ((resid   12 and name HN   )) ((resid   45 and name HD*  ))   4.88  3.08  0.00 ! #SUP  5.18
assign  ((resid   12 and name HN   )) ((resid   45 and name HE*  ))   4.79  2.99  0.00 ! #SUP  4.17
assign  ((resid   11 and name HA   )) ((resid   12 and name HN   ))   3.26  1.46  0.00 ! #SUP  6.39
assign  ((resid   12 and name HN   )) ((resid   13 and name HD1  ))   4.10  2.30  0.00 ! #SUP  7.08
assign  ((resid   12 and name HN   )) ((resid   12 and name HB*  ))   3.40  1.60  0.00 ! #SUP  7.53
assign  ((resid   12 and name HN   )) ((resid   12 and name HG   ))   4.28  2.48  0.00 ! #SUP  6.43
assign  ((resid   12 and name HN   )) ((resid   12 and name HD2* ))   4.78  2.98  0.00 ! #SUP  6.64
assign  ((resid   12 and name HN   )) ((resid   52 and name HD1* ))   5.12  3.32  0.00 ! #SUP  2.57
assign  ((resid   38 and name HN   )) ((resid   41 and name HN   ))   4.33  2.53  0.00 ! #SUP  8.95
assign  ((resid   37 and name HG   )) ((resid   38 and name HN   ))   4.22  2.42  0.00 ! #SUP  7.66
assign  ((resid   38 and name HN   )) ((resid   41 and name HB2  ))   4.09  2.29  0.00 ! #SUP  6.20
assign  ((resid   38 and name HN   )) ((resid   41 and name HG2  ))   4.97  3.17  0.00 ! #SUP  6.73
assign  ((resid   38 and name HN   )) ((resid   41 and name HG1  ))   4.67  2.87  0.00 ! #SUP  6.53
assign  ((resid   38 and name HN   )) ((resid   41 and name HB1  ))   4.28  2.48  0.00 ! #SUP  5.02
assign  ((resid   38 and name HN   )) ((resid   38 and name HB2  ))   3.54  1.74  0.00 ! #SUP  7.07
assign  ((resid   38 and name HN   )) ((resid   38 and name HB1  ))   3.67  1.87  0.00 ! #SUP  7.77
assign  ((resid   37 and name HB1  )) ((resid   38 and name HN   ))   4.45  2.65  0.00 ! #SUP  8.40
assign  ((resid   38 and name HN   )) ((resid   42 and name HG2* ))   5.21  3.41  0.00 ! #SUP  5.15
assign  ((resid   37 and name HD2* )) ((resid   38 and name HN   ))   4.53  2.73  0.00 ! #SUP  7.82
assign  ((resid   62 and name HB   )) ((resid   63 and name HN   ))   4.63  2.83  0.00 ! #SUP  5.66
assign  ((resid   62 and name HN   )) ((resid   63 and name HN   ))   4.63  2.83  0.00 ! #SUP  5.66
assign  ((resid   62 and name HA   )) ((resid   63 and name HN   ))   2.93  1.13  0.00 ! #SUP  6.07
assign  ((resid   30 and name HA   )) ((resid   63 and name HN   ))   3.98  2.18  0.00 ! #SUP  2.85
assign  ((resid   63 and name HN   )) ((resid   63 and name HB2  ))   3.86  2.06  0.00 ! #SUP  5.37
assign  ((resid   63 and name HN   )) ((resid   66 and name HB2  ))   4.51  2.71  0.00 ! #SUP  2.00
assign  ((resid   63 and name HN   )) ((resid   66 and name HB1  ))   4.12  2.32  0.00 ! #SUP  3.87
assign  ((resid   63 and name HN   )) ((resid   64 and name HN   ))   4.71  2.91  0.00 ! #SUP  4.71
assign  ((resid   63 and name HB2  )) ((resid   64 and name HN   ))   3.30  1.50  0.00 ! #SUP  5.79
assign  ((resid   64 and name HN   )) ((resid   64 and name HB2  ))   3.13  1.33  0.00 ! #SUP  4.93
assign  ((resid   64 and name HN   )) ((resid   64 and name HB1  ))   3.03  1.23  0.00 ! #SUP  4.93
assign  ((resid   41 and name HG1  )) ((resid   64 and name HN   ))   4.83  3.03  0.00 ! #SUP  0.75
assign  ((resid   37 and name HD1* )) ((resid   64 and name HN   ))   5.16  3.36  0.00 ! #SUP  5.91
assign  ((resid   23 and name HN   )) ((resid   25 and name HN   ))   4.60  2.80  0.00 ! #SUP  6.49
assign  ((resid   22 and name HA   )) ((resid   23 and name HN   ))   2.98  1.18  0.00 ! #SUP  5.54
assign  ((resid   22 and name HB   )) ((resid   23 and name HN   ))   3.10  1.30  0.00 ! #SUP  8.65
assign  ((resid   16 and name HB1  )) ((resid   23 and name HN   ))   4.66  2.86  0.00 ! #SUP  2.00
assign  ((resid   23 and name HN   )) ((resid   23 and name HB   ))   3.15  1.35  0.00 ! #SUP  8.49
assign  ((resid   22 and name HG2* )) ((resid   23 and name HN   ))   3.90  2.10  0.00 ! #SUP  7.18
assign  ((resid   23 and name HN   )) ((resid   23 and name HG12 ))   3.76  1.96  0.00 ! #SUP  8.25
assign  ((resid   38 and name HA   )) ((resid   39 and name HN   ))   3.58  1.78  0.00 ! #SUP  4.34
assign  ((resid   39 and name HN   )) ((resid   39 and name HB2  ))   4.12  2.32  0.00 ! #SUP  5.17
assign  ((resid   39 and name HN   )) ((resid   39 and name HB1  ))   4.08  2.28  0.00 ! #SUP  5.17
assign  ((resid   38 and name HB1  )) ((resid   39 and name HN   ))   4.60  2.80  0.00 ! #SUP  6.08
assign  ((resid   38 and name HD2* )) ((resid   39 and name HN   ))   4.31  2.51  0.00 ! #SUP  6.37
assign  ((resid   36 and name HG1  )) ((resid   37 and name HN   ))   4.41  2.61  0.00 ! #SUP  6.81
assign  ((resid   37 and name HN   )) ((resid   37 and name HG   ))   4.72  2.92  0.00 ! #SUP  6.85
assign  ((resid   54 and name HD*  )) ((resid   55 and name HN   ))   4.18  2.38  0.00 ! #SUP  5.96
assign  ((resid   36 and name HA   )) ((resid   37 and name HN   ))   2.90  1.10  0.00 ! #SUP  7.30
assign  ((resid   55 and name HN   )) ((resid   59 and name HA   ))   4.05  2.25  0.00 ! #SUP  6.47
assign  ((resid   54 and name HB1  )) ((resid   55 and name HN   ))   3.86  2.06  0.00 ! #SUP  5.52
assign  ((resid   36 and name HG2  )) ((resid   37 and name HN   ))   4.32  2.52  0.00 ! #SUP  7.27
assign  ((resid   37 and name HN   )) ((resid   37 and name HB2  ))   3.15  1.35  0.00 ! #SUP  6.53
assign  ((resid   37 and name HN   )) ((resid   37 and name HB1  ))   3.27  1.47  0.00 ! #SUP  7.21
assign  ((resid   31 and name HN   )) ((resid   63 and name HN   ))   5.33  3.53  0.00 ! #SUP  2.00
assign  ((resid   54 and name HN   )) ((resid   55 and name HN   ))   4.49  2.69  0.00 ! #SUP  6.05
assign  ((resid   31 and name HN   )) ((resid   32 and name HN   ))   3.69  1.89  0.00 ! #SUP  7.03
assign  ((resid   28 and name HN   )) ((resid   29 and name HN   ))   4.41  2.61  0.00 ! #SUP  7.98
assign  ((resid   31 and name HN   )) ((resid   32 and name HD*  ))   4.80  3.00  0.00 ! #SUP  5.35
assign  ((resid   55 and name HN   )) ((resid   60 and name HD*  ))   3.26  1.46  0.00 ! #SUP  4.30
assign  ((resid   30 and name HA   )) ((resid   31 and name HN   ))   3.10  1.30  0.00 ! #SUP  5.43
assign  ((resid   31 and name HN   )) ((resid   31 and name HG2* ))   4.45  2.65  0.00 ! #SUP  5.33
assign  ((resid   31 and name HN   )) ((resid   31 and name HG1* ))   3.78  1.98  0.00 ! #SUP  7.52
assign  ((resid   29 and name HN   )) ((resid   29 and name HB1  ))   3.89  2.09  0.00 ! #SUP  7.14
assign  ((resid   28 and name HB1  )) ((resid   29 and name HN   ))   3.68  1.88  0.00 ! #SUP  7.82
assign  ((resid   27 and name HG2* )) ((resid   29 and name HN   ))   5.07  3.27  0.00 ! #SUP  4.16
assign  ((resid   28 and name HG   )) ((resid   29 and name HN   ))   4.57  2.77  0.00 ! #SUP  7.05
assign  ((resid   57 and name HN   )) ((resid   58 and name HN   ))   3.52  1.72  0.00 ! #SUP  4.35
assign  ((resid   56 and name HB2  )) ((resid   57 and name HN   ))   4.55  2.75  0.00 ! #SUP  3.38
assign  ((resid   10 and name HN   )) ((resid   11 and name HN   ))   3.54  1.74  0.00 ! #SUP  7.31
assign  ((resid    9 and name HB2  )) ((resid   10 and name HN   ))   4.24  2.44  0.00 ! #SUP  4.78
assign  ((resid    9 and name HA   )) ((resid   10 and name HN   ))   2.77  0.97  0.00 ! #SUP  5.52
assign  ((resid   10 and name HN   )) ((resid   11 and name HG1  ))   4.31  2.51  0.00 ! #SUP  4.14
assign  ((resid   66 and name HN   )) ((resid   67 and name HN   ))   3.90  2.10  0.00 ! #SUP  6.61
assign  ((resid   54 and name HN   )) ((resid   54 and name HD*  ))   3.27  1.47  0.00 ! #SUP  8.12
assign  ((resid   54 and name HN   )) ((resid   54 and name HE*  ))   4.41  2.61  0.00 ! #SUP  6.04
assign  ((resid   66 and name HN   )) ((resid   66 and name HB1  ))   3.60  1.80  0.00 ! #SUP  4.45
assign  ((resid   54 and name HN   )) ((resid   54 and name HB2  ))   3.48  1.68  0.00 ! #SUP  6.83
assign  ((resid   54 and name HN   )) ((resid   54 and name HB1  ))   3.66  1.86  0.00 ! #SUP  6.83
assign  ((resid   65 and name HB2  )) ((resid   66 and name HN   ))   3.55  1.75  0.00 ! #SUP  5.88
assign  ((resid    9 and name HB1  )) ((resid   10 and name HN   ))   3.61  1.81  0.00 ! #SUP  5.28
assign  ((resid   53 and name HG*  )) ((resid   54 and name HN   ))   3.58  1.78  0.00 ! #SUP  7.27
assign  ((resid   54 and name HN   )) ((resid   59 and name HA   ))   4.72  2.92  0.00 ! #SUP  3.71
assign  ((resid   66 and name HN   )) ((resid   66 and name HB2  ))   3.89  2.09  0.00 ! #SUP  4.17
assign  ((resid   22 and name HN   )) ((resid   23 and name HN   ))   4.73  2.93  0.00 ! #SUP  6.34
assign  ((resid   21 and name HB   )) ((resid   22 and name HN   ))   3.80  2.00  0.00 ! #SUP  3.20
assign  ((resid   22 and name HN   )) ((resid   25 and name HB2  ))   3.74  1.94  0.00 ! #SUP  5.57
assign  ((resid   22 and name HN   )) ((resid   26 and name HN   ))   4.41  2.61  0.00 ! #SUP  5.27
assign  ((resid   22 and name HN   )) ((resid   25 and name HN   ))   4.11  2.31  0.00 ! #SUP  8.53
assign  ((resid   21 and name HA   )) ((resid   22 and name HN   ))   3.09  1.29  0.00 ! #SUP  3.21
assign  ((resid   22 and name HN   )) ((resid   25 and name HB1  ))   3.65  1.85  0.00 ! #SUP  2.72
assign  ((resid   21 and name HG2* )) ((resid   22 and name HN   ))   3.48  1.68  0.00 ! #SUP  3.39
assign  ((resid   36 and name HN   )) ((resid   37 and name HN   ))   4.45  2.65  0.00 ! #SUP  6.91
assign  ((resid   29 and name HA   )) ((resid   36 and name HN   ))   4.51  2.71  0.00 ! #SUP  4.26
assign  ((resid   35 and name HA   )) ((resid   36 and name HN   ))   2.60  0.80  0.00 ! #SUP  6.82
assign  ((resid   36 and name HN   )) ((resid   36 and name HG2  ))   4.49  2.69  0.00 ! #SUP  7.89
assign  ((resid   35 and name HB2  )) ((resid   36 and name HN   ))   3.81  2.01  0.00 ! #SUP  5.98
assign  ((resid   36 and name HN   )) ((resid   36 and name HB1  ))   3.15  1.35  0.00 ! #SUP  6.31
assign  ((resid   39 and name HN   )) ((resid   40 and name HN   ))   4.73  2.93  0.00 ! #SUP  7.37
assign  ((resid   40 and name HN   )) ((resid   40 and name HD*  ))   4.22  2.42  0.00 ! #SUP  6.27
assign  ((resid   38 and name HB1  )) ((resid   40 and name HN   ))   4.64  2.84  0.00 ! #SUP  5.27
assign  ((resid   38 and name HD2* )) ((resid   40 and name HN   ))   4.29  2.49  0.00 ! #SUP  7.52
assign  ((resid   40 and name HN   )) ((resid   41 and name HN   ))   3.23  1.43  0.00 ! #SUP  7.95
assign  ((resid   32 and name HN   )) ((resid   34 and name HN   ))   4.10  2.30  0.00 ! #SUP  2.61
assign  ((resid   32 and name HN   )) ((resid   32 and name HB2  ))   3.61  1.81  0.00 ! #SUP  6.67
assign  ((resid   53 and name HG*  )) ((resid   60 and name HN   ))   4.77  2.97  0.00 ! #SUP  8.42
assign  ((resid   31 and name HG2* )) ((resid   32 and name HN   ))   4.65  2.85  0.00 ! #SUP  5.96
assign  ((resid   31 and name HG1* )) ((resid   32 and name HN   ))   3.71  1.91  0.00 ! #SUP  9.05
assign  ((resid   54 and name HA   )) ((resid   60 and name HN   ))   3.91  2.11  0.00 ! #SUP  4.49
assign  ((resid   59 and name HB1  )) ((resid   60 and name HN   ))   4.01  2.21  0.00 ! #SUP  4.86
assign  ((resid   44 and name HN   )) ((resid   45 and name HN   ))   3.37  1.57  0.00 ! #SUP  6.42
assign  ((resid   43 and name HN   )) ((resid   44 and name HN   ))   3.39  1.59  0.00 ! #SUP  8.66
assign  ((resid   43 and name HD*  )) ((resid   44 and name HN   ))   4.45  2.65  0.00 ! #SUP  6.31
assign  ((resid   42 and name HA   )) ((resid   44 and name HN   ))   4.42  2.62  0.00 ! #SUP  5.95
assign  ((resid   43 and name HB*  )) ((resid   44 and name HN   ))   3.22  1.42  0.00 ! #SUP  6.20
assign  ((resid   44 and name HN   )) ((resid   44 and name HB2  ))   3.03  1.23  0.00 ! #SUP  5.80
assign  ((resid   44 and name HN   )) ((resid   44 and name HB1  ))   3.37  1.57  0.00 ! #SUP  5.02
assign  ((resid   28 and name HN   )) ((resid   42 and name HG1* ))   4.27  2.47  0.00 ! #SUP  1.39
assign  ((resid   45 and name HN   )) ((resid   47 and name HN   ))   4.03  2.23  0.00 ! #SUP  3.25
assign  ((resid   46 and name HN   )) ((resid   47 and name HN   ))   3.40  1.60  0.00 ! #SUP  7.14
assign  ((resid   47 and name HN   )) ((resid   47 and name HG2  ))   4.31  2.51  0.00 ! #SUP  6.57
assign  ((resid   28 and name HN   )) ((resid   28 and name HD1* ))   4.46  2.66  0.00 ! #SUP  8.09
assign  ((resid   51 and name HA   )) ((resid   52 and name HN   ))   3.13  1.33  0.00 ! #SUP  5.61
assign  ((resid   51 and name HB2  )) ((resid   52 and name HN   ))   4.16  2.36  0.00 ! #SUP  5.70
assign  ((resid   52 and name HN   )) ((resid   52 and name HG12 ))   4.04  2.24  0.00 ! #SUP  6.45
assign  ((resid   52 and name HN   )) ((resid   52 and name HG11 ))   4.06  2.26  0.00 ! #SUP  5.98
assign  ((resid    6 and name HN   )) ((resid    7 and name HN   ))   3.24  1.44  0.00 ! #SUP  5.03
assign  ((resid    5 and name HD2  )) ((resid    6 and name HN   ))   4.13  2.33  0.00 ! #SUP  8.16
assign  ((resid    5 and name HD1  )) ((resid    6 and name HN   ))   3.79  1.99  0.00 ! #SUP  8.15
assign  ((resid    5 and name HB1  )) ((resid    6 and name HN   ))   3.68  1.88  0.00 ! #SUP  6.71
assign  ((resid    3 and name HA   )) ((resid    4 and name HN   ))   2.85  1.05  0.00 ! #SUP  4.62
assign  ((resid    4 and name HN   )) ((resid    4 and name HB2  ))   3.51  1.71  0.00 ! #SUP  3.84
assign  ((resid    4 and name HN   )) ((resid    4 and name HB1  ))   3.16  1.36  0.00 ! #SUP  3.41
assign  ((resid    5 and name HB2  )) ((resid    6 and name HN   ))   4.01  2.21  0.00 ! #SUP  7.55
assign  ((resid   15 and name HN   )) ((resid   16 and name HN   ))   3.38  1.58  0.00 ! #SUP  10.00
assign  ((resid   16 and name HN   )) ((resid   16 and name HB2  ))   3.34  1.54  0.00 ! #SUP  6.33
assign  ((resid   16 and name HN   )) ((resid   16 and name HB1  ))   3.60  1.80  0.00 ! #SUP  5.63
assign  ((resid    1 and name HN   )) ((resid    1 and name HG2  ))   4.90  3.10  0.00 ! #SUP  4.69
assign  ((resid   15 and name HB2  )) ((resid   16 and name HN   ))   3.67  1.87  0.00 ! #SUP  7.51
assign  ((resid   15 and name HB1  )) ((resid   16 and name HN   ))   3.91  2.11  0.00 ! #SUP  8.42
assign  ((resid   15 and name HG   )) ((resid   16 and name HN   ))   3.99  2.19  0.00 ! #SUP  8.10
assign  ((resid    1 and name HA   )) ((resid    2 and name HN   ))   2.86  1.06  0.00 ! #SUP  4.85
assign  ((resid    2 and name HN   )) ((resid    2 and name HB2  ))   4.10  2.30  0.00 ! #SUP  4.84
assign  ((resid    1 and name HN   )) ((resid    1 and name HB2  ))   3.62  1.82  0.00 ! #SUP  3.96
assign  ((resid    1 and name HN   )) ((resid    1 and name HB1  ))   4.03  2.23  0.00 ! #SUP  4.11
assign  ((resid    0 and name HB*  )) ((resid    1 and name HN   ))   4.33  2.53  0.00 ! #SUP  2.29
assign  ((resid   64 and name HN   )) ((resid   65 and name HN   ))   3.37  1.57  0.00 ! #SUP  7.82
assign  ((resid   65 and name HN   )) ((resid   66 and name HN   ))   3.28  1.48  0.00 ! #SUP  7.51
assign  ((resid   65 and name HN   )) ((resid   67 and name HN   ))   4.47  2.67  0.00 ! #SUP  1.93
assign  ((resid   63 and name HB2  )) ((resid   65 and name HN   ))   4.40  2.60  0.00 ! #SUP  3.37
assign  ((resid   64 and name HB1  )) ((resid   65 and name HN   ))   3.32  1.52  0.00 ! #SUP  6.84
assign  ((resid   65 and name HN   )) ((resid   65 and name HG2  ))   3.50  1.70  0.00 ! #SUP  7.86
assign  ((resid   65 and name HN   )) ((resid   65 and name HG1  ))   3.90  2.10  0.00 ! #SUP  9.14
assign  ((resid   43 and name HN   )) ((resid   45 and name HN   ))   4.40  2.60  0.00 ! #SUP  4.59
assign  ((resid   45 and name HN   )) ((resid   46 and name HN   ))   3.30  1.50  0.00 ! #SUP  5.87
assign  ((resid   41 and name HA   )) ((resid   45 and name HN   ))   5.37  3.57  0.00 ! #SUP  3.65
assign  ((resid   45 and name HN   )) ((resid   45 and name HB1  ))   3.22  1.42  0.00 ! #SUP  6.53
assign  ((resid   45 and name HN   )) ((resid   50 and name HD2* ))   4.95  3.15  0.00 ! #SUP  2.07
assign  ((resid   33 and name HB2  )) ((resid   35 and name HN   ))   4.57  2.77  0.00 ! #SUP  5.58
assign  ((resid   70 and name HN   )) ((resid   70 and name HB2  ))   3.99  2.19  0.00 ! #SUP  4.84
assign  ((resid   35 and name HN   )) ((resid   35 and name HB1  ))   3.41  1.61  0.00 ! #SUP  5.64
assign  ((resid   30 and name HN   )) ((resid   37 and name HN   ))   3.93  2.13  0.00 ! #SUP  4.89
assign  ((resid   35 and name HN   )) ((resid   36 and name HN   ))   4.40  2.60  0.00 ! #SUP  6.63
assign  ((resid   29 and name HA   )) ((resid   30 and name HN   ))   3.06  1.26  0.00 ! #SUP  4.91
assign  ((resid   30 and name HN   )) ((resid   30 and name HB2  ))   3.10  1.30  0.00 ! #SUP  4.19
assign  ((resid   35 and name HN   )) ((resid   35 and name HB2  ))   3.28  1.48  0.00 ! #SUP  5.29
assign  ((resid   27 and name HN   )) ((resid   27 and name HG11 ))   3.86  2.06  0.00 ! #SUP  7.82
assign  ((resid   74 and name HA   )) ((resid   75 and name HN   ))   3.35  1.55  0.00 ! #SUP  2.39
assign  ((resid   26 and name HA   )) ((resid   27 and name HN   ))   2.71  0.91  0.00 ! #SUP  8.57
assign  ((resid   27 and name HN   )) ((resid   27 and name HB   ))   3.17  1.37  0.00 ! #SUP  8.06
assign  ((resid   26 and name HG12 )) ((resid   27 and name HN   ))   3.38  1.58  0.00 ! #SUP  7.56
assign  ((resid   26 and name HG11 )) ((resid   27 and name HN   ))   3.59  1.79  0.00 ! #SUP  8.67
assign  ((resid    3 and name HN   )) ((resid    4 and name HN   ))   4.60  2.80  0.00 ! #SUP  4.48
assign  ((resid   19 and name HN   )) ((resid   21 and name HN   ))   4.31  2.51  0.00 ! #SUP  4.88
assign  ((resid    2 and name HD*  )) ((resid    3 and name HN   ))   4.81  3.01  0.00 ! #SUP  5.52
assign  ((resid    2 and name HA   )) ((resid    3 and name HN   ))   3.09  1.29  0.00 ! #SUP  5.52
assign  ((resid   21 and name HN   )) ((resid   21 and name HB   ))   3.53  1.73  0.00 ! #SUP  4.26
assign  ((resid   16 and name HA   )) ((resid   21 and name HN   ))   3.90  2.10  0.00 ! #SUP  1.07
assign  ((resid    3 and name HN   )) ((resid    3 and name HG*  ))   3.83  2.03  0.00 ! #SUP  5.98
assign  ((resid    3 and name HN   )) ((resid    3 and name HB2  ))   3.76  1.96  0.00 ! #SUP  4.57
assign  ((resid    3 and name HN   )) ((resid    3 and name HB1  ))   3.27  1.47  0.00 ! #SUP  4.33
assign  ((resid   53 and name HN   )) ((resid   60 and name HN   ))   3.97  2.17  0.00 ! #SUP  6.14
assign  ((resid   52 and name HA   )) ((resid   53 and name HN   ))   2.96  1.16  0.00 ! #SUP  5.39
assign  ((resid   53 and name HN   )) ((resid   53 and name HB   ))   3.67  1.87  0.00 ! #SUP  5.77
assign  ((resid   55 and name HN   )) ((resid   58 and name HN   ))   3.57  1.77  0.00 ! #SUP  3.74
assign  ((resid   58 and name HN   )) ((resid   58 and name HD21 ))   4.59  2.79  0.00 ! #SUP  6.61
assign  ((resid   54 and name HD*  )) ((resid   58 and name HN   ))   4.22  2.42  0.00 ! #SUP  5.70
assign  ((resid   30 and name HB2  )) ((resid   33 and name HN   ))   4.02  2.22  0.00 ! #SUP  3.29
assign  ((resid   32 and name HN   )) ((resid   33 and name HN   ))   3.20  1.40  0.00 ! #SUP  8.85
assign  ((resid   33 and name HN   )) ((resid   35 and name HN   ))   4.65  2.85  0.00 ! #SUP  3.75
assign  ((resid   33 and name HN   )) ((resid   34 and name HN   ))   3.15  1.35  0.00 ! #SUP  7.58
assign  ((resid   33 and name HN   )) ((resid   33 and name HB2  ))   3.83  2.03  0.00 ! #SUP  5.39
assign  ((resid   30 and name HB1  )) ((resid   33 and name HN   ))   3.51  1.71  0.00 ! #SUP  4.33
assign  ((resid   31 and name HG1* )) ((resid   33 and name HN   ))   5.05  3.25  0.00 ! #SUP  6.91
assign  ((resid   51 and name HN   )) ((resid   51 and name HB2  ))   4.12  2.32  0.00 ! #SUP  4.14
assign  ((resid   50 and name HB1  )) ((resid   51 and name HN   ))   4.27  2.47  0.00 ! #SUP  5.76
assign  ((resid   29 and name HN   )) ((resid   61 and name HN   ))   3.90  2.10  0.00 ! #SUP  7.38
assign  ((resid   60 and name HN   )) ((resid   61 and name HN   ))   4.68  2.88  0.00 ! #SUP  4.93
assign  ((resid   14 and name HN   )) ((resid   15 and name HN   ))   3.35  1.55  0.00 ! #SUP  8.67
assign  ((resid   14 and name HA   )) ((resid   15 and name HN   ))   3.58  1.78  0.00 ! #SUP  7.69
assign  ((resid   60 and name HB2  )) ((resid   61 and name HN   ))   3.46  1.66  0.00 ! #SUP  5.58
assign  ((resid    9 and name HG*  )) ((resid   15 and name HN   ))   4.38  2.58  0.00 ! #SUP  4.66
assign  ((resid   15 and name HN   )) ((resid   15 and name HB1  ))   3.33  1.53  0.00 ! #SUP  8.51
assign  ((resid   19 and name HN   )) ((resid   20 and name HN   ))   3.06  1.26  0.00 ! #SUP  8.84
assign  ((resid   16 and name HA   )) ((resid   19 and name HN   ))   3.78  1.98  0.00 ! #SUP  4.95
assign  ((resid   18 and name HN   )) ((resid   18 and name HG1  ))   3.50  1.70  0.00 ! #SUP  6.88
assign  ((resid   18 and name HN   )) ((resid   18 and name HB2  ))   3.09  1.29  0.00 ! #SUP  6.59
assign  ((resid   76 and name HN   )) ((resid   76 and name HD*  ))   4.25  2.45  0.00 ! #SUP  4.16
assign  ((resid   78 and name HB2  )) ((resid   79 and name HN   ))   4.71  2.91  0.00 ! #SUP  3.15
assign  ((resid   76 and name HN   )) ((resid   76 and name HB2  ))   3.63  1.83  0.00 ! #SUP  4.02
assign  ((resid   48 and name HD1  )) ((resid   49 and name HN   ))   5.50  3.70  0.00 ! #SUP  8.91
assign  ((resid   47 and name HN   )) ((resid   48 and name HN   ))   3.45  1.65  0.00 ! #SUP  9.43
assign  ((resid   46 and name HA   )) ((resid   48 and name HN   ))   3.84  2.04  0.00 ! #SUP  3.79
assign  ((resid   49 and name HN   )) ((resid   49 and name HB2  ))   3.73  1.93  0.00 ! #SUP  5.60
assign  ((resid   49 and name HN   )) ((resid   49 and name HB1  ))   3.66  1.86  0.00 ! #SUP  5.60
assign  ((resid   48 and name HB2  )) ((resid   49 and name HN   ))   3.19  1.39  0.00 ! #SUP  10.00
assign  ((resid   46 and name HB*  )) ((resid   48 and name HN   ))   4.34  2.54  0.00 ! #SUP  4.07
assign  ((resid   48 and name HB1  )) ((resid   49 and name HN   ))   3.39  1.59  0.00 ! #SUP  8.86
assign  ((resid   46 and name HN   )) ((resid   48 and name HN   ))   3.98  2.18  0.00 ! #SUP  4.72
assign  ((resid   44 and name HA   )) ((resid   48 and name HN   ))   4.41  2.61  0.00 ! #SUP  2.39
assign  ((resid   45 and name HA   )) ((resid   48 and name HN   ))   4.20  2.40  0.00 ! #SUP  2.06
assign  ((resid   48 and name HD2  )) ((resid   49 and name HN   ))   4.65  2.85  0.00 ! #SUP  9.20
assign  ((resid    7 and name HN   )) ((resid    7 and name HB2  ))   3.15  1.35  0.00 ! #SUP  5.38
assign  ((resid    7 and name HN   )) ((resid    7 and name HB1  ))   3.19  1.39  0.00 ! #SUP  5.63
assign  ((resid    7 and name HN   )) ((resid    8 and name HN   ))   3.55  1.75  0.00 ! #SUP  6.27
assign  ((resid    6 and name HA   )) ((resid    7 and name HN   ))   3.19  1.39  0.00 ! #SUP  5.43
assign  ((resid    7 and name HN   )) ((resid    7 and name HG2  ))   4.40  2.60  0.00 ! #SUP  5.18
assign  ((resid   76 and name HA   )) ((resid   77 and name HN   ))   3.36  1.56  0.00 ! #SUP  4.26
assign  ((resid   76 and name HB2  )) ((resid   77 and name HN   ))   4.37  2.57  0.00 ! #SUP  4.18
assign  ((resid   77 and name HN   )) ((resid   77 and name HG*  ))   3.95  2.15  0.00 ! #SUP  5.05
assign  ((resid   77 and name HN   )) ((resid   77 and name HB*  ))   3.41  1.61  0.00 ! #SUP  4.82
assign  ((resid   19 and name HA   )) ((resid   20 and name HN   ))   3.34  1.54  0.00 ! #SUP  7.50
assign  ((resid   20 and name HN   )) ((resid   21 and name HN   ))   3.05  1.25  0.00 ! #SUP  6.61
assign  ((resid   34 and name HN   )) ((resid   34 and name HA   ))   2.81  1.01  0.00 ! #SUP  6.97
assign  ((resid   20 and name HN   )) ((resid   20 and name HA   ))   2.60  0.80  0.00 ! #SUP  6.20
assign  ((resid   30 and name HB2  )) ((resid   34 and name HN   ))   3.79  1.99  0.00 ! #SUP  3.17
assign  ((resid   70 and name HB2  )) ((resid   71 and name HN   ))   4.50  2.70  0.00 ! #SUP  3.66
assign  ((resid   20 and name HN   )) ((resid   20 and name HG*  ))   3.20  1.40  0.00 ! #SUP  7.88
assign  ((resid   34 and name HN   )) ((resid   34 and name HB*  ))   3.69  1.89  0.00 ! #SUP  6.79
assign  ((resid   11 and name HD*  )) ((resid   14 and name HE21 ))   4.62  2.82  0.00 ! #SUP  1.10
assign  ((resid   19 and name HB2  )) ((resid   20 and name HN   ))   4.64  2.84  0.00 ! #SUP  6.97
assign  ((resid   34 and name HN   )) ((resid   34 and name HG1  ))   3.99  2.19  0.00 ! #SUP  5.85
assign  ((resid   20 and name HN   )) ((resid   21 and name HG2* ))   4.10  2.30  0.00 ! #SUP  8.28
assign  ((resid   19 and name HD1* )) ((resid   20 and name HN   ))   4.52  2.72  0.00 ! #SUP  6.59
assign  ((resid   79 and name HA   )) ((resid   80 and name HN   ))   2.95  1.15  0.00 ! #SUP  4.38
assign  ((resid   80 and name HN   )) ((resid   80 and name HB*  ))   3.36  1.56  0.00 ! #SUP  2.60
assign  ((resid   79 and name HB1  )) ((resid   80 and name HN   ))   3.90  2.10  0.00 ! #SUP  4.38
assign  ((resid   41 and name HG1  )) ((resid   42 and name HN   ))   4.98  3.18  0.00 ! #SUP  5.40
assign  ((resid   42 and name HB   )) ((resid   43 and name HN   ))   2.92  1.12  0.00 ! #SUP  6.02
assign  ((resid   41 and name HN   )) ((resid   42 and name HN   ))   3.00  1.20  0.00 ! #SUP  8.63
assign  ((resid   41 and name HB2  )) ((resid   42 and name HN   ))   4.11  2.31  0.00 ! #SUP  5.73
assign  ((resid   72 and name HN   )) ((resid   73 and name HG11 ))   4.27  2.47  0.00 ! #SUP  4.46
assign  ((resid   69 and name HN   )) ((resid   69 and name HE*  ))   4.88  3.08  0.00 ! #SUP  4.77
assign  ((resid   10 and name HA   )) ((resid   11 and name HN   ))   3.65  1.85  0.00 ! #SUP  6.65
assign  ((resid    9 and name HA   )) ((resid   11 and name HN   ))   4.41  2.61  0.00 ! #SUP  3.04
assign  ((resid   11 and name HN   )) ((resid   14 and name HB2  ))   4.53  2.73  0.00 ! #SUP  1.50
assign  ((resid    9 and name HB1  )) ((resid   11 and name HN   ))   3.23  1.43  0.00 ! #SUP  2.86
assign  ((resid   67 and name HB1  )) ((resid   68 and name HN   ))   4.08  2.28  0.00 ! #SUP  5.79
assign  ((resid   11 and name HN   )) ((resid   11 and name HG1  ))   4.25  2.45  0.00 ! #SUP  5.92
assign  ((resid   68 and name HG*  )) ((resid   69 and name HN   ))   4.09  2.29  0.00 ! #SUP  5.79
assign  ((resid   67 and name HD1* )) ((resid   68 and name HN   ))   5.19  3.39  0.00 ! #SUP  6.24
assign  ((resid   25 and name HN   )) ((resid   26 and name HN   ))   3.04  1.24  0.00 ! #SUP  7.35
assign  ((resid   23 and name HA   )) ((resid   26 and name HN   ))   4.17  2.37  0.00 ! #SUP  3.74
assign  ((resid   26 and name HN   )) ((resid   26 and name HB   ))   3.04  1.24  0.00 ! #SUP  5.99
assign  ((resid   73 and name HN   )) ((resid   73 and name HG12 ))   4.38  2.58  0.00 ! #SUP  6.32
assign  ((resid   73 and name HN   )) ((resid   73 and name HG11 ))   3.44  1.64  0.00 ! #SUP  6.44
assign  ((resid   73 and name HN   )) ((resid   73 and name HG2* ))   3.85  2.05  0.00 ! #SUP  5.95
assign  ((resid   73 and name HN   )) ((resid   73 and name HD1* ))   4.06  2.26  0.00 ! #SUP  5.53
assign  ((resid   26 and name HN   )) ((resid   26 and name HG2* ))   3.21  1.41  0.00 ! #SUP  6.76
assign  ((resid   43 and name HA   )) ((resid   46 and name HN   ))   4.50  2.70  0.00 ! #SUP  1.71
assign  ((resid   45 and name HB2  )) ((resid   46 and name HN   ))   3.70  1.90  0.00 ! #SUP  4.52
assign  ((resid   36 and name HG2  )) ((resid   36 and name HE21 ))   3.84  2.04  0.00 ! #SUP  6.17
assign  ((resid   36 and name HG1  )) ((resid   36 and name HE21 ))   3.53  1.73  0.00 ! #SUP  5.93
assign  ((resid   27 and name HG2* )) ((resid   36 and name HE21 ))   3.96  2.16  0.00 ! #SUP  3.37
assign  ((resid   16 and name HN   )) ((resid   17 and name HN   ))   3.40  1.60  0.00 ! #SUP  5.85
assign  ((resid   17 and name HN   )) ((resid   17 and name HB   ))   2.88  1.08  0.00 ! #SUP  5.58
assign  ((resid   14 and name HA   )) ((resid   17 and name HN   ))   3.49  1.69  0.00 ! #SUP  2.46
assign  ((resid   16 and name HB1  )) ((resid   17 and name HN   ))   3.66  1.86  0.00 ! #SUP  4.94
assign  ((resid   17 and name HN   )) ((resid   18 and name HN   ))   3.24  1.44  0.00 ! #SUP  7.74
assign  ((resid   16 and name HB2  )) ((resid   17 and name HN   ))   3.42  1.62  0.00 ! #SUP  6.61
assign  ((resid   24 and name HE1  )) ((resid   43 and name HD*  ))   4.33  2.53  0.00 ! #SUP  3.61
assign  ((resid   24 and name HE1  )) ((resid   43 and name HE*  ))   3.67  1.87  0.00 ! #SUP  4.62
assign  ((resid   24 and name HA   )) ((resid   24 and name HE1  ))   4.89  3.09  0.00 ! #SUP  4.07
assign  ((resid   23 and name HG12 )) ((resid   24 and name HE1  ))   4.37  2.57  0.00 ! #SUP  5.65
assign  ((resid   23 and name HD1* )) ((resid   24 and name HE1  ))   4.23  2.43  0.00 ! #SUP  5.76
assign  ((resid    8 and name HN   )) ((resid    9 and name HD2  ))   5.07  3.27  0.00 ! #SUP  4.50
assign  ((resid    8 and name HN   )) ((resid    9 and name HD1  ))   4.92  3.12  0.00 ! #SUP  6.15
assign  ((resid    7 and name HB2  )) ((resid    8 and name HN   ))   4.09  2.29  0.00 ! #SUP  5.02
assign  ((resid   35 and name HN   )) ((resid   35 and name HE21 ))   4.84  3.04  0.00 ! #SUP  5.87
assign  ((resid   35 and name HG*  )) ((resid   35 and name HE21 ))   3.42  1.62  0.00 ! #SUP  5.46
assign  ((resid   20 and name HG*  )) ((resid   20 and name HE21 ))   4.01  2.21  0.00 ! #SUP  3.73
assign  ((resid    3 and name HG*  )) ((resid    3 and name HE21 ))   3.72  1.92  0.00 ! #SUP  2.98
assign  ((resid    2 and name HA   )) ((resid    2 and name HE*  ))   4.19  2.39  0.00 ! #SUP  4.75
assign  ((resid    2 and name HE*  )) ((resid    9 and name HD2  ))   4.08  2.28  0.00 ! #SUP  2.47
assign  ((resid    2 and name HE*  )) ((resid    9 and name HD1  ))   4.88  3.08  0.00 ! #SUP  3.10
assign  ((resid    2 and name HE*  )) ((resid   18 and name HG1  ))   4.73  2.93  0.00 ! #SUP  2.01
assign  ((resid   45 and name HZ   )) ((resid   62 and name HB   ))   4.40  2.60  0.00 ! #SUP  4.14
assign  ((resid    2 and name HE*  )) ((resid   19 and name HG   ))   4.82  3.02  0.00 ! #SUP  4.55
assign  ((resid    2 and name HE*  )) ((resid   15 and name HD1* ))   3.98  2.18  0.00 ! #SUP  1.39
assign  ((resid    2 and name HE*  )) ((resid   19 and name HD1* ))   4.04  2.24  0.00 ! #SUP  5.87
assign  ((resid   45 and name HZ   )) ((resid   53 and name HN   ))   4.62  2.82  0.00 ! #SUP  2.88
assign  ((resid   45 and name HZ   )) ((resid   62 and name HN   ))   4.20  2.40  0.00 ! #SUP  5.91
assign  ((resid   45 and name HZ   )) ((resid   61 and name HA   ))   3.63  1.83  0.00 ! #SUP  4.07
assign  ((resid   45 and name HZ   )) ((resid   52 and name HA   ))   3.53  1.73  0.00 ! #SUP  5.55
assign  ((resid   45 and name HZ   )) ((resid   62 and name HG2* ))   4.20  2.40  0.00 ! #SUP  4.48
assign  ((resid   45 and name HZ   )) ((resid   50 and name HB2  ))   4.51  2.71  0.00 ! #SUP  1.91
assign  ((resid   45 and name HZ   )) ((resid   52 and name HD1* ))   4.09  2.29  0.00 ! #SUP  4.56
assign  ((resid   45 and name HZ   )) ((resid   61 and name HB*  ))   4.33  2.53  0.00 ! #SUP  5.70
assign  ((resid   45 and name HZ   )) ((resid   50 and name HB1  ))   4.41  2.61  0.00 ! #SUP  4.00
assign  ((resid   45 and name HZ   )) ((resid   52 and name HG2* ))   4.97  3.17  0.00 ! #SUP  4.10
assign  ((resid    2 and name HD*  )) ((resid    8 and name HN   ))   4.82  3.02  0.00 ! #SUP  2.94
assign  ((resid   25 and name HN   )) ((resid   25 and name HB1  ))   3.58  1.78  0.00 ! #SUP  6.64
assign  ((resid   25 and name HN   )) ((resid   26 and name HG2* ))   4.29  2.49  0.00 ! #SUP  4.98
assign  ((resid    2 and name HN   )) ((resid    2 and name HD*  ))   3.91  2.11  0.00 ! #SUP  6.02
assign  ((resid    2 and name HA   )) ((resid    2 and name HD*  ))   3.17  1.37  0.00 ! #SUP  6.59
assign  ((resid   23 and name HA   )) ((resid   25 and name HN   ))   3.84  2.04  0.00 ! #SUP  6.96
assign  ((resid    2 and name HD*  )) ((resid    9 and name HD1  ))   4.84  3.04  0.00 ! #SUP  5.15
assign  ((resid   24 and name HB1  )) ((resid   25 and name HN   ))   4.22  2.42  0.00 ! #SUP  5.94
assign  ((resid    1 and name HE*  )) ((resid    2 and name HD*  ))   5.23  3.43  0.00 ! #SUP  4.90
assign  ((resid    2 and name HD*  )) ((resid   59 and name HG2  ))   4.30  2.50  0.00 ! #SUP  1.23
assign  ((resid   25 and name HN   )) ((resid   26 and name HB   ))   4.10  2.30  0.00 ! #SUP  5.80
assign  ((resid    2 and name HD*  )) ((resid   19 and name HG   ))   4.35  2.55  0.00 ! #SUP  3.90
assign  ((resid    2 and name HD*  )) ((resid    8 and name HB*  ))   4.62  2.82  0.00 ! #SUP  2.51
assign  ((resid    2 and name HD*  )) ((resid    8 and name HG*  ))   5.09  3.29  0.00 ! #SUP  5.28
assign  ((resid   21 and name HG2* )) ((resid   25 and name HN   ))   5.27  3.47  0.00 ! #SUP  6.26
assign  ((resid    2 and name HD*  )) ((resid   19 and name HD1* ))   5.02  3.22  0.00 ! #SUP  3.90
assign  ((resid    2 and name HD*  )) ((resid   19 and name HD2* ))   4.83  3.03  0.00 ! #SUP  3.70
assign  ((resid   45 and name HD*  )) ((resid   61 and name HA   ))   4.21  2.41  0.00 ! #SUP  3.23
assign  ((resid   45 and name HN   )) ((resid   45 and name HD*  ))   3.69  1.89  0.00 ! #SUP  7.03
assign  ((resid   45 and name HD*  )) ((resid   62 and name HN   ))   3.43  1.63  0.00 ! #SUP  4.95
assign  ((resid   12 and name HA   )) ((resid   45 and name HD*  ))   4.77  2.97  0.00 ! #SUP  3.09
assign  ((resid   45 and name HD*  )) ((resid   52 and name HA   ))   5.01  3.21  0.00 ! #SUP  4.48
assign  ((resid   45 and name HA   )) ((resid   45 and name HD*  ))   3.24  1.44  0.00 ! #SUP  4.20
assign  ((resid   12 and name HB*  )) ((resid   45 and name HD*  ))   3.52  1.72  0.00 ! #SUP  6.46
assign  ((resid   45 and name HD*  )) ((resid   62 and name HG1* ))   4.21  2.41  0.00 ! #SUP  1.72
assign  ((resid   45 and name HD*  )) ((resid   50 and name HD2* ))   3.49  1.69  0.00 ! #SUP  4.75
assign  ((resid   37 and name HD2* )) ((resid   45 and name HD*  ))   4.17  2.37  0.00 ! #SUP  2.07
assign  ((resid   45 and name HD*  )) ((resid   61 and name HB*  ))   3.73  1.93  0.00 ! #SUP  4.95
assign  ((resid   45 and name HD*  )) ((resid   50 and name HB1  ))   4.39  2.59  0.00 ! #SUP  2.96
assign  ((resid   57 and name HA2  )) ((resid   58 and name HD21 ))   4.70  2.90  0.00 ! #SUP  4.26
assign  ((resid   44 and name HB2  )) ((resid   45 and name HD*  ))   4.22  2.42  0.00 ! #SUP  4.45
assign  ((resid   58 and name HD21 )) ((resid   60 and name HE*  ))   4.57  2.77  0.00 ! #SUP  3.97
assign  ((resid   58 and name HB1  )) ((resid   58 and name HD21 ))   3.93  2.13  0.00 ! #SUP  4.42
assign  ((resid    2 and name HZ   )) ((resid   19 and name HG   ))   4.47  2.67  0.00 ! #SUP  3.71
assign  ((resid    2 and name HZ   )) ((resid   15 and name HD1* ))   4.08  2.28  0.00 ! #SUP  1.57
assign  ((resid    2 and name HZ   )) ((resid   19 and name HD1* ))   3.98  2.18  0.00 ! #SUP  3.98
assign  ((resid    2 and name HZ   )) ((resid   19 and name HD2* ))   4.80  3.00  0.00 ! #SUP  3.90
assign  ((resid   68 and name HE*  )) ((resid   69 and name HZ   ))   4.62  2.82  0.00 ! #SUP  1.83
assign  ((resid   66 and name HA   )) ((resid   69 and name HZ   ))   4.91  3.11  0.00 ! #SUP  2.30
assign  ((resid   13 and name HD2  )) ((resid   14 and name HN   ))   4.37  2.57  0.00 ! #SUP  7.42
assign  ((resid   13 and name HD1  )) ((resid   14 and name HN   ))   4.06  2.26  0.00 ! #SUP  7.25
assign  ((resid   14 and name HN   )) ((resid   14 and name HG1  ))   4.22  2.42  0.00 ! #SUP  8.46
assign  ((resid   13 and name HB1  )) ((resid   14 and name HN   ))   3.93  2.13  0.00 ! #SUP  7.53
assign  ((resid   14 and name HN   )) ((resid   16 and name HN   ))   4.62  2.82  0.00 ! #SUP  5.62
assign  ((resid   69 and name HA   )) ((resid   69 and name HE*  ))   4.45  2.65  0.00 ! #SUP  3.12
assign  ((resid   66 and name HA   )) ((resid   69 and name HE*  ))   4.72  2.92  0.00 ! #SUP  2.76
assign  ((resid   22 and name HB   )) ((resid   24 and name HD2  ))   2.91  1.11  0.00 ! #SUP  4.77
assign  ((resid   24 and name HB2  )) ((resid   24 and name HD2  ))   3.39  1.59  0.00 ! #SUP  2.80
assign  ((resid   24 and name HB1  )) ((resid   24 and name HD2  ))   3.15  1.35  0.00 ! #SUP  2.97
assign  ((resid   22 and name HG2* )) ((resid   24 and name HD2  ))   3.55  1.75  0.00 ! #SUP  2.91
assign  ((resid   45 and name HE*  )) ((resid   50 and name HD2* ))   3.41  1.61  0.00 ! #SUP  4.91
assign  ((resid   45 and name HE*  )) ((resid   62 and name HN   ))   3.42  1.62  0.00 ! #SUP  4.97
assign  ((resid   45 and name HE*  )) ((resid   51 and name HA   ))   4.58  2.78  0.00 ! #SUP  2.35
assign  ((resid   45 and name HE*  )) ((resid   52 and name HA   ))   3.81  2.01  0.00 ! #SUP  6.21
assign  ((resid   45 and name HE*  )) ((resid   62 and name HB   ))   3.36  1.56  0.00 ! #SUP  3.87
assign  ((resid   12 and name HB*  )) ((resid   45 and name HE*  ))   4.04  2.24  0.00 ! #SUP  4.79
assign  ((resid   45 and name HE*  )) ((resid   62 and name HG2* ))   3.56  1.76  0.00 ! #SUP  3.69
assign  ((resid   45 and name HE*  )) ((resid   52 and name HD1* ))   3.63  1.83  0.00 ! #SUP  5.04
assign  ((resid   45 and name HE*  )) ((resid   52 and name HG2* ))   4.70  2.90  0.00 ! #SUP  4.88
assign  ((resid   45 and name HE*  )) ((resid   61 and name HB*  ))   3.80  2.00  0.00 ! #SUP  4.75
assign  ((resid   45 and name HE*  )) ((resid   52 and name HG12 ))   4.75  2.95  0.00 ! #SUP  3.31
assign  ((resid   77 and name HN   )) ((resid   79 and name HD*  ))   4.72  2.92  0.00 ! #SUP  3.85
assign  ((resid   79 and name HN   )) ((resid   79 and name HD*  ))   4.70  2.90  0.00 ! #SUP  5.93
assign  ((resid   23 and name HN   )) ((resid   24 and name HN   ))   3.66  1.86  0.00 ! #SUP  10.00
assign  ((resid   79 and name HD*  )) ((resid   80 and name HN   ))   4.35  2.55  0.00 ! #SUP  4.97
assign  ((resid   24 and name HN   )) ((resid   26 and name HN   ))   4.39  2.59  0.00 ! #SUP  3.95
assign  ((resid   24 and name HN   )) ((resid   25 and name HA   ))   5.26  3.46  0.00 ! #SUP  4.49
assign  ((resid   79 and name HA   )) ((resid   79 and name HD*  ))   3.22  1.42  0.00 ! #SUP  5.70
assign  ((resid   22 and name HB   )) ((resid   24 and name HN   ))   3.09  1.29  0.00 ! #SUP  8.99
assign  ((resid   77 and name HA   )) ((resid   79 and name HD*  ))   4.46  2.66  0.00 ! #SUP  3.03
assign  ((resid   24 and name HN   )) ((resid   24 and name HB2  ))   3.52  1.72  0.00 ! #SUP  6.46
assign  ((resid   78 and name HB2  )) ((resid   79 and name HD*  ))   4.84  3.04  0.00 ! #SUP  5.24
assign  ((resid   78 and name HB1  )) ((resid   79 and name HD*  ))   4.75  2.95  0.00 ! #SUP  6.11
assign  ((resid   24 and name HN   )) ((resid   24 and name HB1  ))   3.41  1.61  0.00 ! #SUP  6.46
assign  ((resid   23 and name HB   )) ((resid   24 and name HN   ))   4.42  2.62  0.00 ! #SUP  9.33
assign  ((resid   22 and name HN   )) ((resid   24 and name HN   ))   4.74  2.94  0.00 ! #SUP  6.66
assign  ((resid   73 and name HG2* )) ((resid   76 and name HD*  ))   4.01  2.21  0.00 ! #SUP  2.25
assign  ((resid   58 and name HD22 )) ((resid   60 and name HE*  ))   3.96  2.16  0.00 ! #SUP  3.14
assign  ((resid   70 and name HA   )) ((resid   70 and name HD*  ))   3.29  1.49  0.00 ! #SUP  4.97
assign  ((resid   76 and name HD*  )) ((resid   77 and name HA   ))   4.51  2.71  0.00 ! #SUP  4.15
assign  ((resid   70 and name HD*  )) ((resid   73 and name HG12 ))   4.58  2.78  0.00 ! #SUP  2.17
assign  ((resid   70 and name HN   )) ((resid   70 and name HD*  ))   4.32  2.52  0.00 ! #SUP  5.13
assign  ((resid   32 and name HD*  )) ((resid   33 and name HN   ))   4.48  2.68  0.00 ! #SUP  7.22
assign  ((resid   43 and name HD*  )) ((resid   46 and name HB*  ))   4.47  2.67  0.00 ! #SUP  1.17
assign  ((resid   70 and name HD*  )) ((resid   73 and name HG11 ))   3.34  1.54  0.00 ! #SUP  4.53
assign  ((resid   23 and name HD1* )) ((resid   43 and name HD*  ))   3.25  1.45  0.00 ! #SUP  7.17
assign  ((resid   43 and name HA   )) ((resid   43 and name HD*  ))   2.59  0.79  0.00 ! #SUP  3.98
assign  ((resid   40 and name HA   )) ((resid   43 and name HD*  ))   3.00  1.20  0.00 ! #SUP  4.25
assign  ((resid   42 and name HB   )) ((resid   43 and name HD*  ))   4.60  2.80  0.00 ! #SUP  4.42
assign  ((resid   40 and name HB2  )) ((resid   41 and name HN   ))   4.40  2.60  0.00 ! #SUP  6.30
assign  ((resid   23 and name HB   )) ((resid   43 and name HD*  ))   3.77  1.97  0.00 ! #SUP  4.15
assign  ((resid   32 and name HD*  )) ((resid   55 and name HG2  ))   3.33  1.53  0.00 ! #SUP  4.80
assign  ((resid   31 and name HG1* )) ((resid   32 and name HD*  ))   3.87  2.07  0.00 ! #SUP  7.76
assign  ((resid   41 and name HN   )) ((resid   41 and name HB2  ))   3.67  1.87  0.00 ! #SUP  7.37
assign  ((resid   41 and name HN   )) ((resid   41 and name HG2  ))   4.20  2.40  0.00 ! #SUP  7.14
assign  ((resid   41 and name HN   )) ((resid   41 and name HG1  ))   3.88  2.08  0.00 ! #SUP  7.20
assign  ((resid   41 and name HN   )) ((resid   41 and name HB1  ))   4.00  2.20  0.00 ! #SUP  6.78
assign  ((resid   38 and name HB2  )) ((resid   41 and name HN   ))   3.69  1.89  0.00 ! #SUP  5.64
assign  ((resid   78 and name HA   )) ((resid   78 and name HD2  ))   4.15  2.35  0.00 ! #SUP  3.31
assign  ((resid   78 and name HB2  )) ((resid   78 and name HD2  ))   3.59  1.79  0.00 ! #SUP  2.94
assign  ((resid   78 and name HB1  )) ((resid   78 and name HD2  ))   3.43  1.63  0.00 ! #SUP  3.96
assign  ((resid   60 and name HN   )) ((resid   60 and name HD*  ))   3.73  1.93  0.00 ! #SUP  6.25
assign  ((resid   58 and name HN   )) ((resid   60 and name HD*  ))   4.60  2.80  0.00 ! #SUP  3.13
assign  ((resid   60 and name HD*  )) ((resid   61 and name HN   ))   3.87  2.07  0.00 ! #SUP  5.39
assign  ((resid   54 and name HA   )) ((resid   60 and name HD*  ))   3.51  1.71  0.00 ! #SUP  5.35
assign  ((resid   60 and name HA   )) ((resid   60 and name HD*  ))   3.28  1.48  0.00 ! #SUP  5.07
assign  ((resid   59 and name HA   )) ((resid   60 and name HD*  ))   4.00  2.20  0.00 ! #SUP  6.06
assign  ((resid   58 and name HB2  )) ((resid   60 and name HD*  ))   4.09  2.29  0.00 ! #SUP  2.31
assign  ((resid   29 and name HG*  )) ((resid   60 and name HD*  ))   3.20  1.40  0.00 ! #SUP  4.50
assign  ((resid   55 and name HB2  )) ((resid   60 and name HD*  ))   3.71  1.91  0.00 ! #SUP  3.25
assign  ((resid   29 and name HB1  )) ((resid   60 and name HD*  ))   3.67  1.87  0.00 ! #SUP  1.97
assign  ((resid   53 and name HG*  )) ((resid   60 and name HD*  ))   4.62  2.82  0.00 ! #SUP  5.08
assign  ((resid   31 and name HG2* )) ((resid   60 and name HD*  ))   4.21  2.41  0.00 ! #SUP  6.25
assign  ((resid   28 and name HA   )) ((resid   60 and name HD*  ))   4.58  2.78  0.00 ! #SUP  2.20
assign  ((resid   30 and name HA   )) ((resid   60 and name HD*  ))   4.66  2.86  0.00 ! #SUP  4.81
assign  ((resid   55 and name HG2  )) ((resid   60 and name HD*  ))   5.09  3.29  0.00 ! #SUP  1.28
assign  ((resid   31 and name HG1* )) ((resid   60 and name HD*  ))   4.93  3.13  0.00 ! #SUP  4.55
assign  ((resid   27 and name HG2* )) ((resid   36 and name HE22 ))   4.23  2.43  0.00 ! #SUP  3.66
assign  ((resid   55 and name HN   )) ((resid   60 and name HE*  ))   3.45  1.65  0.00 ! #SUP  5.40
assign  ((resid   58 and name HN   )) ((resid   60 and name HE*  ))   4.08  2.28  0.00 ! #SUP  6.19
assign  ((resid    3 and name HA   )) ((resid    3 and name HE22 ))   4.70  2.90  0.00 ! #SUP  3.75
assign  ((resid   58 and name HB2  )) ((resid   60 and name HE*  ))   3.22  1.42  0.00 ! #SUP  5.47
assign  ((resid   58 and name HB1  )) ((resid   60 and name HE*  ))   3.52  1.72  0.00 ! #SUP  3.62
assign  ((resid   29 and name HG*  )) ((resid   60 and name HE*  ))   3.30  1.50  0.00 ! #SUP  1.15
assign  ((resid   55 and name HB2  )) ((resid   60 and name HE*  ))   3.44  1.64  0.00 ! #SUP  4.97
assign  ((resid   55 and name HB1  )) ((resid   60 and name HE*  ))   3.39  1.59  0.00 ! #SUP  3.18
assign  ((resid   31 and name HG2* )) ((resid   60 and name HE*  ))   4.61  2.81  0.00 ! #SUP  3.63
assign  ((resid   55 and name HA   )) ((resid   60 and name HE*  ))   4.62  2.82  0.00 ! #SUP  3.19
assign  ((resid   77 and name HB*  )) ((resid   79 and name HE*  ))   4.88  3.08  0.00 ! #SUP  1.39
assign  ((resid   79 and name HA   )) ((resid   79 and name HE*  ))   4.55  2.75  0.00 ! #SUP  3.44
assign  ((resid   77 and name HA   )) ((resid   79 and name HE*  ))   4.82  3.02  0.00 ! #SUP  2.56
assign  ((resid   76 and name HE*  )) ((resid   77 and name HN   ))   4.71  2.91  0.00 ! #SUP  5.26
assign  ((resid   76 and name HA   )) ((resid   76 and name HE*  ))   4.21  2.41  0.00 ! #SUP  3.89
assign  ((resid   76 and name HE*  )) ((resid   78 and name HB1  ))   4.17  2.37  0.00 ! #SUP  1.59
assign  ((resid   73 and name HG2* )) ((resid   76 and name HE*  ))   4.50  2.70  0.00 ! #SUP  1.74
assign  ((resid   39 and name HG*  )) ((resid   43 and name HE*  ))   4.39  2.59  0.00 ! #SUP  2.09
assign  ((resid   23 and name HB   )) ((resid   43 and name HE*  ))   4.25  2.45  0.00 ! #SUP  5.41
assign  ((resid   43 and name HN   )) ((resid   43 and name HE*  ))   4.46  2.66  0.00 ! #SUP  4.59
assign  ((resid   40 and name HA   )) ((resid   43 and name HE*  ))   4.11  2.31  0.00 ! #SUP  3.21
assign  ((resid   23 and name HD1* )) ((resid   43 and name HE*  ))   3.92  2.12  0.00 ! #SUP  7.25
assign  ((resid   23 and name HG2* )) ((resid   43 and name HE*  ))   3.41  1.61  0.00 ! #SUP  6.19
assign  ((resid   54 and name HD*  )) ((resid   59 and name HD2  ))   5.00  3.20  0.00 ! #SUP  2.76
assign  ((resid   54 and name HA   )) ((resid   54 and name HD*  ))   3.52  1.72  0.00 ! #SUP  5.85
assign  ((resid   53 and name HA   )) ((resid   54 and name HD*  ))   3.85  2.05  0.00 ! #SUP  6.93
assign  ((resid   54 and name HD*  )) ((resid   59 and name HA   ))   3.67  1.87  0.00 ! #SUP  9.67
assign  ((resid   54 and name HD*  )) ((resid   59 and name HB2  ))   4.72  2.92  0.00 ! #SUP  4.30
assign  ((resid   52 and name HG2* )) ((resid   54 and name HD*  ))   4.34  2.54  0.00 ! #SUP  4.83
assign  ((resid   50 and name HN   )) ((resid   50 and name HB1  ))   3.67  1.87  0.00 ! #SUP  6.61
assign  ((resid   54 and name HD*  )) ((resid   60 and name HN   ))   4.74  2.94  0.00 ! #SUP  5.53
assign  ((resid   50 and name HN   )) ((resid   50 and name HG   ))   3.49  1.69  0.00 ! #SUP  6.15
assign  ((resid   53 and name HG*  )) ((resid   54 and name HD*  ))   4.34  2.54  0.00 ! #SUP  6.08
assign  ((resid   70 and name HA   )) ((resid   70 and name HE*  ))   4.39  2.59  0.00 ! #SUP  2.07
assign  ((resid   66 and name HA   )) ((resid   69 and name HD*  ))   4.36  2.56  0.00 ! #SUP  3.40
assign  ((resid   69 and name HA   )) ((resid   69 and name HD*  ))   3.57  1.77  0.00 ! #SUP  4.92
assign  ((resid   32 and name HA   )) ((resid   32 and name HE*  ))   4.16  2.36  0.00 ! #SUP  4.25
assign  ((resid   32 and name HE*  )) ((resid   55 and name HG2  ))   3.53  1.73  0.00 ! #SUP  2.93
assign  ((resid   31 and name HG1* )) ((resid   32 and name HE*  ))   4.06  2.26  0.00 ! #SUP  5.66
assign  ((resid   54 and name HE*  )) ((resid   58 and name HA   ))   4.05  2.25  0.00 ! #SUP  3.18
assign  ((resid   54 and name HE*  )) ((resid   59 and name HA   ))   3.70  1.90  0.00 ! #SUP  9.11
assign  ((resid   10 and name HD*  )) ((resid   54 and name HE*  ))   5.05  3.25  0.00 ! #SUP  1.21
assign  ((resid   54 and name HE*  )) ((resid   59 and name HG1  ))   4.69  2.89  0.00 ! #SUP  3.11
assign  ((resid   54 and name HE*  )) ((resid   59 and name HG2  ))   4.37  2.57  0.00 ! #SUP  3.17
assign  ((resid   54 and name HE*  )) ((resid   59 and name HB1  ))   4.03  2.23  0.00 ! #SUP  3.18
assign  ((resid   10 and name HA   )) ((resid   54 and name HE*  ))   4.21  2.41  0.00 ! #SUP  1.38
assign  ((resid   52 and name HB   )) ((resid   54 and name HE*  ))   4.05  2.25  0.00 ! #SUP  2.34
assign  ((resid   62 and name HN   )) ((resid   62 and name HG1* ))   5.04  3.24  0.00 ! #SUP  5.44
assign  ((resid   29 and name HA   )) ((resid   36 and name HG2  ))   3.74  1.94  0.00 ! #SUP  2.58
assign  ((resid   77 and name HN   )) ((resid   78 and name HA   ))   4.33  2.53  0.00 ! #SUP  4.20
assign  ((resid    8 and name HG*  )) ((resid   59 and name HD2  ))   4.80  3.00  0.00 ! #SUP  2.16
assign  ((resid   42 and name HA   )) ((resid   45 and name HN   ))   3.98  2.18  0.00 ! #SUP  3.00
assign  ((resid   46 and name HN   )) ((resid   47 and name HD*  ))   4.40  2.60  0.00 ! #SUP  4.03
assign  ((resid   40 and name HB2  )) ((resid   40 and name HD*  ))   3.47  1.67  0.00 ! #SUP  4.44
assign  ((resid   40 and name HA   )) ((resid   40 and name HD*  ))   4.06  2.26  0.00 ! #SUP  4.33
assign  ((resid   43 and name HB*  )) ((resid   47 and name HB2  ))   3.63  1.83  0.00 ! #SUP  3.88
assign  ((resid   15 and name HN   )) ((resid   16 and name HB2  ))   4.73  2.93  0.00 ! #SUP  6.22
assign  ((resid   43 and name HB*  )) ((resid   47 and name HD*  ))   2.80  1.00  0.00 ! #SUP  3.22
assign  ((resid   43 and name HB*  )) ((resid   47 and name HB1  ))   4.65  2.85  0.00 ! #SUP  3.39
assign  ((resid   16 and name HB2  )) ((resid   22 and name HA   ))   4.72  2.92  0.00 ! #SUP  3.37
assign  ((resid   40 and name HA   )) ((resid   43 and name HB*  ))   3.71  1.91  0.00 ! #SUP  3.99
assign  ((resid   30 and name HA   )) ((resid   60 and name HB2  ))   3.90  2.10  0.00 ! #SUP  4.31
assign  ((resid   62 and name HG1* )) ((resid   66 and name HB1  ))   4.09  2.29  0.00 ! #SUP  6.48
assign  ((resid   31 and name HG2* )) ((resid   60 and name HB2  ))   3.36  1.56  0.00 ! #SUP  6.63
assign  ((resid   65 and name HA   )) ((resid   65 and name HE*  ))   4.46  2.66  0.00 ! #SUP  5.88
assign  ((resid   65 and name HB2  )) ((resid   65 and name HE*  ))   4.16  2.36  0.00 ! #SUP  5.52
assign  ((resid   51 and name HB2  )) ((resid   53 and name HG*  ))   4.72  2.92  0.00 ! #SUP  1.95
assign  ((resid   55 and name HA   )) ((resid   55 and name HD*  ))   4.64  2.84  0.00 ! #SUP  4.31
assign  ((resid   73 and name HG2* )) ((resid   76 and name HB1  ))   4.43  2.63  0.00 ! #SUP  2.25
assign  ((resid   51 and name HB1  )) ((resid   52 and name HN   ))   4.30  2.50  0.00 ! #SUP  5.67
assign  ((resid   44 and name HB2  )) ((resid   45 and name HN   ))   3.92  2.12  0.00 ! #SUP  6.07
assign  ((resid   68 and name HE*  )) ((resid   69 and name HE*  ))   4.79  2.99  0.00 ! #SUP  3.50
assign  ((resid   69 and name HN   )) ((resid   69 and name HB2  ))   3.79  1.99  0.00 ! #SUP  4.96
assign  ((resid   56 and name HB1  )) ((resid   57 and name HA2  ))   4.71  2.91  0.00 ! #SUP  2.82
assign  ((resid   32 and name HA   )) ((resid   34 and name HE*  ))   4.81  3.01  0.00 ! #SUP  0.41
assign  ((resid   69 and name HB1  )) ((resid   70 and name HN   ))   4.38  2.58  0.00 ! #SUP  5.51
assign  ((resid   66 and name HA   )) ((resid   69 and name HB1  ))   3.93  2.13  0.00 ! #SUP  2.37
assign  ((resid   41 and name HA   )) ((resid   44 and name HB1  ))   4.03  2.23  0.00 ! #SUP  2.25
assign  ((resid   44 and name HB1  )) ((resid   45 and name HN   ))   3.98  2.18  0.00 ! #SUP  5.35
assign  ((resid   58 and name HN   )) ((resid   58 and name HB1  ))   3.75  1.95  0.00 ! #SUP  6.01
assign  ((resid   16 and name HB1  )) ((resid   22 and name HA   ))   3.90  2.10  0.00 ! #SUP  2.56
assign  ((resid   21 and name HG2* )) ((resid   25 and name HB2  ))   4.39  2.59  0.00 ! #SUP  4.82
assign  ((resid   22 and name HB   )) ((resid   25 and name HB2  ))   4.56  2.76  0.00 ! #SUP  3.38
assign  ((resid   62 and name HA   )) ((resid   63 and name HB1  ))   4.21  2.41  0.00 ! #SUP  4.23
assign  ((resid   30 and name HB1  )) ((resid   31 and name HN   ))   4.61  2.81  0.00 ! #SUP  5.94
assign  ((resid   30 and name HN   )) ((resid   30 and name HB1  ))   3.37  1.57  0.00 ! #SUP  4.72
assign  ((resid   14 and name HN   )) ((resid   14 and name HG2  ))   4.41  2.61  0.00 ! #SUP  8.07
assign  ((resid   14 and name HA   )) ((resid   14 and name HG1  ))   3.50  1.70  0.00 ! #SUP  5.47
assign  ((resid   25 and name HB1  )) ((resid   26 and name HA   ))   4.16  2.36  0.00 ! #SUP  5.74
assign  ((resid   31 and name HG2* )) ((resid   60 and name HB1  ))   4.58  2.78  0.00 ! #SUP  8.00
assign  ((resid   40 and name HN   )) ((resid   41 and name HG2  ))   4.75  2.95  0.00 ! #SUP  4.31
assign  ((resid   41 and name HA   )) ((resid   41 and name HG2  ))   3.82  2.02  0.00 ! #SUP  4.53
assign  ((resid   38 and name HD2* )) ((resid   41 and name HG2  ))   5.02  3.22  0.00 ! #SUP  5.03
assign  ((resid   37 and name HD2* )) ((resid   41 and name HG2  ))   5.20  3.40  0.00 ! #SUP  5.25
assign  ((resid    1 and name HA   )) ((resid    1 and name HG2  ))   4.08  2.28  0.00 ! #SUP  5.00
assign  ((resid   13 and name HB2  )) ((resid   14 and name HN   ))   4.02  2.22  0.00 ! #SUP  7.53
assign  ((resid   36 and name HA   )) ((resid   36 and name HG2  ))   3.95  2.15  0.00 ! #SUP  7.27
assign  ((resid   14 and name HB2  )) ((resid   15 and name HN   ))   4.06  2.26  0.00 ! #SUP  7.11
assign  ((resid    6 and name HA   )) ((resid    6 and name HG*  ))   3.49  1.69  0.00 ! #SUP  4.39
assign  ((resid   18 and name HA   )) ((resid   18 and name HG1  ))   3.50  1.70  0.00 ! #SUP  5.98
assign  ((resid   20 and name HB2  )) ((resid   21 and name HN   ))   4.03  2.23  0.00 ! #SUP  5.97
assign  ((resid   41 and name HA   )) ((resid   41 and name HG1  ))   4.07  2.27  0.00 ! #SUP  4.90
assign  ((resid    1 and name HG1  )) ((resid    1 and name HE*  ))   3.59  1.79  0.00 ! #SUP  2.17
assign  ((resid   38 and name HB1  )) ((resid   41 and name HG1  ))   4.43  2.63  0.00 ! #SUP  3.67
assign  ((resid   13 and name HG*  )) ((resid   14 and name HN   ))   4.57  2.77  0.00 ! #SUP  7.53
assign  ((resid   36 and name HA   )) ((resid   36 and name HG1  ))   3.61  1.81  0.00 ! #SUP  7.10
assign  ((resid    3 and name HA   )) ((resid    3 and name HG*  ))   3.52  1.72  0.00 ! #SUP  5.65
assign  ((resid   15 and name HA   )) ((resid   18 and name HB2  ))   4.25  2.45  0.00 ! #SUP  3.93
assign  ((resid   75 and name HA   )) ((resid   75 and name HG1  ))   3.83  2.03  0.00 ! #SUP  4.29
assign  ((resid   39 and name HA   )) ((resid   42 and name HB   ))   3.70  1.90  0.00 ! #SUP  3.00
assign  ((resid   18 and name HB1  )) ((resid   19 and name HN   ))   3.04  1.24  0.00 ! #SUP  6.38
assign  ((resid   15 and name HA   )) ((resid   18 and name HB1  ))   4.34  2.54  0.00 ! #SUP  1.94
assign  ((resid   11 and name HB2  )) ((resid   11 and name HD*  ))   3.23  1.43  0.00 ! #SUP  3.57
assign  ((resid   11 and name HB2  )) ((resid   13 and name HD1  ))   4.70  2.90  0.00 ! #SUP  2.95
assign  ((resid   14 and name HN   )) ((resid   14 and name HB1  ))   3.52  1.72  0.00 ! #SUP  7.46
assign  ((resid   34 and name HA   )) ((resid   34 and name HB*  ))   2.81  1.01  0.00 ! #SUP  6.48
assign  ((resid    6 and name HB2  )) ((resid    6 and name HE21 ))   4.79  2.99  0.00 ! #SUP  2.65
assign  ((resid   10 and name HB2  )) ((resid   10 and name HD*  ))   3.71  1.91  0.00 ! #SUP  4.61
assign  ((resid   47 and name HB1  )) ((resid   48 and name HG1  ))   3.45  1.65  0.00 ! #SUP  3.33
assign  ((resid    8 and name HB*  )) ((resid   59 and name HG1  ))   3.14  1.34  0.00 ! #SUP  1.94
assign  ((resid    1 and name HG2  )) ((resid    1 and name HE*  ))   3.84  2.04  0.00 ! #SUP  2.58
assign  ((resid    8 and name HG*  )) ((resid   59 and name HG1  ))   3.22  1.42  0.00 ! #SUP  5.70
assign  ((resid    5 and name HG2  )) ((resid    6 and name HN   ))   3.41  1.61  0.00 ! #SUP  6.95
assign  ((resid   36 and name HB2  )) ((resid   36 and name HE21 ))   4.43  2.63  0.00 ! #SUP  5.29
assign  ((resid   65 and name HN   )) ((resid   65 and name HB1  ))   3.55  1.75  0.00 ! #SUP  8.30
assign  ((resid   29 and name HN   )) ((resid   29 and name HG*  ))   3.12  1.32  0.00 ! #SUP  6.84
assign  ((resid   29 and name HG*  )) ((resid   30 and name HN   ))   3.49  1.69  0.00 ! #SUP  5.42
assign  ((resid   29 and name HA   )) ((resid   29 and name HB2  ))   2.87  1.07  0.00 ! #SUP  4.00
assign  ((resid   29 and name HG*  )) ((resid   60 and name HB2  ))   4.19  2.39  0.00 ! #SUP  2.96
assign  ((resid   29 and name HG*  )) ((resid   37 and name HD1* ))   4.60  2.80  0.00 ! #SUP  3.04
assign  ((resid   67 and name HB2  )) ((resid   68 and name HN   ))   3.85  2.05  0.00 ! #SUP  5.67
assign  ((resid   64 and name HA   )) ((resid   67 and name HB2  ))   3.37  1.57  0.00 ! #SUP  2.25
assign  ((resid    9 and name HG*  )) ((resid   15 and name HA   ))   3.27  1.47  0.00 ! #SUP  4.01
assign  ((resid   39 and name HG*  )) ((resid   43 and name HB*  ))   4.51  2.71  0.00 ! #SUP  2.29
assign  ((resid   72 and name HB2  )) ((resid   73 and name HN   ))   3.71  1.91  0.00 ! #SUP  5.97
assign  ((resid   38 and name HA   )) ((resid   38 and name HG   ))   3.72  1.92  0.00 ! #SUP  3.10
assign  ((resid   10 and name HB1  )) ((resid   10 and name HD*  ))   3.46  1.66  0.00 ! #SUP  4.64
assign  ((resid   39 and name HB1  )) ((resid   40 and name HN   ))   4.08  2.28  0.00 ! #SUP  6.06
assign  ((resid   11 and name HA   )) ((resid   12 and name HB*  ))   4.39  2.59  0.00 ! #SUP  4.59
assign  ((resid   21 and name HG2* )) ((resid   26 and name HB   ))   3.38  1.58  0.00 ! #SUP  5.84
assign  ((resid   12 and name HB*  )) ((resid   46 and name HA   ))   4.55  2.75  0.00 ! #SUP  2.89
assign  ((resid   48 and name HA   )) ((resid   48 and name HG2  ))   3.47  1.67  0.00 ! #SUP  5.49
assign  ((resid   48 and name HB2  )) ((resid   50 and name HN   ))   4.54  2.74  0.00 ! #SUP  4.85
assign  ((resid   52 and name HN   )) ((resid   52 and name HB   ))   3.38  1.58  0.00 ! #SUP  6.17
assign  ((resid   52 and name HB   )) ((resid   52 and name HD1* ))   4.13  2.33  0.00 ! #SUP  4.97
assign  ((resid   19 and name HA   )) ((resid   19 and name HG   ))   2.97  1.17  0.00 ! #SUP  5.48
assign  ((resid   11 and name HA   )) ((resid   11 and name HD*  ))   3.63  1.83  0.00 ! #SUP  5.19
assign  ((resid   10 and name HA   )) ((resid   10 and name HG1  ))   3.51  1.71  0.00 ! #SUP  4.41
assign  ((resid   40 and name HN   )) ((resid   40 and name HB1  ))   3.37  1.57  0.00 ! #SUP  6.35
assign  ((resid   40 and name HB1  )) ((resid   40 and name HD*  ))   3.28  1.48  0.00 ! #SUP  4.10
assign  ((resid   67 and name HN   )) ((resid   67 and name HG   ))   3.81  2.01  0.00 ! #SUP  5.35
assign  ((resid    9 and name HB1  )) ((resid   15 and name HN   ))   4.45  2.65  0.00 ! #SUP  1.38
assign  ((resid   40 and name HN   )) ((resid   40 and name HG*  ))   3.64  1.84  0.00 ! #SUP  6.64
assign  ((resid   43 and name HB*  )) ((resid   47 and name HG2  ))   3.86  2.06  0.00 ! #SUP  2.84
assign  ((resid   38 and name HD2* )) ((resid   40 and name HG*  ))   4.64  2.84  0.00 ! #SUP  3.72
assign  ((resid   40 and name HA   )) ((resid   40 and name HG*  ))   3.73  1.93  0.00 ! #SUP  4.97
assign  ((resid   22 and name HB   )) ((resid   23 and name HB   ))   4.20  2.40  0.00 ! #SUP  6.78
assign  ((resid   19 and name HB2  )) ((resid   21 and name HB   ))   4.42  2.62  0.00 ! #SUP  0.99
assign  ((resid   46 and name HB*  )) ((resid   47 and name HN   ))   3.45  1.65  0.00 ! #SUP  7.01
assign  ((resid   47 and name HA   )) ((resid   47 and name HG1  ))   3.73  1.93  0.00 ! #SUP  5.40
assign  ((resid   43 and name HA   )) ((resid   46 and name HB*  ))   3.81  2.01  0.00 ! #SUP  3.42
assign  ((resid   13 and name HD2  )) ((resid   46 and name HB*  ))   4.35  2.55  0.00 ! #SUP  3.66
assign  ((resid   13 and name HB1  )) ((resid   46 and name HB*  ))   3.17  1.37  0.00 ! #SUP  2.22
assign  ((resid   55 and name HB1  )) ((resid   55 and name HD*  ))   3.16  1.36  0.00 ! #SUP  4.23
assign  ((resid   19 and name HN   )) ((resid   19 and name HB1  ))   3.42  1.62  0.00 ! #SUP  6.60
assign  ((resid   34 and name HN   )) ((resid   34 and name HD2  ))   3.67  1.87  0.00 ! #SUP  6.60
assign  ((resid   34 and name HA   )) ((resid   34 and name HD2  ))   3.14  1.34  0.00 ! #SUP  6.38
assign  ((resid   16 and name HA   )) ((resid   19 and name HB1  ))   4.00  2.20  0.00 ! #SUP  2.50
assign  ((resid   19 and name HB1  )) ((resid   21 and name HG2* ))   3.78  1.98  0.00 ! #SUP  5.56
assign  ((resid   64 and name HA   )) ((resid   67 and name HB1  ))   3.92  2.12  0.00 ! #SUP  2.25
assign  ((resid   38 and name HB1  )) ((resid   41 and name HN   ))   4.10  2.30  0.00 ! #SUP  5.91
assign  ((resid   37 and name HA   )) ((resid   38 and name HB1  ))   4.73  2.93  0.00 ! #SUP  4.94
assign  ((resid   54 and name HE*  )) ((resid   59 and name HB2  ))   4.04  2.24  0.00 ! #SUP  4.89
assign  ((resid   48 and name HB1  )) ((resid   48 and name HD2  ))   3.90  2.10  0.00 ! #SUP  6.40
assign  ((resid   48 and name HB1  )) ((resid   50 and name HD2* ))   4.85  3.05  0.00 ! #SUP  5.60
assign  ((resid    8 and name HB*  )) ((resid   54 and name HE*  ))   4.33  2.53  0.00 ! #SUP  0.75
assign  ((resid    8 and name HB*  )) ((resid    9 and name HD1  ))   4.02  2.22  0.00 ! #SUP  6.07
assign  ((resid   27 and name HB   )) ((resid   27 and name HG12 ))   2.78  0.98  0.00 ! #SUP  5.54
assign  ((resid   34 and name HA   )) ((resid   34 and name HD1  ))   3.87  2.07  0.00 ! #SUP  5.80
assign  ((resid   72 and name HA   )) ((resid   72 and name HG2  ))   3.99  2.19  0.00 ! #SUP  5.82
assign  ((resid   37 and name HG   )) ((resid   63 and name HA   ))   3.71  1.91  0.00 ! #SUP  4.00
assign  ((resid   37 and name HA   )) ((resid   37 and name HG   ))   3.43  1.63  0.00 ! #SUP  6.21
assign  ((resid   37 and name HG   )) ((resid   64 and name HN   ))   4.82  3.02  0.00 ! #SUP  4.00
assign  ((resid   65 and name HG1  )) ((resid   65 and name HE*  ))   3.84  2.04  0.00 ! #SUP  5.48
assign  ((resid   37 and name HG   )) ((resid   63 and name HB1  ))   4.21  2.41  0.00 ! #SUP  2.96
assign  ((resid   37 and name HG   )) ((resid   41 and name HB2  ))   4.14  2.34  0.00 ! #SUP  1.50
assign  ((resid   55 and name HG1  )) ((resid   60 and name HE*  ))   4.92  3.12  0.00 ! #SUP  2.85
assign  ((resid   31 and name HG2* )) ((resid   55 and name HG1  ))   4.78  2.98  0.00 ! #SUP  1.12
assign  ((resid   51 and name HA   )) ((resid   52 and name HG12 ))   4.91  3.11  0.00 ! #SUP  2.74
assign  ((resid   31 and name HG2* )) ((resid   55 and name HG2  ))   4.63  2.83  0.00 ! #SUP  4.58
assign  ((resid   32 and name HA   )) ((resid   55 and name HG2  ))   4.24  2.44  0.00 ! #SUP  3.37
assign  ((resid   62 and name HG1* )) ((resid   66 and name HB2  ))   4.12  2.32  0.00 ! #SUP  4.29
assign  ((resid   62 and name HG1* )) ((resid   67 and name HG   ))   3.82  2.02  0.00 ! #SUP  3.03
assign  ((resid   53 and name HG*  )) ((resid   62 and name HG1* ))   3.87  2.07  0.00 ! #SUP  3.94
assign  ((resid   62 and name HA   )) ((resid   62 and name HG1* ))   3.44  1.64  0.00 ! #SUP  5.42
assign  ((resid   34 and name HG2  )) ((resid   34 and name HE*  ))   4.05  2.25  0.00 ! #SUP  4.70
assign  ((resid    8 and name HG*  )) ((resid   59 and name HD1  ))   4.75  2.95  0.00 ! #SUP  3.81
assign  ((resid    8 and name HG*  )) ((resid   59 and name HG2  ))   3.57  1.77  0.00 ! #SUP  2.80
assign  ((resid    8 and name HG*  )) ((resid    9 and name HD2  ))   4.72  2.92  0.00 ! #SUP  5.18
assign  ((resid   16 and name HB2  )) ((resid   22 and name HG2* ))   3.92  2.12  0.00 ! #SUP  1.84
assign  ((resid   34 and name HN   )) ((resid   34 and name HG2  ))   4.19  2.39  0.00 ! #SUP  6.39
assign  ((resid   17 and name HN   )) ((resid   17 and name HG2* ))   3.66  1.86  0.00 ! #SUP  6.75
assign  ((resid   22 and name HA   )) ((resid   22 and name HG2* ))   3.09  1.29  0.00 ! #SUP  2.61
assign  ((resid   17 and name HA   )) ((resid   17 and name HG2* ))   2.93  1.13  0.00 ! #SUP  3.86
assign  ((resid   22 and name HG2* )) ((resid   43 and name HE*  ))   4.83  3.03  0.00 ! #SUP  1.47
assign  ((resid   28 and name HA   )) ((resid   28 and name HG   ))   3.72  1.92  0.00 ! #SUP  5.78
assign  ((resid    8 and name HB*  )) ((resid    9 and name HD1  ))   4.13  2.33  0.00 ! #SUP  5.63
assign  ((resid    8 and name HN   )) ((resid    8 and name HB*  ))   3.74  1.94  0.00 ! #SUP  5.77
assign  ((resid    8 and name HB*  )) ((resid   54 and name HE*  ))   4.56  2.76  0.00 ! #SUP  0.75
assign  ((resid   28 and name HG   )) ((resid   61 and name HB*  ))   4.83  3.03  0.00 ! #SUP  5.83
assign  ((resid   34 and name HA   )) ((resid   34 and name HG1  ))   3.74  1.94  0.00 ! #SUP  6.07
assign  ((resid   34 and name HG1  )) ((resid   34 and name HE*  ))   4.04  2.24  0.00 ! #SUP  5.06
assign  ((resid   27 and name HA   )) ((resid   27 and name HG11 ))   3.68  1.88  0.00 ! #SUP  6.09
assign  ((resid   23 and name HA   )) ((resid   23 and name HG12 ))   3.17  1.37  0.00 ! #SUP  6.53
assign  ((resid   23 and name HG12 )) ((resid   43 and name HE*  ))   5.02  3.22  0.00 ! #SUP  3.98
assign  ((resid   61 and name HA   )) ((resid   62 and name HG2* ))   3.97  2.17  0.00 ! #SUP  4.08
assign  ((resid   21 and name HN   )) ((resid   21 and name HG2* ))   3.20  1.40  0.00 ! #SUP  4.88
assign  ((resid   19 and name HN   )) ((resid   21 and name HG2* ))   4.03  2.23  0.00 ! #SUP  6.85
assign  ((resid   62 and name HN   )) ((resid   62 and name HG2* ))   4.12  2.32  0.00 ! #SUP  6.19
assign  ((resid   21 and name HA   )) ((resid   21 and name HG2* ))   3.65  1.85  0.00 ! #SUP  3.53
assign  ((resid   19 and name HA   )) ((resid   21 and name HG2* ))   4.06  2.26  0.00 ! #SUP  5.29
assign  ((resid   52 and name HA   )) ((resid   62 and name HG2* ))   3.71  1.91  0.00 ! #SUP  2.60
assign  ((resid   21 and name HG2* )) ((resid   26 and name HA   ))   3.50  1.70  0.00 ! #SUP  3.91
assign  ((resid   16 and name HA   )) ((resid   21 and name HG2* ))   3.09  1.29  0.00 ! #SUP  2.96
assign  ((resid   16 and name HB1  )) ((resid   21 and name HG2* ))   4.13  2.33  0.00 ! #SUP  2.13
assign  ((resid   28 and name HN   )) ((resid   28 and name HB1  ))   4.16  2.36  0.00 ! #SUP  7.42
assign  ((resid   12 and name HD1* )) ((resid   16 and name HN   ))   4.76  2.96  0.00 ! #SUP  3.52
assign  ((resid   12 and name HD1* )) ((resid   45 and name HB2  ))   4.34  2.54  0.00 ! #SUP  2.31
assign  ((resid   12 and name HN   )) ((resid   12 and name HD1* ))   4.67  2.87  0.00 ! #SUP  6.01
assign  ((resid   12 and name HD1* )) ((resid   45 and name HD*  ))   3.81  2.01  0.00 ! #SUP  6.03
assign  ((resid   12 and name HD1* )) ((resid   45 and name HE*  ))   4.81  3.01  0.00 ! #SUP  4.23
assign  ((resid   38 and name HD2* )) ((resid   41 and name HN   ))   4.33  2.53  0.00 ! #SUP  8.03
assign  ((resid   12 and name HD1* )) ((resid   61 and name HA   ))   4.87  3.07  0.00 ! #SUP  0.75
assign  ((resid   12 and name HA   )) ((resid   12 and name HD1* ))   3.30  1.50  0.00 ! #SUP  4.00
assign  ((resid   38 and name HD2* )) ((resid   40 and name HD*  ))   3.93  2.13  0.00 ! #SUP  3.62
assign  ((resid   38 and name HD1* )) ((resid   41 and name HG1  ))   4.81  3.01  0.00 ! #SUP  4.41
assign  ((resid   12 and name HD1* )) ((resid   15 and name HB2  ))   4.15  2.35  0.00 ! #SUP  2.96
assign  ((resid   38 and name HB2  )) ((resid   38 and name HD2* ))   3.18  1.38  0.00 ! #SUP  5.48
assign  ((resid   38 and name HB1  )) ((resid   38 and name HD1* ))   3.30  1.50  0.00 ! #SUP  5.06
assign  ((resid   12 and name HD1* )) ((resid   23 and name HD1* ))   3.46  1.66  0.00 ! #SUP  2.91
assign  ((resid   38 and name HN   )) ((resid   38 and name HD1* ))   3.68  1.88  0.00 ! #SUP  6.68
assign  ((resid   38 and name HA   )) ((resid   38 and name HD2* ))   2.86  1.06  0.00 ! #SUP  5.37
assign  ((resid   15 and name HA   )) ((resid   15 and name HD1* ))   3.19  1.39  0.00 ! #SUP  4.79
assign  ((resid    8 and name HB*  )) ((resid   15 and name HD1* ))   3.24  1.44  0.00 ! #SUP  1.41
assign  ((resid   15 and name HB1  )) ((resid   15 and name HD2* ))   3.86  2.06  0.00 ! #SUP  5.15
assign  ((resid   12 and name HA   )) ((resid   12 and name HD2* ))   3.78  1.98  0.00 ! #SUP  4.86
assign  ((resid    9 and name HD2  )) ((resid   15 and name HD1* ))   3.94  2.14  0.00 ! #SUP  3.48
assign  ((resid   15 and name HD1* )) ((resid   18 and name HB2  ))   4.48  2.68  0.00 ! #SUP  2.96
assign  ((resid    9 and name HG*  )) ((resid   15 and name HD1* ))   3.41  1.61  0.00 ! #SUP  4.12
assign  ((resid   15 and name HD2* )) ((resid   59 and name HB1  ))   3.57  1.77  0.00 ! #SUP  1.39
assign  ((resid   12 and name HD2* )) ((resid   23 and name HD1* ))   2.90  1.10  0.00 ! #SUP  4.89
assign  ((resid   15 and name HD2* )) ((resid   52 and name HG2* ))   4.36  2.56  0.00 ! #SUP  0.85
assign  ((resid   12 and name HD2* )) ((resid   61 and name HB*  ))   4.82  3.02  0.00 ! #SUP  0.75
assign  ((resid   12 and name HD2* )) ((resid   46 and name HN   ))   4.08  2.28  0.00 ! #SUP  2.82
assign  ((resid   12 and name HD2* )) ((resid   45 and name HD*  ))   3.59  1.79  0.00 ! #SUP  7.41
assign  ((resid   12 and name HD2* )) ((resid   45 and name HE*  ))   4.99  3.19  0.00 ! #SUP  5.61
assign  ((resid   12 and name HD2* )) ((resid   46 and name HA   ))   4.43  2.63  0.00 ! #SUP  3.93
assign  ((resid   12 and name HD2* )) ((resid   45 and name HB2  ))   4.54  2.74  0.00 ! #SUP  3.85
assign  ((resid   12 and name HD2* )) ((resid   42 and name HA   ))   4.09  2.29  0.00 ! #SUP  0.75
assign  ((resid   67 and name HN   )) ((resid   67 and name HD1* ))   4.68  2.88  0.00 ! #SUP  5.67
assign  ((resid   64 and name HA   )) ((resid   67 and name HD1* ))   3.42  1.62  0.00 ! #SUP  2.12
assign  ((resid   67 and name HA   )) ((resid   67 and name HD1* ))   3.37  1.57  0.00 ! #SUP  6.08
assign  ((resid   16 and name HA   )) ((resid   19 and name HD1* ))   4.51  2.71  0.00 ! #SUP  4.39
assign  ((resid   18 and name HG1  )) ((resid   19 and name HD1* ))   4.50  2.70  0.00 ! #SUP  5.10
assign  ((resid   18 and name HB2  )) ((resid   19 and name HD1* ))   4.53  2.73  0.00 ! #SUP  5.25
assign  ((resid   19 and name HB2  )) ((resid   19 and name HD1* ))   3.50  1.70  0.00 ! #SUP  6.66
assign  ((resid   67 and name HB1  )) ((resid   67 and name HD1* ))   3.25  1.45  0.00 ! #SUP  4.90
assign  ((resid   62 and name HG1* )) ((resid   67 and name HD1* ))   3.89  2.09  0.00 ! #SUP  3.03
assign  ((resid   73 and name HG2* )) ((resid   73 and name HG11 ))   3.30  1.50  0.00 ! #SUP  5.49
assign  ((resid   15 and name HG   )) ((resid   19 and name HD1* ))   3.23  1.43  0.00 ! #SUP  3.35
assign  ((resid   73 and name HG2* )) ((resid   74 and name HN   ))   4.81  3.01  0.00 ! #SUP  3.71
assign  ((resid   73 and name HG2* )) ((resid   73 and name HG12 ))   4.12  2.32  0.00 ! #SUP  5.40
assign  ((resid   19 and name HN   )) ((resid   19 and name HD2* ))   3.81  2.01  0.00 ! #SUP  6.75
assign  ((resid   19 and name HA   )) ((resid   19 and name HD2* ))   3.66  1.86  0.00 ! #SUP  4.90
assign  ((resid   19 and name HD2* )) ((resid   26 and name HG12 ))   3.36  1.56  0.00 ! #SUP  2.11
assign  ((resid   19 and name HD2* )) ((resid   27 and name HN   ))   4.60  2.80  0.00 ! #SUP  2.12
assign  ((resid    2 and name HE*  )) ((resid   19 and name HD2* ))   4.39  2.59  0.00 ! #SUP  4.55
assign  ((resid   23 and name HD1* )) ((resid   43 and name HA   ))   3.13  1.33  0.00 ! #SUP  3.88
assign  ((resid   23 and name HA   )) ((resid   23 and name HD1* ))   3.56  1.76  0.00 ! #SUP  6.47
assign  ((resid   53 and name HG*  )) ((resid   62 and name HB   ))   3.88  2.08  0.00 ! #SUP  4.42
assign  ((resid   12 and name HG   )) ((resid   23 and name HD1* ))   2.98  1.18  0.00 ! #SUP  2.74
assign  ((resid   53 and name HG*  )) ((resid   62 and name HG2* ))   3.06  1.26  0.00 ! #SUP  5.36
assign  ((resid   31 and name HG2* )) ((resid   53 and name HG*  ))   3.77  1.97  0.00 ! #SUP  1.50
assign  ((resid   53 and name HN   )) ((resid   53 and name HG*  ))   3.51  1.71  0.00 ! #SUP  6.79
assign  ((resid   23 and name HD1* )) ((resid   46 and name HN   ))   4.22  2.42  0.00 ! #SUP  0.75
assign  ((resid   45 and name HE*  )) ((resid   53 and name HG*  ))   4.10  2.30  0.00 ! #SUP  4.06
assign  ((resid   53 and name HA   )) ((resid   53 and name HG*  ))   3.10  1.30  0.00 ! #SUP  6.69
assign  ((resid   52 and name HA   )) ((resid   53 and name HG*  ))   3.13  1.33  0.00 ! #SUP  4.04
assign  ((resid   53 and name HG*  )) ((resid   60 and name HB2  ))   3.74  1.94  0.00 ! #SUP  5.41
assign  ((resid   53 and name HG*  )) ((resid   60 and name HB1  ))   3.94  2.14  0.00 ! #SUP  3.29
assign  ((resid   62 and name HG1* )) ((resid   67 and name HD2* ))   4.01  2.21  0.00 ! #SUP  2.68
assign  ((resid   31 and name HG1* )) ((resid   53 and name HG*  ))   3.59  1.79  0.00 ! #SUP  3.41
assign  ((resid   42 and name HN   )) ((resid   42 and name HG2* ))   2.98  1.18  0.00 ! #SUP  5.40
assign  ((resid   39 and name HA   )) ((resid   42 and name HG2* ))   3.59  1.79  0.00 ! #SUP  3.58
assign  ((resid   42 and name HA   )) ((resid   42 and name HG1* ))   2.86  1.06  0.00 ! #SUP  4.36
assign  ((resid   70 and name HE*  )) ((resid   73 and name HD1* ))   4.57  2.77  0.00 ! #SUP  0.51
assign  ((resid   73 and name HA   )) ((resid   73 and name HD1* ))   3.89  2.09  0.00 ! #SUP  5.05
assign  ((resid   73 and name HB   )) ((resid   73 and name HD1* ))   3.58  1.78  0.00 ! #SUP  4.92
assign  ((resid   27 and name HA   )) ((resid   27 and name HD1* ))   3.27  1.47  0.00 ! #SUP  6.05
assign  ((resid   27 and name HB   )) ((resid   27 and name HD1* ))   3.42  1.62  0.00 ! #SUP  5.62
assign  ((resid   23 and name HN   )) ((resid   26 and name HG2* ))   5.04  3.24  0.00 ! #SUP  3.80
assign  ((resid   26 and name HG2* )) ((resid   27 and name HN   ))   4.04  2.24  0.00 ! #SUP  8.41
assign  ((resid   26 and name HA   )) ((resid   26 and name HG2* ))   3.58  1.78  0.00 ! #SUP  6.91
assign  ((resid   23 and name HA   )) ((resid   26 and name HG2* ))   3.16  1.36  0.00 ! #SUP  5.26
assign  ((resid   27 and name HG2* )) ((resid   37 and name HN   ))   4.87  3.07  0.00 ! #SUP  3.88
assign  ((resid   27 and name HG2* )) ((resid   28 and name HN   ))   3.53  1.73  0.00 ! #SUP  8.37
assign  ((resid   27 and name HN   )) ((resid   27 and name HG2* ))   3.62  1.82  0.00 ! #SUP  8.14
assign  ((resid   27 and name HA   )) ((resid   27 and name HG2* ))   3.15  1.35  0.00 ! #SUP  6.39
assign  ((resid   15 and name HA   )) ((resid   15 and name HG   ))   3.78  1.98  0.00 ! #SUP  5.74
assign  ((resid   27 and name HG2* )) ((resid   36 and name HG2  ))   3.72  1.92  0.00 ! #SUP  3.00
assign  ((resid   27 and name HG2* )) ((resid   27 and name HG11 ))   3.20  1.40  0.00 ! #SUP  5.64
assign  ((resid   19 and name HD2* )) ((resid   26 and name HD1* ))   2.82  1.02  0.00 ! #SUP  1.89
assign  ((resid   45 and name HA   )) ((resid   50 and name HD1* ))   3.50  1.70  0.00 ! #SUP  1.72
assign  ((resid   15 and name HG   )) ((resid   16 and name HA   ))   3.42  1.62  0.00 ! #SUP  5.08
assign  ((resid   26 and name HB   )) ((resid   26 and name HD1* ))   3.27  1.47  0.00 ! #SUP  4.90
assign  ((resid   49 and name HN   )) ((resid   50 and name HD1* ))   4.80  3.00  0.00 ! #SUP  8.21
assign  ((resid   50 and name HN   )) ((resid   50 and name HD1* ))   3.82  2.02  0.00 ! #SUP  6.50
assign  ((resid   50 and name HA   )) ((resid   50 and name HD1* ))   2.96  1.16  0.00 ! #SUP  6.37
assign  ((resid   48 and name HD2  )) ((resid   50 and name HD1* ))   4.73  2.93  0.00 ! #SUP  3.97
assign  ((resid   48 and name HD1  )) ((resid   50 and name HD1* ))   4.58  2.78  0.00 ! #SUP  3.97
assign  ((resid   50 and name HB1  )) ((resid   50 and name HD1* ))   3.78  1.98  0.00 ! #SUP  5.97
assign  ((resid   49 and name HN   )) ((resid   50 and name HD2* ))   4.94  3.14  0.00 ! #SUP  9.43
assign  ((resid   23 and name HG2* )) ((resid   24 and name HE1  ))   4.32  2.52  0.00 ! #SUP  6.43
assign  ((resid   45 and name HZ   )) ((resid   50 and name HD2* ))   4.55  2.75  0.00 ! #SUP  4.83
assign  ((resid   23 and name HG2* )) ((resid   43 and name HD*  ))   3.94  2.14  0.00 ! #SUP  5.42
assign  ((resid   50 and name HN   )) ((resid   50 and name HD2* ))   4.05  2.25  0.00 ! #SUP  6.50
assign  ((resid   50 and name HD2* )) ((resid   62 and name HN   ))   4.80  3.00  0.00 ! #SUP  0.75
assign  ((resid   23 and name HG2* )) ((resid   43 and name HA   ))   3.61  1.81  0.00 ! #SUP  2.44
assign  ((resid   50 and name HA   )) ((resid   50 and name HD2* ))   4.21  2.41  0.00 ! #SUP  6.21
assign  ((resid   45 and name HA   )) ((resid   50 and name HD2* ))   3.46  1.66  0.00 ! #SUP  4.83
assign  ((resid   23 and name HA   )) ((resid   23 and name HG2* ))   3.27  1.47  0.00 ! #SUP  6.67
assign  ((resid   48 and name HD2  )) ((resid   50 and name HD2* ))   4.10  2.30  0.00 ! #SUP  5.35
assign  ((resid   48 and name HD1  )) ((resid   50 and name HD2* ))   4.12  2.32  0.00 ! #SUP  5.63
assign  ((resid   50 and name HD2* )) ((resid   62 and name HB   ))   4.15  2.35  0.00 ! #SUP  0.75
assign  ((resid   48 and name HB2  )) ((resid   50 and name HD2* ))   4.27  2.47  0.00 ! #SUP  6.86
assign  ((resid   12 and name HG   )) ((resid   23 and name HG2* ))   3.87  2.07  0.00 ! #SUP  2.55
assign  ((resid   26 and name HG12 )) ((resid   28 and name HD1* ))   4.10  2.30  0.00 ! #SUP  3.27
assign  ((resid   12 and name HD1* )) ((resid   28 and name HD1* ))   4.21  2.41  0.00 ! #SUP  1.27
assign  ((resid   12 and name HD2* )) ((resid   23 and name HG2* ))   4.00  2.20  0.00 ! #SUP  4.84
assign  ((resid   26 and name HG11 )) ((resid   28 and name HD1* ))   3.38  1.58  0.00 ! #SUP  4.49
assign  ((resid   23 and name HG2* )) ((resid   23 and name HD1* ))   2.91  1.11  0.00 ! #SUP  7.19
assign  ((resid   26 and name HD1* )) ((resid   28 and name HD1* ))   2.85  1.05  0.00 ! #SUP  6.11
assign  ((resid   50 and name HB1  )) ((resid   50 and name HD2* ))   3.50  1.70  0.00 ! #SUP  5.82
assign  ((resid   28 and name HB1  )) ((resid   28 and name HD1* ))   3.49  1.69  0.00 ! #SUP  6.64
assign  ((resid   52 and name HN   )) ((resid   52 and name HD1* ))   4.37  2.57  0.00 ! #SUP  6.38
assign  ((resid   52 and name HD1* )) ((resid   54 and name HE*  ))   5.04  3.24  0.00 ! #SUP  1.94
assign  ((resid   52 and name HD1* )) ((resid   61 and name HA   ))   4.11  2.31  0.00 ! #SUP  2.93
assign  ((resid   12 and name HA   )) ((resid   52 and name HD1* ))   3.70  1.90  0.00 ! #SUP  1.89
assign  ((resid   52 and name HA   )) ((resid   52 and name HD1* ))   3.26  1.46  0.00 ! #SUP  5.83
assign  ((resid   28 and name HD2* )) ((resid   61 and name HN   ))   4.70  2.90  0.00 ! #SUP  4.98
assign  ((resid   45 and name HD*  )) ((resid   52 and name HD1* ))   4.34  2.54  0.00 ! #SUP  3.35
assign  ((resid   12 and name HG   )) ((resid   28 and name HD2* ))   4.94  3.14  0.00 ! #SUP  3.69
assign  ((resid   28 and name HD2* )) ((resid   29 and name HN   ))   4.56  2.76  0.00 ! #SUP  7.78
assign  ((resid   28 and name HN   )) ((resid   28 and name HD2* ))   4.40  2.60  0.00 ! #SUP  7.45
assign  ((resid   28 and name HD2* )) ((resid   42 and name HA   ))   4.17  2.37  0.00 ! #SUP  0.75
assign  ((resid   28 and name HB2  )) ((resid   28 and name HD2* ))   3.12  1.32  0.00 ! #SUP  5.95
assign  ((resid   28 and name HB1  )) ((resid   28 and name HD2* ))   3.45  1.65  0.00 ! #SUP  5.98
assign  ((resid   12 and name HD1* )) ((resid   28 and name HD2* ))   3.32  1.52  0.00 ! #SUP  4.43
assign  ((resid   28 and name HD2* )) ((resid   42 and name HG1* ))   3.19  1.39  0.00 ! #SUP  2.00
assign  ((resid   26 and name HD1* )) ((resid   28 and name HD2* ))   3.16  1.36  0.00 ! #SUP  2.85
assign  ((resid   28 and name HD2* )) ((resid   61 and name HB*  ))   3.38  1.58  0.00 ! #SUP  6.99
assign  ((resid   28 and name HD2* )) ((resid   62 and name HN   ))   5.03  3.23  0.00 ! #SUP  0.98
assign  ((resid   37 and name HD1* )) ((resid   38 and name HN   ))   4.64  2.84  0.00 ! #SUP  8.01
assign  ((resid   37 and name HD1* )) ((resid   63 and name HN   ))   4.19  2.39  0.00 ! #SUP  5.83
assign  ((resid   37 and name HN   )) ((resid   37 and name HD1* ))   3.37  1.57  0.00 ! #SUP  7.14
assign  ((resid   30 and name HN   )) ((resid   37 and name HD1* ))   3.72  1.92  0.00 ! #SUP  6.74
assign  ((resid   37 and name HD1* )) ((resid   61 and name HN   ))   4.72  2.92  0.00 ! #SUP  3.32
assign  ((resid   37 and name HD1* )) ((resid   62 and name HN   ))   4.29  2.49  0.00 ! #SUP  6.21
assign  ((resid   37 and name HD1* )) ((resid   62 and name HA   ))   4.37  2.57  0.00 ! #SUP  5.61
assign  ((resid   29 and name HA   )) ((resid   37 and name HD1* ))   3.80  2.00  0.00 ! #SUP  6.79
assign  ((resid   37 and name HD1* )) ((resid   63 and name HA   ))   3.71  1.91  0.00 ! #SUP  6.67
assign  ((resid   36 and name HA   )) ((resid   37 and name HD1* ))   4.09  2.29  0.00 ! #SUP  4.79
assign  ((resid   30 and name HB2  )) ((resid   37 and name HD1* ))   4.07  2.27  0.00 ! #SUP  2.31
assign  ((resid   52 and name HG2* )) ((resid   60 and name HN   ))   3.86  2.06  0.00 ! #SUP  5.54
assign  ((resid   52 and name HN   )) ((resid   52 and name HG2* ))   4.44  2.64  0.00 ! #SUP  6.89
assign  ((resid   52 and name HG2* )) ((resid   53 and name HN   ))   3.55  1.75  0.00 ! #SUP  7.30
assign  ((resid   52 and name HG2* )) ((resid   54 and name HE*  ))   3.88  2.08  0.00 ! #SUP  4.05
assign  ((resid   52 and name HG2* )) ((resid   54 and name HA   ))   5.02  3.22  0.00 ! #SUP  2.20
assign  ((resid   52 and name HG2* )) ((resid   53 and name HA   ))   4.67  2.87  0.00 ! #SUP  6.34
assign  ((resid   52 and name HA   )) ((resid   52 and name HG2* ))   3.40  1.60  0.00 ! #SUP  5.18
assign  ((resid   52 and name HG2* )) ((resid   59 and name HA   ))   3.56  1.76  0.00 ! #SUP  3.87
assign  ((resid   52 and name HG2* )) ((resid   59 and name HB2  ))   3.87  2.07  0.00 ! #SUP  2.25
assign  ((resid   52 and name HG2* )) ((resid   52 and name HG11 ))   3.47  1.67  0.00 ! #SUP  4.08
assign  ((resid   37 and name HD2* )) ((resid   42 and name HN   ))   4.33  2.53  0.00 ! #SUP  5.31
assign  ((resid   37 and name HD2* )) ((resid   61 and name HA   ))   4.87  3.07  0.00 ! #SUP  3.11
assign  ((resid   37 and name HA   )) ((resid   37 and name HD2* ))   3.90  2.10  0.00 ! #SUP  5.85
assign  ((resid   37 and name HD2* )) ((resid   45 and name HB2  ))   4.63  2.83  0.00 ! #SUP  1.14
assign  ((resid   37 and name HB2  )) ((resid   37 and name HD2* ))   3.19  1.39  0.00 ! #SUP  4.57
assign  ((resid   37 and name HB1  )) ((resid   37 and name HD2* ))   3.34  1.54  0.00 ! #SUP  5.98
assign  ((resid   37 and name HD2* )) ((resid   42 and name HG2* ))   3.49  1.69  0.00 ! #SUP  6.44
assign  ((resid   37 and name HD2* )) ((resid   62 and name HN   ))   3.88  2.08  0.00 ! #SUP  5.04
assign  ((resid   37 and name HD2* )) ((resid   42 and name HA   ))   3.50  1.70  0.00 ! #SUP  3.33
assign  ((resid   37 and name HD2* )) ((resid   41 and name HB1  ))   3.77  1.97  0.00 ! #SUP  4.72
assign  ((resid   61 and name HN   )) ((resid   61 and name HB*  ))   3.75  1.95  0.00 ! #SUP  6.30
assign  ((resid   60 and name HA   )) ((resid   61 and name HB*  ))   4.44  2.64  0.00 ! #SUP  3.68
assign  ((resid   30 and name HA   )) ((resid   61 and name HB*  ))   4.51  2.71  0.00 ! #SUP  2.46
assign  ((resid   42 and name HA   )) ((resid   61 and name HB*  ))   4.84  3.04  0.00 ! #SUP  1.19
assign  ((resid   60 and name HB2  )) ((resid   61 and name HB*  ))   4.76  2.96  0.00 ! #SUP  4.21
assign  ((resid   61 and name HB*  )) ((resid   62 and name HB   ))   4.59  2.79  0.00 ! #SUP  5.13
assign  ((resid   61 and name HB*  )) ((resid   62 and name HG1* ))   5.49  3.69  0.00 ! #SUP  4.95
assign  ((resid   12 and name HD1* )) ((resid   61 and name HB*  ))   5.08  3.28  0.00 ! #SUP  2.00
assign  ((resid   53 and name HG*  )) ((resid   61 and name HB*  ))   4.62  2.82  0.00 ! #SUP  6.39
assign  ((resid   37 and name HD2* )) ((resid   61 and name HB*  ))   3.36  1.56  0.00 ! #SUP  4.90
assign  ((resid   29 and name HN   )) ((resid   61 and name HB*  ))   5.23  3.43  0.00 ! #SUP  7.79
assign  ((resid   61 and name HB*  )) ((resid   62 and name HN   ))   3.00  1.20  0.00 ! #SUP  5.62
assign  ((resid   61 and name HB*  )) ((resid   62 and name HA   ))   4.73  2.93  0.00 ! #SUP  5.13
assign  ((resid   28 and name HB2  )) ((resid   61 and name HB*  ))   3.85  2.05  0.00 ! #SUP  5.75
assign  ((resid   28 and name HB1  )) ((resid   61 and name HB*  ))   4.11  2.31  0.00 ! #SUP  3.97
assign  ((resid   31 and name HG1* )) ((resid   32 and name HA   ))   4.36  2.56  0.00 ! #SUP  7.21
assign  ((resid   30 and name HA   )) ((resid   31 and name HG1* ))   5.39  3.59  0.00 ! #SUP  4.38
assign  ((resid   31 and name HA   )) ((resid   31 and name HG1* ))   3.75  1.95  0.00 ! #SUP  6.34
assign  ((resid   31 and name HG1* )) ((resid   60 and name HB1  ))   5.05  3.25  0.00 ! #SUP  5.83
assign  ((resid   31 and name HG1* )) ((resid   55 and name HG2  ))   4.93  3.13  0.00 ! #SUP  6.38
assign  ((resid   45 and name HE*  )) ((resid   50 and name HB1  ))   4.37  2.57  0.00 ! #SUP  4.05
assign  ((resid   13 and name HA   )) ((resid   16 and name HB2  ))   3.77  1.97  0.00 ! #SUP  1.50
assign  ((resid   17 and name HA   )) ((resid   17 and name HB   ))   2.89  1.09  0.00 ! #SUP  3.00
assign  ((resid   16 and name HA   )) ((resid   19 and name HB2  ))   4.03  2.23  0.00 ! #SUP  2.50
assign  ((resid   31 and name HA   )) ((resid   31 and name HG2* ))   3.30  1.50  0.00 ! #SUP  4.37
assign  ((resid   31 and name HA   )) ((resid   60 and name HB1  ))   4.80  3.00  0.00 ! #SUP  4.42
assign  ((resid   66 and name HA   )) ((resid   69 and name HN   ))   4.04  2.24  0.00 ! #SUP  4.97
assign  ((resid    4 and name HB2  )) ((resid    5 and name HA   ))   3.70  1.90  0.00 ! #SUP  4.07
assign  ((resid   71 and name HN   )) ((resid   71 and name HB*  ))   4.07  2.27  0.00 ! #SUP  1.96
assign  ((resid   23 and name HA   )) ((resid   23 and name HG11 ))   3.09  1.29  0.00 ! #SUP  6.14
assign  ((resid   26 and name HA   )) ((resid   26 and name HG12 ))   3.19  1.39  0.00 ! #SUP  6.20
assign  ((resid   26 and name HA   )) ((resid   26 and name HG11 ))   3.71  1.91  0.00 ! #SUP  6.57
assign  ((resid   54 and name HB1  )) ((resid   59 and name HA   ))   4.24  2.44  0.00 ! #SUP  3.89
assign  ((resid   73 and name HA   )) ((resid   73 and name HG12 ))   3.99  2.19  0.00 ! #SUP  5.63
assign  ((resid   73 and name HA   )) ((resid   73 and name HG11 ))   3.76  1.96  0.00 ! #SUP  6.01
assign  ((resid   73 and name HA   )) ((resid   73 and name HG2* ))   3.27  1.47  0.00 ! #SUP  5.43
assign  ((resid   59 and name HA   )) ((resid   60 and name HN   ))   2.93  1.13  0.00 ! #SUP  5.13
assign  ((resid   62 and name HA   )) ((resid   66 and name HB1  ))   4.49  2.69  0.00 ! #SUP  2.25
assign  ((resid   37 and name HD2* )) ((resid   62 and name HA   ))   4.74  2.94  0.00 ! #SUP  4.75
assign  ((resid   30 and name HA   )) ((resid   62 and name HA   ))   4.40  2.60  0.00 ! #SUP  4.28
assign  ((resid   53 and name HA   )) ((resid   54 and name HN   ))   2.86  1.06  0.00 ! #SUP  7.45
assign  ((resid   53 and name HA   )) ((resid   53 and name HG1* ))   3.15  1.35  0.00 ! #SUP  5.11
assign  ((resid   71 and name HA   )) ((resid   71 and name HB*  ))   2.75  0.95  0.00 ! #SUP  1.00
assign  ((resid   69 and name HA   )) ((resid   69 and name HB2  ))   2.80  1.00  0.00 ! #SUP  3.86
assign  ((resid   80 and name HA   )) ((resid   80 and name HB*  ))   2.67  0.87  0.00 ! #SUP  1.11
assign  ((resid   65 and name HA   )) ((resid   65 and name HG1  ))   3.38  1.58  0.00 ! #SUP  6.38
assign  ((resid   15 and name HD1* )) ((resid   18 and name HA   ))   4.92  3.12  0.00 ! #SUP  1.50
assign  ((resid   12 and name HA   )) ((resid   15 and name HB1  ))   4.00  2.20  0.00 ! #SUP  2.97
assign  ((resid   18 and name HA   )) ((resid   18 and name HB2  ))   2.87  1.07  0.00 ! #SUP  5.40
assign  ((resid   17 and name HG2* )) ((resid   18 and name HA   ))   4.34  2.54  0.00 ! #SUP  5.29
assign  ((resid   47 and name HA   )) ((resid   47 and name HB2  ))   2.98  1.18  0.00 ! #SUP  5.44
assign  ((resid   73 and name HB   )) ((resid   74 and name HA   ))   4.36  2.56  0.00 ! #SUP  4.23
assign  ((resid   41 and name HA   )) ((resid   44 and name HN   ))   3.57  1.77  0.00 ! #SUP  4.15
assign  ((resid   14 and name HA   )) ((resid   17 and name HG2* ))   4.17  2.37  0.00 ! #SUP  1.27
assign  ((resid   40 and name HA   )) ((resid   43 and name HN   ))   3.75  1.95  0.00 ! #SUP  4.77
assign  ((resid   40 and name HA   )) ((resid   40 and name HB1  ))   2.90  1.10  0.00 ! #SUP  4.37
assign  ((resid   43 and name HA   )) ((resid   43 and name HB*  ))   2.98  1.18  0.00 ! #SUP  3.43
assign  ((resid   27 and name HA   )) ((resid   28 and name HN   ))   2.77  0.97  0.00 ! #SUP  7.37
assign  ((resid   29 and name HA   )) ((resid   30 and name HA   ))   4.26  2.46  0.00 ! #SUP  0.02
assign  ((resid   68 and name HA   )) ((resid   68 and name HB*  ))   2.70  0.90  0.00 ! #SUP  3.26
assign  ((resid   68 and name HA   )) ((resid   68 and name HG*  ))   3.59  1.79  0.00 ! #SUP  4.31
assign  ((resid   63 and name HA   )) ((resid   63 and name HB2  ))   3.00  1.20  0.00 ! #SUP  3.00
assign  ((resid   37 and name HD2* )) ((resid   63 and name HA   ))   3.87  2.07  0.00 ! #SUP  5.77
assign  ((resid   63 and name HA   )) ((resid   64 and name HN   ))   3.09  1.29  0.00 ! #SUP  4.71
assign  ((resid   76 and name HA   )) ((resid   76 and name HB2  ))   2.78  0.98  0.00 ! #SUP  4.41
assign  ((resid   60 and name HA   )) ((resid   61 and name HN   ))   2.95  1.15  0.00 ! #SUP  5.31
assign  ((resid   30 and name HA   )) ((resid   37 and name HD1* ))   4.07  2.27  0.00 ! #SUP  2.31
assign  ((resid   44 and name HA   )) ((resid   47 and name HN   ))   3.28  1.48  0.00 ! #SUP  3.55
assign  ((resid   39 and name HA   )) ((resid   42 and name HN   ))   3.68  1.88  0.00 ! #SUP  4.55
assign  ((resid   39 and name HA   )) ((resid   39 and name HG*  ))   3.95  2.15  0.00 ! #SUP  3.19
assign  ((resid   54 and name HA   )) ((resid   55 and name HN   ))   2.90  1.10  0.00 ! #SUP  5.27
assign  ((resid   54 and name HA   )) ((resid   59 and name HA   ))   3.36  1.56  0.00 ! #SUP  7.35
assign  ((resid   75 and name HA   )) ((resid   75 and name HB2  ))   3.01  1.21  0.00 ! #SUP  4.47
assign  ((resid   37 and name HA   )) ((resid   38 and name HN   ))   2.90  1.10  0.00 ! #SUP  8.43
assign  ((resid   37 and name HA   )) ((resid   37 and name HD1* ))   3.37  1.57  0.00 ! #SUP  6.54
assign  ((resid   24 and name HA   )) ((resid   24 and name HB2  ))   3.00  1.20  0.00 ! #SUP  4.18
assign  ((resid   72 and name HA   )) ((resid   72 and name HG1  ))   3.47  1.67  0.00 ! #SUP  5.20
assign  ((resid   48 and name HA   )) ((resid   48 and name HB2  ))   2.92  1.12  0.00 ! #SUP  5.99
assign  ((resid   48 and name HA   )) ((resid   48 and name HG1  ))   3.03  1.23  0.00 ! #SUP  6.55
assign  ((resid   48 and name HA   )) ((resid   49 and name HN   ))   3.13  1.33  0.00 ! #SUP  6.80
assign  ((resid   29 and name HB2  )) ((resid   36 and name HA   ))   3.30  1.50  0.00 ! #SUP  4.47
assign  ((resid   20 and name HA   )) ((resid   20 and name HG*  ))   2.73  0.93  0.00 ! #SUP  5.44
assign  ((resid   78 and name HA   )) ((resid   78 and name HB2  ))   2.81  1.01  0.00 ! #SUP  3.63
assign  ((resid   29 and name HA   )) ((resid   36 and name HA   ))   2.85  1.05  0.00 ! #SUP  6.50
assign  ((resid   77 and name HA   )) ((resid   77 and name HD*  ))   3.70  1.90  0.00 ! #SUP  2.58
assign  ((resid   77 and name HA   )) ((resid   77 and name HB*  ))   2.85  1.05  0.00 ! #SUP  3.22
assign  ((resid   77 and name HA   )) ((resid   77 and name HG*  ))   3.29  1.49  0.00 ! #SUP  3.48
assign  ((resid   56 and name HA   )) ((resid   56 and name HB2  ))   2.92  1.12  0.00 ! #SUP  1.93
assign  ((resid   35 and name HA   )) ((resid   35 and name HG*  ))   3.35  1.55  0.00 ! #SUP  5.98
assign  ((resid   35 and name HA   )) ((resid   35 and name HB1  ))   2.99  1.19  0.00 ! #SUP  5.39
assign  ((resid   19 and name HA   )) ((resid   20 and name HB2  ))   3.95  2.15  0.00 ! #SUP  5.18
assign  ((resid   49 and name HA   )) ((resid   50 and name HN   ))   3.38  1.58  0.00 ! #SUP  6.23
assign  ((resid   50 and name HA   )) ((resid   51 and name HN   ))   3.06  1.26  0.00 ! #SUP  5.99
assign  ((resid    8 and name HA   )) ((resid    9 and name HD2  ))   3.00  1.20  0.00 ! #SUP  4.81
assign  ((resid    8 and name HA   )) ((resid    9 and name HD1  ))   3.12  1.32  0.00 ! #SUP  6.55
assign  ((resid    8 and name HA   )) ((resid    8 and name HG*  ))   3.33  1.53  0.00 ! #SUP  6.55
assign  ((resid   50 and name HA   )) ((resid   51 and name HB1  ))   4.45  2.65  0.00 ! #SUP  4.95
assign  ((resid   50 and name HA   )) ((resid   50 and name HG   ))   4.18  2.38  0.00 ! #SUP  5.85
assign  ((resid   29 and name HA   )) ((resid   37 and name HN   ))   3.51  1.71  0.00 ! #SUP  6.37
assign  ((resid   28 and name HA   )) ((resid   29 and name HN   ))   2.74  0.94  0.00 ! #SUP  8.46
assign  ((resid   28 and name HA   )) ((resid   28 and name HB1  ))   2.97  1.17  0.00 ! #SUP  6.41
assign  ((resid   28 and name HA   )) ((resid   28 and name HD2* ))   3.71  1.91  0.00 ! #SUP  6.37
assign  ((resid    4 and name HA   )) ((resid    4 and name HB2  ))   2.78  0.98  0.00 ! #SUP  3.90
assign  ((resid    9 and name HD2  )) ((resid   15 and name HB1  ))   4.49  2.69  0.00 ! #SUP  2.71
assign  ((resid    8 and name HG*  )) ((resid    9 and name HD1  ))   4.48  2.68  0.00 ! #SUP  7.17
assign  ((resid   61 and name HA   )) ((resid   62 and name HN   ))   3.47  1.67  0.00 ! #SUP  3.77
assign  ((resid   37 and name HD1* )) ((resid   61 and name HA   ))   4.29  2.49  0.00 ! #SUP  3.85
assign  ((resid   52 and name HA   )) ((resid   61 and name HA   ))   4.37  2.57  0.00 ! #SUP  4.66
assign  ((resid   28 and name HB2  )) ((resid   29 and name HN   ))   4.49  2.69  0.00 ! #SUP  7.78
assign  ((resid   48 and name HB2  )) ((resid   48 and name HD2  ))   3.54  1.74  0.00 ! #SUP  6.80
assign  ((resid   25 and name HN   )) ((resid   25 and name HB2  ))   3.65  1.85  0.00 ! #SUP  5.93
assign  ((resid   10 and name HA   )) ((resid   10 and name HD*  ))   3.38  1.58  0.00 ! #SUP  4.87
assign  ((resid   47 and name HG2  )) ((resid   47 and name HD*  ))   2.66  0.86  0.00 ! #SUP  3.66
assign  ((resid   31 and name HN   )) ((resid   60 and name HB2  ))   4.39  2.59  0.00 ! #SUP  6.56
assign  ((resid   77 and name HB*  )) ((resid   77 and name HD*  ))   3.20  1.40  0.00 ! #SUP  2.45
assign  ((resid   31 and name HN   )) ((resid   60 and name HB1  ))   4.36  2.56  0.00 ! #SUP  6.73
assign  ((resid   31 and name HB   )) ((resid   60 and name HB1  ))   3.67  1.87  0.00 ! #SUP  5.91
assign  ((resid   72 and name HG2  )) ((resid   72 and name HE*  ))   3.88  2.08  0.00 ! #SUP  2.17
assign  ((resid   65 and name HD*  )) ((resid   65 and name HE*  ))   2.96  1.16  0.00 ! #SUP  4.74
assign  ((resid   64 and name HB2  )) ((resid   65 and name HN   ))   3.70  1.90  0.00 ! #SUP  6.84
assign  ((resid   68 and name HD*  )) ((resid   68 and name HE*  ))   3.05  1.25  0.00 ! #SUP  1.96
assign  ((resid   68 and name HG*  )) ((resid   68 and name HE*  ))   3.31  1.51  0.00 ! #SUP  3.98
assign  ((resid   34 and name HB*  )) ((resid   34 and name HE*  ))   4.00  2.20  0.00 ! #SUP  5.14
assign  ((resid   19 and name HB1  )) ((resid   19 and name HD2* ))   3.29  1.49  0.00 ! #SUP  4.13
assign  ((resid   12 and name HA   )) ((resid   15 and name HB2  ))   4.13  2.33  0.00 ! #SUP  4.44
assign  ((resid   67 and name HN   )) ((resid   67 and name HB2  ))   3.49  1.69  0.00 ! #SUP  5.62
assign  ((resid   37 and name HB2  )) ((resid   42 and name HG2* ))   4.21  2.41  0.00 ! #SUP  4.57
assign  ((resid   67 and name HN   )) ((resid   67 and name HB1  ))   3.72  1.92  0.00 ! #SUP  5.51
assign  ((resid   41 and name HA   )) ((resid   44 and name HB2  ))   3.82  2.02  0.00 ! #SUP  3.18
assign  ((resid   12 and name HB*  )) ((resid   12 and name HD1* ))   3.79  1.99  0.00 ! #SUP  4.84
assign  ((resid   12 and name HB*  )) ((resid   13 and name HD2  ))   4.08  2.28  0.00 ! #SUP  5.90
assign  ((resid    2 and name HB2  )) ((resid    8 and name HG*  ))   4.62  2.82  0.00 ! #SUP  1.21
assign  ((resid   79 and name HB2  )) ((resid   80 and name HN   ))   4.20  2.40  0.00 ! #SUP  4.43
assign  ((resid   23 and name HB   )) ((resid   23 and name HD1* ))   3.46  1.66  0.00 ! #SUP  6.76
assign  ((resid   18 and name HG2  )) ((resid   19 and name HD1* ))   4.81  3.01  0.00 ! #SUP  5.64
assign  ((resid   18 and name HN   )) ((resid   18 and name HG2  ))   3.54  1.74  0.00 ! #SUP  6.27
assign  ((resid   75 and name HB2  )) ((resid   75 and name HG1  ))   2.68  0.88  0.00 ! #SUP  3.72
assign  ((resid   29 and name HA   )) ((resid   29 and name HG*  ))   3.02  1.22  0.00 ! #SUP  4.00
assign  ((resid   29 and name HB1  )) ((resid   29 and name HG*  ))   2.93  1.13  0.00 ! #SUP  3.97
assign  ((resid   18 and name HA   )) ((resid   18 and name HG2  ))   3.48  1.68  0.00 ! #SUP  5.27
assign  ((resid    7 and name HA   )) ((resid    7 and name HG2  ))   3.32  1.52  0.00 ! #SUP  3.44
assign  ((resid    7 and name HA   )) ((resid    7 and name HG1  ))   3.43  1.63  0.00 ! #SUP  2.96
assign  ((resid   62 and name HN   )) ((resid   62 and name HB   ))   3.70  1.90  0.00 ! #SUP  5.42
assign  ((resid   53 and name HG2* )) ((resid   62 and name HB   ))   3.80  2.00  0.00 ! #SUP  3.56
assign  ((resid   11 and name HB1  )) ((resid   13 and name HD1  ))   4.61  2.81  0.00 ! #SUP  1.89
assign  ((resid   33 and name HB2  )) ((resid   35 and name HG*  ))   3.78  1.98  0.00 ! #SUP  2.12
assign  ((resid   35 and name HB2  )) ((resid   35 and name HG*  ))   2.83  1.03  0.00 ! #SUP  4.97
assign  ((resid   35 and name HN   )) ((resid   35 and name HG*  ))   3.15  1.35  0.00 ! #SUP  6.59
assign  ((resid   35 and name HB1  )) ((resid   35 and name HG*  ))   2.81  1.01  0.00 ! #SUP  5.54
assign  ((resid   27 and name HG2* )) ((resid   36 and name HG1  ))   4.07  2.27  0.00 ! #SUP  3.00
assign  ((resid   14 and name HA   )) ((resid   14 and name HG2  ))   3.40  1.60  0.00 ! #SUP  5.30
assign  ((resid    3 and name HB2  )) ((resid    3 and name HG*  ))   2.46  0.66  0.00 ! #SUP  4.38
assign  ((resid   52 and name HG2* )) ((resid   59 and name HB1  ))   4.38  2.58  0.00 ! #SUP  2.25
assign  ((resid   29 and name HB1  )) ((resid   30 and name HN   ))   4.16  2.36  0.00 ! #SUP  5.45
assign  ((resid   65 and name HB2  )) ((resid   65 and name HD*  ))   3.46  1.66  0.00 ! #SUP  6.41
assign  ((resid   65 and name HB1  )) ((resid   66 and name HN   ))   3.73  1.93  0.00 ! #SUP  5.57
assign  ((resid   55 and name HB1  )) ((resid   58 and name HD22 ))   4.67  2.87  0.00 ! #SUP  0.17
assign  ((resid   55 and name HA   )) ((resid   55 and name HB2  ))   2.99  1.19  0.00 ! #SUP  4.00
assign  ((resid   33 and name HN   )) ((resid   33 and name HB1  ))   4.01  2.21  0.00 ! #SUP  6.07
assign  ((resid   68 and name HN   )) ((resid   68 and name HB*  ))   3.23  1.43  0.00 ! #SUP  4.35
assign  ((resid   37 and name HD2* )) ((resid   63 and name HB2  ))   4.63  2.83  0.00 ! #SUP  4.61
assign  ((resid   63 and name HB1  )) ((resid   64 and name HN   ))   4.31  2.51  0.00 ! #SUP  4.71
assign  ((resid   44 and name HA   )) ((resid   47 and name HB2  ))   2.86  1.06  0.00 ! #SUP  2.65
assign  ((resid   26 and name HG11 )) ((resid   28 and name HA   ))   4.49  2.69  0.00 ! #SUP  2.95
assign  ((resid   65 and name HB1  )) ((resid   65 and name HD*  ))   2.87  1.07  0.00 ! #SUP  5.00
assign  ((resid   65 and name HG1  )) ((resid   65 and name HD*  ))   2.83  1.03  0.00 ! #SUP  5.70
assign  ((resid   68 and name HG*  )) ((resid   68 and name HD*  ))   3.00  1.20  0.00 ! #SUP  3.07
assign  ((resid   72 and name HA   )) ((resid   72 and name HD*  ))   3.13  1.33  0.00 ! #SUP  5.07
assign  ((resid   72 and name HG2  )) ((resid   72 and name HD*  ))   2.53  0.73  0.00 ! #SUP  4.15
assign  ((resid    6 and name HB2  )) ((resid    6 and name HG*  ))   2.92  1.12  0.00 ! #SUP  4.43
assign  ((resid   23 and name HG2* )) ((resid   23 and name HG11 ))   3.94  2.14  0.00 ! #SUP  6.52
assign  ((resid   48 and name HN   )) ((resid   48 and name HG2  ))   4.22  2.42  0.00 ! #SUP  6.40
assign  ((resid   34 and name HB*  )) ((resid   34 and name HD1  ))   3.45  1.65  0.00 ! #SUP  5.71
assign  ((resid   34 and name HG2  )) ((resid   34 and name HD1  ))   3.04  1.24  0.00 ! #SUP  4.38
assign  ((resid   10 and name HN   )) ((resid   10 and name HG2  ))   4.56  2.76  0.00 ! #SUP  5.62
assign  ((resid   10 and name HA   )) ((resid   10 and name HG2  ))   3.35  1.55  0.00 ! #SUP  5.37
assign  ((resid   38 and name HN   )) ((resid   38 and name HG   ))   3.69  1.89  0.00 ! #SUP  7.07
assign  ((resid   47 and name HN   )) ((resid   47 and name HG1  ))   4.35  2.55  0.00 ! #SUP  7.37
assign  ((resid   47 and name HA   )) ((resid   47 and name HG2  ))   3.76  1.96  0.00 ! #SUP  4.08
assign  ((resid   26 and name HG2* )) ((resid   28 and name HD2* ))   3.68  1.88  0.00 ! #SUP  1.51
assign  ((resid   55 and name HA   )) ((resid   55 and name HG1  ))   3.75  1.95  0.00 ! #SUP  4.31
assign  ((resid   77 and name HB*  )) ((resid   77 and name HG*  ))   2.51  0.71  0.00 ! #SUP  3.21
assign  ((resid   12 and name HD2* )) ((resid   13 and name HD2  ))   4.62  2.82  0.00 ! #SUP  5.00
assign  ((resid   12 and name HD2* )) ((resid   42 and name HB   ))   4.55  2.75  0.00 ! #SUP  0.75
assign  ((resid   12 and name HB*  )) ((resid   12 and name HD2* ))   3.44  1.64  0.00 ! #SUP  5.44
assign  ((resid   12 and name HD2* )) ((resid   46 and name HB*  ))   3.73  1.93  0.00 ! #SUP  6.68
assign  ((resid   12 and name HD2* )) ((resid   28 and name HD2* ))   3.31  1.51  0.00 ! #SUP  2.72
assign  ((resid   27 and name HG2* )) ((resid   27 and name HG12 ))   3.25  1.45  0.00 ! #SUP  5.65
assign  ((resid   27 and name HN   )) ((resid   27 and name HG12 ))   4.26  2.46  0.00 ! #SUP  7.97
assign  ((resid   13 and name HA   )) ((resid   16 and name HB1  ))   4.23  2.43  0.00 ! #SUP  1.50
assign  ((resid   20 and name HN   )) ((resid   20 and name HB2  ))   4.17  2.37  0.00 ! #SUP  7.21
assign  ((resid   37 and name HD2* )) ((resid   41 and name HB2  ))   4.02  2.22  0.00 ! #SUP  6.23
assign  ((resid   19 and name HB2  )) ((resid   19 and name HD2* ))   3.10  1.30  0.00 ! #SUP  4.45
assign  ((resid   11 and name HG1  )) ((resid   14 and name HE21 ))   4.55  2.75  0.00 ! #SUP  0.96
assign  ((resid   34 and name HA   )) ((resid   34 and name HG2  ))   4.02  2.22  0.00 ! #SUP  6.18
assign  ((resid   67 and name HB2  )) ((resid   67 and name HD1* ))   3.92  2.12  0.00 ! #SUP  4.97
assign  ((resid   67 and name HA   )) ((resid   67 and name HD2* ))   3.36  1.56  0.00 ! #SUP  3.54
assign  ((resid   15 and name HN   )) ((resid   15 and name HD2* ))   3.82  2.02  0.00 ! #SUP  6.78
assign  ((resid   42 and name HG1* )) ((resid   43 and name HD*  ))   4.89  3.09  0.00 ! #SUP  4.87
assign  ((resid   42 and name HG1* )) ((resid   43 and name HN   ))   3.87  2.07  0.00 ! #SUP  7.39
assign  ((resid   39 and name HA   )) ((resid   42 and name HG1* ))   4.44  2.64  0.00 ! #SUP  2.72
assign  ((resid   37 and name HB2  )) ((resid   42 and name HG1* ))   3.58  1.78  0.00 ! #SUP  2.35
assign  ((resid   37 and name HD1* )) ((resid   63 and name HB2  ))   4.70  2.90  0.00 ! #SUP  5.47
assign  ((resid   37 and name HD1* )) ((resid   63 and name HB1  ))   3.39  1.59  0.00 ! #SUP  6.00
assign  ((resid   37 and name HB1  )) ((resid   37 and name HD1* ))   3.90  2.10  0.00 ! #SUP  6.54
assign  ((resid   15 and name HD2* )) ((resid   52 and name HD1* ))   3.90  2.10  0.00 ! #SUP  1.15
assign  ((resid   28 and name HD1* )) ((resid   29 and name HN   ))   3.79  1.99  0.00 ! #SUP  7.73
assign  ((resid   28 and name HD1* )) ((resid   61 and name HN   ))   4.67  2.87  0.00 ! #SUP  4.16
assign  ((resid   28 and name HA   )) ((resid   28 and name HD1* ))   2.95  1.15  0.00 ! #SUP  7.04
assign  ((resid   27 and name HA   )) ((resid   28 and name HD1* ))   3.89  2.09  0.00 ! #SUP  7.01
assign  ((resid   42 and name HA   )) ((resid   42 and name HG2* ))   3.46  1.66  0.00 ! #SUP  4.40
assign  ((resid   62 and name HG1* )) ((resid   67 and name HN   ))   4.04  2.24  0.00 ! #SUP  3.13
assign  ((resid   62 and name HG1* )) ((resid   63 and name HN   ))   3.79  1.99  0.00 ! #SUP  5.66
assign  ((resid   17 and name HG2* )) ((resid   18 and name HN   ))   3.51  1.71  0.00 ! #SUP  7.18
assign  ((resid   17 and name HG2* )) ((resid   18 and name HG1  ))   4.38  2.58  0.00 ! #SUP  3.74
assign  ((resid   48 and name HB2  )) ((resid   50 and name HD1* ))   4.18  2.38  0.00 ! #SUP  5.00
assign  ((resid   62 and name HA   )) ((resid   62 and name HG2* ))   3.54  1.74  0.00 ! #SUP  5.48
assign  ((resid   62 and name HG2* )) ((resid   63 and name HN   ))   4.12  2.32  0.00 ! #SUP  5.66
assign  ((resid   62 and name HG2* )) ((resid   66 and name HB1  ))   4.33  2.53  0.00 ! #SUP  2.89
assign  ((resid   53 and name HG2* )) ((resid   62 and name HG2* ))   4.02  2.22  0.00 ! #SUP  3.34
assign  ((resid   22 and name HG2* )) ((resid   24 and name HN   ))   4.11  2.31  0.00 ! #SUP  5.27
assign  ((resid   28 and name HA   )) ((resid   61 and name HB*  ))   3.99  2.19  0.00 ! #SUP  5.42
assign  ((resid   37 and name HD1* )) ((resid   61 and name HB*  ))   3.39  1.59  0.00 ! #SUP  6.64
assign  ((resid   53 and name HN   )) ((resid   53 and name HG2* ))   3.62  1.82  0.00 ! #SUP  5.17
assign  ((resid   53 and name HA   )) ((resid   53 and name HG2* ))   3.37  1.57  0.00 ! #SUP  5.32
assign  ((resid   53 and name HG2* )) ((resid   60 and name HB2  ))   4.61  2.81  0.00 ! #SUP  2.00
assign  ((resid   31 and name HG1* )) ((resid   53 and name HG2* ))   3.96  2.16  0.00 ! #SUP  1.07
assign  ((resid   16 and name HB2  )) ((resid   21 and name HG2* ))   4.67  2.87  0.00 ! #SUP  2.74
assign  ((resid   19 and name HB2  )) ((resid   21 and name HG2* ))   3.84  2.04  0.00 ! #SUP  6.66
assign  ((resid   19 and name HD2* )) ((resid   21 and name HG2* ))   3.75  1.95  0.00 ! #SUP  5.82
assign  ((resid   21 and name HG2* )) ((resid   26 and name HG2* ))   3.57  1.77  0.00 ! #SUP  3.46
assign  ((resid   46 and name HN   )) ((resid   46 and name HB*  ))   3.07  1.27  0.00 ! #SUP  4.89
assign  ((resid   12 and name HB*  )) ((resid   46 and name HB*  ))   3.35  1.55  0.00 ! #SUP  5.47
assign  ((resid   23 and name HD1* )) ((resid   46 and name HB*  ))   3.41  1.61  0.00 ! #SUP  2.00
assign  ((resid   13 and name HG*  )) ((resid   46 and name HB*  ))   4.59  2.79  0.00 ! #SUP  2.22
assign  ((resid   31 and name HG1* )) ((resid   55 and name HA   ))   4.76  2.96  0.00 ! #SUP  0.75
assign  ((resid    1 and name HE*  )) ((resid    2 and name HA   ))   3.19  1.39  0.00 ! #SUP  3.83
assign  ((resid   27 and name HG2* )) ((resid   28 and name HA   ))   3.84  2.04  0.00 ! #SUP  7.55
assign  ((resid   23 and name HG12 )) ((resid   26 and name HG2* ))   4.12  2.32  0.00 ! #SUP  2.04
assign  ((resid   23 and name HG2* )) ((resid   23 and name HG12 ))   3.48  1.68  0.00 ! #SUP  7.08
assign  ((resid   26 and name HA   )) ((resid   26 and name HD1* ))   4.05  2.25  0.00 ! #SUP  5.70
assign  ((resid   23 and name HA   )) ((resid   26 and name HD1* ))   3.95  2.15  0.00 ! #SUP  1.06
assign  ((resid   26 and name HD1* )) ((resid   27 and name HN   ))   4.68  2.88  0.00 ! #SUP  8.33
assign  ((resid   26 and name HD1* )) ((resid   28 and name HA   ))   4.00  2.20  0.00 ! #SUP  4.21
assign  ((resid   21 and name HG2* )) ((resid   26 and name HD1* ))   3.99  2.19  0.00 ! #SUP  2.54
assign  ((resid   27 and name HN   )) ((resid   27 and name HD1* ))   4.45  2.65  0.00 ! #SUP  7.85
assign  ((resid   12 and name HB*  )) ((resid   52 and name HD1* ))   3.68  1.88  0.00 ! #SUP  1.99
assign  ((resid   52 and name HD1* )) ((resid   53 and name HN   ))   4.12  2.32  0.00 ! #SUP  6.09
assign  ((resid   31 and name HN   )) ((resid   60 and name HD*  ))   4.66  2.86  0.00 ! #SUP  5.56
assign  ((resid   31 and name HN   )) ((resid   62 and name HA   ))   4.56  2.76  0.00 ! #SUP  2.51
assign  ((resid   31 and name HN   )) ((resid   31 and name HB   ))   3.48  1.68  0.00 ! #SUP  4.83
assign  ((resid   29 and name HB2  )) ((resid   37 and name HN   ))   4.02  2.22  0.00 ! #SUP  4.41
assign  ((resid   26 and name HN   )) ((resid   27 and name HN   ))   4.62  2.82  0.00 ! #SUP  7.37
assign  ((resid   63 and name HN   )) ((resid   63 and name HB1  ))   3.33  1.53  0.00 ! #SUP  5.81
assign  ((resid   27 and name HD1* )) ((resid   28 and name HN   ))   3.69  1.89  0.00 ! #SUP  6.56
assign  ((resid   28 and name HN   )) ((resid   28 and name HB2  ))   3.50  1.70  0.00 ! #SUP  6.94
assign  ((resid   27 and name HB   )) ((resid   28 and name HN   ))   4.66  2.86  0.00 ! #SUP  7.56
assign  ((resid   39 and name HN   )) ((resid   39 and name HG*  ))   4.00  2.20  0.00 ! #SUP  4.29
assign  ((resid   45 and name HN   )) ((resid   45 and name HB2  ))   2.95  1.15  0.00 ! #SUP  6.53
assign  ((resid   45 and name HN   )) ((resid   46 and name HB*  ))   5.04  3.24  0.00 ! #SUP  4.43
assign  ((resid   29 and name HB2  )) ((resid   30 and name HN   ))   3.70  1.90  0.00 ! #SUP  5.11
assign  ((resid   66 and name HN   )) ((resid   68 and name HN   ))   4.97  3.17  0.00 ! #SUP  3.28
assign  ((resid   17 and name HB   )) ((resid   18 and name HN   ))   3.22  1.42  0.00 ! #SUP  5.85
assign  ((resid   18 and name HN   )) ((resid   18 and name HB1  ))   3.44  1.64  0.00 ! #SUP  6.16
assign  ((resid   12 and name HN   )) ((resid   13 and name HD2  ))   3.94  2.14  0.00 ! #SUP  6.73
assign  ((resid   67 and name HN   )) ((resid   68 and name HN   ))   4.03  2.23  0.00 ! #SUP  7.59
assign  ((resid   64 and name HA   )) ((resid   67 and name HN   ))   4.69  2.89  0.00 ! #SUP  3.87
assign  ((resid   16 and name HA   )) ((resid   18 and name HN   ))   4.99  3.19  0.00 ! #SUP  6.05
assign  ((resid   40 and name HN   )) ((resid   42 and name HN   ))   4.64  2.84  0.00 ! #SUP  5.21
assign  ((resid   42 and name HN   )) ((resid   42 and name HB   ))   3.36  1.56  0.00 ! #SUP  5.88
assign  ((resid   11 and name HB2  )) ((resid   12 and name HN   ))   3.80  2.00  0.00 ! #SUP  6.62
assign  ((resid   15 and name HN   )) ((resid   15 and name HB2  ))   3.07  1.27  0.00 ! #SUP  8.22
assign  ((resid   15 and name HN   )) ((resid   15 and name HD1* ))   4.63  2.83  0.00 ! #SUP  7.90
assign  ((resid   53 and name HB   )) ((resid   54 and name HN   ))   3.99  2.19  0.00 ! #SUP  7.04
assign  ((resid   53 and name HG1* )) ((resid   54 and name HN   ))   3.88  2.08  0.00 ! #SUP  6.07
assign  ((resid    9 and name HD2  )) ((resid   15 and name HN   ))   5.10  3.30  0.00 ! #SUP  3.99
assign  ((resid   15 and name HN   )) ((resid   15 and name HG   ))   4.36  2.56  0.00 ! #SUP  8.46
assign  ((resid   77 and name HN   )) ((resid   78 and name HD2  ))   4.76  2.96  0.00 ! #SUP  4.10
assign  ((resid   77 and name HN   )) ((resid   78 and name HB1  ))   4.34  2.54  0.00 ! #SUP  5.94
assign  ((resid   31 and name HA   )) ((resid   32 and name HN   ))   3.50  1.70  0.00 ! #SUP  6.99
assign  ((resid   30 and name HB1  )) ((resid   32 and name HN   ))   4.85  3.05  0.00 ! #SUP  3.61
assign  ((resid   32 and name HN   )) ((resid   32 and name HD*  ))   3.83  2.03  0.00 ! #SUP  7.70
assign  ((resid   47 and name HN   )) ((resid   47 and name HD*  ))   4.64  2.84  0.00 ! #SUP  7.47
assign  ((resid   47 and name HN   )) ((resid   47 and name HB2  ))   3.03  1.23  0.00 ! #SUP  7.42
assign  ((resid   60 and name HB1  )) ((resid   61 and name HN   ))   3.99  2.19  0.00 ! #SUP  5.35
assign  ((resid   10 and name HN   )) ((resid   10 and name HB1  ))   3.53  1.73  0.00 ! #SUP  5.69
assign  ((resid   10 and name HN   )) ((resid   10 and name HB2  ))   3.73  1.93  0.00 ! #SUP  6.15
assign  ((resid   52 and name HD1* )) ((resid   61 and name HN   ))   4.70  2.90  0.00 ! #SUP  1.14
assign  ((resid   23 and name HN   )) ((resid   23 and name HG11 ))   3.84  2.04  0.00 ! #SUP  8.14
assign  ((resid   23 and name HN   )) ((resid   23 and name HD1* ))   4.32  2.52  0.00 ! #SUP  8.13
assign  ((resid   23 and name HN   )) ((resid   23 and name HG2* ))   3.61  1.81  0.00 ! #SUP  8.34
assign  ((resid   54 and name HB2  )) ((resid   55 and name HN   ))   4.14  2.34  0.00 ! #SUP  5.62
assign  ((resid   35 and name HG*  )) ((resid   36 and name HN   ))   3.94  2.14  0.00 ! #SUP  7.48
assign  ((resid   36 and name HN   )) ((resid   36 and name HG1  ))   3.60  1.80  0.00 ! #SUP  7.70
assign  ((resid   36 and name HN   )) ((resid   36 and name HB2  ))   2.82  1.02  0.00 ! #SUP  6.55
assign  ((resid   16 and name HB2  )) ((resid   23 and name HN   ))   4.83  3.03  0.00 ! #SUP  2.96
assign  ((resid    2 and name HB2  )) ((resid    3 and name HN   ))   4.39  2.59  0.00 ! #SUP  4.57
assign  ((resid    7 and name HA   )) ((resid    8 and name HN   ))   3.07  1.27  0.00 ! #SUP  5.63
assign  ((resid    7 and name HB1  )) ((resid    8 and name HN   ))   4.63  2.83  0.00 ! #SUP  5.93
assign  ((resid    8 and name HN   )) ((resid    8 and name HB*  ))   3.69  1.89  0.00 ! #SUP  6.37
assign  ((resid    8 and name HN   )) ((resid    8 and name HG*  ))   3.18  1.38  0.00 ! #SUP  8.00
assign  ((resid   25 and name HB2  )) ((resid   26 and name HN   ))   4.18  2.38  0.00 ! #SUP  5.48
assign  ((resid   25 and name HB1  )) ((resid   26 and name HN   ))   3.98  2.18  0.00 ! #SUP  5.93
assign  ((resid   21 and name HG2* )) ((resid   26 and name HN   ))   4.65  2.85  0.00 ! #SUP  5.92
assign  ((resid   72 and name HN   )) ((resid   72 and name HG2  ))   4.96  3.16  0.00 ! #SUP  4.19
assign  ((resid   72 and name HN   )) ((resid   72 and name HB2  ))   4.19  2.39  0.00 ! #SUP  4.33
assign  ((resid   42 and name HG2* )) ((resid   44 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.53
assign  ((resid    2 and name HN   )) ((resid    2 and name HB1  ))   3.73  1.93  0.00 ! #SUP  4.67
assign  ((resid   76 and name HN   )) ((resid   76 and name HB1  ))   3.50  1.70  0.00 ! #SUP  3.76
assign  ((resid   75 and name HA   )) ((resid   76 and name HN   ))   3.59  1.79  0.00 ! #SUP  4.11
assign  ((resid   73 and name HG2* )) ((resid   76 and name HN   ))   5.45  3.65  0.00 ! #SUP  1.84
assign  ((resid   65 and name HN   )) ((resid   65 and name HB2  ))   2.96  1.16  0.00 ! #SUP  8.68
assign  ((resid   65 and name HN   )) ((resid   65 and name HD*  ))   3.58  1.78  0.00 ! #SUP  8.52
assign  ((resid   58 and name HN   )) ((resid   59 and name HA   ))   4.93  3.13  0.00 ! #SUP  6.04
assign  ((resid   58 and name HN   )) ((resid   58 and name HB2  ))   3.18  1.38  0.00 ! #SUP  6.01
assign  ((resid    4 and name HA   )) ((resid    7 and name HN   ))   4.78  2.98  0.00 ! #SUP  0.75
assign  ((resid    7 and name HN   )) ((resid    8 and name HG*  ))   5.13  3.33  0.00 ! #SUP  5.33
assign  ((resid   29 and name HN   )) ((resid   60 and name HD*  ))   4.30  2.50  0.00 ! #SUP  6.03
assign  ((resid   29 and name HN   )) ((resid   60 and name HA   ))   4.21  2.41  0.00 ! #SUP  4.35
assign  ((resid   29 and name HN   )) ((resid   29 and name HB2  ))   3.64  1.84  0.00 ! #SUP  6.54
assign  ((resid   69 and name HN   )) ((resid   70 and name HN   ))   4.09  2.29  0.00 ! #SUP  5.80
assign  ((resid   69 and name HN   )) ((resid   69 and name HB1  ))   3.24  1.44  0.00 ! #SUP  5.18
assign  ((resid   68 and name HB*  )) ((resid   69 and name HN   ))   3.70  1.90  0.00 ! #SUP  4.85
assign  ((resid   69 and name HN   )) ((resid   69 and name HD*  ))   4.48  2.68  0.00 ! #SUP  6.04
assign  ((resid   73 and name HN   )) ((resid   73 and name HB   ))   3.35  1.55  0.00 ! #SUP  6.32
assign  ((resid   72 and name HG1  )) ((resid   73 and name HN   ))   3.87  2.07  0.00 ! #SUP  4.45
assign  ((resid   37 and name HD2* )) ((resid   64 and name HN   ))   5.34  3.54  0.00 ! #SUP  4.55
assign  ((resid   49 and name HN   )) ((resid   49 and name HA   ))   2.90  1.10  0.00 ! #SUP  6.48
assign  ((resid   48 and name HG1  )) ((resid   49 and name HN   ))   4.80  3.00  0.00 ! #SUP  8.47
assign  ((resid   30 and name HB2  )) ((resid   35 and name HN   ))   3.67  1.87  0.00 ! #SUP  2.16
assign  ((resid   34 and name HN   )) ((resid   35 and name HN   ))   3.70  1.90  0.00 ! #SUP  7.16
assign  ((resid   70 and name HN   )) ((resid   70 and name HB1  ))   3.59  1.79  0.00 ! #SUP  4.28
assign  ((resid   69 and name HD*  )) ((resid   70 and name HN   ))   5.13  3.33  0.00 ! #SUP  6.01
assign  ((resid   60 and name HN   )) ((resid   60 and name HB2  ))   4.07  2.27  0.00 ! #SUP  5.90
assign  ((resid   32 and name HB1  )) ((resid   33 and name HN   ))   4.01  2.21  0.00 ! #SUP  6.72
assign  ((resid   33 and name HN   )) ((resid   34 and name HA   ))   4.22  2.42  0.00 ! #SUP  5.52
assign  ((resid   32 and name HB2  )) ((resid   33 and name HN   ))   3.47  1.67  0.00 ! #SUP  6.56
assign  ((resid   30 and name HB1  )) ((resid   34 and name HN   ))   4.03  2.23  0.00 ! #SUP  3.17
assign  ((resid   41 and name HN   )) ((resid   42 and name HG2* ))   4.70  2.90  0.00 ! #SUP  4.90
assign  ((resid   40 and name HG*  )) ((resid   41 and name HN   ))   3.91  2.11  0.00 ! #SUP  6.15
assign  ((resid   53 and name HG2* )) ((resid   60 and name HN   ))   5.47  3.67  0.00 ! #SUP  4.32
assign  ((resid   31 and name HB   )) ((resid   60 and name HN   ))   5.50  3.70  0.00 ! #SUP  2.62
assign  ((resid    4 and name HA   )) ((resid    6 and name HN   ))   4.38  2.58  0.00 ! #SUP  4.93
assign  ((resid    6 and name HN   )) ((resid    6 and name HG*  ))   3.57  1.77  0.00 ! #SUP  6.60
assign  ((resid    6 and name HN   )) ((resid    6 and name HB2  ))   2.98  1.18  0.00 ! #SUP  6.32
assign  ((resid   23 and name HG12 )) ((resid   24 and name HN   ))   4.68  2.88  0.00 ! #SUP  8.49
assign  ((resid   23 and name HD1* )) ((resid   24 and name HN   ))   5.31  3.51  0.00 ! #SUP  9.55
assign  ((resid   23 and name HG2* )) ((resid   24 and name HN   ))   3.88  2.08  0.00 ! #SUP  9.34
assign  ((resid   24 and name HN   )) ((resid   24 and name HE1  ))   4.67  2.87  0.00 ! #SUP  7.62
assign  ((resid   48 and name HN   )) ((resid   48 and name HD1  ))   4.66  2.86  0.00 ! #SUP  7.03
assign  ((resid   68 and name HN   )) ((resid   68 and name HG*  ))   4.43  2.63  0.00 ! #SUP  5.31
assign  ((resid   45 and name HB1  )) ((resid   46 and name HN   ))   3.26  1.46  0.00 ! #SUP  4.52
assign  ((resid   47 and name HB2  )) ((resid   48 and name HN   ))   3.46  1.66  0.00 ! #SUP  7.26
assign  ((resid   48 and name HN   )) ((resid   49 and name HA   ))   4.71  2.91  0.00 ! #SUP  4.10
assign  ((resid   48 and name HN   )) ((resid   48 and name HB2  ))   3.21  1.41  0.00 ! #SUP  7.90
assign  ((resid   48 and name HN   )) ((resid   48 and name HG1  ))   3.38  1.58  0.00 ! #SUP  7.11
assign  ((resid   19 and name HN   )) ((resid   19 and name HG   ))   3.30  1.50  0.00 ! #SUP  6.82
assign  ((resid   19 and name HN   )) ((resid   19 and name HB2  ))   3.17  1.37  0.00 ! #SUP  7.25
assign  ((resid   19 and name HN   )) ((resid   19 and name HD1* ))   3.83  2.03  0.00 ! #SUP  8.38
assign  ((resid   43 and name HN   )) ((resid   43 and name HD*  ))   3.70  1.90  0.00 ! #SUP  6.46
assign  ((resid   43 and name HN   )) ((resid   43 and name HB*  ))   3.12  1.32  0.00 ! #SUP  5.83
assign  ((resid   42 and name HG2* )) ((resid   43 and name HN   ))   3.71  1.91  0.00 ! #SUP  7.17
assign  ((resid   11 and name HN   )) ((resid   11 and name HB1  ))   3.58  1.78  0.00 ! #SUP  5.22
assign  ((resid   49 and name HN   )) ((resid   50 and name HN   ))   3.47  1.67  0.00 ! #SUP  8.94
assign  ((resid   48 and name HB1  )) ((resid   50 and name HN   ))   4.37  2.57  0.00 ! #SUP  3.90
assign  ((resid   50 and name HN   )) ((resid   50 and name HB2  ))   3.38  1.58  0.00 ! #SUP  6.68
assign  ((resid   17 and name HN   )) ((resid   18 and name HB2  ))   4.39  2.59  0.00 ! #SUP  3.27
assign  ((resid   14 and name HN   )) ((resid   14 and name HB2  ))   3.14  1.34  0.00 ! #SUP  7.70
assign  ((resid   14 and name HN   )) ((resid   15 and name HB1  ))   5.44  3.64  0.00 ! #SUP  6.93
assign  ((resid   51 and name HN   )) ((resid   51 and name HB1  ))   3.79  1.99  0.00 ! #SUP  4.49
assign  ((resid   50 and name HB2  )) ((resid   51 and name HN   ))   3.75  1.95  0.00 ! #SUP  4.66
assign  ((resid   15 and name HD1* )) ((resid   16 and name HN   ))   4.54  2.74  0.00 ! #SUP  7.27
assign  ((resid   13 and name HA   )) ((resid   16 and name HN   ))   3.61  1.81  0.00 ! #SUP  4.43
assign  ((resid   70 and name HD*  )) ((resid   71 and name HN   ))   5.43  3.63  0.00 ! #SUP  4.38
assign  ((resid   25 and name HN   )) ((resid   26 and name HA   ))   4.77  2.97  0.00 ! #SUP  6.85
assign  ((resid   24 and name HB2  )) ((resid   25 and name HN   ))   4.44  2.64  0.00 ! #SUP  5.94
assign  ((resid   33 and name HB2  )) ((resid   35 and name HE21 ))   5.14  3.34  0.00 ! #SUP  1.93
assign  ((resid   24 and name HN   )) ((resid   25 and name HN   ))   3.32  1.52  0.00 ! #SUP  8.81
assign  ((resid   35 and name HA   )) ((resid   35 and name HE21 ))   4.67  2.87  0.00 ! #SUP  4.82
assign  ((resid   35 and name HB1  )) ((resid   35 and name HE21 ))   4.81  3.01  0.00 ! #SUP  4.74
assign  ((resid   58 and name HA   )) ((resid   58 and name HD21 ))   4.97  3.17  0.00 ! #SUP  4.34
assign  ((resid   58 and name HB2  )) ((resid   58 and name HD22 ))   3.85  2.05  0.00 ! #SUP  3.44
assign  ((resid   35 and name HA   )) ((resid   35 and name HE22 ))   5.06  3.26  0.00 ! #SUP  4.13
assign  ((resid   35 and name HG*  )) ((resid   35 and name HE22 ))   3.88  2.08  0.00 ! #SUP  4.84
assign  ((resid   35 and name HB1  )) ((resid   35 and name HE22 ))   5.03  3.23  0.00 ! #SUP  4.16
assign  ((resid   58 and name HB2  )) ((resid   58 and name HD21 ))   3.54  1.74  0.00 ! #SUP  4.42
assign  ((resid   58 and name HN   )) ((resid   58 and name HD22 ))   5.17  3.37  0.00 ! #SUP  5.46
assign  ((resid   40 and name HN   )) ((resid   43 and name HN   ))   5.04  3.24  0.00 ! #SUP  2.68
assign  ((resid   40 and name HN   )) ((resid   40 and name HB2  ))   3.12  1.32  0.00 ! #SUP  6.73
assign  ((resid   20 and name HA   )) ((resid   21 and name HN   ))   2.88  1.08  0.00 ! #SUP  5.78
assign  ((resid   19 and name HB1  )) ((resid   21 and name HN   ))   4.63  2.83  0.00 ! #SUP  4.04
assign  ((resid   14 and name HG2  )) ((resid   14 and name HE21 ))   3.79  1.99  0.00 ! #SUP  3.95
assign  ((resid    9 and name HG*  )) ((resid   14 and name HE22 ))   5.43  3.63  0.00 ! #SUP  0.89
assign  ((resid    6 and name HG*  )) ((resid    6 and name HE21 ))   3.66  1.86  0.00 ! #SUP  3.23
assign  ((resid    3 and name HE22 )) ((resid    4 and name HA   ))   4.14  2.34  0.00 ! #SUP  3.13
assign  ((resid   20 and name HG*  )) ((resid   20 and name HE22 ))   3.72  1.92  0.00 ! #SUP  3.55
assign  ((resid   36 and name HB1  )) ((resid   36 and name HE21 ))   4.72  2.92  0.00 ! #SUP  5.20
assign  ((resid    3 and name HE21 )) ((resid    4 and name HA   ))   4.22  2.42  0.00 ! #SUP  2.60
assign  ((resid   36 and name HA   )) ((resid   36 and name HE21 ))   5.23  3.43  0.00 ! #SUP  6.16
assign  ((resid   27 and name HD1* )) ((resid   36 and name HE21 ))   4.26  2.46  0.00 ! #SUP  1.44
assign  ((resid   27 and name HD1* )) ((resid   36 and name HE22 ))   4.18  2.38  0.00 ! #SUP  1.53
assign  ((resid   22 and name HN   )) ((resid   26 and name HB   ))   4.75  2.95  0.00 ! #SUP  4.03
assign  ((resid   54 and name HD*  )) ((resid   57 and name HN   ))   5.10  3.30  0.00 ! #SUP  3.12
assign  ((resid   56 and name HB1  )) ((resid   57 and name HN   ))   4.29  2.49  0.00 ! #SUP  3.96
assign  ((resid    2 and name HE*  )) ((resid   54 and name HE*  ))   4.57  2.77  0.00 ! #SUP  1.08
assign  ((resid    2 and name HD*  )) ((resid   54 and name HE*  ))   3.94  2.14  0.00 ! #SUP  1.50
assign  ((resid    2 and name HB1  )) ((resid   54 and name HE*  ))   4.76  2.96  0.00 ! #SUP  1.09
assign  ((resid    9 and name HG*  )) ((resid   54 and name HE*  ))   4.45  2.65  0.00 ! #SUP  1.68
assign  ((resid   55 and name HG1  )) ((resid   32 and name HN   ))   4.52  2.72  0.00 ! #SUP  3.89
assign  ((resid   12 and name HD1* )) ((resid   46 and name HN   ))   5.02  3.22  0.00 ! #SUP  0.02
assign  ((resid   54 and name HA   )) ((resid   60 and name HE*  ))   3.90  2.10  0.00 ! #SUP  2.86
assign  ((resid   24 and name HA   )) ((resid   43 and name HE*  ))   3.32  1.52  0.00 ! #SUP  0.02
assign  ((resid   55 and name HA   )) ((resid   31 and name HG2* ))   4.60  2.80  0.00 ! #SUP  0.01
assign  ((resid   10 and name HA   )) ((resid   52 and name HD1* ))   4.03  2.23  0.00 ! #SUP  0.02
assign  ((resid   30 and name HB2  )) ((resid   63 and name HN   ))   5.16  3.36  0.00 ! #SUP  0.02
assign  ((resid   37 and name HN   )) ((resid   28 and name HN   ))   4.51  2.71  0.00 ! #SUP  1.34
assign  ((resid   59 and name HD3  )) ((resid    8 and name HN   ))   5.15  3.35  0.00 ! #SUP  1.29
assign  ((resid   41 and name HG2  )) ((resid   64 and name HN   ))   5.00  3.20  0.00 ! #SUP  0.75
assign  ((resid   41 and name HG1  )) ((resid   64 and name HB2  ))   4.66  2.86  0.00 ! #SUP  0.75
assign  ((resid   41 and name HG2  )) ((resid   64 and name HB2  ))   4.22  2.42  0.00 ! #SUP  0.75
assign  ((resid   31 and name HN   )) ((resid   61 and name HB*  ))   4.87  3.07  0.00 ! #SUP  0.75
assign  ((resid   29 and name HB2  )) ((resid   60 and name HB2  ))   5.34  3.54  0.00 ! #SUP  2.17
assign  ((resid   30 and name HA   )) ((resid   63 and name HN   ))   4.04  2.24  0.00 ! #SUP  4.61
assign  ((resid   30 and name HN   )) ((resid   63 and name HN   ))   4.77  2.97  0.00 ! #SUP  0.02
assign  ((resid   31 and name HN   )) ((resid   62 and name HA   ))   3.87  2.07  0.00 ! #SUP  5.96
assign  ((resid   31 and name HA   )) ((resid   60 and name HE*  ))   3.65  1.85  0.00 ! #SUP  2.39
assign  ((resid   31 and name HG2* )) ((resid   60 and name HE*  ))   4.68  2.88  0.00 ! #SUP  3.56
assign  ((resid   31 and name HG1* )) ((resid   62 and name HA   ))   4.79  2.99  0.00 ! #SUP  4.41
assign  ((resid   31 and name HG1* )) ((resid   61 and name HA   ))   4.72  2.92  0.00 ! #SUP  2.85
assign  ((resid   31 and name HG1* )) ((resid   61 and name HB*  ))   4.19  2.39  0.00 ! #SUP  7.17
assign  ((resid   31 and name HG1* )) ((resid   62 and name HG1* ))   5.29  3.49  0.00 ! #SUP  8.18
assign  ((resid   32 and name HD*  )) ((resid   62 and name HG1* ))   3.67  1.87  0.00 ! #SUP  4.66
assign  ((resid   32 and name HE*  )) ((resid   62 and name HB   ))   4.82  3.02  0.00 ! #SUP  1.50
assign  ((resid   32 and name HE*  )) ((resid   62 and name HG1* ))   3.84  2.04  0.00 ! #SUP  5.53
assign  ((resid   32 and name HE*  )) ((resid   62 and name HG2* ))   3.78  1.98  0.00 ! #SUP  5.34
assign  ((resid   32 and name HN   )) ((resid   62 and name HG2* ))   5.19  3.39  0.00 ! #SUP  5.56
assign (resid 1 and name C) (resid 2 and name N) (resid 2 and name CA) (resid 2 and name C) 1.0 -78.33 24.56 2
assign (resid 2 and name N) (resid 2 and name CA) (resid 2 and name C) (resid 3 and name N) 1.0 119.16 55.28 2
assign (resid 2 and name C) (resid 3 and name N) (resid 3 and name CA) (resid 3 and name C) 1.0 -84.65 34.46 2
assign (resid 3 and name N) (resid 3 and name CA) (resid 3 and name C) (resid 4 and name N) 1.0 132.27 39.04 2
assign (resid 3 and name C) (resid 4 and name N) (resid 4 and name CA) (resid 4 and name C) 1.0 -71.93 20.20 2
assign (resid 4 and name N) (resid 4 and name CA) (resid 4 and name C) (resid 5 and name N) 1.0 133.51 36.78 2
assign (resid 10 and name C) (resid 11 and name N) (resid 11 and name CA) (resid 11 and name C) 1.0 -115.81 42.78 2
assign (resid 11 and name N) (resid 11 and name CA) (resid 11 and name C) (resid 12 and name N) 1.0 143.04 35.04 2
assign (resid 11 and name C) (resid 12 and name N) (resid 12 and name CA) (resid 12 and name C) 1.0 -59.38 8.48 2
assign (resid 12 and name N) (resid 12 and name CA) (resid 12 and name C) (resid 13 and name N) 1.0 -44.18 14.46 2
assign (resid 12 and name C) (resid 13 and name N) (resid 13 and name CA) (resid 13 and name C) 1.0 -60.55 15.04 2
assign (resid 13 and name N) (resid 13 and name CA) (resid 13 and name C) (resid 14 and name N) 1.0 -42.68 7.98 2
assign (resid 13 and name C) (resid 14 and name N) (resid 14 and name CA) (resid 14 and name C) 1.0 -70.98 16.66 2
assign (resid 14 and name N) (resid 14 and name CA) (resid 14 and name C) (resid 15 and name N) 1.0 -37.51 12.90 2
assign (resid 14 and name C) (resid 15 and name N) (resid 15 and name CA) (resid 15 and name C) 1.0 -65.83 7.20 2
assign (resid 15 and name N) (resid 15 and name CA) (resid 15 and name C) (resid 16 and name N) 1.0 -43.90 8.38 2
assign (resid 15 and name C) (resid 16 and name N) (resid 16 and name CA) (resid 16 and name C) 1.0 -63.61 14.70 2
assign (resid 16 and name N) (resid 16 and name CA) (resid 16 and name C) (resid 17 and name N) 1.0 -39.33 20.02 2
assign (resid 16 and name C) (resid 17 and name N) (resid 17 and name CA) (resid 17 and name C) 1.0 -64.86 8.16 2
assign (resid 17 and name N) (resid 17 and name CA) (resid 17 and name C) (resid 18 and name N) 1.0 -38.00 9.30 2
assign (resid 17 and name C) (resid 18 and name N) (resid 18 and name CA) (resid 18 and name C) 1.0 -62.50 12.74 2
assign (resid 18 and name N) (resid 18 and name CA) (resid 18 and name C) (resid 19 and name N) 1.0 -31.17 25.58 2
assign (resid 18 and name C) (resid 19 and name N) (resid 19 and name CA) (resid 19 and name C) 1.0 -90.60 19.92 2
assign (resid 19 and name N) (resid 19 and name CA) (resid 19 and name C) (resid 20 and name N) 1.0 5.17 31.98 2
assign (resid 21 and name C) (resid 22 and name N) (resid 22 and name CA) (resid 22 and name C) 1.0 -123.70 24.28 2
assign (resid 22 and name N) (resid 22 and name CA) (resid 22 and name C) (resid 23 and name N) 1.0 158.90 26.84 2
assign (resid 25 and name C) (resid 26 and name N) (resid 26 and name CA) (resid 26 and name C) 1.0 -91.36 46.00 2
assign (resid 26 and name N) (resid 26 and name CA) (resid 26 and name C) (resid 27 and name N) 1.0 127.27 15.76 2
assign (resid 26 and name C) (resid 27 and name N) (resid 27 and name CA) (resid 27 and name C) 1.0 -99.59 33.20 2
assign (resid 27 and name N) (resid 27 and name CA) (resid 27 and name C) (resid 28 and name N) 1.0 122.32 35.78 2
assign (resid 27 and name C) (resid 28 and name N) (resid 28 and name CA) (resid 28 and name C) 1.0 -118.62 28.72 2
assign (resid 28 and name N) (resid 28 and name CA) (resid 28 and name C) (resid 29 and name N) 1.0 140.70 19.38 2
assign (resid 28 and name C) (resid 29 and name N) (resid 29 and name CA) (resid 29 and name C) 1.0 -118.53 24.84 2
assign (resid 29 and name C) (resid 30 and name N) (resid 30 and name CA) (resid 30 and name C) 1.0 -121.02 53.10 2
assign (resid 30 and name N) (resid 30 and name CA) (resid 30 and name C) (resid 31 and name N) 1.0 123.64 20.08 2
assign (resid 31 and name C) (resid 32 and name N) (resid 32 and name CA) (resid 32 and name C) 1.0 -97.51 30.40 2
assign (resid 32 and name N) (resid 32 and name CA) (resid 32 and name C) (resid 33 and name N) 1.0 -29.53 41.34 2
assign (resid 35 and name C) (resid 36 and name N) (resid 36 and name CA) (resid 36 and name C) 1.0 -69.58 24.78 2
assign (resid 36 and name N) (resid 36 and name CA) (resid 36 and name C) (resid 37 and name N) 1.0 121.45 16.60 2
assign (resid 36 and name C) (resid 37 and name N) (resid 37 and name CA) (resid 37 and name C) 1.0 -76.41 26.62 2
assign (resid 37 and name N) (resid 37 and name CA) (resid 37 and name C) (resid 38 and name N) 1.0 125.44 22.78 2
assign (resid 37 and name C) (resid 38 and name N) (resid 38 and name CA) (resid 38 and name C) 1.0 -119.43 63.80 2
assign (resid 38 and name N) (resid 38 and name CA) (resid 38 and name C) (resid 39 and name N) 1.0 116.15 14.18 2
assign (resid 38 and name C) (resid 39 and name N) (resid 39 and name CA) (resid 39 and name C) 1.0 -61.87 11.28 2
assign (resid 39 and name N) (resid 39 and name CA) (resid 39 and name C) (resid 40 and name N) 1.0 -29.11 27.86 2
assign (resid 39 and name C) (resid 40 and name N) (resid 40 and name CA) (resid 40 and name C) 1.0 -60.34 13.08 2
assign (resid 40 and name N) (resid 40 and name CA) (resid 40 and name C) (resid 41 and name N) 1.0 -39.93 11.60 2
assign (resid 40 and name C) (resid 41 and name N) (resid 41 and name CA) (resid 41 and name C) 1.0 -67.34 15.20 2
assign (resid 41 and name N) (resid 41 and name CA) (resid 41 and name C) (resid 42 and name N) 1.0 -38.32 15.72 2
assign (resid 41 and name C) (resid 42 and name N) (resid 42 and name CA) (resid 42 and name C) 1.0 -61.44 6.80 2
assign (resid 42 and name N) (resid 42 and name CA) (resid 42 and name C) (resid 43 and name N) 1.0 -41.81 6.46 2
assign (resid 42 and name C) (resid 43 and name N) (resid 43 and name CA) (resid 43 and name C) 1.0 -64.75 25.14 2
assign (resid 43 and name N) (resid 43 and name CA) (resid 43 and name C) (resid 44 and name N) 1.0 -35.47 33.88 2
assign (resid 43 and name C) (resid 44 and name N) (resid 44 and name CA) (resid 44 and name C) 1.0 -67.62 15.48 2
assign (resid 44 and name N) (resid 44 and name CA) (resid 44 and name C) (resid 45 and name N) 1.0 -42.97 19.20 2
assign (resid 44 and name C) (resid 45 and name N) (resid 45 and name CA) (resid 45 and name C) 1.0 -63.47 7.14 2
assign (resid 45 and name N) (resid 45 and name CA) (resid 45 and name C) (resid 46 and name N) 1.0 -42.70 7.52 2
assign (resid 45 and name C) (resid 46 and name N) (resid 46 and name CA) (resid 46 and name C) 1.0 -69.34 15.14 2
assign (resid 46 and name N) (resid 46 and name CA) (resid 46 and name C) (resid 47 and name N) 1.0 -34.27 20.92 2
assign (resid 51 and name C) (resid 52 and name N) (resid 52 and name CA) (resid 52 and name C) 1.0 -109.26 27.94 2
assign (resid 52 and name N) (resid 52 and name CA) (resid 52 and name C) (resid 53 and name N) 1.0 116.23 41.76 2
assign (resid 52 and name C) (resid 53 and name N) (resid 53 and name CA) (resid 53 and name C) 1.0 -117.59 25.96 2
assign (resid 53 and name N) (resid 53 and name CA) (resid 53 and name C) (resid 54 and name N) 1.0 124.86 11.04 2
assign (resid 53 and name C) (resid 54 and name N) (resid 54 and name CA) (resid 54 and name C) 1.0 -119.21 24.12 2
assign (resid 54 and name N) (resid 54 and name CA) (resid 54 and name C) (resid 55 and name N) 1.0 128.10 17.58 2
assign (resid 54 and name C) (resid 55 and name N) (resid 55 and name CA) (resid 55 and name C) 1.0 -117.91 54.92 2
assign (resid 55 and name N) (resid 55 and name CA) (resid 55 and name C) (resid 56 and name N) 1.0 128.71 23.22 2
assign (resid 57 and name C) (resid 58 and name N) (resid 58 and name CA) (resid 58 and name C) 1.0 -107.58 35.28 2
assign (resid 58 and name N) (resid 58 and name CA) (resid 58 and name C) (resid 59 and name N) 1.0 135.28 59.90 2
assign (resid 59 and name C) (resid 60 and name N) (resid 60 and name CA) (resid 60 and name C) 1.0 -129.13 35.56 2
assign (resid 60 and name N) (resid 60 and name CA) (resid 60 and name C) (resid 61 and name N) 1.0 140.19 31.78 2
assign (resid 61 and name C) (resid 62 and name N) (resid 62 and name CA) (resid 62 and name C) 1.0 -123.25 24.50 2
assign (resid 62 and name N) (resid 62 and name CA) (resid 62 and name C) (resid 63 and name N) 1.0 131.34 19.16 2
assign (resid 63 and name C) (resid 64 and name N) (resid 64 and name CA) (resid 64 and name C) 1.0 -57.99 13.52 2
assign (resid 64 and name N) (resid 64 and name CA) (resid 64 and name C) (resid 65 and name N) 1.0 -41.55 25.12 2
assign (resid 64 and name C) (resid 65 and name N) (resid 65 and name CA) (resid 65 and name C) 1.0 -66.96 15.12 2
assign (resid 65 and name N) (resid 65 and name CA) (resid 65 and name C) (resid 66 and name N) 1.0 -38.48 18.54 2
assign (resid 65 and name C) (resid 66 and name N) (resid 66 and name CA) (resid 66 and name C) 1.0 -63.76 8.26 2
assign (resid 66 and name N) (resid 66 and name CA) (resid 66 and name C) (resid 67 and name N) 1.0 -38.38 19.58 2
assign (resid 66 and name C) (resid 67 and name N) (resid 67 and name CA) (resid 67 and name C) 1.0 -66.19 13.88 2
assign (resid 67 and name N) (resid 67 and name CA) (resid 67 and name C) (resid 68 and name N) 1.0 -39.14 25.08 2
assign (resid 67 and name C) (resid 68 and name N) (resid 68 and name CA) (resid 68 and name C) 1.0 -68.01 11.38 2
assign (resid 68 and name N) (resid 68 and name CA) (resid 68 and name C) (resid 69 and name N) 1.0 -34.57 20.78 2
assign (resid 68 and name C) (resid 69 and name N) (resid 69 and name CA) (resid 69 and name C) 1.0 -66.11 9.42 2
assign (resid 69 and name N) (resid 69 and name CA) (resid 69 and name C) (resid 70 and name N) 1.0 -39.47 12.38 2
assign (resid 71 and name C) (resid 72 and name N) (resid 72 and name CA) (resid 72 and name C) 1.0 -67.37 23.54 2
assign (resid 72 and name N) (resid 72 and name CA) (resid 72 and name C) (resid 73 and name N) 1.0 -37.06 19.44 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY  -1           HT1      GLY  -1  60.013  -8.061   7.142
    2    H2   GLY  -1           HT2      GLY  -1  61.102  -7.218   6.190
    3    H3   GLY  -1           HT3      GLY  -1  59.660  -7.842   5.512
    4    HA2  GLY  -1           HA1      GLY  -1  58.384  -6.368   6.920
    5    HA3  GLY  -1           HA2      GLY  -1  59.890  -5.716   7.548
    6    H    ALA   0           HN       ALA   0  60.196  -6.454   4.208
    7    HA   ALA   0           HA       ALA   0  59.250  -3.829   3.445
    8    HB1  ALA   0           HB1      ALA   0  61.325  -3.335   2.251
    9    HB2  ALA   0           HB2      ALA   0  62.026  -4.847   2.815
   10    HB3  ALA   0           HB3      ALA   0  61.645  -3.570   3.969
   11    H    MET   1           HN       MET   1  57.804  -4.266   1.945
   12    HA   MET   1           HA       MET   1  58.488  -6.046  -0.280
   13    HB2  MET   1           HB2      MET   1  57.097  -7.205   1.555
   14    HB3  MET   1           HB1      MET   1  55.820  -6.090   1.150
   15    HG2  MET   1           HG2      MET   1  56.969  -7.991  -0.878
   16    HG3  MET   1           HG1      MET   1  55.722  -8.492   0.243
   17    HE1  MET   1           HE1      MET   1  55.200  -6.051  -3.593
   18    HE2  MET   1           HE2      MET   1  56.511  -7.162  -3.186
   19    HE3  MET   1           HE3      MET   1  56.441  -5.560  -2.451
   20    H    PHE   2           HN       PHE   2  58.654  -4.404  -1.724
   21    HA   PHE   2           HA       PHE   2  56.661  -2.286  -1.761
   22    HB2  PHE   2           HB2      PHE   2  59.340  -2.236  -1.623
   23    HB3  PHE   2           HB1      PHE   2  59.118  -2.207  -3.352
   24    HD1  PHE   2           HD1      PHE   2  56.746  -0.563  -1.079
   25    HD2  PHE   2           HD2      PHE   2  60.121  -0.158  -3.574
   26    HE1  PHE   2           HE1      PHE   2  56.482   1.879  -1.014
   27    HE2  PHE   2           HE2      PHE   2  59.927   2.214  -3.563
   28    HZ   PHE   2           HZ       PHE   2  58.052   3.302  -2.248
   29    H    GLN   3           HN       GLN   3  55.220  -2.283  -3.358
   30    HA   GLN   3           HA       GLN   3  55.701  -3.846  -5.812
   31    HB2  GLN   3           HB2      GLN   3  53.794  -4.183  -3.864
   32    HB3  GLN   3           HB1      GLN   3  52.957  -3.168  -5.018
   33    HG2  GLN   3           HG2      GLN   3  54.315  -5.706  -5.754
   34    HG3  GLN   3           HG1      GLN   3  52.649  -5.668  -5.192
   35   HE21  GLN   3          HE21      GLN   3  52.097  -3.129  -6.673
   36   HE22  GLN   3          HE22      GLN   3  52.007  -3.550  -8.325
   37    H    ASP   4           HN       ASP   4  54.456  -2.986  -7.658
   38    HA   ASP   4           HA       ASP   4  54.906  -0.432  -8.498
   39    HB2  ASP   4           HB2      ASP   4  54.386  -2.150 -10.059
   40    HB3  ASP   4           HB1      ASP   4  52.827  -2.456  -9.324
   41    HA   PRO   5           HA       PRO   5  53.911   1.309  -9.913
   42    HB2  PRO   5           HB2      PRO   5  53.350   3.828  -9.991
   43    HB3  PRO   5           HB1      PRO   5  52.116   2.517  -9.989
   44    HG2  PRO   5           HG2      PRO   5  52.958   4.097  -7.587
   45    HG3  PRO   5           HG1      PRO   5  51.339   4.051  -8.313
   46    HD2  PRO   5           HD2      PRO   5  52.156   2.340  -6.343
   47    HD3  PRO   5           HD1      PRO   5  50.919   1.923  -7.546
   48    H    GLN   6           HN       GLN   6  54.618   1.345  -7.141
   49    HA   GLN   6           HA       GLN   6  56.804   3.222  -6.802
   50    HB2  GLN   6           HB2      GLN   6  56.172   0.771  -5.141
   51    HB3  GLN   6           HB1      GLN   6  57.332   2.018  -4.724
   52    HG2  GLN   6           HG2      GLN   6  54.385   2.516  -5.052
   53    HG3  GLN   6           HG1      GLN   6  55.153   2.138  -3.514
   54   HE21  GLN   6          HE21      GLN   6  54.552   4.071  -2.636
   55   HE22  GLN   6          HE22      GLN   6  55.299   5.566  -3.048
   56    H    GLU   7           HN       GLU   7  57.464   2.578  -8.761
   57    HA   GLU   7           HA       GLU   7  58.602   0.247  -9.666
   58    HB2  GLU   7           HB2      GLU   7  58.109   2.219 -11.034
   59    HB3  GLU   7           HB1      GLU   7  59.508   3.020 -10.355
   60    HG2  GLU   7           HG2      GLU   7  60.971   1.523 -11.336
   61    HG3  GLU   7           HG1      GLU   7  59.682   0.444 -11.872
   62    H    ARG   8           HN       ARG   8  59.827   2.197  -7.420
   63    HA   ARG   8           HA       ARG   8  61.544   2.056  -5.905
   64    HB2  ARG   8           HB2      ARG   8  62.424  -0.578  -7.160
   65    HB3  ARG   8           HB1      ARG   8  62.794   0.025  -5.559
   66    HG2  ARG   8           HG2      ARG   8  61.189  -1.310  -4.838
   67    HG3  ARG   8           HG1      ARG   8  60.090  -0.101  -5.510
   68    HD2  ARG   8           HD2      ARG   8  59.541  -2.396  -6.249
   69    HD3  ARG   8           HD1      ARG   8  59.895  -1.287  -7.571
   70    HE   ARG   8           HE       ARG   8  62.281  -2.522  -7.040
   71   HH11  ARG   8          HH11      ARG   8  59.052  -3.611  -8.058
   72   HH12  ARG   8          HH12      ARG   8  59.655  -4.998  -8.843
   73   HH21  ARG   8          HH21      ARG   8  63.065  -4.439  -8.166
   74   HH22  ARG   8          HH22      ARG   8  61.926  -5.479  -8.885
   75    HA   PRO   9           HA       PRO   9  64.976   3.784  -8.293
   76    HB2  PRO   9           HB2      PRO   9  66.286   4.792  -6.175
   77    HB3  PRO   9           HB1      PRO   9  64.907   5.634  -6.792
   78    HG2  PRO   9           HG2      PRO   9  65.262   3.920  -4.435
   79    HG3  PRO   9           HG1      PRO   9  64.134   5.277  -4.664
   80    HD2  PRO   9           HD2      PRO   9  63.579   2.597  -4.671
   81    HD3  PRO   9           HD1      PRO   9  62.475   3.810  -5.320
   82    H    ARG  10           HN       ARG  10  67.499   4.022  -7.234
   83    HA   ARG  10           HA       ARG  10  68.207   1.487  -6.028
   84    HB2  ARG  10           HB2      ARG  10  69.533   3.000  -8.232
   85    HB3  ARG  10           HB1      ARG  10  70.426   1.899  -7.197
   86    HG2  ARG  10           HG2      ARG  10  68.011   1.145  -8.828
   87    HG3  ARG  10           HG1      ARG  10  69.693   0.910  -9.303
   88    HD2  ARG  10           HD2      ARG  10  70.089  -0.587  -7.501
   89    HD3  ARG  10           HD1      ARG  10  68.519  -0.267  -6.787
   90    HE   ARG  10           HE       ARG  10  67.885  -1.185  -9.215
   91   HH11  ARG  10          HH11      ARG  10  69.901  -2.467  -6.592
   92   HH12  ARG  10          HH12      ARG  10  69.781  -4.090  -7.097
   93   HH21  ARG  10          HH21      ARG  10  67.569  -3.483  -9.796
   94   HH22  ARG  10          HH22      ARG  10  68.382  -4.675  -8.906
   95    H    LYS  11           HN       LYS  11  67.913   4.775  -5.555
   96    HA   LYS  11           HA       LYS  11  70.221   4.694  -3.805
   97    HB2  LYS  11           HB2      LYS  11  68.832   7.175  -4.771
   98    HB3  LYS  11           HB1      LYS  11  70.279   7.012  -3.840
   99    HG2  LYS  11           HG2      LYS  11  71.340   5.736  -5.760
  100    HG3  LYS  11           HG1      LYS  11  69.944   6.286  -6.708
  101    HD2  LYS  11           HD2      LYS  11  70.465   8.548  -6.324
  102    HD3  LYS  11           HD1      LYS  11  71.719   8.083  -5.162
  103    HE2  LYS  11           HE2      LYS  11  72.757   8.769  -7.296
  104    HE3  LYS  11           HE1      LYS  11  73.032   7.069  -6.971
  105    HZ1  LYS  11           HZ1      LYS  11  72.432   7.649  -9.275
  106    HZ2  LYS  11           HZ2      LYS  11  70.857   7.999  -8.792
  107    HZ3  LYS  11           HZ3      LYS  11  71.529   6.432  -8.596
  108    H    LEU  12           HN       LEU  12  69.968   5.190  -1.723
  109    HA   LEU  12           HA       LEU  12  67.604   4.533  -0.464
  110    HB2  LEU  12           HB2      LEU  12  69.629   4.152   0.613
  111    HB3  LEU  12           HB1      LEU  12  70.107   5.837   0.513
  112    HG   LEU  12           HG       LEU  12  68.336   6.413   2.093
  113   HD11  LEU  12          HD11      LEU  12  66.839   4.489   1.595
  114   HD12  LEU  12          HD12      LEU  12  67.217   4.689   3.324
  115   HD13  LEU  12          HD13      LEU  12  68.049   3.444   2.379
  116   HD21  LEU  12          HD21      LEU  12  69.401   5.553   4.032
  117   HD22  LEU  12          HD22      LEU  12  70.641   5.840   2.788
  118   HD23  LEU  12          HD23      LEU  12  70.041   4.212   3.103
  119    HA   PRO  13           HA       PRO  13  66.880   9.161   0.782
  120    HB2  PRO  13           HB2      PRO  13  67.901  11.135  -0.809
  121    HB3  PRO  13           HB1      PRO  13  68.815  10.391   0.518
  122    HG2  PRO  13           HG2      PRO  13  68.949   9.723  -2.395
  123    HG3  PRO  13           HG1      PRO  13  70.278  10.093  -1.278
  124    HD2  PRO  13           HD2      PRO  13  69.606   7.560  -1.858
  125    HD3  PRO  13           HD1      PRO  13  70.135   8.001  -0.241
  126    H    GLN  14           HN       GLN  14  67.201   8.411  -2.561
  127    HA   GLN  14           HA       GLN  14  64.894   9.742  -3.479
  128    HB2  GLN  14           HB2      GLN  14  66.404   7.423  -4.656
  129    HB3  GLN  14           HB1      GLN  14  65.117   8.314  -5.456
  130    HG2  GLN  14           HG2      GLN  14  66.466  10.364  -5.305
  131    HG3  GLN  14           HG1      GLN  14  67.768   9.430  -4.574
  132   HE21  GLN  14          HE21      GLN  14  65.761   8.158  -7.125
  133   HE22  GLN  14          HE22      GLN  14  66.971   8.190  -8.339
  134    H    LEU  15           HN       LEU  15  65.486   6.351  -2.418
  135    HA   LEU  15           HA       LEU  15  62.962   5.355  -2.980
  136    HB2  LEU  15           HB2      LEU  15  64.928   4.014  -2.389
  137    HB3  LEU  15           HB1      LEU  15  64.919   4.717  -0.830
  138    HG   LEU  15           HG       LEU  15  62.843   3.725  -0.251
  139   HD11  LEU  15          HD11      LEU  15  61.860   3.586  -2.578
  140   HD12  LEU  15          HD12      LEU  15  61.763   2.077  -1.687
  141   HD13  LEU  15          HD13      LEU  15  62.999   2.272  -2.919
  142   HD21  LEU  15          HD21      LEU  15  64.826   1.869  -1.424
  143   HD22  LEU  15          HD22      LEU  15  63.649   1.445  -0.156
  144   HD23  LEU  15          HD23      LEU  15  64.921   2.672   0.132
  145    H    CYS  16           HN       CYS  16  64.277   6.973  -0.232
  146    HA   CYS  16           HA       CYS  16  62.148   6.703   1.512
  147    HB2  CYS  16           HB2      CYS  16  64.055   9.050   1.215
  148    HB3  CYS  16           HB1      CYS  16  63.009   8.803   2.583
  149    HG   CYS  16           HG       CYS  16  65.535   6.729   1.599
  150    H    THR  17           HN       THR  17  62.624   8.945  -1.122
  151    HA   THR  17           HA       THR  17  60.434  10.633  -0.765
  152    HB   THR  17           HB       THR  17  61.903   9.709  -3.183
  153    HG1  THR  17           HG1      THR  17  63.265  11.001  -2.190
  154   HG21  THR  17          HG21      THR  17  59.828  11.899  -3.012
  155   HG22  THR  17          HG22      THR  17  59.745  10.394  -3.943
  156   HG23  THR  17          HG23      THR  17  60.904  11.644  -4.399
  157    H    GLU  18           HN       GLU  18  60.715   7.579  -2.721
  158    HA   GLU  18           HA       GLU  18  58.200   7.295  -3.584
  159    HB2  GLU  18           HB2      GLU  18  60.387   5.534  -2.790
  160    HB3  GLU  18           HB1      GLU  18  58.830   4.803  -3.186
  161    HG2  GLU  18           HG2      GLU  18  60.213   4.809  -5.091
  162    HG3  GLU  18           HG1      GLU  18  58.859   5.961  -5.264
  163    H    LEU  19           HN       LEU  19  59.534   6.048  -0.493
  164    HA   LEU  19           HA       LEU  19  57.064   5.243   0.542
  165    HB2  LEU  19           HB2      LEU  19  59.783   5.680   1.632
  166    HB3  LEU  19           HB1      LEU  19  58.521   5.178   2.685
  167    HG   LEU  19           HG       LEU  19  58.224   3.211   0.983
  168   HD11  LEU  19          HD11      LEU  19  60.964   4.083   0.288
  169   HD12  LEU  19          HD12      LEU  19  59.560   4.046  -0.771
  170   HD13  LEU  19          HD13      LEU  19  60.230   2.540  -0.141
  171   HD21  LEU  19          HD21      LEU  19  59.930   1.903   2.145
  172   HD22  LEU  19          HD22      LEU  19  59.023   2.934   3.263
  173   HD23  LEU  19          HD23      LEU  19  60.635   3.413   2.720
  174    H    GLN  20           HN       GLN  20  58.082   8.306   0.018
  175    HA   GLN  20           HA       GLN  20  57.321  10.317   0.641
  176    HB2  GLN  20           HB2      GLN  20  55.222   8.578   1.843
  177    HB3  GLN  20           HB1      GLN  20  55.044  10.346   1.826
  178    HG2  GLN  20           HG2      GLN  20  55.425   8.635  -0.617
  179    HG3  GLN  20           HG1      GLN  20  53.830   8.992   0.034
  180   HE21  GLN  20          HE21      GLN  20  56.413  11.459  -0.023
  181   HE22  GLN  20          HE22      GLN  20  55.687  12.352  -1.285
  182    H    THR  21           HN       THR  21  59.220   8.963   2.298
  183    HA   THR  21           HA       THR  21  58.747  10.320   4.804
  184    HB   THR  21           HB       THR  21  57.857   7.950   4.942
  185    HG1  THR  21           HG1      THR  21  58.863   7.582   6.957
  186   HG21  THR  21          HG21      THR  21  60.794   7.219   4.780
  187   HG22  THR  21          HG22      THR  21  59.569   6.830   3.577
  188   HG23  THR  21          HG23      THR  21  59.481   6.110   5.185
  189    H    THR  22           HN       THR  22  60.980   9.383   6.127
  190    HA   THR  22           HA       THR  22  63.145  10.012   4.236
  191    HB   THR  22           HB       THR  22  63.564  10.740   7.066
  192    HG1  THR  22           HG1      THR  22  61.971  12.356   5.303
  193   HG21  THR  22          HG21      THR  22  64.044  12.048   4.377
  194   HG22  THR  22          HG22      THR  22  65.249  11.238   5.370
  195   HG23  THR  22          HG23      THR  22  64.536  12.758   5.911
  196    H    ILE  23           HN       ILE  23  65.350   9.448   5.411
  197    HA   ILE  23           HA       ILE  23  65.683   6.779   5.515
  198    HB   ILE  23           HB       ILE  23  67.366   8.782   6.927
  199   HG12  ILE  23          HG12      ILE  23  67.049   8.100   4.044
  200   HG13  ILE  23          HG11      ILE  23  67.014   9.639   4.823
  201   HG21  ILE  23          HG21      ILE  23  69.210   7.177   6.275
  202   HG22  ILE  23          HG22      ILE  23  67.971   6.111   5.601
  203   HG23  ILE  23          HG23      ILE  23  68.008   6.434   7.337
  204   HD11  ILE  23          HD11      ILE  23  69.437   9.499   5.242
  205   HD12  ILE  23          HD12      ILE  23  69.050   9.352   3.509
  206   HD13  ILE  23          HD13      ILE  23  69.407   7.909   4.468
  207    H    HIS  24           HN       HIS  24  64.710   8.962   7.870
  208    HA   HIS  24           HA       HIS  24  65.733   7.861  10.242
  209    HB2  HIS  24           HB2      HIS  24  63.557   9.921   9.948
  210    HB3  HIS  24           HB1      HIS  24  64.735   9.816  11.230
  211    HD1  HIS  24           HD1      HIS  24  67.113   9.479   9.060
  212    HD2  HIS  24           HD2      HIS  24  64.312  12.431   9.341
  213    HE1  HIS  24           HE1      HIS  24  67.841  11.176   7.330
  214    H    ASP  25           HN       ASP  25  63.215   7.128   8.224
  215    HA   ASP  25           HA       ASP  25  61.517   5.982  10.336
  216    HB2  ASP  25           HB2      ASP  25  60.547   8.091   9.439
  217    HB3  ASP  25           HB1      ASP  25  60.635   7.396   7.861
  218    H    ILE  26           HN       ILE  26  62.507   5.938   6.953
  219    HA   ILE  26           HA       ILE  26  61.098   3.907   5.834
  220    HB   ILE  26           HB       ILE  26  62.598   5.256   4.529
  221   HG12  ILE  26          HG12      ILE  26  63.652   2.476   4.452
  222   HG13  ILE  26          HG11      ILE  26  62.095   2.742   3.794
  223   HG21  ILE  26          HG21      ILE  26  64.838   3.788   5.908
  224   HG22  ILE  26          HG22      ILE  26  64.376   5.459   6.193
  225   HG23  ILE  26          HG23      ILE  26  65.016   4.976   4.611
  226   HD11  ILE  26          HD11      ILE  26  63.161   4.352   2.175
  227   HD12  ILE  26          HD12      ILE  26  63.720   2.665   2.088
  228   HD13  ILE  26          HD13      ILE  26  64.720   3.878   2.874
  229    H    ILE  27           HN       ILE  27  60.902   1.774   5.877
  230    HA   ILE  27           HA       ILE  27  62.817   0.283   7.421
  231    HB   ILE  27           HB       ILE  27  60.167  -0.553   6.261
  232   HG12  ILE  27          HG12      ILE  27  59.820   1.054   8.056
  233   HG13  ILE  27          HG11      ILE  27  59.357  -0.564   8.560
  234   HG21  ILE  27          HG21      ILE  27  62.051  -1.978   8.124
  235   HG22  ILE  27          HG22      ILE  27  61.727  -2.371   6.440
  236   HG23  ILE  27          HG23      ILE  27  60.446  -2.563   7.651
  237   HD11  ILE  27          HD11      ILE  27  61.467  -0.763   9.795
  238   HD12  ILE  27          HD12      ILE  27  60.478   0.586  10.342
  239   HD13  ILE  27          HD13      ILE  27  61.885   0.887   9.319
  240    H    LEU  28           HN       LEU  28  64.428  -0.230   6.582
  241    HA   LEU  28           HA       LEU  28  64.296  -1.302   3.906
  242    HB2  LEU  28           HB2      LEU  28  65.686   0.868   4.807
  243    HB3  LEU  28           HB1      LEU  28  66.880  -0.424   4.774
  244    HG   LEU  28           HG       LEU  28  66.409  -0.895   2.483
  245   HD11  LEU  28          HD11      LEU  28  64.726   0.946   1.505
  246   HD12  LEU  28          HD12      LEU  28  64.081   0.727   3.187
  247   HD13  LEU  28          HD13      LEU  28  64.205  -0.632   2.099
  248   HD21  LEU  28          HD21      LEU  28  67.139   1.153   1.494
  249   HD22  LEU  28          HD22      LEU  28  67.922   1.012   3.081
  250   HD23  LEU  28          HD23      LEU  28  66.532   2.070   2.864
  251    H    GLU  29           HN       GLU  29  65.174  -3.481   3.880
  252    HA   GLU  29           HA       GLU  29  66.602  -3.931   6.412
  253    HB2  GLU  29           HB2      GLU  29  66.095  -6.286   6.187
  254    HB3  GLU  29           HB1      GLU  29  64.824  -5.222   6.910
  255    HG2  GLU  29           HG2      GLU  29  63.870  -5.265   4.690
  256    HG3  GLU  29           HG1      GLU  29  65.048  -6.578   4.349
  257    H    CYS  30           HN       CYS  30  68.055  -6.205   6.338
  258    HA   CYS  30           HA       CYS  30  69.657  -5.769   4.109
  259    HB2  CYS  30           HB2      CYS  30  70.407  -6.864   6.379
  260    HB3  CYS  30           HB1      CYS  30  69.684  -8.296   5.713
  261    H    VAL  31           HN       VAL  31  69.377  -6.405   2.332
  262    HA   VAL  31           HA       VAL  31  67.409  -8.000   1.163
  263    HB   VAL  31           HB       VAL  31  68.628  -6.466  -0.262
  264   HG11  VAL  31          HG11      VAL  31  70.952  -6.667  -0.594
  265   HG12  VAL  31          HG12      VAL  31  71.056  -7.691   0.858
  266   HG13  VAL  31          HG13      VAL  31  70.480  -5.995   0.968
  267   HG21  VAL  31          HG21      VAL  31  69.749  -9.155  -0.883
  268   HG22  VAL  31          HG22      VAL  31  69.841  -7.720  -1.904
  269   HG23  VAL  31          HG23      VAL  31  68.269  -8.423  -1.535
  270    H    TYR  32           HN       TYR  32  70.439  -8.746   2.466
  271    HA   TYR  32           HA       TYR  32  70.443 -11.455   1.516
  272    HB2  TYR  32           HB2      TYR  32  72.576 -10.101   3.162
  273    HB3  TYR  32           HB1      TYR  32  72.743 -11.577   2.209
  274    HD1  TYR  32           HD1      TYR  32  71.438 -10.939  -0.315
  275    HD2  TYR  32           HD2      TYR  32  73.897  -8.452   2.151
  276    HE1  TYR  32           HE1      TYR  32  71.927  -9.672  -2.182
  277    HE2  TYR  32           HE2      TYR  32  74.454  -7.058   0.199
  278    HH   TYR  32           HH       TYR  32  74.506  -7.289  -2.255
  279    H    CYS  33           HN       CYS  33  70.575  -9.715   4.689
  280    HA   CYS  33           HA       CYS  33  70.563 -12.269   6.129
  281    HB2  CYS  33           HB2      CYS  33  70.869  -9.478   7.218
  282    HB3  CYS  33           HB1      CYS  33  71.099 -10.982   8.098
  283    H    LYS  34           HN       LYS  34  68.356  -9.927   5.125
  284    HA   LYS  34           HA       LYS  34  66.336  -9.460   5.404
  285    HB2  LYS  34           HB2      LYS  34  66.092 -12.018   6.938
  286    HB3  LYS  34           HB1      LYS  34  64.797 -11.160   6.105
  287    HG2  LYS  34           HG2      LYS  34  67.204 -12.420   4.849
  288    HG3  LYS  34           HG1      LYS  34  65.572 -13.041   4.792
  289    HD2  LYS  34           HD2      LYS  34  65.006 -10.779   3.671
  290    HD3  LYS  34           HD1      LYS  34  66.736 -10.626   3.486
  291    HE2  LYS  34           HE2      LYS  34  65.144 -12.963   2.455
  292    HE3  LYS  34           HE1      LYS  34  65.746 -11.626   1.476
  293    HZ1  LYS  34           HZ1      LYS  34  67.171 -13.609   1.395
  294    HZ2  LYS  34           HZ2      LYS  34  67.497 -13.469   3.040
  295    HZ3  LYS  34           HZ3      LYS  34  67.974 -12.253   1.960
  296    H    GLN  35           HN       GLN  35  68.321  -8.998   7.774
  297    HA   GLN  35           HA       GLN  35  66.444  -8.462   9.854
  298    HB2  GLN  35           HB2      GLN  35  68.303  -7.863  11.027
  299    HB3  GLN  35           HB1      GLN  35  68.464  -9.509  10.432
  300    HG2  GLN  35           HG2      GLN  35  69.975  -8.590   8.683
  301    HG3  GLN  35           HG1      GLN  35  69.827  -7.026   9.510
  302   HE21  GLN  35          HE21      GLN  35  69.548  -8.187  12.050
  303   HE22  GLN  35          HE22      GLN  35  71.045  -8.772  12.571
  304    H    GLN  36           HN       GLN  36  65.641  -6.519  10.090
  305    HA   GLN  36           HA       GLN  36  65.878  -4.413   8.377
  306    HB2  GLN  36           HB2      GLN  36  64.306  -5.113  10.439
  307    HB3  GLN  36           HB1      GLN  36  65.316  -3.897  11.208
  308    HG2  GLN  36           HG2      GLN  36  64.742  -2.377   9.308
  309    HG3  GLN  36           HG1      GLN  36  63.636  -3.672   8.823
  310   HE21  GLN  36          HE21      GLN  36  61.764  -4.060   9.968
  311   HE22  GLN  36          HE22      GLN  36  61.185  -3.001  11.192
  312    H    LEU  37           HN       LEU  37  67.410  -2.904   8.161
  313    HA   LEU  37           HA       LEU  37  69.773  -2.983   9.679
  314    HB2  LEU  37           HB2      LEU  37  68.705  -1.185   7.562
  315    HB3  LEU  37           HB1      LEU  37  69.946  -0.625   8.620
  316    HG   LEU  37           HG       LEU  37  71.308  -2.611   7.997
  317   HD11  LEU  37          HD11      LEU  37  69.659  -4.104   7.199
  318   HD12  LEU  37          HD12      LEU  37  70.737  -3.714   5.850
  319   HD13  LEU  37          HD13      LEU  37  69.146  -2.968   5.961
  320   HD21  LEU  37          HD21      LEU  37  71.777  -0.443   7.081
  321   HD22  LEU  37          HD22      LEU  37  70.547  -0.664   5.842
  322   HD23  LEU  37          HD23      LEU  37  72.000  -1.667   5.830
  323    H    LEU  38           HN       LEU  38  70.532  -1.900  11.310
  324    HA   LEU  38           HA       LEU  38  69.027  -0.472  13.111
  325    HB2  LEU  38           HB2      LEU  38  71.560  -1.510  12.847
  326    HB3  LEU  38           HB1      LEU  38  71.814   0.184  12.622
  327    HG   LEU  38           HG       LEU  38  70.419  -0.922  14.979
  328   HD11  LEU  38          HD11      LEU  38  72.646  -1.824  14.826
  329   HD12  LEU  38          HD12      LEU  38  72.597  -0.650  16.154
  330   HD13  LEU  38          HD13      LEU  38  73.326  -0.218  14.596
  331   HD21  LEU  38          HD21      LEU  38  70.032   1.466  14.566
  332   HD22  LEU  38          HD22      LEU  38  71.772   1.743  14.524
  333   HD23  LEU  38          HD23      LEU  38  70.996   1.235  16.024
  334    H    ARG  39           HN       ARG  39  68.480   1.691  12.982
  335    HA   ARG  39           HA       ARG  39  68.426   3.037  10.594
  336    HB2  ARG  39           HB2      ARG  39  67.035   3.590  12.519
  337    HB3  ARG  39           HB1      ARG  39  68.430   4.277  13.335
  338    HG2  ARG  39           HG2      ARG  39  68.612   5.991  11.638
  339    HG3  ARG  39           HG1      ARG  39  67.273   5.281  10.749
  340    HD2  ARG  39           HD2      ARG  39  66.538   7.186  12.115
  341    HD3  ARG  39           HD1      ARG  39  65.762   5.679  12.604
  342    HE   ARG  39           HE       ARG  39  68.157   6.377  14.052
  343   HH11  ARG  39          HH11      ARG  39  64.629   6.348  14.047
  344   HH12  ARG  39          HH12      ARG  39  64.502   6.822  15.676
  345   HH21  ARG  39          HH21      ARG  39  67.974   6.930  16.285
  346   HH22  ARG  39          HH22      ARG  39  66.429   7.113  16.985
  347    H    ARG  40           HN       ARG  40  71.068   3.097  12.960
  348    HA   ARG  40           HA       ARG  40  72.605   5.164  11.906
  349    HB2  ARG  40           HB2      ARG  40  73.333   2.597  13.287
  350    HB3  ARG  40           HB1      ARG  40  74.481   3.857  12.889
  351    HG2  ARG  40           HG2      ARG  40  72.075   4.245  14.598
  352    HG3  ARG  40           HG1      ARG  40  73.677   3.858  15.239
  353    HD2  ARG  40           HD2      ARG  40  72.956   6.299  13.598
  354    HD3  ARG  40           HD1      ARG  40  73.219   6.285  15.340
  355    HE   ARG  40           HE       ARG  40  75.453   5.277  13.843
  356   HH11  ARG  40          HH11      ARG  40  73.996   8.222  15.166
  357   HH12  ARG  40          HH12      ARG  40  75.460   9.104  15.130
  358   HH21  ARG  40          HH21      ARG  40  77.438   6.538  13.788
  359   HH22  ARG  40          HH22      ARG  40  77.425   8.151  14.310
  360    H    GLU  41           HN       GLU  41  72.487   1.715  11.173
  361    HA   GLU  41           HA       GLU  41  74.512   1.706   9.156
  362    HB2  GLU  41           HB2      GLU  41  72.198  -0.196   9.533
  363    HB3  GLU  41           HB1      GLU  41  73.613  -0.539   8.573
  364    HG2  GLU  41           HG2      GLU  41  73.355  -0.325  11.540
  365    HG3  GLU  41           HG1      GLU  41  73.893  -1.689  10.565
  366    H    VAL  42           HN       VAL  42  71.066   2.189   9.152
  367    HA   VAL  42           HA       VAL  42  70.750   2.166   6.333
  368    HB   VAL  42           HB       VAL  42  69.027   3.913   8.129
  369   HG11  VAL  42          HG11      VAL  42  67.294   3.412   6.528
  370   HG12  VAL  42          HG12      VAL  42  68.341   2.233   5.761
  371   HG13  VAL  42          HG13      VAL  42  68.736   3.961   5.638
  372   HG21  VAL  42          HG21      VAL  42  68.678   0.959   7.677
  373   HG22  VAL  42          HG22      VAL  42  67.583   2.011   8.578
  374   HG23  VAL  42          HG23      VAL  42  69.209   1.691   9.186
  375    H    TYR  43           HN       TYR  43  71.506   4.777   8.659
  376    HA   TYR  43           HA       TYR  43  71.706   6.829   6.777
  377    HB2  TYR  43           HB2      TYR  43  73.159   6.448   9.374
  378    HB3  TYR  43           HB1      TYR  43  73.312   7.924   8.400
  379    HD1  TYR  43           HD1      TYR  43  70.590   8.323   7.548
  380    HD2  TYR  43           HD2      TYR  43  72.066   6.978  11.270
  381    HE1  TYR  43           HE1      TYR  43  68.565   9.100   8.612
  382    HE2  TYR  43           HE2      TYR  43  70.015   7.763  12.369
  383    HH   TYR  43           HH       TYR  43  68.252   9.419  11.928
  384    H    ASP  44           HN       ASP  44  74.127   4.407   7.729
  385    HA   ASP  44           HA       ASP  44  76.415   5.371   6.530
  386    HB2  ASP  44           HB2      ASP  44  75.328   2.562   6.791
  387    HB3  ASP  44           HB1      ASP  44  76.803   2.918   6.025
  388    H    PHE  45           HN       PHE  45  73.715   3.876   5.164
  389    HA   PHE  45           HA       PHE  45  74.765   3.115   2.699
  390    HB2  PHE  45           HB2      PHE  45  72.441   2.774   4.081
  391    HB3  PHE  45           HB1      PHE  45  72.017   3.991   2.914
  392    HD1  PHE  45           HD2      PHE  45  73.439   0.610   3.249
  393    HD2  PHE  45           HD1      PHE  45  71.585   3.547   0.791
  394    HE1  PHE  45           HE2      PHE  45  72.973  -1.088   1.509
  395    HE2  PHE  45           HE1      PHE  45  71.158   1.874  -0.913
  396    HZ   PHE  45           HZ       PHE  45  71.808  -0.419  -0.568
  397    H    ALA  46           HN       ALA  46  72.813   5.972   3.649
  398    HA   ALA  46           HA       ALA  46  73.274   7.224   1.064
  399    HB1  ALA  46           HB1      ALA  46  71.825   9.057   1.877
  400    HB2  ALA  46           HB2      ALA  46  71.680   8.240   3.433
  401    HB3  ALA  46           HB3      ALA  46  71.047   7.497   1.963
  402    H    ARG  47           HN       ARG  47  74.762   7.271   4.189
  403    HA   ARG  47           HA       ARG  47  75.842   9.882   3.849
  404    HB2  ARG  47           HB2      ARG  47  76.012   7.726   5.853
  405    HB3  ARG  47           HB1      ARG  47  77.440   8.721   5.787
  406    HG2  ARG  47           HG2      ARG  47  75.806   9.462   7.493
  407    HG3  ARG  47           HG1      ARG  47  76.128  10.705   6.291
  408    HD2  ARG  47           HD2      ARG  47  74.035  10.176   5.156
  409    HD3  ARG  47           HD1      ARG  47  73.743   8.853   6.277
  410    HE   ARG  47           HE       ARG  47  73.928  10.886   7.950
  411   HH11  ARG  47          HH11      ARG  47  72.263  10.939   4.803
  412   HH12  ARG  47          HH12      ARG  47  70.908  11.781   5.375
  413   HH21  ARG  47          HH21      ARG  47  72.020  12.083   8.724
  414   HH22  ARG  47          HH22      ARG  47  70.777  12.476   7.642
  415    H    ARG  48           HN       ARG  48  76.471   6.874   2.571
  416    HA   ARG  48           HA       ARG  48  78.980   7.819   1.447
  417    HB2  ARG  48           HB2      ARG  48  77.852   5.099   1.898
  418    HB3  ARG  48           HB1      ARG  48  79.341   5.409   1.011
  419    HG2  ARG  48           HG2      ARG  48  80.405   6.250   2.956
  420    HG3  ARG  48           HG1      ARG  48  78.888   6.210   3.864
  421    HD2  ARG  48           HD2      ARG  48  78.788   3.876   3.737
  422    HD3  ARG  48           HD1      ARG  48  80.121   3.819   2.603
  423    HE   ARG  48           HE       ARG  48  81.521   4.694   4.443
  424   HH11  ARG  48          HH11      ARG  48  78.542   2.987   5.228
  425   HH12  ARG  48          HH12      ARG  48  79.037   2.502   6.772
  426   HH21  ARG  48          HH21      ARG  48  82.270   3.931   6.509
  427   HH22  ARG  48          HH22      ARG  48  81.240   2.953   7.479
  428    H    ASP  49           HN       ASP  49  78.573   5.565  -0.611
  429    HA   ASP  49           HA       ASP  49  76.512   6.937  -2.149
  430    HB2  ASP  49           HB2      ASP  49  77.948   6.902  -4.100
  431    HB3  ASP  49           HB1      ASP  49  78.694   7.837  -2.809
  432    H    LEU  50           HN       LEU  50  76.324   4.430  -0.771
  433    HA   LEU  50           HA       LEU  50  76.727   2.315  -2.616
  434    HB2  LEU  50           HB2      LEU  50  75.127   2.394  -0.059
  435    HB3  LEU  50           HB1      LEU  50  75.328   0.953  -1.026
  436    HG   LEU  50           HG       LEU  50  77.829   1.233  -0.657
  437   HD11  LEU  50          HD11      LEU  50  78.521   2.455   1.308
  438   HD12  LEU  50          HD12      LEU  50  76.876   3.071   1.501
  439   HD13  LEU  50          HD13      LEU  50  77.824   3.506   0.073
  440   HD21  LEU  50          HD21      LEU  50  76.054   0.678   1.687
  441   HD22  LEU  50          HD22      LEU  50  77.751   0.220   1.539
  442   HD23  LEU  50          HD23      LEU  50  76.546  -0.487   0.446
  443    H    CYS  51           HN       CYS  51  74.693   0.781  -2.951
  444    HA   CYS  51           HA       CYS  51  72.446   2.404  -3.886
  445    HB2  CYS  51           HB2      CYS  51  72.308   0.996  -5.859
  446    HB3  CYS  51           HB1      CYS  51  73.859   1.832  -5.779
  447    HG   CYS  51           HG       CYS  51  73.797  -1.221  -4.415
  448    H    ILE  52           HN       ILE  52  70.530   1.274  -3.964
  449    HA   ILE  52           HA       ILE  52  70.318  -0.702  -1.909
  450    HB   ILE  52           HB       ILE  52  68.308   0.835  -3.508
  451   HG12  ILE  52          HG12      ILE  52  69.198   0.607  -0.699
  452   HG13  ILE  52          HG11      ILE  52  69.431   1.989  -1.808
  453   HG21  ILE  52          HG21      ILE  52  66.519  -0.226  -2.187
  454   HG22  ILE  52          HG22      ILE  52  67.689  -1.330  -1.465
  455   HG23  ILE  52          HG23      ILE  52  67.333  -1.430  -3.189
  456   HD11  ILE  52          HD11      ILE  52  67.067   0.860  -0.602
  457   HD12  ILE  52          HD12      ILE  52  67.049   2.174  -1.835
  458   HD13  ILE  52          HD13      ILE  52  67.818   2.422  -0.202
  459    H    VAL  53           HN       VAL  53  69.583  -2.553  -2.017
  460    HA   VAL  53           HA       VAL  53  69.837  -3.935  -4.530
  461    HB   VAL  53           HB       VAL  53  70.607  -5.815  -2.839
  462   HG11  VAL  53          HG11      VAL  53  71.990  -4.759  -4.630
  463   HG12  VAL  53          HG12      VAL  53  72.927  -5.053  -3.163
  464   HG13  VAL  53          HG13      VAL  53  72.349  -3.425  -3.534
  465   HG21  VAL  53          HG21      VAL  53  71.830  -4.830  -0.934
  466   HG22  VAL  53          HG22      VAL  53  70.106  -4.497  -0.813
  467   HG23  VAL  53          HG23      VAL  53  71.214  -3.246  -1.355
  468    H    TYR  54           HN       TYR  54  68.054  -4.732  -5.056
  469    HA   TYR  54           HA       TYR  54  65.943  -5.256  -3.154
  470    HB2  TYR  54           HB2      TYR  54  66.017  -5.244  -6.170
  471    HB3  TYR  54           HB1      TYR  54  64.583  -5.496  -5.176
  472    HD1  TYR  54           HD1      TYR  54  67.183  -3.030  -6.065
  473    HD2  TYR  54           HD2      TYR  54  63.434  -3.682  -4.176
  474    HE1  TYR  54           HE1      TYR  54  66.836  -0.588  -5.841
  475    HE2  TYR  54           HE2      TYR  54  63.106  -1.315  -4.002
  476    HH   TYR  54           HH       TYR  54  65.085   0.919  -5.591
  477    H    ARG  55           HN       ARG  55  65.769  -6.996  -2.407
  478    HA   ARG  55           HA       ARG  55  67.129  -9.236  -3.650
  479    HB2  ARG  55           HB2      ARG  55  66.460  -8.869  -0.943
  480    HB3  ARG  55           HB1      ARG  55  65.308 -10.068  -1.488
  481    HG2  ARG  55           HG2      ARG  55  68.343 -10.401  -1.760
  482    HG3  ARG  55           HG1      ARG  55  67.456 -11.048  -0.451
  483    HD2  ARG  55           HD2      ARG  55  67.145 -11.685  -3.406
  484    HD3  ARG  55           HD1      ARG  55  67.874 -12.732  -2.201
  485    HE   ARG  55           HE       ARG  55  65.393 -12.586  -1.281
  486   HH11  ARG  55          HH11      ARG  55  66.476 -12.927  -4.654
  487   HH12  ARG  55          HH12      ARG  55  65.196 -13.916  -5.136
  488   HH21  ARG  55          HH21      ARG  55  63.634 -13.943  -1.918
  489   HH22  ARG  55          HH22      ARG  55  63.489 -14.518  -3.521
  490    H    ASP  56           HN       ASP  56  65.950 -10.188  -5.296
  491    HA   ASP  56           HA       ASP  56  64.315 -11.048  -6.593
  492    HB2  ASP  56           HB2      ASP  56  63.437 -12.207  -4.576
  493    HB3  ASP  56           HB1      ASP  56  62.499 -10.754  -4.212
  494    H    GLY  57           HN       GLY  57  62.902  -8.542  -4.585
  495    HA2  GLY  57           HA2      GLY  57  62.918  -6.594  -6.455
  496    HA3  GLY  57           HA1      GLY  57  61.346  -7.377  -6.683
  497    H    ASN  58           HN       ASN  58  63.163  -6.825  -3.653
  498    HA   ASN  58           HA       ASN  58  61.144  -4.824  -2.821
  499    HB2  ASN  58           HB2      ASN  58  62.357  -6.890  -1.013
  500    HB3  ASN  58           HB1      ASN  58  60.981  -5.878  -0.675
  501   HD21  ASN  58          HD21      ASN  58  62.185  -8.700  -2.232
  502   HD22  ASN  58          HD22      ASN  58  60.711  -9.511  -2.455
  503    HA   PRO  59           HA       PRO  59  64.865  -2.903  -1.892
  504    HB2  PRO  59           HB2      PRO  59  63.700  -0.851  -0.245
  505    HB3  PRO  59           HB1      PRO  59  64.105  -0.769  -1.961
  506    HG2  PRO  59           HG2      PRO  59  61.491  -0.758  -1.062
  507    HG3  PRO  59           HG1      PRO  59  61.964  -1.350  -2.626
  508    HD2  PRO  59           HD2      PRO  59  61.512  -2.949  -0.116
  509    HD3  PRO  59           HD1      PRO  59  60.935  -3.268  -1.767
  510    H    TYR  60           HN       TYR  60  66.487  -3.290  -0.825
  511    HA   TYR  60           HA       TYR  60  66.233  -3.206   1.962
  512    HB2  TYR  60           HB2      TYR  60  67.787  -5.569   0.950
  513    HB3  TYR  60           HB1      TYR  60  67.157  -5.136   2.364
  514    HD1  TYR  60           HD2      TYR  60  64.905  -5.310   3.001
  515    HD2  TYR  60           HD1      TYR  60  66.243  -6.691  -0.705
  516    HE1  TYR  60           HE2      TYR  60  62.889  -6.731   2.825
  517    HE2  TYR  60           HE1      TYR  60  64.234  -8.116  -0.930
  518    HH   TYR  60           HH       TYR  60  61.561  -7.768   1.125
  519    H    ALA  61           HN       ALA  61  67.982  -2.887   2.852
  520    HA   ALA  61           HA       ALA  61  69.933  -1.372   1.454
  521    HB1  ALA  61           HB1      ALA  61  68.674  -0.724   3.474
  522    HB2  ALA  61           HB2      ALA  61  70.463  -0.673   3.622
  523    HB3  ALA  61           HB3      ALA  61  69.527  -2.047   4.272
  524    H    VAL  62           HN       VAL  62  72.069  -1.855   2.937
  525    HA   VAL  62           HA       VAL  62  72.594  -4.719   2.887
  526    HB   VAL  62           HB       VAL  62  74.285  -2.368   1.917
  527   HG11  VAL  62          HG11      VAL  62  75.630  -3.710   3.197
  528   HG12  VAL  62          HG12      VAL  62  76.045  -3.837   1.484
  529   HG13  VAL  62          HG13      VAL  62  75.167  -5.163   2.298
  530   HG21  VAL  62          HG21      VAL  62  74.425  -3.598  -0.162
  531   HG22  VAL  62          HG22      VAL  62  72.785  -3.130   0.247
  532   HG23  VAL  62          HG23      VAL  62  73.329  -4.806   0.515
  533    H    CYS  63           HN       CYS  63  72.725  -5.296   4.955
  534    HA   CYS  63           HA       CYS  63  72.889  -3.509   7.084
  535    HB2  CYS  63           HB2      CYS  63  72.757  -5.368   8.482
  536    HB3  CYS  63           HB1      CYS  63  72.020  -5.864   6.954
  537    H    ASP  64           HN       ASP  64  74.446  -3.984   8.956
  538    HA   ASP  64           HA       ASP  64  76.874  -2.706   8.730
  539    HB2  ASP  64           HB2      ASP  64  75.832  -3.179  10.873
  540    HB3  ASP  64           HB1      ASP  64  76.095  -4.896  10.658
  541    H    LYS  65           HN       LYS  65  76.344  -6.170   8.708
  542    HA   LYS  65           HA       LYS  65  79.075  -6.927   8.483
  543    HB2  LYS  65           HB2      LYS  65  76.567  -8.470   7.876
  544    HB3  LYS  65           HB1      LYS  65  78.171  -9.157   8.065
  545    HG2  LYS  65           HG2      LYS  65  78.229  -8.488  10.377
  546    HG3  LYS  65           HG1      LYS  65  76.669  -7.681  10.210
  547    HD2  LYS  65           HD2      LYS  65  76.360  -9.849  11.245
  548    HD3  LYS  65           HD1      LYS  65  75.656  -9.817   9.623
  549    HE2  LYS  65           HE2      LYS  65  77.553 -11.011   8.721
  550    HE3  LYS  65           HE1      LYS  65  78.376 -10.943  10.276
  551    HZ1  LYS  65           HZ1      LYS  65  75.864 -12.418   9.678
  552    HZ2  LYS  65           HZ2      LYS  65  76.576 -12.294  11.192
  553    HZ3  LYS  65           HZ3      LYS  65  77.390 -13.088   9.957
  554    H    CYS  66           HN       CYS  66  76.398  -6.744   6.218
  555    HA   CYS  66           HA       CYS  66  77.905  -7.767   4.026
  556    HB2  CYS  66           HB2      CYS  66  75.219  -6.463   4.268
  557    HB3  CYS  66           HB1      CYS  66  75.785  -7.138   2.760
  558    H    LEU  67           HN       LEU  67  77.244  -4.529   5.257
  559    HA   LEU  67           HA       LEU  67  77.650  -3.036   3.050
  560    HB2  LEU  67           HB2      LEU  67  76.952  -2.523   5.500
  561    HB3  LEU  67           HB1      LEU  67  78.655  -2.146   5.693
  562    HG   LEU  67           HG       LEU  67  77.187  -1.020   3.435
  563   HD11  LEU  67          HD11      LEU  67  77.049   0.037   6.259
  564   HD12  LEU  67          HD12      LEU  67  75.732  -0.630   5.287
  565   HD13  LEU  67          HD13      LEU  67  76.475   0.905   4.824
  566   HD21  LEU  67          HD21      LEU  67  78.698   0.915   3.813
  567   HD22  LEU  67          HD22      LEU  67  79.570  -0.597   3.564
  568   HD23  LEU  67          HD23      LEU  67  79.396   0.064   5.192
  569    H    LYS  68           HN       LYS  68  80.060  -4.434   5.176
  570    HA   LYS  68           HA       LYS  68  82.193  -3.040   3.879
  571    HB2  LYS  68           HB2      LYS  68  83.703  -4.497   5.198
  572    HB3  LYS  68           HB1      LYS  68  82.486  -3.705   6.184
  573    HG2  LYS  68           HG2      LYS  68  81.163  -5.816   6.110
  574    HG3  LYS  68           HG1      LYS  68  82.529  -6.574   5.299
  575    HD2  LYS  68           HD2      LYS  68  83.952  -6.051   7.232
  576    HD3  LYS  68           HD1      LYS  68  82.569  -5.308   8.037
  577    HE2  LYS  68           HE2      LYS  68  81.376  -7.459   7.941
  578    HE3  LYS  68           HE1      LYS  68  82.783  -8.195   7.185
  579    HZ1  LYS  68           HZ1      LYS  68  82.671  -7.016   9.898
  580    HZ2  LYS  68           HZ2      LYS  68  84.056  -7.658   9.194
  581    HZ3  LYS  68           HZ3      LYS  68  82.743  -8.656   9.535
  582    H    PHE  69           HN       PHE  69  80.507  -6.057   3.291
  583    HA   PHE  69           HA       PHE  69  82.437  -7.262   1.657
  584    HB2  PHE  69           HB2      PHE  69  79.549  -7.505   2.020
  585    HB3  PHE  69           HB1      PHE  69  80.428  -8.630   1.048
  586    HD1  PHE  69           HD2      PHE  69  82.723  -8.380   3.465
  587    HD2  PHE  69           HD1      PHE  69  78.634  -9.456   3.072
  588    HE1  PHE  69           HE2      PHE  69  82.889  -9.757   5.483
  589    HE2  PHE  69           HE1      PHE  69  78.763 -10.811   5.043
  590    HZ   PHE  69           HZ       PHE  69  80.890 -10.987   6.298
  591    H    TYR  70           HN       TYR  70  79.427  -5.434   1.184
  592    HA   TYR  70           HA       TYR  70  79.721  -5.682  -1.688
  593    HB2  TYR  70           HB2      TYR  70  77.319  -5.101   0.024
  594    HB3  TYR  70           HB1      TYR  70  77.304  -5.150  -1.739
  595    HD1  TYR  70           HD1      TYR  70  77.798  -7.262  -2.909
  596    HD2  TYR  70           HD2      TYR  70  77.385  -7.118   1.310
  597    HE1  TYR  70           HE1      TYR  70  77.593  -9.684  -2.861
  598    HE2  TYR  70           HE2      TYR  70  77.174  -9.558   1.395
  599    HH   TYR  70           HH       TYR  70  76.597 -11.419  -0.051
  600    H    SER  71           HN       SER  71  80.855  -3.459   0.287
  601    HA   SER  71           HA       SER  71  79.691  -1.044  -0.530
  602    HB2  SER  71           HB2      SER  71  82.057  -0.188   0.205
  603    HB3  SER  71           HB1      SER  71  80.974  -0.890   1.408
  604    HG   SER  71           HG       SER  71  82.724  -2.019   1.767
  605    H    LYS  72           HN       LYS  72  81.737  -3.196  -2.089
  606    HA   LYS  72           HA       LYS  72  83.107  -1.700  -4.015
  607    HB2  LYS  72           HB2      LYS  72  83.417  -4.102  -3.492
  608    HB3  LYS  72           HB1      LYS  72  81.872  -4.439  -4.219
  609    HG2  LYS  72           HG2      LYS  72  83.616  -5.037  -5.783
  610    HG3  LYS  72           HG1      LYS  72  82.688  -3.661  -6.377
  611    HD2  LYS  72           HD2      LYS  72  84.452  -2.134  -5.722
  612    HD3  LYS  72           HD1      LYS  72  85.369  -3.465  -5.008
  613    HE2  LYS  72           HE2      LYS  72  86.252  -2.882  -7.213
  614    HE3  LYS  72           HE1      LYS  72  85.582  -4.507  -7.213
  615    HZ1  LYS  72           HZ1      LYS  72  84.962  -3.252  -9.194
  616    HZ2  LYS  72           HZ2      LYS  72  84.204  -2.088  -8.268
  617    HZ3  LYS  72           HZ3      LYS  72  83.598  -3.664  -8.314
  618    H    ILE  73           HN       ILE  73  79.850  -2.891  -3.847
  619    HA   ILE  73           HA       ILE  73  79.206  -2.155  -6.575
  620    HB   ILE  73           HB       ILE  73  77.293  -3.025  -4.411
  621   HG12  ILE  73          HG12      ILE  73  78.753  -4.772  -6.427
  622   HG13  ILE  73          HG11      ILE  73  79.079  -4.727  -4.699
  623   HG21  ILE  73          HG21      ILE  73  75.886  -3.727  -6.325
  624   HG22  ILE  73          HG22      ILE  73  77.112  -3.104  -7.432
  625   HG23  ILE  73          HG23      ILE  73  76.245  -1.999  -6.364
  626   HD11  ILE  73          HD11      ILE  73  76.835  -5.587  -4.259
  627   HD12  ILE  73          HD12      ILE  73  77.765  -6.675  -5.292
  628   HD13  ILE  73          HD13      ILE  73  76.520  -5.639  -5.994
  629    H    SER  74           HN       SER  74  79.138   0.034  -6.829
  630    HA   SER  74           HA       SER  74  77.282   1.347  -5.052
  631    HB2  SER  74           HB2      SER  74  79.716   2.618  -6.329
  632    HB3  SER  74           HB1      SER  74  78.552   3.460  -5.300
  633    HG   SER  74           HG       SER  74  79.636   1.122  -4.293
  634    H    GLU  75           HN       GLU  75  75.649   0.834  -6.345
  635    HA   GLU  75           HA       GLU  75  74.015   1.107  -7.742
  636    HB2  GLU  75           HB2      GLU  75  74.304   3.533  -7.576
  637    HB3  GLU  75           HB1      GLU  75  75.486   3.497  -8.875
  638    HG2  GLU  75           HG2      GLU  75  73.856   2.944 -10.481
  639    HG3  GLU  75           HG1      GLU  75  72.669   2.536  -9.245
  640    H    TYR  76           HN       TYR  76  73.712  -0.502  -8.883
  641    HA   TYR  76           HA       TYR  76  75.527  -1.031 -11.130
  642    HB2  TYR  76           HB2      TYR  76  75.468  -2.496  -8.934
  643    HB3  TYR  76           HB1      TYR  76  74.041  -3.183  -9.707
  644    HD1  TYR  76           HD2      TYR  76  77.607  -2.475 -10.180
  645    HD2  TYR  76           HD1      TYR  76  74.268  -4.736 -11.426
  646    HE1  TYR  76           HE2      TYR  76  79.077  -3.816 -11.538
  647    HE2  TYR  76           HE1      TYR  76  75.729  -6.148 -12.820
  648    HH   TYR  76           HH       TYR  76  77.936  -5.988 -13.907
  649    H    ARG  77           HN       ARG  77  74.394  -2.246 -12.910
  650    HA   ARG  77           HA       ARG  77  71.623  -1.361 -13.094
  651    HB2  ARG  77           HB2      ARG  77  73.778  -1.597 -15.190
  652    HB3  ARG  77           HB1      ARG  77  72.082  -1.579 -15.635
  653    HG2  ARG  77           HG2      ARG  77  72.943   0.627 -15.919
  654    HG3  ARG  77           HG1      ARG  77  71.880   0.639 -14.520
  655    HD2  ARG  77           HD2      ARG  77  73.878   0.490 -13.059
  656    HD3  ARG  77           HD1      ARG  77  74.895   0.588 -14.497
  657    HE   ARG  77           HE       ARG  77  73.142   2.718 -14.573
  658   HH11  ARG  77          HH11      ARG  77  75.873   1.679 -12.556
  659   HH12  ARG  77          HH12      ARG  77  76.278   3.244 -12.047
  660   HH21  ARG  77          HH21      ARG  77  73.702   4.847 -13.889
  661   HH22  ARG  77          HH22      ARG  77  75.024   5.110 -12.852
  662    H    HIS  78           HN       HIS  78  72.304  -3.673 -11.838
  663    HA   HIS  78           HA       HIS  78  71.871  -5.776 -13.666
  664    HB2  HIS  78           HB2      HIS  78  71.767  -7.296 -11.651
  665    HB3  HIS  78           HB1      HIS  78  73.239  -6.320 -11.882
  666    HD1  HIS  78           HD1      HIS  78  72.596  -7.653  -9.137
  667    HD2  HIS  78           HD2      HIS  78  71.456  -3.866 -10.250
  668    HE1  HIS  78           HE1      HIS  78  72.319  -6.394  -6.976
  669    H    TYR  79           HN       TYR  79  69.976  -5.666 -14.621
  670    HA   TYR  79           HA       TYR  79  67.614  -5.434 -12.942
  671    HB2  TYR  79           HB2      TYR  79  68.294  -3.991 -15.463
  672    HB3  TYR  79           HB1      TYR  79  66.605  -4.280 -15.049
  673    HD1  TYR  79           HD1      TYR  79  69.714  -3.134 -13.170
  674    HD2  TYR  79           HD2      TYR  79  65.573  -2.532 -14.032
  675    HE1  TYR  79           HE1      TYR  79  69.663  -1.210 -11.651
  676    HE2  TYR  79           HE2      TYR  79  65.541  -0.619 -12.514
  677    HH   TYR  79           HH       TYR  79  68.181   0.908 -11.413
  678    H    SER  80           HN       SER  80  65.657  -6.273 -13.764
  679    HA   SER  80           HA       SER  80  64.395  -7.977 -14.340
  680    HB2  SER  80           HB2      SER  80  66.337  -8.332 -16.649
  681    HB3  SER  80           HB1      SER  80  64.729  -9.053 -16.543
  682    HG   SER  80           HG       SER  80  65.495  -6.511 -17.227
  Start of MODEL    2
    1    H1   GLY  -1           HT1      GLY  -1  54.342   5.222  -2.828
    2    H2   GLY  -1           HT2      GLY  -1  55.349   3.891  -2.899
    3    H3   GLY  -1           HT3      GLY  -1  55.798   5.226  -1.965
    4    HA2  GLY  -1           HA1      GLY  -1  53.982   4.809  -0.473
    5    HA3  GLY  -1           HA2      GLY  -1  53.561   3.393  -1.443
    6    H    ALA   0           HN       ALA   0  53.969   2.485   0.841
    7    HA   ALA   0           HA       ALA   0  56.736   2.201   1.592
    8    HB1  ALA   0           HB1      ALA   0  54.963   2.236   3.297
    9    HB2  ALA   0           HB2      ALA   0  55.908   0.750   3.369
   10    HB3  ALA   0           HB3      ALA   0  54.306   0.741   2.631
   11    H    MET   1           HN       MET   1  54.242   0.175   0.122
   12    HA   MET   1           HA       MET   1  56.221  -1.899  -0.394
   13    HB2  MET   1           HB2      MET   1  54.430  -3.343  -0.848
   14    HB3  MET   1           HB1      MET   1  53.834  -2.370   0.483
   15    HG2  MET   1           HG2      MET   1  52.068  -2.436  -0.865
   16    HG3  MET   1           HG1      MET   1  52.790  -0.922  -1.416
   17    HE1  MET   1           HE1      MET   1  52.586  -0.505  -3.930
   18    HE2  MET   1           HE2      MET   1  51.065  -1.305  -3.502
   19    HE3  MET   1           HE3      MET   1  51.914  -1.739  -4.995
   20    H    PHE   2           HN       PHE   2  56.970  -2.183  -2.496
   21    HA   PHE   2           HA       PHE   2  55.983  -0.144  -4.303
   22    HB2  PHE   2           HB2      PHE   2  58.654  -1.469  -4.138
   23    HB3  PHE   2           HB1      PHE   2  58.180  -0.515  -5.527
   24    HD1  PHE   2           HD2      PHE   2  57.505   1.878  -5.223
   25    HD2  PHE   2           HD1      PHE   2  59.347  -0.458  -2.174
   26    HE1  PHE   2           HE2      PHE   2  58.083   3.843  -4.093
   27    HE2  PHE   2           HE1      PHE   2  59.992   1.491  -1.064
   28    HZ   PHE   2           HZ       PHE   2  59.349   3.740  -1.962
   29    H    GLN   3           HN       GLN   3  55.235  -0.567  -6.267
   30    HA   GLN   3           HA       GLN   3  54.591  -3.323  -6.783
   31    HB2  GLN   3           HB2      GLN   3  53.197  -1.011  -6.999
   32    HB3  GLN   3           HB1      GLN   3  53.778  -1.158  -8.642
   33    HG2  GLN   3           HG2      GLN   3  52.261  -3.356  -7.254
   34    HG3  GLN   3           HG1      GLN   3  51.463  -2.060  -8.128
   35   HE21  GLN   3          HE21      GLN   3  53.410  -4.963  -8.397
   36   HE22  GLN   3          HE22      GLN   3  53.209  -5.137 -10.090
   37    H    ASP   4           HN       ASP   4  54.643  -3.871  -9.181
   38    HA   ASP   4           HA       ASP   4  57.340  -4.056  -9.983
   39    HB2  ASP   4           HB2      ASP   4  55.998  -6.037  -9.943
   40    HB3  ASP   4           HB1      ASP   4  54.785  -5.293 -10.967
   41    HA   PRO   5           HA       PRO   5  58.597  -4.344 -11.638
   42    HB2  PRO   5           HB2      PRO   5  60.192  -2.759 -13.429
   43    HB3  PRO   5           HB1      PRO   5  59.613  -4.404 -13.676
   44    HG2  PRO   5           HG2      PRO   5  58.766  -2.229 -15.128
   45    HG3  PRO   5           HG1      PRO   5  57.825  -3.712 -14.914
   46    HD2  PRO   5           HD2      PRO   5  57.583  -1.092 -13.483
   47    HD3  PRO   5           HD1      PRO   5  56.312  -2.190 -14.059
   48    H    GLN   6           HN       GLN   6  59.328  -0.979 -12.463
   49    HA   GLN   6           HA       GLN   6  60.728  -0.767  -9.938
   50    HB2  GLN   6           HB2      GLN   6  61.555   0.203 -12.642
   51    HB3  GLN   6           HB1      GLN   6  62.032   1.120 -11.227
   52    HG2  GLN   6           HG2      GLN   6  62.642  -1.808 -11.616
   53    HG3  GLN   6           HG1      GLN   6  63.734  -0.498 -12.065
   54   HE21  GLN   6          HE21      GLN   6  64.720   0.707 -10.432
   55   HE22  GLN   6          HE22      GLN   6  64.759   0.215  -8.781
   56    H    GLU   7           HN       GLU   7  58.573  -0.243  -9.316
   57    HA   GLU   7           HA       GLU   7  57.766   2.489  -9.807
   58    HB2  GLU   7           HB2      GLU   7  56.128   0.713  -9.254
   59    HB3  GLU   7           HB1      GLU   7  56.869   0.527  -7.679
   60    HG2  GLU   7           HG2      GLU   7  56.224   2.739  -7.041
   61    HG3  GLU   7           HG1      GLU   7  55.563   3.058  -8.642
   62    H    ARG   8           HN       ARG   8  60.139   1.122  -8.340
   63    HA   ARG   8           HA       ARG   8  60.502   3.214  -6.371
   64    HB2  ARG   8           HB2      ARG   8  61.581   1.675  -4.799
   65    HB3  ARG   8           HB1      ARG   8  59.956   1.183  -5.143
   66    HG2  ARG   8           HG2      ARG   8  62.438  -0.004  -6.240
   67    HG3  ARG   8           HG1      ARG   8  61.459  -0.520  -4.832
   68    HD2  ARG   8           HD2      ARG   8  59.710  -1.296  -6.177
   69    HD3  ARG   8           HD1      ARG   8  60.258  -0.413  -7.610
   70    HE   ARG   8           HE       ARG   8  62.189  -2.018  -7.476
   71   HH11  ARG   8          HH11      ARG   8  58.867  -2.929  -6.552
   72   HH12  ARG   8          HH12      ARG   8  59.080  -4.565  -6.928
   73   HH21  ARG   8          HH21      ARG   8  62.445  -4.264  -8.005
   74   HH22  ARG   8          HH22      ARG   8  61.134  -5.336  -7.832
   75    HA   PRO   9           HA       PRO   9  64.352   4.022  -8.386
   76    HB2  PRO   9           HB2      PRO   9  65.798   4.981  -6.348
   77    HB3  PRO   9           HB1      PRO   9  64.487   5.946  -6.933
   78    HG2  PRO   9           HG2      PRO   9  64.662   4.115  -4.625
   79    HG3  PRO   9           HG1      PRO   9  63.866   5.711  -4.712
   80    HD2  PRO   9           HD2      PRO   9  62.598   3.391  -4.688
   81    HD3  PRO   9           HD1      PRO   9  61.866   4.670  -5.580
   82    H    ARG  10           HN       ARG  10  66.917   3.975  -7.426
   83    HA   ARG  10           HA       ARG  10  67.345   1.511  -5.956
   84    HB2  ARG  10           HB2      ARG  10  68.840   2.556  -8.332
   85    HB3  ARG  10           HB1      ARG  10  69.471   1.356  -7.222
   86    HG2  ARG  10           HG2      ARG  10  67.149   0.174  -7.823
   87    HG3  ARG  10           HG1      ARG  10  67.360   1.123  -9.293
   88    HD2  ARG  10           HD2      ARG  10  69.596   0.164  -9.566
   89    HD3  ARG  10           HD1      ARG  10  69.303  -0.743  -8.070
   90    HE   ARG  10           HE       ARG  10  67.465  -1.139 -10.316
   91   HH11  ARG  10          HH11      ARG  10  70.079  -2.503  -8.323
   92   HH12  ARG  10          HH12      ARG  10  69.819  -4.099  -8.855
   93   HH21  ARG  10          HH21      ARG  10  67.137  -3.336 -11.040
   94   HH22  ARG  10          HH22      ARG  10  68.126  -4.577 -10.408
   95    H    LYS  11           HN       LYS  11  67.316   4.726  -5.656
   96    HA   LYS  11           HA       LYS  11  69.810   4.708  -4.153
   97    HB2  LYS  11           HB2      LYS  11  68.229   7.142  -4.906
   98    HB3  LYS  11           HB1      LYS  11  69.816   7.008  -4.229
   99    HG2  LYS  11           HG2      LYS  11  70.579   5.828  -6.305
  100    HG3  LYS  11           HG1      LYS  11  69.034   6.312  -7.022
  101    HD2  LYS  11           HD2      LYS  11  69.528   8.635  -6.465
  102    HD3  LYS  11           HD1      LYS  11  71.079   8.088  -5.808
  103    HE2  LYS  11           HE2      LYS  11  71.754   7.295  -8.013
  104    HE3  LYS  11           HE1      LYS  11  70.197   7.776  -8.681
  105    HZ1  LYS  11           HZ1      LYS  11  72.221   9.606  -7.520
  106    HZ2  LYS  11           HZ2      LYS  11  70.718  10.069  -8.115
  107    HZ3  LYS  11           HZ3      LYS  11  71.869   9.424  -9.164
  108    H    LEU  12           HN       LEU  12  69.701   5.141  -2.022
  109    HA   LEU  12           HA       LEU  12  67.427   4.527  -0.610
  110    HB2  LEU  12           HB2      LEU  12  69.527   4.134   0.338
  111    HB3  LEU  12           HB1      LEU  12  69.998   5.816   0.198
  112    HG   LEU  12           HG       LEU  12  68.339   6.419   1.882
  113   HD11  LEU  12          HD11      LEU  12  66.801   4.503   1.482
  114   HD12  LEU  12          HD12      LEU  12  67.270   4.737   3.183
  115   HD13  LEU  12          HD13      LEU  12  68.036   3.457   2.226
  116   HD21  LEU  12          HD21      LEU  12  70.037   4.194   2.827
  117   HD22  LEU  12          HD22      LEU  12  69.552   5.641   3.734
  118   HD23  LEU  12          HD23      LEU  12  70.687   5.756   2.376
  119    HA   PRO  13           HA       PRO  13  66.829   9.146   0.669
  120    HB2  PRO  13           HB2      PRO  13  67.746  11.096  -1.005
  121    HB3  PRO  13           HB1      PRO  13  68.723  10.407   0.307
  122    HG2  PRO  13           HG2      PRO  13  68.770   9.725  -2.605
  123    HG3  PRO  13           HG1      PRO  13  70.128  10.050  -1.512
  124    HD2  PRO  13           HD2      PRO  13  69.373   7.551  -2.146
  125    HD3  PRO  13           HD1      PRO  13  70.008   7.942  -0.550
  126    H    GLN  14           HN       GLN  14  66.956   8.602  -2.784
  127    HA   GLN  14           HA       GLN  14  64.545   9.908  -3.428
  128    HB2  GLN  14           HB2      GLN  14  65.960   7.641  -4.806
  129    HB3  GLN  14           HB1      GLN  14  64.557   8.479  -5.446
  130    HG2  GLN  14           HG2      GLN  14  65.855  10.577  -5.441
  131    HG3  GLN  14           HG1      GLN  14  67.260   9.664  -4.887
  132   HE21  GLN  14          HE21      GLN  14  64.946   8.343  -7.175
  133   HE22  GLN  14          HE22      GLN  14  66.021   8.398  -8.518
  134    H    LEU  15           HN       LEU  15  65.295   6.536  -2.515
  135    HA   LEU  15           HA       LEU  15  62.787   5.491  -2.889
  136    HB2  LEU  15           HB2      LEU  15  64.877   4.234  -2.515
  137    HB3  LEU  15           HB1      LEU  15  64.905   4.851  -0.922
  138    HG   LEU  15           HG       LEU  15  62.909   3.741  -0.321
  139   HD11  LEU  15          HD11      LEU  15  63.098   2.516  -3.084
  140   HD12  LEU  15          HD12      LEU  15  61.857   3.687  -2.578
  141   HD13  LEU  15          HD13      LEU  15  61.912   2.086  -1.853
  142   HD21  LEU  15          HD21      LEU  15  63.837   1.484  -0.387
  143   HD22  LEU  15          HD22      LEU  15  65.040   2.755  -0.021
  144   HD23  LEU  15          HD23      LEU  15  64.970   2.053  -1.629
  145    H    CYS  16           HN       CYS  16  64.279   6.961  -0.083
  146    HA   CYS  16           HA       CYS  16  62.191   6.551   1.720
  147    HB2  CYS  16           HB2      CYS  16  64.139   8.849   1.497
  148    HB3  CYS  16           HB1      CYS  16  63.213   8.541   2.950
  149    HG   CYS  16           HG       CYS  16  65.640   6.582   1.580
  150    H    THR  17           HN       THR  17  62.713   9.153  -0.626
  151    HA   THR  17           HA       THR  17  60.563  10.830  -0.195
  152    HB   THR  17           HB       THR  17  61.999   9.875  -2.613
  153    HG1  THR  17           HG1      THR  17  62.230  12.261  -1.131
  154   HG21  THR  17          HG21      THR  17  60.010  12.150  -2.504
  155   HG22  THR  17          HG22      THR  17  59.954  10.654  -3.472
  156   HG23  THR  17          HG23      THR  17  61.157  11.882  -3.831
  157    H    GLU  18           HN       GLU  18  60.851   7.890  -2.039
  158    HA   GLU  18           HA       GLU  18  58.343   7.712  -3.214
  159    HB2  GLU  18           HB2      GLU  18  60.483   5.873  -2.535
  160    HB3  GLU  18           HB1      GLU  18  59.074   5.342  -3.438
  161    HG2  GLU  18           HG2      GLU  18  60.715   7.720  -4.117
  162    HG3  GLU  18           HG1      GLU  18  61.183   6.170  -4.728
  163    H    LEU  19           HN       LEU  19  59.679   5.998  -0.373
  164    HA   LEU  19           HA       LEU  19  57.237   4.942   0.492
  165    HB2  LEU  19           HB2      LEU  19  59.815   5.526   1.800
  166    HB3  LEU  19           HB1      LEU  19  58.551   4.874   2.735
  167    HG   LEU  19           HG       LEU  19  58.682   3.013   0.695
  168   HD11  LEU  19          HD11      LEU  19  60.504   4.170  -0.350
  169   HD12  LEU  19          HD12      LEU  19  61.000   2.601   0.297
  170   HD13  LEU  19          HD13      LEU  19  61.405   4.084   1.153
  171   HD21  LEU  19          HD21      LEU  19  60.302   3.225   3.151
  172   HD22  LEU  19          HD22      LEU  19  60.020   1.726   2.245
  173   HD23  LEU  19          HD23      LEU  19  58.667   2.561   3.055
  174    H    GLN  20           HN       GLN  20  58.067   8.137   0.347
  175    HA   GLN  20           HA       GLN  20  56.996  10.012   1.088
  176    HB2  GLN  20           HB2      GLN  20  55.116   7.922   2.121
  177    HB3  GLN  20           HB1      GLN  20  54.737   9.654   2.181
  178    HG2  GLN  20           HG2      GLN  20  54.688   9.745  -0.211
  179    HG3  GLN  20           HG1      GLN  20  55.336   8.111  -0.339
  180   HE21  GLN  20          HE21      GLN  20  52.551  10.021   0.405
  181   HE22  GLN  20          HE22      GLN  20  51.405   8.736   0.351
  182    H    THR  21           HN       THR  21  59.053   8.723   2.638
  183    HA   THR  21           HA       THR  21  58.503   9.889   5.232
  184    HB   THR  21           HB       THR  21  57.821   7.446   5.303
  185    HG1  THR  21           HG1      THR  21  58.822   7.093   7.272
  186   HG21  THR  21          HG21      THR  21  59.588   5.720   5.330
  187   HG22  THR  21          HG22      THR  21  60.782   6.946   4.903
  188   HG23  THR  21          HG23      THR  21  59.504   6.535   3.765
  189    H    THR  22           HN       THR  22  60.951   8.976   6.410
  190    HA   THR  22           HA       THR  22  62.926   9.872   4.419
  191    HB   THR  22           HB       THR  22  63.494  10.448   7.285
  192    HG1  THR  22           HG1      THR  22  61.292  11.148   6.863
  193   HG21  THR  22          HG21      THR  22  64.361  12.566   6.172
  194   HG22  THR  22          HG22      THR  22  64.018  11.780   4.613
  195   HG23  THR  22          HG23      THR  22  65.162  11.071   5.754
  196    H    ILE  23           HN       ILE  23  65.224   9.327   5.422
  197    HA   ILE  23           HA       ILE  23  65.656   6.664   5.449
  198    HB   ILE  23           HB       ILE  23  67.371   8.661   6.833
  199   HG12  ILE  23          HG12      ILE  23  66.967   8.069   3.944
  200   HG13  ILE  23          HG11      ILE  23  66.815   9.599   4.752
  201   HG21  ILE  23          HG21      ILE  23  67.903   6.094   5.292
  202   HG22  ILE  23          HG22      ILE  23  68.089   6.307   7.038
  203   HG23  ILE  23          HG23      ILE  23  69.185   7.133   5.914
  204   HD11  ILE  23          HD11      ILE  23  69.261   9.594   5.134
  205   HD12  ILE  23          HD12      ILE  23  68.828   9.523   3.406
  206   HD13  ILE  23          HD13      ILE  23  69.299   8.050   4.272
  207    H    HIS  24           HN       HIS  24  64.652   8.753   7.845
  208    HA   HIS  24           HA       HIS  24  65.794   7.635  10.194
  209    HB2  HIS  24           HB2      HIS  24  63.688   9.749   9.965
  210    HB3  HIS  24           HB1      HIS  24  64.897   9.586  11.211
  211    HD1  HIS  24           HD1      HIS  24  67.243   9.286   8.896
  212    HD2  HIS  24           HD2      HIS  24  64.459  12.249   9.396
  213    HE1  HIS  24           HE1      HIS  24  67.921  11.003   7.278
  214    H    ASP  25           HN       ASP  25  63.453   6.688   8.311
  215    HA   ASP  25           HA       ASP  25  61.794   5.571  10.440
  216    HB2  ASP  25           HB2      ASP  25  60.756   7.721   9.801
  217    HB3  ASP  25           HB1      ASP  25  60.611   7.117   8.171
  218    H    ILE  26           HN       ILE  26  62.589   5.708   7.028
  219    HA   ILE  26           HA       ILE  26  61.122   3.790   5.821
  220    HB   ILE  26           HB       ILE  26  62.669   5.137   4.569
  221   HG12  ILE  26          HG12      ILE  26  63.611   2.317   4.375
  222   HG13  ILE  26          HG11      ILE  26  62.090   2.712   3.697
  223   HG21  ILE  26          HG21      ILE  26  64.459   5.247   6.225
  224   HG22  ILE  26          HG22      ILE  26  65.083   4.773   4.640
  225   HG23  ILE  26          HG23      ILE  26  64.866   3.562   5.907
  226   HD11  ILE  26          HD11      ILE  26  64.789   3.765   2.897
  227   HD12  ILE  26          HD12      ILE  26  63.269   4.339   2.190
  228   HD13  ILE  26          HD13      ILE  26  63.758   2.641   2.022
  229    H    ILE  27           HN       ILE  27  60.859   1.660   5.795
  230    HA   ILE  27           HA       ILE  27  62.725   0.125   7.325
  231    HB   ILE  27           HB       ILE  27  60.092  -0.704   6.124
  232   HG12  ILE  27          HG12      ILE  27  59.701   0.900   7.897
  233   HG13  ILE  27          HG11      ILE  27  59.260  -0.714   8.434
  234   HG21  ILE  27          HG21      ILE  27  60.368  -2.702   7.557
  235   HG22  ILE  27          HG22      ILE  27  61.992  -2.104   7.984
  236   HG23  ILE  27          HG23      ILE  27  61.622  -2.524   6.320
  237   HD11  ILE  27          HD11      ILE  27  61.772   0.784   9.169
  238   HD12  ILE  27          HD12      ILE  27  61.361  -0.845   9.700
  239   HD13  ILE  27          HD13      ILE  27  60.367   0.526  10.203
  240    H    LEU  28           HN       LEU  28  64.363  -0.141   6.459
  241    HA   LEU  28           HA       LEU  28  64.288  -1.331   3.836
  242    HB2  LEU  28           HB2      LEU  28  65.627   0.870   4.738
  243    HB3  LEU  28           HB1      LEU  28  66.839  -0.405   4.711
  244    HG   LEU  28           HG       LEU  28  66.393  -0.887   2.424
  245   HD11  LEU  28          HD11      LEU  28  64.661   0.905   1.426
  246   HD12  LEU  28          HD12      LEU  28  64.009   0.661   3.103
  247   HD13  LEU  28          HD13      LEU  28  64.189  -0.690   2.014
  248   HD21  LEU  28          HD21      LEU  28  67.865   1.007   2.980
  249   HD22  LEU  28          HD22      LEU  28  66.466   2.076   2.851
  250   HD23  LEU  28          HD23      LEU  28  67.039   1.188   1.434
  251    H    GLU  29           HN       GLU  29  65.047  -3.474   3.872
  252    HA   GLU  29           HA       GLU  29  66.538  -3.911   6.378
  253    HB2  GLU  29           HB2      GLU  29  66.078  -6.264   6.154
  254    HB3  GLU  29           HB1      GLU  29  64.783  -5.244   6.904
  255    HG2  GLU  29           HG2      GLU  29  63.754  -5.324   4.741
  256    HG3  GLU  29           HG1      GLU  29  65.015  -6.516   4.294
  257    H    CYS  30           HN       CYS  30  68.030  -6.186   6.258
  258    HA   CYS  30           HA       CYS  30  69.537  -5.671   3.985
  259    HB2  CYS  30           HB2      CYS  30  70.404  -6.837   6.133
  260    HB3  CYS  30           HB1      CYS  30  69.604  -8.243   5.507
  261    H    VAL  31           HN       VAL  31  69.322  -6.325   2.223
  262    HA   VAL  31           HA       VAL  31  67.280  -7.858   1.097
  263    HB   VAL  31           HB       VAL  31  68.475  -6.304  -0.331
  264   HG11  VAL  31          HG11      VAL  31  70.911  -7.634   0.631
  265   HG12  VAL  31          HG12      VAL  31  70.397  -5.914   0.826
  266   HG13  VAL  31          HG13      VAL  31  70.774  -6.599  -0.776
  267   HG21  VAL  31          HG21      VAL  31  68.012  -8.243  -1.613
  268   HG22  VAL  31          HG22      VAL  31  69.502  -9.006  -1.045
  269   HG23  VAL  31          HG23      VAL  31  69.575  -7.570  -2.067
  270    H    TYR  32           HN       TYR  32  70.381  -8.648   2.320
  271    HA   TYR  32           HA       TYR  32  70.281 -11.339   1.287
  272    HB2  TYR  32           HB2      TYR  32  72.564 -10.030   2.762
  273    HB3  TYR  32           HB1      TYR  32  72.625 -11.513   1.813
  274    HD1  TYR  32           HD2      TYR  32  71.257 -10.956  -0.612
  275    HD2  TYR  32           HD1      TYR  32  73.722  -8.321   1.680
  276    HE1  TYR  32           HE2      TYR  32  71.642  -9.723  -2.540
  277    HE2  TYR  32           HE1      TYR  32  74.133  -6.944  -0.310
  278    HH   TYR  32           HH       TYR  32  74.061  -7.202  -2.765
  279    H    CYS  33           HN       CYS  33  70.451  -9.632   4.441
  280    HA   CYS  33           HA       CYS  33  70.521 -12.249   5.791
  281    HB2  CYS  33           HB2      CYS  33  71.049  -9.633   7.209
  282    HB3  CYS  33           HB1      CYS  33  71.412 -11.261   7.668
  283    H    LYS  34           HN       LYS  34  68.287  -9.835   5.003
  284    HA   LYS  34           HA       LYS  34  66.354  -9.346   5.576
  285    HB2  LYS  34           HB2      LYS  34  66.624 -12.147   6.071
  286    HB3  LYS  34           HB1      LYS  34  65.321 -11.430   7.010
  287    HG2  LYS  34           HG2      LYS  34  64.734 -12.305   4.751
  288    HG3  LYS  34           HG1      LYS  34  64.261 -10.619   5.122
  289    HD2  LYS  34           HD2      LYS  34  66.260  -9.907   3.783
  290    HD3  LYS  34           HD1      LYS  34  66.488 -11.598   3.349
  291    HE2  LYS  34           HE2      LYS  34  65.241 -10.177   1.715
  292    HE3  LYS  34           HE1      LYS  34  64.460 -11.682   2.189
  293    HZ1  LYS  34           HZ1      LYS  34  62.971  -9.566   2.191
  294    HZ2  LYS  34           HZ2      LYS  34  63.757  -9.171   3.659
  295    HZ3  LYS  34           HZ3      LYS  34  62.918 -10.578   3.508
  296    H    GLN  35           HN       GLN  35  68.561  -9.146   8.085
  297    HA   GLN  35           HA       GLN  35  66.483  -8.467   9.812
  298    HB2  GLN  35           HB2      GLN  35  68.041  -8.192  11.445
  299    HB3  GLN  35           HB1      GLN  35  68.643  -9.566  10.566
  300    HG2  GLN  35           HG2      GLN  35  69.652  -6.794  10.168
  301    HG3  GLN  35           HG1      GLN  35  70.378  -7.901  11.363
  302   HE21  GLN  35          HE21      GLN  35  69.897  -6.981   8.193
  303   HE22  GLN  35          HE22      GLN  35  71.061  -8.005   7.464
  304    H    GLN  36           HN       GLN  36  65.678  -6.509  10.061
  305    HA   GLN  36           HA       GLN  36  65.969  -4.490   8.309
  306    HB2  GLN  36           HB2      GLN  36  64.297  -5.125  10.232
  307    HB3  GLN  36           HB1      GLN  36  65.303  -4.016  11.149
  308    HG2  GLN  36           HG2      GLN  36  64.904  -2.322   9.373
  309    HG3  GLN  36           HG1      GLN  36  63.840  -3.564   8.671
  310   HE21  GLN  36          HE21      GLN  36  61.869  -3.987   9.572
  311   HE22  GLN  36          HE22      GLN  36  61.183  -3.043  10.836
  312    H    LEU  37           HN       LEU  37  67.381  -2.862   8.127
  313    HA   LEU  37           HA       LEU  37  69.760  -2.807   9.707
  314    HB2  LEU  37           HB2      LEU  37  68.656  -1.106   7.512
  315    HB3  LEU  37           HB1      LEU  37  69.934  -0.567   8.539
  316    HG   LEU  37           HG       LEU  37  71.230  -2.613   7.868
  317   HD11  LEU  37          HD11      LEU  37  69.032  -2.837   5.848
  318   HD12  LEU  37          HD12      LEU  37  69.488  -4.022   7.071
  319   HD13  LEU  37          HD13      LEU  37  70.581  -3.659   5.734
  320   HD21  LEU  37          HD21      LEU  37  71.754  -0.440   6.965
  321   HD22  LEU  37          HD22      LEU  37  70.487  -0.609   5.757
  322   HD23  LEU  37          HD23      LEU  37  71.902  -1.657   5.698
  323    H    LEU  38           HN       LEU  38  70.513  -1.583  11.056
  324    HA   LEU  38           HA       LEU  38  68.843  -0.215  12.883
  325    HB2  LEU  38           HB2      LEU  38  71.428  -1.292  12.627
  326    HB3  LEU  38           HB1      LEU  38  71.629   0.409  12.846
  327    HG   LEU  38           HG       LEU  38  70.079  -1.360  14.726
  328   HD11  LEU  38          HD11      LEU  38  72.409  -1.965  14.623
  329   HD12  LEU  38          HD12      LEU  38  72.025  -1.215  16.180
  330   HD13  LEU  38          HD13      LEU  38  72.886  -0.297  14.933
  331   HD21  LEU  38          HD21      LEU  38  70.230   0.524  16.263
  332   HD22  LEU  38          HD22      LEU  38  69.425   1.011  14.769
  333   HD23  LEU  38          HD23      LEU  38  71.109   1.453  15.051
  334    H    ARG  39           HN       ARG  39  68.398   2.072  12.664
  335    HA   ARG  39           HA       ARG  39  68.670   3.249  10.190
  336    HB2  ARG  39           HB2      ARG  39  67.963   5.344  10.995
  337    HB3  ARG  39           HB1      ARG  39  67.195   4.136  12.009
  338    HG2  ARG  39           HG2      ARG  39  69.709   5.527  12.801
  339    HG3  ARG  39           HG1      ARG  39  68.140   6.234  13.137
  340    HD2  ARG  39           HD2      ARG  39  69.201   3.589  14.125
  341    HD3  ARG  39           HD1      ARG  39  68.855   5.029  15.087
  342    HE   ARG  39           HE       ARG  39  66.515   4.281  13.767
  343   HH11  ARG  39          HH11      ARG  39  68.580   3.159  16.415
  344   HH12  ARG  39          HH12      ARG  39  67.355   2.231  17.146
  345   HH21  ARG  39          HH21      ARG  39  64.851   3.025  14.761
  346   HH22  ARG  39          HH22      ARG  39  65.171   2.145  16.184
  347    H    ARG  40           HN       ARG  40  71.146   3.234  12.650
  348    HA   ARG  40           HA       ARG  40  72.793   5.275  11.768
  349    HB2  ARG  40           HB2      ARG  40  73.756   2.579  12.615
  350    HB3  ARG  40           HB1      ARG  40  74.503   4.144  12.831
  351    HG2  ARG  40           HG2      ARG  40  72.804   4.723  14.493
  352    HG3  ARG  40           HG1      ARG  40  72.087   3.119  14.292
  353    HD2  ARG  40           HD2      ARG  40  74.819   3.816  15.320
  354    HD3  ARG  40           HD1      ARG  40  73.524   2.998  16.199
  355    HE   ARG  40           HE       ARG  40  74.343   1.539  13.855
  356   HH11  ARG  40          HH11      ARG  40  75.283   2.071  17.229
  357   HH12  ARG  40          HH12      ARG  40  76.206   0.657  17.322
  358   HH21  ARG  40          HH21      ARG  40  75.586  -0.318  13.960
  359   HH22  ARG  40          HH22      ARG  40  76.396  -0.776  15.389
  360    H    GLU  41           HN       GLU  41  72.576   1.822  10.888
  361    HA   GLU  41           HA       GLU  41  74.638   1.785   8.920
  362    HB2  GLU  41           HB2      GLU  41  72.309  -0.110   8.997
  363    HB3  GLU  41           HB1      GLU  41  73.941  -0.509   8.564
  364    HG2  GLU  41           HG2      GLU  41  72.693  -0.203  11.260
  365    HG3  GLU  41           HG1      GLU  41  73.534  -1.581  10.585
  366    H    VAL  42           HN       VAL  42  71.175   2.315   8.928
  367    HA   VAL  42           HA       VAL  42  70.828   2.243   6.090
  368    HB   VAL  42           HB       VAL  42  69.065   3.926   7.903
  369   HG11  VAL  42          HG11      VAL  42  68.702   3.985   5.444
  370   HG12  VAL  42          HG12      VAL  42  67.327   3.335   6.348
  371   HG13  VAL  42          HG13      VAL  42  68.421   2.233   5.515
  372   HG21  VAL  42          HG21      VAL  42  67.693   1.988   8.381
  373   HG22  VAL  42          HG22      VAL  42  69.338   1.710   8.969
  374   HG23  VAL  42          HG23      VAL  42  68.794   0.970   7.464
  375    H    TYR  43           HN       TYR  43  71.539   4.798   8.441
  376    HA   TYR  43           HA       TYR  43  71.564   6.959   6.641
  377    HB2  TYR  43           HB2      TYR  43  73.102   6.538   9.206
  378    HB3  TYR  43           HB1      TYR  43  73.148   8.052   8.291
  379    HD1  TYR  43           HD2      TYR  43  69.987   7.298   7.709
  380    HD2  TYR  43           HD1      TYR  43  72.397   7.995  11.111
  381    HE1  TYR  43           HE2      TYR  43  68.012   7.903   8.910
  382    HE2  TYR  43           HE1      TYR  43  70.392   8.624  12.403
  383    HH   TYR  43           HH       TYR  43  67.296   7.931  11.457
  384    H    ASP  44           HN       ASP  44  74.071   4.631   7.547
  385    HA   ASP  44           HA       ASP  44  76.276   5.727   6.372
  386    HB2  ASP  44           HB2      ASP  44  75.430   2.832   6.394
  387    HB3  ASP  44           HB1      ASP  44  77.003   3.425   6.019
  388    H    PHE  45           HN       PHE  45  73.768   3.865   5.009
  389    HA   PHE  45           HA       PHE  45  74.768   3.323   2.522
  390    HB2  PHE  45           HB2      PHE  45  72.466   2.786   3.868
  391    HB3  PHE  45           HB1      PHE  45  71.966   4.034   2.765
  392    HD1  PHE  45           HD2      PHE  45  73.439   0.688   2.964
  393    HD2  PHE  45           HD1      PHE  45  71.677   3.707   0.541
  394    HE1  PHE  45           HE2      PHE  45  73.097  -0.938   1.117
  395    HE2  PHE  45           HE1      PHE  45  71.372   2.108  -1.264
  396    HZ   PHE  45           HZ       PHE  45  72.042  -0.198  -0.982
  397    H    ALA  46           HN       ALA  46  72.734   6.102   3.530
  398    HA   ALA  46           HA       ALA  46  73.079   7.430   0.956
  399    HB1  ALA  46           HB1      ALA  46  70.884   7.616   2.028
  400    HB2  ALA  46           HB2      ALA  46  71.635   9.193   1.853
  401    HB3  ALA  46           HB3      ALA  46  71.647   8.382   3.420
  402    H    ARG  47           HN       ARG  47  74.640   7.427   3.991
  403    HA   ARG  47           HA       ARG  47  75.713  10.068   3.763
  404    HB2  ARG  47           HB2      ARG  47  75.866   7.809   5.627
  405    HB3  ARG  47           HB1      ARG  47  77.343   8.728   5.595
  406    HG2  ARG  47           HG2      ARG  47  75.868   9.423   7.351
  407    HG3  ARG  47           HG1      ARG  47  76.105  10.724   6.192
  408    HD2  ARG  47           HD2      ARG  47  73.939  10.336   5.230
  409    HD3  ARG  47           HD1      ARG  47  73.725   8.876   6.187
  410    HE   ARG  47           HE       ARG  47  73.944  10.515   8.137
  411   HH11  ARG  47          HH11      ARG  47  72.344  11.324   5.060
  412   HH12  ARG  47          HH12      ARG  47  71.211  12.367   5.768
  413   HH21  ARG  47          HH21      ARG  47  72.349  11.924   9.104
  414   HH22  ARG  47          HH22      ARG  47  71.208  12.710   8.153
  415    H    ARG  48           HN       ARG  48  76.418   6.998   2.563
  416    HA   ARG  48           HA       ARG  48  78.954   7.876   1.379
  417    HB2  ARG  48           HB2      ARG  48  77.631   5.238   1.740
  418    HB3  ARG  48           HB1      ARG  48  79.221   5.425   1.034
  419    HG2  ARG  48           HG2      ARG  48  80.106   6.162   3.152
  420    HG3  ARG  48           HG1      ARG  48  78.482   6.279   3.834
  421    HD2  ARG  48           HD2      ARG  48  78.239   3.835   3.409
  422    HD3  ARG  48           HD1      ARG  48  79.951   3.832   2.985
  423    HE   ARG  48           HE       ARG  48  79.535   5.022   5.513
  424   HH11  ARG  48          HH11      ARG  48  79.738   1.830   3.987
  425   HH12  ARG  48          HH12      ARG  48  80.005   1.009   5.472
  426   HH21  ARG  48          HH21      ARG  48  79.898   3.870   7.510
  427   HH22  ARG  48          HH22      ARG  48  80.107   2.175   7.478
  428    H    ASP  49           HN       ASP  49  78.699   5.877  -0.730
  429    HA   ASP  49           HA       ASP  49  76.266   6.705  -2.083
  430    HB2  ASP  49           HB2      ASP  49  77.945   8.156  -3.064
  431    HB3  ASP  49           HB1      ASP  49  79.003   6.782  -3.375
  432    H    LEU  50           HN       LEU  50  75.578   4.677  -1.389
  433    HA   LEU  50           HA       LEU  50  76.599   2.531  -3.029
  434    HB2  LEU  50           HB2      LEU  50  74.747   2.433  -0.659
  435    HB3  LEU  50           HB1      LEU  50  75.269   1.035  -1.574
  436    HG   LEU  50           HG       LEU  50  77.629   1.768  -0.972
  437   HD11  LEU  50          HD11      LEU  50  77.187   3.913  -0.207
  438   HD12  LEU  50          HD12      LEU  50  77.864   2.970   1.136
  439   HD13  LEU  50          HD13      LEU  50  76.130   3.337   1.077
  440   HD21  LEU  50          HD21      LEU  50  75.772   0.775   1.125
  441   HD22  LEU  50          HD22      LEU  50  77.535   0.677   1.175
  442   HD23  LEU  50          HD23      LEU  50  76.631  -0.210  -0.076
  443    H    CYS  51           HN       CYS  51  74.576   0.881  -3.456
  444    HA   CYS  51           HA       CYS  51  72.315   2.415  -4.474
  445    HB2  CYS  51           HB2      CYS  51  72.294   0.910  -6.445
  446    HB3  CYS  51           HB1      CYS  51  73.765   1.873  -6.382
  447    HG   CYS  51           HG       CYS  51  75.487  -0.101  -6.004
  448    H    ILE  52           HN       ILE  52  70.388   1.328  -4.417
  449    HA   ILE  52           HA       ILE  52  70.323  -0.562  -2.276
  450    HB   ILE  52           HB       ILE  52  68.246   1.101  -3.613
  451   HG12  ILE  52          HG12      ILE  52  69.347   0.577  -0.941
  452   HG13  ILE  52          HG11      ILE  52  69.525   2.056  -1.921
  453   HG21  ILE  52          HG21      ILE  52  67.142  -1.118  -3.410
  454   HG22  ILE  52          HG22      ILE  52  66.477   0.048  -2.268
  455   HG23  ILE  52          HG23      ILE  52  67.611  -1.181  -1.711
  456   HD11  ILE  52          HD11      ILE  52  67.223   0.908  -0.566
  457   HD12  ILE  52          HD12      ILE  52  67.134   2.336  -1.649
  458   HD13  ILE  52          HD13      ILE  52  68.090   2.385  -0.109
  459    H    VAL  53           HN       VAL  53  69.425  -2.363  -2.178
  460    HA   VAL  53           HA       VAL  53  69.586  -3.916  -4.601
  461    HB   VAL  53           HB       VAL  53  70.351  -5.697  -2.834
  462   HG11  VAL  53          HG11      VAL  53  71.738  -4.745  -4.663
  463   HG12  VAL  53          HG12      VAL  53  72.682  -4.948  -3.183
  464   HG13  VAL  53          HG13      VAL  53  72.092  -3.348  -3.651
  465   HG21  VAL  53          HG21      VAL  53  71.553  -4.668  -0.957
  466   HG22  VAL  53          HG22      VAL  53  69.843  -4.276  -0.877
  467   HG23  VAL  53          HG23      VAL  53  71.000  -3.079  -1.455
  468    H    TYR  54           HN       TYR  54  67.765  -4.618  -5.070
  469    HA   TYR  54           HA       TYR  54  65.680  -5.135  -3.144
  470    HB2  TYR  54           HB2      TYR  54  65.786  -5.096  -6.147
  471    HB3  TYR  54           HB1      TYR  54  64.333  -5.398  -5.193
  472    HD1  TYR  54           HD2      TYR  54  66.868  -2.791  -6.029
  473    HD2  TYR  54           HD1      TYR  54  63.157  -3.667  -4.148
  474    HE1  TYR  54           HE2      TYR  54  66.398  -0.350  -5.709
  475    HE2  TYR  54           HE1      TYR  54  62.726  -1.388  -3.870
  476    HH   TYR  54           HH       TYR  54  64.019   0.723  -3.618
  477    H    ARG  55           HN       ARG  55  65.480  -6.900  -2.393
  478    HA   ARG  55           HA       ARG  55  66.790  -9.157  -3.692
  479    HB2  ARG  55           HB2      ARG  55  66.318  -8.778  -0.938
  480    HB3  ARG  55           HB1      ARG  55  65.138  -9.974  -1.403
  481    HG2  ARG  55           HG2      ARG  55  68.126 -10.351  -1.943
  482    HG3  ARG  55           HG1      ARG  55  67.360 -10.887  -0.508
  483    HD2  ARG  55           HD2      ARG  55  66.606 -11.738  -3.326
  484    HD3  ARG  55           HD1      ARG  55  67.605 -12.671  -2.216
  485    HE   ARG  55           HE       ARG  55  64.873 -12.000  -1.417
  486   HH11  ARG  55          HH11      ARG  55  67.205 -14.492  -2.399
  487   HH12  ARG  55          HH12      ARG  55  66.143 -15.788  -2.126
  488   HH21  ARG  55          HH21      ARG  55  63.414 -13.801  -1.076
  489   HH22  ARG  55          HH22      ARG  55  63.926 -15.384  -1.356
  490    H    ASP  56           HN       ASP  56  65.444 -10.369  -5.083
  491    HA   ASP  56           HA       ASP  56  63.659 -11.141  -6.210
  492    HB2  ASP  56           HB2      ASP  56  62.793 -12.090  -4.101
  493    HB3  ASP  56           HB1      ASP  56  62.074 -10.543  -3.678
  494    H    GLY  57           HN       GLY  57  62.063  -8.634  -4.324
  495    HA2  GLY  57           HA2      GLY  57  62.323  -6.662  -6.303
  496    HA3  GLY  57           HA1      GLY  57  60.715  -7.392  -6.410
  497    H    ASN  58           HN       ASN  58  62.715  -6.788  -3.536
  498    HA   ASN  58           HA       ASN  58  60.720  -4.821  -2.591
  499    HB2  ASN  58           HB2      ASN  58  62.119  -6.812  -0.843
  500    HB3  ASN  58           HB1      ASN  58  60.723  -5.856  -0.440
  501   HD21  ASN  58          HD21      ASN  58  61.949  -8.666  -2.009
  502   HD22  ASN  58          HD22      ASN  58  60.496  -9.541  -2.143
  503    HA   PRO  59           HA       PRO  59  64.519  -2.817  -1.899
  504    HB2  PRO  59           HB2      PRO  59  63.416  -0.754  -0.228
  505    HB3  PRO  59           HB1      PRO  59  63.837  -0.661  -1.937
  506    HG2  PRO  59           HG2      PRO  59  61.225  -0.578  -0.994
  507    HG3  PRO  59           HG1      PRO  59  61.596  -0.999  -2.578
  508    HD2  PRO  59           HD2      PRO  59  60.939  -2.786  -0.330
  509    HD3  PRO  59           HD1      PRO  59  60.631  -2.987  -2.059
  510    H    TYR  60           HN       TYR  60  66.242  -3.071  -0.839
  511    HA   TYR  60           HA       TYR  60  66.044  -3.051   1.954
  512    HB2  TYR  60           HB2      TYR  60  67.587  -5.397   0.864
  513    HB3  TYR  60           HB1      TYR  60  66.989  -4.994   2.315
  514    HD1  TYR  60           HD1      TYR  60  64.733  -5.210   2.995
  515    HD2  TYR  60           HD2      TYR  60  66.062  -6.545  -0.736
  516    HE1  TYR  60           HE1      TYR  60  62.776  -6.713   2.851
  517    HE2  TYR  60           HE2      TYR  60  64.104  -8.057  -0.911
  518    HH   TYR  60           HH       TYR  60  61.474  -7.907   1.200
  519    H    ALA  61           HN       ALA  61  67.994  -2.978   2.773
  520    HA   ALA  61           HA       ALA  61  69.865  -1.372   1.283
  521    HB1  ALA  61           HB1      ALA  61  69.590  -1.987   4.128
  522    HB2  ALA  61           HB2      ALA  61  68.638  -0.741   3.363
  523    HB3  ALA  61           HB3      ALA  61  70.440  -0.594   3.418
  524    H    VAL  62           HN       VAL  62  72.053  -1.835   2.268
  525    HA   VAL  62           HA       VAL  62  72.570  -4.699   2.421
  526    HB   VAL  62           HB       VAL  62  74.255  -2.290   1.608
  527   HG11  VAL  62          HG11      VAL  62  75.588  -3.664   2.894
  528   HG12  VAL  62          HG12      VAL  62  76.077  -3.678   1.197
  529   HG13  VAL  62          HG13      VAL  62  75.201  -5.072   1.887
  530   HG21  VAL  62          HG21      VAL  62  73.374  -4.673   0.065
  531   HG22  VAL  62          HG22      VAL  62  74.507  -3.449  -0.514
  532   HG23  VAL  62          HG23      VAL  62  72.840  -2.999  -0.174
  533    H    CYS  63           HN       CYS  63  72.580  -5.278   4.508
  534    HA   CYS  63           HA       CYS  63  72.751  -3.494   6.646
  535    HB2  CYS  63           HB2      CYS  63  72.548  -5.341   8.030
  536    HB3  CYS  63           HB1      CYS  63  71.874  -5.828   6.474
  537    H    ASP  64           HN       ASP  64  74.331  -3.996   8.511
  538    HA   ASP  64           HA       ASP  64  76.813  -2.804   7.993
  539    HB2  ASP  64           HB2      ASP  64  75.878  -2.781  10.189
  540    HB3  ASP  64           HB1      ASP  64  75.900  -4.527  10.273
  541    H    LYS  65           HN       LYS  65  76.045  -6.152   8.505
  542    HA   LYS  65           HA       LYS  65  78.554  -7.397   8.354
  543    HB2  LYS  65           HB2      LYS  65  75.909  -8.319   7.253
  544    HB3  LYS  65           HB1      LYS  65  77.292  -9.353   7.478
  545    HG2  LYS  65           HG2      LYS  65  77.117  -9.216   9.827
  546    HG3  LYS  65           HG1      LYS  65  75.927  -7.913   9.717
  547    HD2  LYS  65           HD2      LYS  65  74.806 -10.058  10.152
  548    HD3  LYS  65           HD1      LYS  65  74.394  -9.385   8.569
  549    HE2  LYS  65           HE2      LYS  65  76.033 -10.904   7.524
  550    HE3  LYS  65           HE1      LYS  65  76.338 -11.627   9.103
  551    HZ1  LYS  65           HZ1      LYS  65  74.748 -12.916   7.805
  552    HZ2  LYS  65           HZ2      LYS  65  73.742 -11.578   7.670
  553    HZ3  LYS  65           HZ3      LYS  65  73.994 -12.290   9.172
  554    H    CYS  66           HN       CYS  66  76.191  -6.709   5.869
  555    HA   CYS  66           HA       CYS  66  77.795  -7.660   3.745
  556    HB2  CYS  66           HB2      CYS  66  75.150  -6.254   3.887
  557    HB3  CYS  66           HB1      CYS  66  75.825  -6.845   2.380
  558    H    LEU  67           HN       LEU  67  77.184  -4.507   5.096
  559    HA   LEU  67           HA       LEU  67  78.068  -2.855   3.107
  560    HB2  LEU  67           HB2      LEU  67  78.315  -2.635   6.043
  561    HB3  LEU  67           HB1      LEU  67  78.944  -1.385   4.991
  562    HG   LEU  67           HG       LEU  67  76.070  -2.299   5.160
  563   HD11  LEU  67          HD11      LEU  67  75.719  -0.066   5.971
  564   HD12  LEU  67          HD12      LEU  67  77.475   0.196   5.798
  565   HD13  LEU  67          HD13      LEU  67  76.869  -0.985   6.982
  566   HD21  LEU  67          HD21      LEU  67  76.568  -1.672   2.860
  567   HD22  LEU  67          HD22      LEU  67  77.359  -0.206   3.424
  568   HD23  LEU  67          HD23      LEU  67  75.626  -0.410   3.647
  569    H    LYS  68           HN       LYS  68  80.089  -4.428   5.527
  570    HA   LYS  68           HA       LYS  68  82.491  -3.321   4.508
  571    HB2  LYS  68           HB2      LYS  68  83.662  -4.972   5.929
  572    HB3  LYS  68           HB1      LYS  68  82.397  -4.125   6.805
  573    HG2  LYS  68           HG2      LYS  68  80.916  -6.075   6.433
  574    HG3  LYS  68           HG1      LYS  68  82.276  -6.916   5.700
  575    HD2  LYS  68           HD2      LYS  68  83.518  -6.720   7.808
  576    HD3  LYS  68           HD1      LYS  68  82.140  -5.885   8.534
  577    HE2  LYS  68           HE2      LYS  68  80.743  -7.863   8.088
  578    HE3  LYS  68           HE1      LYS  68  82.151  -8.687   7.432
  579    HZ1  LYS  68           HZ1      LYS  68  83.202  -8.494   9.623
  580    HZ2  LYS  68           HZ2      LYS  68  81.789  -9.372   9.648
  581    HZ3  LYS  68           HZ3      LYS  68  81.788  -7.787  10.237
  582    H    PHE  69           HN       PHE  69  80.604  -6.155   3.533
  583    HA   PHE  69           HA       PHE  69  82.629  -7.442   2.094
  584    HB2  PHE  69           HB2      PHE  69  79.705  -7.389   2.010
  585    HB3  PHE  69           HB1      PHE  69  80.617  -8.524   1.077
  586    HD1  PHE  69           HD2      PHE  69  82.532  -8.752   3.776
  587    HD2  PHE  69           HD1      PHE  69  78.443  -9.274   2.767
  588    HE1  PHE  69           HE2      PHE  69  82.262 -10.303   5.658
  589    HE2  PHE  69           HE1      PHE  69  78.138 -10.786   4.600
  590    HZ   PHE  69           HZ       PHE  69  80.054 -11.341   6.089
  591    H    TYR  70           HN       TYR  70  79.840  -5.393   1.330
  592    HA   TYR  70           HA       TYR  70  80.522  -5.501  -1.439
  593    HB2  TYR  70           HB2      TYR  70  78.028  -4.520  -0.077
  594    HB3  TYR  70           HB1      TYR  70  78.265  -4.602  -1.827
  595    HD1  TYR  70           HD1      TYR  70  78.783  -6.858  -2.859
  596    HD2  TYR  70           HD2      TYR  70  77.393  -6.451   1.118
  597    HE1  TYR  70           HE1      TYR  70  78.160  -9.226  -2.844
  598    HE2  TYR  70           HE2      TYR  70  76.779  -8.825   1.173
  599    HH   TYR  70           HH       TYR  70  76.272 -10.613  -0.313
  600    H    SER  71           HN       SER  71  81.345  -3.363   0.954
  601    HA   SER  71           HA       SER  71  81.349  -1.045  -0.763
  602    HB2  SER  71           HB2      SER  71  83.109  -1.640   1.646
  603    HB3  SER  71           HB1      SER  71  82.919  -0.066   0.872
  604    HG   SER  71           HG       SER  71  80.860  -1.574   2.095
  605    H    LYS  72           HN       LYS  72  83.214  -3.827  -0.210
  606    HA   LYS  72           HA       LYS  72  85.514  -3.019  -1.729
  607    HB2  LYS  72           HB2      LYS  72  85.590  -4.656   0.164
  608    HB3  LYS  72           HB1      LYS  72  84.614  -5.746  -0.792
  609    HG2  LYS  72           HG2      LYS  72  86.895  -6.456  -0.912
  610    HG3  LYS  72           HG1      LYS  72  86.408  -5.820  -2.485
  611    HD2  LYS  72           HD2      LYS  72  87.539  -3.707  -1.975
  612    HD3  LYS  72           HD1      LYS  72  87.988  -4.327  -0.388
  613    HE2  LYS  72           HE2      LYS  72  89.867  -4.514  -1.892
  614    HE3  LYS  72           HE1      LYS  72  89.271  -6.118  -1.475
  615    HZ1  LYS  72           HZ1      LYS  72  89.742  -5.964  -3.831
  616    HZ2  LYS  72           HZ2      LYS  72  88.720  -4.663  -4.008
  617    HZ3  LYS  72           HZ3      LYS  72  88.095  -6.162  -3.634
  618    H    ILE  73           HN       ILE  73  82.631  -5.002  -2.088
  619    HA   ILE  73           HA       ILE  73  83.308  -5.726  -4.787
  620    HB   ILE  73           HB       ILE  73  80.629  -6.113  -3.499
  621   HG12  ILE  73          HG12      ILE  73  83.120  -7.854  -3.365
  622   HG13  ILE  73          HG11      ILE  73  82.111  -7.202  -2.068
  623   HG21  ILE  73          HG21      ILE  73  81.941  -7.524  -5.816
  624   HG22  ILE  73          HG22      ILE  73  80.638  -6.341  -5.923
  625   HG23  ILE  73          HG23      ILE  73  80.349  -7.907  -5.160
  626   HD11  ILE  73          HD11      ILE  73  81.845  -9.616  -2.334
  627   HD12  ILE  73          HD12      ILE  73  81.230  -9.352  -3.967
  628   HD13  ILE  73          HD13      ILE  73  80.343  -8.725  -2.576
  629    H    SER  74           HN       SER  74  83.469  -3.727  -5.717
  630    HA   SER  74           HA       SER  74  80.910  -3.082  -6.793
  631    HB2  SER  74           HB2      SER  74  83.005  -0.941  -6.216
  632    HB3  SER  74           HB1      SER  74  81.408  -0.666  -6.903
  633    HG   SER  74           HG       SER  74  81.001  -2.009  -4.708
  634    H    GLU  75           HN       GLU  75  84.328  -2.642  -6.923
  635    HA   GLU  75           HA       GLU  75  84.503  -3.206  -9.773
  636    HB2  GLU  75           HB2      GLU  75  86.657  -2.662  -7.715
  637    HB3  GLU  75           HB1      GLU  75  86.923  -2.808  -9.445
  638    HG2  GLU  75           HG2      GLU  75  85.211  -0.690  -8.173
  639    HG3  GLU  75           HG1      GLU  75  86.909  -0.475  -8.596
  640    H    TYR  76           HN       TYR  76  83.703  -5.363  -9.652
  641    HA   TYR  76           HA       TYR  76  85.562  -7.407  -8.909
  642    HB2  TYR  76           HB2      TYR  76  84.258  -6.555  -6.805
  643    HB3  TYR  76           HB1      TYR  76  82.897  -7.380  -7.563
  644    HD1  TYR  76           HD1      TYR  76  86.397  -7.942  -6.724
  645    HD2  TYR  76           HD2      TYR  76  82.533  -9.558  -6.965
  646    HE1  TYR  76           HE1      TYR  76  87.248 -10.008  -5.710
  647    HE2  TYR  76           HE2      TYR  76  83.318 -11.674  -5.940
  648    HH   TYR  76           HH       TYR  76  86.187 -11.933  -4.330
  649    H    ARG  77           HN       ARG  77  84.601  -9.502  -9.730
  650    HA   ARG  77           HA       ARG  77  82.252  -9.114 -11.218
  651    HB2  ARG  77           HB2      ARG  77  83.319 -10.367 -13.216
  652    HB3  ARG  77           HB1      ARG  77  83.697  -8.675 -12.993
  653    HG2  ARG  77           HG2      ARG  77  85.709  -9.607 -13.578
  654    HG3  ARG  77           HG1      ARG  77  85.754  -9.510 -11.810
  655    HD2  ARG  77           HD2      ARG  77  85.130 -11.842 -11.666
  656    HD3  ARG  77           HD1      ARG  77  85.086 -11.962 -13.420
  657    HE   ARG  77           HE       ARG  77  87.605 -11.021 -12.550
  658   HH11  ARG  77          HH11      ARG  77  85.706 -14.003 -12.733
  659   HH12  ARG  77          HH12      ARG  77  87.048 -15.038 -12.765
  660   HH21  ARG  77          HH21      ARG  77  89.475 -12.478 -12.596
  661   HH22  ARG  77          HH22      ARG  77  89.223 -14.162 -12.696
  662    H    HIS  78           HN       HIS  78  81.052 -10.273 -10.033
  663    HA   HIS  78           HA       HIS  78  81.849 -13.024  -9.780
  664    HB2  HIS  78           HB2      HIS  78  80.594 -13.118  -7.647
  665    HB3  HIS  78           HB1      HIS  78  82.004 -12.038  -7.537
  666    HD1  HIS  78           HD1      HIS  78  78.736 -12.425  -6.291
  667    HD2  HIS  78           HD2      HIS  78  80.781  -9.379  -8.107
  668    HE1  HIS  78           HE1      HIS  78  77.515 -10.338  -5.602
  669    H    TYR  79           HN       TYR  79  80.144 -11.441 -11.625
  670    HA   TYR  79           HA       TYR  79  77.414 -11.899 -10.858
  671    HB2  TYR  79           HB2      TYR  79  78.679 -10.330 -13.081
  672    HB3  TYR  79           HB1      TYR  79  76.941 -10.501 -12.862
  673    HD1  TYR  79           HD1      TYR  79  80.007  -9.394 -11.004
  674    HD2  TYR  79           HD2      TYR  79  75.819  -9.006 -11.551
  675    HE1  TYR  79           HE1      TYR  79  80.002  -7.462  -9.511
  676    HE2  TYR  79           HE2      TYR  79  75.782  -7.096 -10.046
  677    HH   TYR  79           HH       TYR  79  77.078  -6.094  -8.300
  678    H    SER  80           HN       SER  80  75.947 -12.898 -12.265
  679    HA   SER  80           HA       SER  80  76.706 -14.158 -14.692
  680    HB2  SER  80           HB2      SER  80  75.901 -15.859 -12.292
  681    HB3  SER  80           HB1      SER  80  75.981 -16.446 -13.953
  682    HG   SER  80           HG       SER  80  78.222 -15.147 -13.080
  Start of MODEL    3
    1    H1   GLY  -1           HT1      GLY  -1  55.592  -1.028   0.846
    2    H2   GLY  -1           HT2      GLY  -1  56.422   0.437   0.663
    3    H3   GLY  -1           HT3      GLY  -1  54.993   0.395   1.538
    4    HA2  GLY  -1           HA1      GLY  -1  56.905   0.587   2.945
    5    HA3  GLY  -1           HA2      GLY  -1  56.042  -0.921   3.242
    6    H    ALA   0           HN       ALA   0  57.689  -2.252   3.839
    7    HA   ALA   0           HA       ALA   0  60.244  -2.300   2.638
    8    HB1  ALA   0           HB1      ALA   0  58.804  -4.464   4.188
    9    HB2  ALA   0           HB2      ALA   0  59.846  -3.220   4.877
   10    HB3  ALA   0           HB3      ALA   0  60.526  -4.454   3.815
   11    H    MET   1           HN       MET   1  57.212  -3.809   1.914
   12    HA   MET   1           HA       MET   1  58.406  -5.102  -0.432
   13    HB2  MET   1           HB2      MET   1  56.772  -6.442   0.888
   14    HB3  MET   1           HB1      MET   1  55.551  -5.210   0.591
   15    HG2  MET   1           HG2      MET   1  56.335  -5.716  -1.940
   16    HG3  MET   1           HG1      MET   1  56.627  -7.290  -1.210
   17    HE1  MET   1           HE1      MET   1  54.061  -4.512  -2.082
   18    HE2  MET   1           HE2      MET   1  53.787  -4.609  -0.347
   19    HE3  MET   1           HE3      MET   1  52.538  -5.157  -1.468
   20    H    PHE   2           HN       PHE   2  58.381  -3.865  -2.249
   21    HA   PHE   2           HA       PHE   2  56.275  -1.912  -2.461
   22    HB2  PHE   2           HB2      PHE   2  59.044  -1.930  -3.200
   23    HB3  PHE   2           HB1      PHE   2  58.108  -1.509  -4.600
   24    HD1  PHE   2           HD2      PHE   2  55.912  -0.090  -2.701
   25    HD2  PHE   2           HD1      PHE   2  60.108   0.151  -3.186
   26    HE1  PHE   2           HE2      PHE   2  55.864   2.236  -1.930
   27    HE2  PHE   2           HE1      PHE   2  60.107   2.414  -2.454
   28    HZ   PHE   2           HZ       PHE   2  57.960   3.521  -1.802
   29    H    GLN   3           HN       GLN   3  54.891  -1.884  -4.102
   30    HA   GLN   3           HA       GLN   3  54.898  -4.247  -5.806
   31    HB2  GLN   3           HB2      GLN   3  52.392  -3.757  -6.082
   32    HB3  GLN   3           HB1      GLN   3  52.939  -4.469  -4.587
   33    HG2  GLN   3           HG2      GLN   3  51.254  -2.885  -4.048
   34    HG3  GLN   3           HG1      GLN   3  52.777  -2.186  -3.539
   35   HE21  GLN   3          HE21      GLN   3  53.588  -1.169  -6.027
   36   HE22  GLN   3          HE22      GLN   3  52.534   0.013  -6.574
   37    H    ASP   4           HN       ASP   4  53.660  -3.986  -7.889
   38    HA   ASP   4           HA       ASP   4  55.088  -1.937  -9.358
   39    HB2  ASP   4           HB2      ASP   4  54.751  -4.239 -10.292
   40    HB3  ASP   4           HB1      ASP   4  53.016  -3.973 -10.257
   41    HA   PRO   5           HA       PRO   5  54.797  -0.768 -11.361
   42    HB2  PRO   5           HB2      PRO   5  54.295   1.396 -12.611
   43    HB3  PRO   5           HB1      PRO   5  53.110   0.046 -12.432
   44    HG2  PRO   5           HG2      PRO   5  53.166   2.541 -10.787
   45    HG3  PRO   5           HG1      PRO   5  51.832   1.990 -11.836
   46    HD2  PRO   5           HD2      PRO   5  52.147   1.362  -9.163
   47    HD3  PRO   5           HD1      PRO   5  51.194   0.404 -10.317
   48    H    GLN   6           HN       GLN   6  54.660   0.198  -8.782
   49    HA   GLN   6           HA       GLN   6  56.499   2.422  -8.510
   50    HB2  GLN   6           HB2      GLN   6  55.599   0.493  -6.346
   51    HB3  GLN   6           HB1      GLN   6  56.611   1.900  -6.065
   52    HG2  GLN   6           HG2      GLN   6  54.810   3.362  -6.772
   53    HG3  GLN   6           HG1      GLN   6  53.809   1.962  -7.144
   54   HE21  GLN   6          HE21      GLN   6  53.397   4.170  -5.292
   55   HE22  GLN   6          HE22      GLN   6  53.131   3.483  -3.741
   56    H    GLU   7           HN       GLU   7  57.709   1.465  -9.944
   57    HA   GLU   7           HA       GLU   7  59.313  -0.744  -9.881
   58    HB2  GLU   7           HB2      GLU   7  59.195   1.772 -11.276
   59    HB3  GLU   7           HB1      GLU   7  60.725   0.933 -11.337
   60    HG2  GLU   7           HG2      GLU   7  58.080  -0.321 -12.016
   61    HG3  GLU   7           HG1      GLU   7  59.166   0.416 -13.197
   62    H    ARG   8           HN       ARG   8  59.550   1.767  -7.897
   63    HA   ARG   8           HA       ARG   8  60.977   2.477  -6.272
   64    HB2  ARG   8           HB2      ARG   8  62.528  -0.106  -6.759
   65    HB3  ARG   8           HB1      ARG   8  62.562   0.857  -5.307
   66    HG2  ARG   8           HG2      ARG   8  61.200  -0.821  -4.587
   67    HG3  ARG   8           HG1      ARG   8  60.035   0.299  -5.254
   68    HD2  ARG   8           HD2      ARG   8  59.642  -2.075  -5.881
   69    HD3  ARG   8           HD1      ARG   8  59.751  -0.944  -7.221
   70    HE   ARG   8           HE       ARG   8  62.228  -2.244  -6.662
   71   HH11  ARG   8          HH11      ARG   8  59.114  -2.544  -8.317
   72   HH12  ARG   8          HH12      ARG   8  59.642  -3.675  -9.468
   73   HH21  ARG   8          HH21      ARG   8  62.982  -3.871  -8.284
   74   HH22  ARG   8          HH22      ARG   8  61.860  -4.474  -9.397
   75    HA   PRO   9           HA       PRO   9  64.727   4.181  -8.309
   76    HB2  PRO   9           HB2      PRO   9  66.017   5.139  -6.177
   77    HB3  PRO   9           HB1      PRO   9  64.621   6.006  -6.699
   78    HG2  PRO   9           HG2      PRO   9  65.041   4.175  -4.461
   79    HG3  PRO   9           HG1      PRO   9  63.888   5.521  -4.603
   80    HD2  PRO   9           HD2      PRO   9  63.373   2.829  -4.723
   81    HD3  PRO   9           HD1      PRO   9  62.237   4.059  -5.276
   82    H    ARG  10           HN       ARG  10  67.260   4.329  -7.330
   83    HA   ARG  10           HA       ARG  10  67.966   1.772  -6.109
   84    HB2  ARG  10           HB2      ARG  10  69.315   3.332  -8.274
   85    HB3  ARG  10           HB1      ARG  10  70.126   2.109  -7.323
   86    HG2  ARG  10           HG2      ARG  10  67.715   1.663  -9.087
   87    HG3  ARG  10           HG1      ARG  10  69.402   1.263  -9.442
   88    HD2  ARG  10           HD2      ARG  10  69.447  -0.272  -7.553
   89    HD3  ARG  10           HD1      ARG  10  67.766   0.131  -7.206
   90    HE   ARG  10           HE       ARG  10  67.592  -0.688  -9.709
   91   HH11  ARG  10          HH11      ARG  10  69.167  -2.170  -6.873
   92   HH12  ARG  10          HH12      ARG  10  69.000  -3.753  -7.462
   93   HH21  ARG  10          HH21      ARG  10  67.345  -2.876 -10.465
   94   HH22  ARG  10          HH22      ARG  10  67.917  -4.167  -9.515
   95    H    LYS  11           HN       LYS  11  67.612   4.971  -5.540
   96    HA   LYS  11           HA       LYS  11  70.092   5.099  -3.993
   97    HB2  LYS  11           HB2      LYS  11  68.291   7.441  -4.600
   98    HB3  LYS  11           HB1      LYS  11  69.934   7.389  -4.082
   99    HG2  LYS  11           HG2      LYS  11  69.455   6.169  -6.716
  100    HG3  LYS  11           HG1      LYS  11  69.255   7.912  -6.612
  101    HD2  LYS  11           HD2      LYS  11  71.457   7.461  -7.296
  102    HD3  LYS  11           HD1      LYS  11  71.490   8.047  -5.632
  103    HE2  LYS  11           HE2      LYS  11  71.817   5.753  -4.819
  104    HE3  LYS  11           HE1      LYS  11  71.734   5.140  -6.471
  105    HZ1  LYS  11           HZ1      LYS  11  73.753   6.490  -6.943
  106    HZ2  LYS  11           HZ2      LYS  11  73.999   5.277  -5.837
  107    HZ3  LYS  11           HZ3      LYS  11  73.876   6.865  -5.296
  108    H    LEU  12           HN       LEU  12  69.889   5.410  -1.828
  109    HA   LEU  12           HA       LEU  12  67.622   4.556  -0.516
  110    HB2  LEU  12           HB2      LEU  12  69.648   4.266   0.552
  111    HB3  LEU  12           HB1      LEU  12  70.083   5.959   0.424
  112    HG   LEU  12           HG       LEU  12  68.358   6.520   2.044
  113   HD11  LEU  12          HD11      LEU  12  66.846   4.616   1.602
  114   HD12  LEU  12          HD12      LEU  12  67.266   4.815   3.316
  115   HD13  LEU  12          HD13      LEU  12  68.050   3.544   2.351
  116   HD21  LEU  12          HD21      LEU  12  70.673   5.946   2.669
  117   HD22  LEU  12          HD22      LEU  12  70.054   4.329   3.082
  118   HD23  LEU  12          HD23      LEU  12  69.471   5.751   3.944
  119    HA   PRO  13           HA       PRO  13  66.532   8.977   0.958
  120    HB2  PRO  13           HB2      PRO  13  67.401  11.155  -0.426
  121    HB3  PRO  13           HB1      PRO  13  68.384  10.350   0.822
  122    HG2  PRO  13           HG2      PRO  13  68.541   9.984  -2.142
  123    HG3  PRO  13           HG1      PRO  13  69.843  10.340  -0.988
  124    HD2  PRO  13           HD2      PRO  13  69.347   7.834  -1.818
  125    HD3  PRO  13           HD1      PRO  13  69.875   8.164  -0.168
  126    H    GLN  14           HN       GLN  14  66.927   8.601  -2.461
  127    HA   GLN  14           HA       GLN  14  64.499   9.788  -3.282
  128    HB2  GLN  14           HB2      GLN  14  66.337   7.796  -4.610
  129    HB3  GLN  14           HB1      GLN  14  64.925   8.468  -5.403
  130    HG2  GLN  14           HG2      GLN  14  65.796  10.675  -5.315
  131    HG3  GLN  14           HG1      GLN  14  67.092  10.187  -4.235
  132   HE21  GLN  14          HE21      GLN  14  66.287   8.215  -7.009
  133   HE22  GLN  14          HE22      GLN  14  67.667   8.631  -7.929
  134    H    LEU  15           HN       LEU  15  65.347   6.480  -2.260
  135    HA   LEU  15           HA       LEU  15  62.898   5.297  -2.875
  136    HB2  LEU  15           HB2      LEU  15  64.971   4.083  -2.407
  137    HB3  LEU  15           HB1      LEU  15  64.963   4.722  -0.824
  138    HG   LEU  15           HG       LEU  15  62.949   3.589  -0.252
  139   HD11  LEU  15          HD11      LEU  15  62.008   1.888  -1.724
  140   HD12  LEU  15          HD12      LEU  15  63.204   2.247  -2.951
  141   HD13  LEU  15          HD13      LEU  15  61.961   3.455  -2.542
  142   HD21  LEU  15          HD21      LEU  15  65.078   2.681   0.161
  143   HD22  LEU  15          HD22      LEU  15  65.111   1.956  -1.441
  144   HD23  LEU  15          HD23      LEU  15  63.942   1.373  -0.227
  145    H    CYS  16           HN       CYS  16  64.173   6.791   0.012
  146    HA   CYS  16           HA       CYS  16  62.006   6.305   1.740
  147    HB2  CYS  16           HB2      CYS  16  63.798   8.750   1.615
  148    HB3  CYS  16           HB1      CYS  16  62.868   8.250   3.018
  149    HG   CYS  16           HG       CYS  16  65.476   6.526   1.632
  150    H    THR  17           HN       THR  17  62.567   8.802  -0.605
  151    HA   THR  17           HA       THR  17  60.370  10.446  -0.304
  152    HB   THR  17           HB       THR  17  62.099   9.579  -2.533
  153    HG1  THR  17           HG1      THR  17  62.540  11.127  -0.645
  154   HG21  THR  17          HG21      THR  17  59.876  11.615  -2.776
  155   HG22  THR  17          HG22      THR  17  60.136  10.112  -3.700
  156   HG23  THR  17          HG23      THR  17  61.224  11.472  -3.919
  157    H    GLU  18           HN       GLU  18  60.758   7.432  -2.026
  158    HA   GLU  18           HA       GLU  18  58.275   7.300  -3.291
  159    HB2  GLU  18           HB2      GLU  18  60.412   5.469  -2.588
  160    HB3  GLU  18           HB1      GLU  18  58.986   4.873  -3.442
  161    HG2  GLU  18           HG2      GLU  18  60.830   7.111  -4.238
  162    HG3  GLU  18           HG1      GLU  18  60.861   5.541  -4.984
  163    H    LEU  19           HN       LEU  19  59.568   5.640  -0.418
  164    HA   LEU  19           HA       LEU  19  57.115   4.634   0.473
  165    HB2  LEU  19           HB2      LEU  19  59.716   5.172   1.762
  166    HB3  LEU  19           HB1      LEU  19  58.428   4.534   2.684
  167    HG   LEU  19           HG       LEU  19  58.453   2.681   0.702
  168   HD11  LEU  19          HD11      LEU  19  60.685   2.189   0.080
  169   HD12  LEU  19          HD12      LEU  19  61.236   3.670   0.867
  170   HD13  LEU  19          HD13      LEU  19  60.171   3.759  -0.536
  171   HD21  LEU  19          HD21      LEU  19  60.305   2.870   2.987
  172   HD22  LEU  19          HD22      LEU  19  59.885   1.371   2.139
  173   HD23  LEU  19          HD23      LEU  19  58.650   2.267   3.060
  174    H    GLN  20           HN       GLN  20  57.709   7.794   0.163
  175    HA   GLN  20           HA       GLN  20  56.610   9.654   0.949
  176    HB2  GLN  20           HB2      GLN  20  54.958   7.512   2.226
  177    HB3  GLN  20           HB1      GLN  20  54.469   9.216   2.189
  178    HG2  GLN  20           HG2      GLN  20  54.234   9.121  -0.188
  179    HG3  GLN  20           HG1      GLN  20  54.991   7.530  -0.257
  180   HE21  GLN  20          HE21      GLN  20  52.640   8.423   2.180
  181   HE22  GLN  20          HE22      GLN  20  51.401   7.374   1.608
  182    H    THR  21           HN       THR  21  58.863   8.578   2.413
  183    HA   THR  21           HA       THR  21  58.333   9.797   4.981
  184    HB   THR  21           HB       THR  21  57.802   7.340   5.171
  185    HG1  THR  21           HG1      THR  21  58.698   7.274   7.161
  186   HG21  THR  21          HG21      THR  21  60.754   7.006   4.671
  187   HG22  THR  21          HG22      THR  21  59.441   6.401   3.638
  188   HG23  THR  21          HG23      THR  21  59.677   5.750   5.270
  189    H    THR  22           HN       THR  22  60.731   9.226   6.186
  190    HA   THR  22           HA       THR  22  62.736  10.056   4.195
  191    HB   THR  22           HB       THR  22  63.214  10.828   7.031
  192    HG1  THR  22           HG1      THR  22  60.869  11.341   6.209
  193   HG21  THR  22          HG21      THR  22  64.083  12.849   5.915
  194   HG22  THR  22          HG22      THR  22  63.506  12.225   4.365
  195   HG23  THR  22          HG23      THR  22  64.773  11.374   5.239
  196    H    ILE  23           HN       ILE  23  65.059   9.565   5.180
  197    HA   ILE  23           HA       ILE  23  65.526   6.923   5.392
  198    HB   ILE  23           HB       ILE  23  67.106   9.035   6.752
  199   HG12  ILE  23          HG12      ILE  23  66.928   8.204   3.894
  200   HG13  ILE  23          HG11      ILE  23  66.727   9.783   4.586
  201   HG21  ILE  23          HG21      ILE  23  67.846   6.355   5.508
  202   HG22  ILE  23          HG22      ILE  23  67.828   6.714   7.239
  203   HG23  ILE  23          HG23      ILE  23  69.025   7.482   6.188
  204   HD11  ILE  23          HD11      ILE  23  68.843   9.589   3.385
  205   HD12  ILE  23          HD12      ILE  23  69.242   8.215   4.432
  206   HD13  ILE  23          HD13      ILE  23  69.125   9.834   5.129
  207    H    HIS  24           HN       HIS  24  64.624   9.168   7.710
  208    HA   HIS  24           HA       HIS  24  65.689   8.172  10.090
  209    HB2  HIS  24           HB2      HIS  24  63.477  10.176   9.721
  210    HB3  HIS  24           HB1      HIS  24  64.639  10.142  11.022
  211    HD1  HIS  24           HD1      HIS  24  67.014   9.729   8.828
  212    HD2  HIS  24           HD2      HIS  24  64.232  12.703   9.065
  213    HE1  HIS  24           HE1      HIS  24  67.735  11.382   7.061
  214    H    ASP  25           HN       ASP  25  63.149   7.208   8.215
  215    HA   ASP  25           HA       ASP  25  61.658   6.006  10.459
  216    HB2  ASP  25           HB2      ASP  25  60.585   8.157   9.671
  217    HB3  ASP  25           HB1      ASP  25  60.368   7.373   8.138
  218    H    ILE  26           HN       ILE  26  62.565   5.945   7.081
  219    HA   ILE  26           HA       ILE  26  61.046   3.879   6.067
  220    HB   ILE  26           HB       ILE  26  62.408   5.251   4.614
  221   HG12  ILE  26          HG12      ILE  26  63.518   2.490   4.513
  222   HG13  ILE  26          HG11      ILE  26  61.907   2.707   3.984
  223   HG21  ILE  26          HG21      ILE  26  64.782   3.860   5.845
  224   HG22  ILE  26          HG22      ILE  26  64.307   5.526   6.145
  225   HG23  ILE  26          HG23      ILE  26  64.838   5.037   4.526
  226   HD11  ILE  26          HD11      ILE  26  64.424   3.872   2.817
  227   HD12  ILE  26          HD12      ILE  26  62.802   4.304   2.242
  228   HD13  ILE  26          HD13      ILE  26  63.381   2.630   2.139
  229    H    ILE  27           HN       ILE  27  60.904   1.751   6.299
  230    HA   ILE  27           HA       ILE  27  63.096   0.434   7.600
  231    HB   ILE  27           HB       ILE  27  60.273  -0.463   7.012
  232   HG12  ILE  27          HG12      ILE  27  60.449   1.131   8.838
  233   HG13  ILE  27          HG11      ILE  27  59.985  -0.461   9.413
  234   HG21  ILE  27          HG21      ILE  27  61.757  -2.327   6.770
  235   HG22  ILE  27          HG22      ILE  27  60.794  -2.499   8.248
  236   HG23  ILE  27          HG23      ILE  27  62.486  -1.990   8.340
  237   HD11  ILE  27          HD11      ILE  27  62.317  -0.823  10.154
  238   HD12  ILE  27          HD12      ILE  27  61.572   0.569  10.931
  239   HD13  ILE  27          HD13      ILE  27  62.720   0.811   9.619
  240    H    LEU  28           HN       LEU  28  64.562  -0.167   6.674
  241    HA   LEU  28           HA       LEU  28  64.285  -1.237   3.990
  242    HB2  LEU  28           HB2      LEU  28  65.715   0.913   4.885
  243    HB3  LEU  28           HB1      LEU  28  66.897  -0.385   4.808
  244    HG   LEU  28           HG       LEU  28  66.375  -0.817   2.518
  245   HD11  LEU  28          HD11      LEU  28  64.134  -0.515   2.204
  246   HD12  LEU  28          HD12      LEU  28  64.658   1.100   1.644
  247   HD13  LEU  28          HD13      LEU  28  64.124   0.818   3.326
  248   HD21  LEU  28          HD21      LEU  28  67.937   1.026   3.071
  249   HD22  LEU  28          HD22      LEU  28  66.574   2.140   2.994
  250   HD23  LEU  28          HD23      LEU  28  67.082   1.259   1.546
  251    H    GLU  29           HN       GLU  29  65.134  -3.418   3.898
  252    HA   GLU  29           HA       GLU  29  66.677  -3.867   6.341
  253    HB2  GLU  29           HB2      GLU  29  66.207  -6.234   6.159
  254    HB3  GLU  29           HB1      GLU  29  64.950  -5.198   6.940
  255    HG2  GLU  29           HG2      GLU  29  63.911  -5.298   4.762
  256    HG3  GLU  29           HG1      GLU  29  65.065  -6.608   4.378
  257    H    CYS  30           HN       CYS  30  68.175  -6.099   6.195
  258    HA   CYS  30           HA       CYS  30  69.705  -5.586   3.954
  259    HB2  CYS  30           HB2      CYS  30  70.538  -6.755   6.108
  260    HB3  CYS  30           HB1      CYS  30  69.713  -8.165   5.494
  261    H    VAL  31           HN       VAL  31  69.522  -6.228   2.153
  262    HA   VAL  31           HA       VAL  31  67.428  -7.715   1.006
  263    HB   VAL  31           HB       VAL  31  68.643  -6.136  -0.395
  264   HG11  VAL  31          HG11      VAL  31  70.903  -6.473  -0.897
  265   HG12  VAL  31          HG12      VAL  31  71.036  -7.583   0.488
  266   HG13  VAL  31          HG13      VAL  31  70.582  -5.854   0.729
  267   HG21  VAL  31          HG21      VAL  31  68.069  -8.083  -1.677
  268   HG22  VAL  31          HG22      VAL  31  69.603  -8.834  -1.214
  269   HG23  VAL  31          HG23      VAL  31  69.593  -7.380  -2.209
  270    H    TYR  32           HN       TYR  32  70.551  -8.553   2.142
  271    HA   TYR  32           HA       TYR  32  70.430 -11.222   1.068
  272    HB2  TYR  32           HB2      TYR  32  72.677  -9.949   2.621
  273    HB3  TYR  32           HB1      TYR  32  72.754 -11.423   1.652
  274    HD1  TYR  32           HD2      TYR  32  71.381 -10.798  -0.798
  275    HD2  TYR  32           HD1      TYR  32  73.905  -8.272   1.569
  276    HE1  TYR  32           HE2      TYR  32  71.804  -9.533  -2.701
  277    HE2  TYR  32           HE1      TYR  32  74.365  -6.870  -0.393
  278    HH   TYR  32           HH       TYR  32  74.346  -7.134  -2.801
  279    H    CYS  33           HN       CYS  33  70.669  -9.626   4.282
  280    HA   CYS  33           HA       CYS  33  70.664 -12.252   5.595
  281    HB2  CYS  33           HB2      CYS  33  70.934  -9.513   6.842
  282    HB3  CYS  33           HB1      CYS  33  71.178 -11.054   7.644
  283    H    LYS  34           HN       LYS  34  68.498  -9.728   4.747
  284    HA   LYS  34           HA       LYS  34  66.558  -9.045   5.320
  285    HB2  LYS  34           HB2      LYS  34  66.428 -11.881   6.216
  286    HB3  LYS  34           HB1      LYS  34  65.069 -10.810   6.516
  287    HG2  LYS  34           HG2      LYS  34  64.906 -12.262   4.560
  288    HG3  LYS  34           HG1      LYS  34  64.676 -10.550   4.149
  289    HD2  LYS  34           HD2      LYS  34  66.940 -10.587   3.205
  290    HD3  LYS  34           HD1      LYS  34  67.147 -12.254   3.750
  291    HE2  LYS  34           HE2      LYS  34  66.562 -12.092   1.338
  292    HE3  LYS  34           HE1      LYS  34  65.383 -13.010   2.271
  293    HZ1  LYS  34           HZ1      LYS  34  65.085 -10.180   1.409
  294    HZ2  LYS  34           HZ2      LYS  34  63.957 -11.064   2.290
  295    HZ3  LYS  34           HZ3      LYS  34  64.305 -11.505   0.724
  296    H    GLN  35           HN       GLN  35  68.778  -8.563   7.139
  297    HA   GLN  35           HA       GLN  35  67.507  -8.451   9.673
  298    HB2  GLN  35           HB2      GLN  35  69.465  -9.240   9.991
  299    HB3  GLN  35           HB1      GLN  35  70.251  -8.561   8.555
  300    HG2  GLN  35           HG2      GLN  35  71.305  -7.543  10.345
  301    HG3  GLN  35           HG1      GLN  35  70.046  -6.443   9.748
  302   HE21  GLN  35          HE21      GLN  35  69.229  -9.202  11.693
  303   HE22  GLN  35          HE22      GLN  35  68.774  -8.337  13.116
  304    H    GLN  36           HN       GLN  36  66.377  -6.755   9.891
  305    HA   GLN  36           HA       GLN  36  66.248  -4.531   8.297
  306    HB2  GLN  36           HB2      GLN  36  64.739  -5.532  10.185
  307    HB3  GLN  36           HB1      GLN  36  65.631  -4.388  11.186
  308    HG2  GLN  36           HG2      GLN  36  65.019  -2.641   9.496
  309    HG3  GLN  36           HG1      GLN  36  64.060  -3.970   8.807
  310   HE21  GLN  36          HE21      GLN  36  62.169  -4.587   9.731
  311   HE22  GLN  36          HE22      GLN  36  61.429  -3.743  11.047
  312    H    LEU  37           HN       LEU  37  67.690  -2.917   8.050
  313    HA   LEU  37           HA       LEU  37  69.955  -2.698   9.698
  314    HB2  LEU  37           HB2      LEU  37  68.804  -1.016   7.504
  315    HB3  LEU  37           HB1      LEU  37  70.087  -0.476   8.525
  316    HG   LEU  37           HG       LEU  37  71.396  -2.498   7.830
  317   HD11  LEU  37          HD11      LEU  37  70.761  -3.547   5.696
  318   HD12  LEU  37          HD12      LEU  37  69.191  -2.744   5.814
  319   HD13  LEU  37          HD13      LEU  37  69.673  -3.920   7.029
  320   HD21  LEU  37          HD21      LEU  37  72.064  -1.517   5.683
  321   HD22  LEU  37          HD22      LEU  37  71.892  -0.314   6.958
  322   HD23  LEU  37          HD23      LEU  37  70.634  -0.485   5.733
  323    H    LEU  38           HN       LEU  38  70.439  -1.716  11.288
  324    HA   LEU  38           HA       LEU  38  68.700  -0.345  12.967
  325    HB2  LEU  38           HB2      LEU  38  71.347  -1.291  12.861
  326    HB3  LEU  38           HB1      LEU  38  71.444   0.426  13.079
  327    HG   LEU  38           HG       LEU  38  69.918  -1.428  14.901
  328   HD11  LEU  38          HD11      LEU  38  72.612  -0.141  15.237
  329   HD12  LEU  38          HD12      LEU  38  72.292  -1.836  14.887
  330   HD13  LEU  38          HD13      LEU  38  71.771  -1.145  16.436
  331   HD21  LEU  38          HD21      LEU  38  69.080   0.883  14.870
  332   HD22  LEU  38          HD22      LEU  38  70.717   1.457  15.213
  333   HD23  LEU  38          HD23      LEU  38  69.861   0.478  16.402
  334    H    ARG  39           HN       ARG  39  68.245   1.868  12.926
  335    HA   ARG  39           HA       ARG  39  68.243   3.242  10.550
  336    HB2  ARG  39           HB2      ARG  39  66.865   3.828  12.480
  337    HB3  ARG  39           HB1      ARG  39  68.279   4.436  13.317
  338    HG2  ARG  39           HG2      ARG  39  68.547   6.156  11.591
  339    HG3  ARG  39           HG1      ARG  39  67.105   5.560  10.786
  340    HD2  ARG  39           HD2      ARG  39  67.213   6.651  13.601
  341    HD3  ARG  39           HD1      ARG  39  66.538   7.477  12.198
  342    HE   ARG  39           HE       ARG  39  65.142   5.195  12.229
  343   HH11  ARG  39          HH11      ARG  39  65.780   7.506  14.849
  344   HH12  ARG  39          HH12      ARG  39  64.331   7.173  15.659
  345   HH21  ARG  39          HH21      ARG  39  63.199   4.748  13.329
  346   HH22  ARG  39          HH22      ARG  39  62.814   5.565  14.777
  347    H    ARG  40           HN       ARG  40  70.757   3.392  13.061
  348    HA   ARG  40           HA       ARG  40  72.424   5.344  12.174
  349    HB2  ARG  40           HB2      ARG  40  72.466   3.775  14.196
  350    HB3  ARG  40           HB1      ARG  40  73.246   2.648  13.102
  351    HG2  ARG  40           HG2      ARG  40  75.004   4.317  12.722
  352    HG3  ARG  40           HG1      ARG  40  74.213   5.320  13.945
  353    HD2  ARG  40           HD2      ARG  40  76.003   4.060  15.025
  354    HD3  ARG  40           HD1      ARG  40  74.406   3.510  15.564
  355    HE   ARG  40           HE       ARG  40  75.244   1.947  13.386
  356   HH11  ARG  40          HH11      ARG  40  75.992   2.354  16.831
  357   HH12  ARG  40          HH12      ARG  40  76.568   0.755  17.004
  358   HH21  ARG  40          HH21      ARG  40  76.007  -0.188  13.648
  359   HH22  ARG  40          HH22      ARG  40  76.586  -0.716  15.171
  360    H    GLU  41           HN       GLU  41  72.287   1.905  11.208
  361    HA   GLU  41           HA       GLU  41  74.460   1.943   9.276
  362    HB2  GLU  41           HB2      GLU  41  72.238  -0.086   9.382
  363    HB3  GLU  41           HB1      GLU  41  73.887  -0.397   8.944
  364    HG2  GLU  41           HG2      GLU  41  72.696  -0.052  11.674
  365    HG3  GLU  41           HG1      GLU  41  73.449  -1.472  10.990
  366    H    VAL  42           HN       VAL  42  71.024   2.483   9.237
  367    HA   VAL  42           HA       VAL  42  70.718   2.211   6.408
  368    HB   VAL  42           HB       VAL  42  68.987   4.011   8.150
  369   HG11  VAL  42          HG11      VAL  42  67.263   3.529   6.517
  370   HG12  VAL  42          HG12      VAL  42  68.335   2.385   5.725
  371   HG13  VAL  42          HG13      VAL  42  68.709   4.119   5.669
  372   HG21  VAL  42          HG21      VAL  42  67.515   2.114   8.531
  373   HG22  VAL  42          HG22      VAL  42  69.125   1.788   9.187
  374   HG23  VAL  42          HG23      VAL  42  68.630   1.069   7.656
  375    H    TYR  43           HN       TYR  43  71.406   4.945   8.582
  376    HA   TYR  43           HA       TYR  43  71.531   6.932   6.630
  377    HB2  TYR  43           HB2      TYR  43  73.022   6.639   9.198
  378    HB3  TYR  43           HB1      TYR  43  73.169   8.066   8.152
  379    HD1  TYR  43           HD2      TYR  43  70.539   8.647   7.367
  380    HD2  TYR  43           HD1      TYR  43  71.836   7.054  11.053
  381    HE1  TYR  43           HE2      TYR  43  68.512   9.473   8.418
  382    HE2  TYR  43           HE1      TYR  43  69.792   7.883  12.135
  383    HH   TYR  43           HH       TYR  43  68.107   9.664  11.716
  384    H    ASP  44           HN       ASP  44  73.942   4.514   7.556
  385    HA   ASP  44           HA       ASP  44  76.271   5.490   6.468
  386    HB2  ASP  44           HB2      ASP  44  75.101   2.716   6.605
  387    HB3  ASP  44           HB1      ASP  44  76.611   3.001   5.894
  388    H    PHE  45           HN       PHE  45  73.625   4.013   4.975
  389    HA   PHE  45           HA       PHE  45  74.746   3.500   2.503
  390    HB2  PHE  45           HB2      PHE  45  72.472   2.892   3.830
  391    HB3  PHE  45           HB1      PHE  45  71.930   4.140   2.729
  392    HD1  PHE  45           HD1      PHE  45  73.483   0.787   2.930
  393    HD2  PHE  45           HD2      PHE  45  71.677   3.801   0.497
  394    HE1  PHE  45           HE1      PHE  45  73.176  -0.826   1.103
  395    HE2  PHE  45           HE2      PHE  45  71.417   2.187  -1.305
  396    HZ   PHE  45           HZ       PHE  45  72.118  -0.109  -1.007
  397    H    ALA  46           HN       ALA  46  72.916   6.321   3.819
  398    HA   ALA  46           HA       ALA  46  73.049   7.680   1.236
  399    HB1  ALA  46           HB1      ALA  46  71.625   9.426   2.222
  400    HB2  ALA  46           HB2      ALA  46  71.696   8.611   3.783
  401    HB3  ALA  46           HB3      ALA  46  70.899   7.849   2.412
  402    H    ARG  47           HN       ARG  47  74.732   7.584   4.222
  403    HA   ARG  47           HA       ARG  47  75.859  10.191   4.076
  404    HB2  ARG  47           HB2      ARG  47  76.208   7.733   5.719
  405    HB3  ARG  47           HB1      ARG  47  77.440   9.000   5.857
  406    HG2  ARG  47           HG2      ARG  47  75.805  10.495   6.650
  407    HG3  ARG  47           HG1      ARG  47  74.497   9.424   6.143
  408    HD2  ARG  47           HD2      ARG  47  74.824   9.280   8.524
  409    HD3  ARG  47           HD1      ARG  47  75.205   7.777   7.679
  410    HE   ARG  47           HE       ARG  47  77.533   8.267   7.979
  411   HH11  ARG  47          HH11      ARG  47  75.348  10.270   9.940
  412   HH12  ARG  47          HH12      ARG  47  76.475  10.504  11.189
  413   HH21  ARG  47          HH21      ARG  47  79.056   8.580   9.752
  414   HH22  ARG  47          HH22      ARG  47  78.613   9.534  11.094
  415    H    ARG  48           HN       ARG  48  76.386   7.294   2.569
  416    HA   ARG  48           HA       ARG  48  78.774   8.294   1.240
  417    HB2  ARG  48           HB2      ARG  48  77.700   5.573   1.804
  418    HB3  ARG  48           HB1      ARG  48  79.101   5.849   0.782
  419    HG2  ARG  48           HG2      ARG  48  80.372   6.649   2.621
  420    HG3  ARG  48           HG1      ARG  48  78.932   6.783   3.634
  421    HD2  ARG  48           HD2      ARG  48  78.654   4.406   3.554
  422    HD3  ARG  48           HD1      ARG  48  80.071   4.267   2.532
  423    HE   ARG  48           HE       ARG  48  81.328   5.313   4.438
  424   HH11  ARG  48          HH11      ARG  48  78.473   3.328   5.048
  425   HH12  ARG  48          HH12      ARG  48  78.828   3.035   6.683
  426   HH21  ARG  48          HH21      ARG  48  81.886   4.855   6.666
  427   HH22  ARG  48          HH22      ARG  48  80.870   3.891   7.620
  428    H    ASP  49           HN       ASP  49  78.185   6.168  -0.782
  429    HA   ASP  49           HA       ASP  49  75.512   6.765  -1.602
  430    HB2  ASP  49           HB2      ASP  49  76.679   8.676  -2.634
  431    HB3  ASP  49           HB1      ASP  49  77.766   7.559  -3.462
  432    H    LEU  50           HN       LEU  50  75.309   4.705  -1.161
  433    HA   LEU  50           HA       LEU  50  76.518   2.830  -2.977
  434    HB2  LEU  50           HB2      LEU  50  74.710   2.421  -0.594
  435    HB3  LEU  50           HB1      LEU  50  75.359   1.122  -1.565
  436    HG   LEU  50           HG       LEU  50  77.654   1.990  -0.914
  437   HD11  LEU  50          HD11      LEU  50  77.821   3.214   1.198
  438   HD12  LEU  50          HD12      LEU  50  76.076   3.519   1.103
  439   HD13  LEU  50          HD13      LEU  50  77.147   4.121  -0.157
  440   HD21  LEU  50          HD21      LEU  50  77.654   0.869   1.224
  441   HD22  LEU  50          HD22      LEU  50  76.734  -0.049   0.019
  442   HD23  LEU  50          HD23      LEU  50  75.894   0.910   1.256
  443    H    CYS  51           HN       CYS  51  74.664   0.992  -3.487
  444    HA   CYS  51           HA       CYS  51  72.363   2.427  -4.554
  445    HB2  CYS  51           HB2      CYS  51  72.417   0.806  -6.443
  446    HB3  CYS  51           HB1      CYS  51  73.823   1.862  -6.401
  447    HG   CYS  51           HG       CYS  51  75.567  -0.073  -5.405
  448    H    ILE  52           HN       ILE  52  70.461   1.423  -4.408
  449    HA   ILE  52           HA       ILE  52  70.380  -0.502  -2.314
  450    HB   ILE  52           HB       ILE  52  68.267   1.137  -3.645
  451   HG12  ILE  52          HG12      ILE  52  69.408   0.677  -0.979
  452   HG13  ILE  52          HG11      ILE  52  69.614   2.119  -2.009
  453   HG21  ILE  52          HG21      ILE  52  67.216  -1.114  -3.334
  454   HG22  ILE  52          HG22      ILE  52  66.560   0.080  -2.213
  455   HG23  ILE  52          HG23      ILE  52  67.740  -1.103  -1.650
  456   HD11  ILE  52          HD11      ILE  52  67.244   2.441  -1.767
  457   HD12  ILE  52          HD12      ILE  52  68.218   2.542  -0.232
  458   HD13  ILE  52          HD13      ILE  52  67.279   1.072  -0.615
  459    H    VAL  53           HN       VAL  53  69.533  -2.274  -2.238
  460    HA   VAL  53           HA       VAL  53  69.723  -3.841  -4.648
  461    HB   VAL  53           HB       VAL  53  70.523  -5.577  -2.867
  462   HG11  VAL  53          HG11      VAL  53  72.212  -3.161  -3.606
  463   HG12  VAL  53          HG12      VAL  53  71.920  -4.540  -4.664
  464   HG13  VAL  53          HG13      VAL  53  72.831  -4.755  -3.166
  465   HG21  VAL  53          HG21      VAL  53  71.627  -4.547  -0.960
  466   HG22  VAL  53          HG22      VAL  53  69.918  -4.152  -0.920
  467   HG23  VAL  53          HG23      VAL  53  71.095  -2.954  -1.466
  468    H    TYR  54           HN       TYR  54  67.875  -4.513  -5.107
  469    HA   TYR  54           HA       TYR  54  65.821  -5.009  -3.139
  470    HB2  TYR  54           HB2      TYR  54  65.838  -4.982  -6.157
  471    HB3  TYR  54           HB1      TYR  54  64.419  -5.252  -5.143
  472    HD1  TYR  54           HD1      TYR  54  67.000  -2.752  -6.041
  473    HD2  TYR  54           HD2      TYR  54  63.289  -3.486  -4.135
  474    HE1  TYR  54           HE1      TYR  54  66.627  -0.316  -5.766
  475    HE2  TYR  54           HE2      TYR  54  62.914  -1.143  -3.905
  476    HH   TYR  54           HH       TYR  54  64.888   1.160  -5.472
  477    H    ARG  55           HN       ARG  55  65.577  -6.792  -2.432
  478    HA   ARG  55           HA       ARG  55  66.826  -8.984  -3.832
  479    HB2  ARG  55           HB2      ARG  55  66.285  -8.711  -1.063
  480    HB3  ARG  55           HB1      ARG  55  65.206  -9.976  -1.608
  481    HG2  ARG  55           HG2      ARG  55  68.250 -10.113  -2.070
  482    HG3  ARG  55           HG1      ARG  55  67.498 -10.750  -0.667
  483    HD2  ARG  55           HD2      ARG  55  67.774 -12.566  -2.155
  484    HD3  ARG  55           HD1      ARG  55  66.068 -12.158  -2.276
  485    HE   ARG  55           HE       ARG  55  67.746 -10.886  -4.236
  486   HH11  ARG  55          HH11      ARG  55  65.798 -13.766  -3.499
  487   HH12  ARG  55          HH12      ARG  55  65.585 -14.228  -5.111
  488   HH21  ARG  55          HH21      ARG  55  67.475 -11.567  -6.488
  489   HH22  ARG  55          HH22      ARG  55  66.575 -12.956  -6.850
  490    H    ASP  56           HN       ASP  56  65.452  -9.906  -5.401
  491    HA   ASP  56           HA       ASP  56  63.676 -10.449  -6.613
  492    HB2  ASP  56           HB2      ASP  56  62.173 -10.175  -4.037
  493    HB3  ASP  56           HB1      ASP  56  61.303 -10.451  -5.539
  494    H    GLY  57           HN       GLY  57  61.881  -8.193  -4.604
  495    HA2  GLY  57           HA2      GLY  57  62.513  -6.048  -6.346
  496    HA3  GLY  57           HA1      GLY  57  60.839  -6.598  -6.554
  497    H    ASN  58           HN       ASN  58  62.677  -6.596  -3.580
  498    HA   ASN  58           HA       ASN  58  60.858  -4.513  -2.529
  499    HB2  ASN  58           HB2      ASN  58  62.205  -6.630  -0.894
  500    HB3  ASN  58           HB1      ASN  58  60.813  -5.694  -0.435
  501   HD21  ASN  58          HD21      ASN  58  62.051  -8.382  -2.181
  502   HD22  ASN  58          HD22      ASN  58  60.599  -9.245  -2.385
  503    HA   PRO  59           HA       PRO  59  64.717  -2.701  -1.877
  504    HB2  PRO  59           HB2      PRO  59  63.736  -0.642  -0.173
  505    HB3  PRO  59           HB1      PRO  59  64.091  -0.539  -1.898
  506    HG2  PRO  59           HG2      PRO  59  61.529  -0.393  -0.824
  507    HG3  PRO  59           HG1      PRO  59  61.877  -0.837  -2.470
  508    HD2  PRO  59           HD2      PRO  59  61.278  -2.600  -0.129
  509    HD3  PRO  59           HD1      PRO  59  60.803  -2.769  -1.834
  510    H    TYR  60           HN       TYR  60  66.397  -3.052  -0.840
  511    HA   TYR  60           HA       TYR  60  66.197  -3.003   1.940
  512    HB2  TYR  60           HB2      TYR  60  67.703  -5.404   0.904
  513    HB3  TYR  60           HB1      TYR  60  67.099  -4.945   2.325
  514    HD1  TYR  60           HD1      TYR  60  64.890  -5.208   3.055
  515    HD2  TYR  60           HD2      TYR  60  66.121  -6.457  -0.748
  516    HE1  TYR  60           HE1      TYR  60  62.878  -6.650   2.889
  517    HE2  TYR  60           HE2      TYR  60  64.151  -7.898  -0.945
  518    HH   TYR  60           HH       TYR  60  61.544  -7.722   1.290
  519    H    ALA  61           HN       ALA  61  68.049  -2.816   2.754
  520    HA   ALA  61           HA       ALA  61  69.916  -1.245   1.270
  521    HB1  ALA  61           HB1      ALA  61  69.765  -1.938   4.088
  522    HB2  ALA  61           HB2      ALA  61  68.668  -0.768   3.403
  523    HB3  ALA  61           HB3      ALA  61  70.458  -0.452   3.380
  524    H    VAL  62           HN       VAL  62  72.139  -1.706   2.319
  525    HA   VAL  62           HA       VAL  62  72.671  -4.576   2.457
  526    HB   VAL  62           HB       VAL  62  74.381  -2.213   1.553
  527   HG11  VAL  62          HG11      VAL  62  75.700  -3.529   2.831
  528   HG12  VAL  62          HG12      VAL  62  76.152  -3.705   1.132
  529   HG13  VAL  62          HG13      VAL  62  75.253  -5.007   1.965
  530   HG21  VAL  62          HG21      VAL  62  73.435  -4.608   0.061
  531   HG22  VAL  62          HG22      VAL  62  74.589  -3.414  -0.545
  532   HG23  VAL  62          HG23      VAL  62  72.934  -2.923  -0.205
  533    H    CYS  63           HN       CYS  63  72.742  -5.132   4.515
  534    HA   CYS  63           HA       CYS  63  72.891  -3.363   6.626
  535    HB2  CYS  63           HB2      CYS  63  72.921  -5.251   8.051
  536    HB3  CYS  63           HB1      CYS  63  72.133  -5.742   6.546
  537    H    ASP  64           HN       ASP  64  74.553  -3.394   8.397
  538    HA   ASP  64           HA       ASP  64  76.936  -2.163   7.555
  539    HB2  ASP  64           HB2      ASP  64  75.991  -1.895   9.788
  540    HB3  ASP  64           HB1      ASP  64  76.356  -3.563  10.148
  541    H    LYS  65           HN       LYS  65  76.237  -5.414   8.420
  542    HA   LYS  65           HA       LYS  65  78.885  -6.419   8.406
  543    HB2  LYS  65           HB2      LYS  65  76.283  -7.870   7.958
  544    HB3  LYS  65           HB1      LYS  65  77.822  -8.613   8.368
  545    HG2  LYS  65           HG2      LYS  65  77.831  -7.484  10.505
  546    HG3  LYS  65           HG1      LYS  65  76.333  -6.659  10.093
  547    HD2  LYS  65           HD2      LYS  65  75.828  -8.523  11.528
  548    HD3  LYS  65           HD1      LYS  65  75.233  -8.832   9.891
  549    HE2  LYS  65           HE2      LYS  65  77.134 -10.265   9.427
  550    HE3  LYS  65           HE1      LYS  65  77.834  -9.893  11.001
  551    HZ1  LYS  65           HZ1      LYS  65  75.931 -10.957  12.034
  552    HZ2  LYS  65           HZ2      LYS  65  76.753 -12.020  11.032
  553    HZ3  LYS  65           HZ3      LYS  65  75.291 -11.333  10.515
  554    H    CYS  66           HN       CYS  66  76.253  -6.530   5.997
  555    HA   CYS  66           HA       CYS  66  77.826  -7.850   4.091
  556    HB2  CYS  66           HB2      CYS  66  75.232  -6.401   3.958
  557    HB3  CYS  66           HB1      CYS  66  75.911  -6.982   2.465
  558    H    LEU  67           HN       LEU  67  77.181  -4.435   4.695
  559    HA   LEU  67           HA       LEU  67  78.271  -3.240   2.493
  560    HB2  LEU  67           HB2      LEU  67  77.063  -2.447   4.683
  561    HB3  LEU  67           HB1      LEU  67  78.705  -2.155   5.214
  562    HG   LEU  67           HG       LEU  67  77.723  -1.132   2.635
  563   HD11  LEU  67          HD11      LEU  67  77.098   0.970   3.819
  564   HD12  LEU  67          HD12      LEU  67  77.368   0.105   5.353
  565   HD13  LEU  67          HD13      LEU  67  76.131  -0.455   4.213
  566   HD21  LEU  67          HD21      LEU  67  79.384   0.665   3.040
  567   HD22  LEU  67          HD22      LEU  67  80.122  -0.938   3.043
  568   HD23  LEU  67          HD23      LEU  67  79.813  -0.106   4.567
  569    H    LYS  68           HN       LYS  68  79.706  -4.700   5.278
  570    HA   LYS  68           HA       LYS  68  82.374  -3.856   4.753
  571    HB2  LYS  68           HB2      LYS  68  81.815  -4.139   7.034
  572    HB3  LYS  68           HB1      LYS  68  81.027  -5.665   6.746
  573    HG2  LYS  68           HG2      LYS  68  84.005  -5.395   6.482
  574    HG3  LYS  68           HG1      LYS  68  83.244  -5.582   8.066
  575    HD2  LYS  68           HD2      LYS  68  82.075  -7.620   7.078
  576    HD3  LYS  68           HD1      LYS  68  83.192  -7.474   5.729
  577    HE2  LYS  68           HE2      LYS  68  83.929  -7.870   8.618
  578    HE3  LYS  68           HE1      LYS  68  83.895  -9.117   7.393
  579    HZ1  LYS  68           HZ1      LYS  68  85.722  -6.748   7.438
  580    HZ2  LYS  68           HZ2      LYS  68  85.651  -7.868   6.186
  581    HZ3  LYS  68           HZ3      LYS  68  86.161  -8.349   7.706
  582    H    PHE  69           HN       PHE  69  80.508  -6.934   4.273
  583    HA   PHE  69           HA       PHE  69  82.580  -8.492   3.340
  584    HB2  PHE  69           HB2      PHE  69  79.717  -8.512   2.692
  585    HB3  PHE  69           HB1      PHE  69  80.816  -9.831   2.427
  586    HD1  PHE  69           HD1      PHE  69  82.158  -9.393   5.248
  587    HD2  PHE  69           HD2      PHE  69  78.179  -9.828   3.854
  588    HE1  PHE  69           HE1      PHE  69  81.499 -10.257   7.426
  589    HE2  PHE  69           HE2      PHE  69  77.487 -10.671   5.992
  590    HZ   PHE  69           HZ       PHE  69  79.183 -10.878   7.841
  591    H    TYR  70           HN       TYR  70  80.076  -6.648   1.704
  592    HA   TYR  70           HA       TYR  70  81.178  -7.355  -0.892
  593    HB2  TYR  70           HB2      TYR  70  78.466  -6.303  -0.095
  594    HB3  TYR  70           HB1      TYR  70  78.948  -6.792  -1.717
  595    HD1  TYR  70           HD2      TYR  70  79.814  -9.197  -1.963
  596    HD2  TYR  70           HD1      TYR  70  77.498  -7.868   1.335
  597    HE1  TYR  70           HE2      TYR  70  79.222 -11.502  -1.470
  598    HE2  TYR  70           HE1      TYR  70  76.897 -10.186   1.874
  599    HH   TYR  70           HH       TYR  70  76.704 -12.300   0.571
  600    H    SER  71           HN       SER  71  82.340  -5.277   0.756
  601    HA   SER  71           HA       SER  71  81.431  -2.735   0.058
  602    HB2  SER  71           HB2      SER  71  83.843  -2.138   0.778
  603    HB3  SER  71           HB1      SER  71  82.761  -2.868   1.962
  604    HG   SER  71           HG       SER  71  83.989  -4.512   2.084
  605    H    LYS  72           HN       LYS  72  83.397  -5.003  -1.592
  606    HA   LYS  72           HA       LYS  72  84.499  -3.432  -3.663
  607    HB2  LYS  72           HB2      LYS  72  85.179  -5.712  -3.206
  608    HB3  LYS  72           HB1      LYS  72  83.567  -6.292  -3.499
  609    HG2  LYS  72           HG2      LYS  72  84.966  -6.901  -5.351
  610    HG3  LYS  72           HG1      LYS  72  83.787  -5.711  -5.881
  611    HD2  LYS  72           HD2      LYS  72  85.485  -3.974  -5.823
  612    HD3  LYS  72           HD1      LYS  72  86.665  -5.123  -5.182
  613    HE2  LYS  72           HE2      LYS  72  86.468  -6.480  -7.206
  614    HE3  LYS  72           HE1      LYS  72  85.263  -5.371  -7.846
  615    HZ1  LYS  72           HZ1      LYS  72  86.949  -3.643  -7.932
  616    HZ2  LYS  72           HZ2      LYS  72  87.449  -5.007  -8.781
  617    HZ3  LYS  72           HZ3      LYS  72  88.104  -4.693  -7.282
  618    H    ILE  73           HN       ILE  73  81.460  -5.069  -3.226
  619    HA   ILE  73           HA       ILE  73  80.532  -4.439  -5.932
  620    HB   ILE  73           HB       ILE  73  79.026  -6.149  -3.939
  621   HG12  ILE  73          HG12      ILE  73  81.282  -7.040  -5.771
  622   HG13  ILE  73          HG11      ILE  73  81.327  -7.011  -4.015
  623   HG21  ILE  73          HG21      ILE  73  79.226  -6.202  -6.966
  624   HG22  ILE  73          HG22      ILE  73  77.884  -5.523  -6.049
  625   HG23  ILE  73          HG23      ILE  73  78.203  -7.258  -5.991
  626   HD11  ILE  73          HD11      ILE  73  81.005  -9.261  -4.819
  627   HD12  ILE  73          HD12      ILE  73  79.583  -8.753  -5.729
  628   HD13  ILE  73          HD13      ILE  73  79.556  -8.715  -3.967
  629    H    SER  74           HN       SER  74  80.518  -2.667  -3.276
  630    HA   SER  74           HA       SER  74  77.806  -2.101  -2.763
  631    HB2  SER  74           HB2      SER  74  78.785   0.001  -1.734
  632    HB3  SER  74           HB1      SER  74  79.475  -1.516  -1.139
  633    HG   SER  74           HG       SER  74  81.278  -0.579  -1.679
  634    H    GLU  75           HN       GLU  75  80.206  -0.692  -4.739
  635    HA   GLU  75           HA       GLU  75  78.180   0.320  -6.580
  636    HB2  GLU  75           HB2      GLU  75  79.021   2.266  -5.239
  637    HB3  GLU  75           HB1      GLU  75  80.650   1.896  -5.783
  638    HG2  GLU  75           HG2      GLU  75  79.898   2.244  -8.117
  639    HG3  GLU  75           HG1      GLU  75  78.333   2.743  -7.495
  640    H    TYR  76           HN       TYR  76  78.702  -1.625  -7.676
  641    HA   TYR  76           HA       TYR  76  81.154  -1.380  -9.206
  642    HB2  TYR  76           HB2      TYR  76  81.598  -3.003  -7.443
  643    HB3  TYR  76           HB1      TYR  76  80.166  -3.922  -7.910
  644    HD1  TYR  76           HD1      TYR  76  82.353  -2.404 -10.382
  645    HD2  TYR  76           HD2      TYR  76  81.427  -5.952  -8.279
  646    HE1  TYR  76           HE1      TYR  76  83.687  -3.598 -11.948
  647    HE2  TYR  76           HE2      TYR  76  82.801  -7.252  -9.862
  648    HH   TYR  76           HH       TYR  76  83.616  -7.048 -12.145
  649    H    ARG  77           HN       ARG  77  80.243  -0.777 -10.984
  650    HA   ARG  77           HA       ARG  77  78.340  -2.634 -12.253
  651    HB2  ARG  77           HB2      ARG  77  78.363   0.375 -12.583
  652    HB3  ARG  77           HB1      ARG  77  77.250  -0.740 -13.351
  653    HG2  ARG  77           HG2      ARG  77  77.439  -0.203 -10.392
  654    HG3  ARG  77           HG1      ARG  77  76.213   0.446 -11.479
  655    HD2  ARG  77           HD2      ARG  77  75.374  -1.785 -11.909
  656    HD3  ARG  77           HD1      ARG  77  76.677  -2.489 -10.954
  657    HE   ARG  77           HE       ARG  77  75.317  -0.672  -9.359
  658   HH11  ARG  77          HH11      ARG  77  74.748  -3.856 -10.893
  659   HH12  ARG  77          HH12      ARG  77  73.638  -4.373  -9.733
  660   HH21  ARG  77          HH21      ARG  77  73.760  -1.457  -7.727
  661   HH22  ARG  77          HH22      ARG  77  73.018  -2.977  -7.964
  662    H    HIS  78           HN       HIS  78  81.430  -1.570 -12.320
  663    HA   HIS  78           HA       HIS  78  81.509  -1.091 -15.111
  664    HB2  HIS  78           HB2      HIS  78  83.909  -0.617 -14.927
  665    HB3  HIS  78           HB1      HIS  78  82.868   0.212 -13.766
  666    HD1  HIS  78           HD1      HIS  78  85.790  -2.097 -13.940
  667    HD2  HIS  78           HD2      HIS  78  83.205  -0.353 -11.299
  668    HE1  HIS  78           HE1      HIS  78  86.916  -2.360 -11.693
  669    H    TYR  79           HN       TYR  79  81.073  -2.679 -16.276
  670    HA   TYR  79           HA       TYR  79  82.633  -5.136 -16.015
  671    HB2  TYR  79           HB2      TYR  79  79.700  -4.773 -16.572
  672    HB3  TYR  79           HB1      TYR  79  80.556  -6.254 -16.977
  673    HD1  TYR  79           HD2      TYR  79  80.366  -3.959 -14.005
  674    HD2  TYR  79           HD1      TYR  79  80.240  -7.944 -15.488
  675    HE1  TYR  79           HE2      TYR  79  80.010  -4.788 -11.741
  676    HE2  TYR  79           HE1      TYR  79  79.905  -8.778 -13.214
  677    HH   TYR  79           HH       TYR  79  80.372  -8.021 -10.924
  678    H    SER  80           HN       SER  80  82.851  -6.254 -18.045
  679    HA   SER  80           HA       SER  80  82.133  -4.870 -20.453
  680    HB2  SER  80           HB2      SER  80  85.001  -5.635 -19.785
  681    HB3  SER  80           HB1      SER  80  84.444  -4.966 -21.320
  682    HG   SER  80           HG       SER  80  83.602  -3.386 -19.371
  Start of MODEL    4
    1    H1   GLY  -1           HT1      GLY  -1  57.315  -5.298   7.345
    2    H2   GLY  -1           HT2      GLY  -1  58.060  -6.626   8.093
    3    H3   GLY  -1           HT3      GLY  -1  57.432  -6.770   6.523
    4    HA2  GLY  -1           HA1      GLY  -1  59.663  -5.031   7.300
    5    HA3  GLY  -1           HA2      GLY  -1  59.811  -6.580   6.479
    6    H    ALA   0           HN       ALA   0  60.954  -4.958   5.090
    7    HA   ALA   0           HA       ALA   0  59.391  -3.205   3.479
    8    HB1  ALA   0           HB1      ALA   0  62.172  -4.263   2.986
    9    HB2  ALA   0           HB2      ALA   0  61.777  -2.827   3.927
   10    HB3  ALA   0           HB3      ALA   0  61.428  -2.869   2.198
   11    H    MET   1           HN       MET   1  57.855  -4.077   2.302
   12    HA   MET   1           HA       MET   1  58.609  -6.030   0.241
   13    HB2  MET   1           HB2      MET   1  57.200  -6.997   2.193
   14    HB3  MET   1           HB1      MET   1  55.914  -5.957   1.639
   15    HG2  MET   1           HG2      MET   1  57.149  -8.166  -0.018
   16    HG3  MET   1           HG1      MET   1  55.731  -8.373   0.986
   17    HE1  MET   1           HE1      MET   1  57.147  -7.573  -2.432
   18    HE2  MET   1           HE2      MET   1  56.964  -5.851  -2.014
   19    HE3  MET   1           HE3      MET   1  55.935  -6.575  -3.233
   20    H    PHE   2           HN       PHE   2  58.870  -4.348  -1.190
   21    HA   PHE   2           HA       PHE   2  56.694  -2.485  -1.507
   22    HB2  PHE   2           HB2      PHE   2  59.399  -2.143  -1.194
   23    HB3  PHE   2           HB1      PHE   2  59.220  -2.169  -2.908
   24    HD1  PHE   2           HD1      PHE   2  56.414  -0.709  -1.161
   25    HD2  PHE   2           HD2      PHE   2  60.211  -0.051  -2.805
   26    HE1  PHE   2           HE1      PHE   2  55.941   1.719  -1.233
   27    HE2  PHE   2           HE2      PHE   2  59.846   2.293  -2.944
   28    HZ   PHE   2           HZ       PHE   2  57.654   3.262  -2.134
   29    H    GLN   3           HN       GLN   3  55.516  -2.565  -3.296
   30    HA   GLN   3           HA       GLN   3  56.445  -4.089  -5.592
   31    HB2  GLN   3           HB2      GLN   3  54.291  -5.012  -5.955
   32    HB3  GLN   3           HB1      GLN   3  54.598  -5.250  -4.252
   33    HG2  GLN   3           HG2      GLN   3  52.642  -3.480  -5.631
   34    HG3  GLN   3           HG1      GLN   3  52.357  -4.637  -4.324
   35   HE21  GLN   3          HE21      GLN   3  53.109  -1.562  -5.244
   36   HE22  GLN   3          HE22      GLN   3  53.394  -0.761  -3.774
   37    H    ASP   4           HN       ASP   4  55.084  -3.315  -7.677
   38    HA   ASP   4           HA       ASP   4  55.385  -0.460  -7.626
   39    HB2  ASP   4           HB2      ASP   4  55.077  -0.553  -9.988
   40    HB3  ASP   4           HB1      ASP   4  55.849  -2.080  -9.633
   41    HA   PRO   5           HA       PRO   5  53.719   0.965  -9.905
   42    HB2  PRO   5           HB2      PRO   5  52.612   3.323  -9.464
   43    HB3  PRO   5           HB1      PRO   5  51.728   1.843  -9.944
   44    HG2  PRO   5           HG2      PRO   5  52.047   2.831  -7.133
   45    HG3  PRO   5           HG1      PRO   5  50.527   2.678  -8.039
   46    HD2  PRO   5           HD2      PRO   5  51.362   0.707  -6.501
   47    HD3  PRO   5           HD1      PRO   5  50.668   0.352  -8.098
   48    H    GLN   6           HN       GLN   6  54.113   1.186  -6.870
   49    HA   GLN   6           HA       GLN   6  56.009   3.293  -6.431
   50    HB2  GLN   6           HB2      GLN   6  55.509   0.779  -4.824
   51    HB3  GLN   6           HB1      GLN   6  56.570   2.078  -4.307
   52    HG2  GLN   6           HG2      GLN   6  53.663   2.505  -4.915
   53    HG3  GLN   6           HG1      GLN   6  54.251   2.053  -3.316
   54   HE21  GLN   6          HE21      GLN   6  54.151   4.590  -5.726
   55   HE22  GLN   6          HE22      GLN   6  54.720   5.834  -4.689
   56    H    GLU   7           HN       GLU   7  56.896   2.808  -8.258
   57    HA   GLU   7           HA       GLU   7  58.281   0.992  -9.564
   58    HB2  GLU   7           HB2      GLU   7  58.153   3.220 -10.358
   59    HB3  GLU   7           HB1      GLU   7  59.236   3.779  -9.093
   60    HG2  GLU   7           HG2      GLU   7  60.970   2.361 -10.032
   61    HG3  GLU   7           HG1      GLU   7  59.915   1.991 -11.400
   62    H    ARG   8           HN       ARG   8  59.634   2.523  -6.954
   63    HA   ARG   8           HA       ARG   8  61.395   2.043  -5.490
   64    HB2  ARG   8           HB2      ARG   8  61.808  -0.566  -7.047
   65    HB3  ARG   8           HB1      ARG   8  62.512  -0.105  -5.500
   66    HG2  ARG   8           HG2      ARG   8  60.835  -0.651  -4.350
   67    HG3  ARG   8           HG1      ARG   8  59.586  -0.106  -5.510
   68    HD2  ARG   8           HD2      ARG   8  61.275  -2.614  -5.575
   69    HD3  ARG   8           HD1      ARG   8  59.580  -2.527  -5.096
   70    HE   ARG   8           HE       ARG   8  60.246  -1.549  -7.733
   71   HH11  ARG   8          HH11      ARG   8  58.964  -4.263  -5.778
   72   HH12  ARG   8          HH12      ARG   8  58.182  -4.977  -7.112
   73   HH21  ARG   8          HH21      ARG   8  59.170  -2.619  -9.535
   74   HH22  ARG   8          HH22      ARG   8  58.301  -4.058  -9.245
   75    HA   PRO   9           HA       PRO   9  64.573   3.865  -8.158
   76    HB2  PRO   9           HB2      PRO   9  65.983   4.905  -6.113
   77    HB3  PRO   9           HB1      PRO   9  64.563   5.738  -6.630
   78    HG2  PRO   9           HG2      PRO   9  65.064   4.034  -4.318
   79    HG3  PRO   9           HG1      PRO   9  63.892   5.355  -4.505
   80    HD2  PRO   9           HD2      PRO   9  63.396   2.648  -4.488
   81    HD3  PRO   9           HD1      PRO   9  62.235   3.832  -5.076
   82    H    ARG  10           HN       ARG  10  67.157   4.152  -7.287
   83    HA   ARG  10           HA       ARG  10  67.992   1.591  -6.180
   84    HB2  ARG  10           HB2      ARG  10  69.206   3.275  -8.319
   85    HB3  ARG  10           HB1      ARG  10  70.170   2.181  -7.343
   86    HG2  ARG  10           HG2      ARG  10  69.674   0.972  -9.237
   87    HG3  ARG  10           HG1      ARG  10  68.552   0.377  -8.053
   88    HD2  ARG  10           HD2      ARG  10  66.749   1.716  -8.933
   89    HD3  ARG  10           HD1      ARG  10  67.831   2.475 -10.097
   90    HE   ARG  10           HE       ARG  10  68.054   0.310 -11.158
   91   HH11  ARG  10          HH11      ARG  10  65.253   0.679  -8.960
   92   HH12  ARG  10          HH12      ARG  10  64.317  -0.468  -9.776
   93   HH21  ARG  10          HH21      ARG  10  66.734  -1.242 -12.267
   94   HH22  ARG  10          HH22      ARG  10  65.152  -1.569 -11.744
   95    H    LYS  11           HN       LYS  11  67.610   4.840  -5.523
   96    HA   LYS  11           HA       LYS  11  69.962   4.750  -3.809
   97    HB2  LYS  11           HB2      LYS  11  68.457   7.180  -4.703
   98    HB3  LYS  11           HB1      LYS  11  69.818   7.093  -3.643
   99    HG2  LYS  11           HG2      LYS  11  71.207   6.109  -5.414
  100    HG3  LYS  11           HG1      LYS  11  69.866   6.356  -6.540
  101    HD2  LYS  11           HD2      LYS  11  69.880   8.722  -6.060
  102    HD3  LYS  11           HD1      LYS  11  71.166   8.428  -4.874
  103    HE2  LYS  11           HE2      LYS  11  71.425   7.843  -7.816
  104    HE3  LYS  11           HE1      LYS  11  71.987   9.336  -7.074
  105    HZ1  LYS  11           HZ1      LYS  11  73.782   7.753  -7.307
  106    HZ2  LYS  11           HZ2      LYS  11  72.959   6.599  -6.405
  107    HZ3  LYS  11           HZ3      LYS  11  73.486   8.008  -5.676
  108    H    LEU  12           HN       LEU  12  69.750   5.138  -1.741
  109    HA   LEU  12           HA       LEU  12  67.491   4.386  -0.374
  110    HB2  LEU  12           HB2      LEU  12  69.550   4.093   0.634
  111    HB3  LEU  12           HB1      LEU  12  70.003   5.773   0.430
  112    HG   LEU  12           HG       LEU  12  68.359   6.415   2.127
  113   HD11  LEU  12          HD11      LEU  12  68.051   3.465   2.504
  114   HD12  LEU  12          HD12      LEU  12  66.822   4.508   1.757
  115   HD13  LEU  12          HD13      LEU  12  67.298   4.751   3.465
  116   HD21  LEU  12          HD21      LEU  12  70.693   5.811   2.663
  117   HD22  LEU  12          HD22      LEU  12  70.075   4.204   3.086
  118   HD23  LEU  12          HD23      LEU  12  69.538   5.622   3.982
  119    HA   PRO  13           HA       PRO  13  66.602   8.875   0.996
  120    HB2  PRO  13           HB2      PRO  13  67.500  10.990  -0.453
  121    HB3  PRO  13           HB1      PRO  13  68.493  10.166   0.777
  122    HG2  PRO  13           HG2      PRO  13  68.538   9.744  -2.178
  123    HG3  PRO  13           HG1      PRO  13  69.886  10.084  -1.072
  124    HD2  PRO  13           HD2      PRO  13  69.276   7.583  -1.829
  125    HD3  PRO  13           HD1      PRO  13  69.877   7.918  -0.206
  126    H    GLN  14           HN       GLN  14  66.880   8.364  -2.413
  127    HA   GLN  14           HA       GLN  14  64.482   9.679  -3.166
  128    HB2  GLN  14           HB2      GLN  14  65.874   7.482  -4.680
  129    HB3  GLN  14           HB1      GLN  14  64.816   8.730  -5.322
  130    HG2  GLN  14           HG2      GLN  14  66.492  10.422  -4.643
  131    HG3  GLN  14           HG1      GLN  14  67.576   9.115  -4.186
  132   HE21  GLN  14          HE21      GLN  14  66.466   7.534  -6.547
  133   HE22  GLN  14          HE22      GLN  14  67.301   8.213  -7.885
  134    H    LEU  15           HN       LEU  15  65.294   6.323  -2.210
  135    HA   LEU  15           HA       LEU  15  62.807   5.191  -2.754
  136    HB2  LEU  15           HB2      LEU  15  64.887   3.943  -2.228
  137    HB3  LEU  15           HB1      LEU  15  64.834   4.632  -0.658
  138    HG   LEU  15           HG       LEU  15  62.859   3.506  -0.056
  139   HD11  LEU  15          HD11      LEU  15  61.818   3.383  -2.372
  140   HD12  LEU  15          HD12      LEU  15  61.770   1.882  -1.473
  141   HD13  LEU  15          HD13      LEU  15  62.959   2.077  -2.750
  142   HD21  LEU  15          HD21      LEU  15  64.916   1.813  -1.341
  143   HD22  LEU  15          HD22      LEU  15  63.781   1.263  -0.086
  144   HD23  LEU  15          HD23      LEU  15  64.983   2.549   0.250
  145    H    CYS  16           HN       CYS  16  64.162   6.782   0.029
  146    HA   CYS  16           HA       CYS  16  62.010   6.405   1.762
  147    HB2  CYS  16           HB2      CYS  16  63.852   8.797   1.573
  148    HB3  CYS  16           HB1      CYS  16  62.892   8.359   2.980
  149    HG   CYS  16           HG       CYS  16  65.389   6.409   1.684
  150    H    THR  17           HN       THR  17  62.678   8.784  -0.681
  151    HA   THR  17           HA       THR  17  60.539  10.532  -0.490
  152    HB   THR  17           HB       THR  17  62.188   9.466  -2.700
  153    HG1  THR  17           HG1      THR  17  62.876  11.031  -0.977
  154   HG21  THR  17          HG21      THR  17  61.349  11.330  -4.176
  155   HG22  THR  17          HG22      THR  17  60.020  11.551  -3.013
  156   HG23  THR  17          HG23      THR  17  60.235  10.007  -3.859
  157    H    GLU  18           HN       GLU  18  60.847   7.517  -2.290
  158    HA   GLU  18           HA       GLU  18  58.389   7.294  -3.465
  159    HB2  GLU  18           HB2      GLU  18  60.376   5.428  -2.432
  160    HB3  GLU  18           HB1      GLU  18  58.984   4.828  -3.346
  161    HG2  GLU  18           HG2      GLU  18  60.764   7.030  -4.295
  162    HG3  GLU  18           HG1      GLU  18  61.230   5.393  -4.611
  163    H    LEU  19           HN       LEU  19  59.479   5.730  -0.391
  164    HA   LEU  19           HA       LEU  19  56.954   5.013   0.554
  165    HB2  LEU  19           HB2      LEU  19  59.614   5.460   1.789
  166    HB3  LEU  19           HB1      LEU  19  58.288   5.029   2.785
  167    HG   LEU  19           HG       LEU  19  58.095   2.986   1.125
  168   HD11  LEU  19          HD11      LEU  19  60.214   2.225   0.305
  169   HD12  LEU  19          HD12      LEU  19  60.935   3.770   0.764
  170   HD13  LEU  19          HD13      LEU  19  59.675   3.713  -0.471
  171   HD21  LEU  19          HD21      LEU  19  58.566   2.793   3.482
  172   HD22  LEU  19          HD22      LEU  19  60.237   3.277   3.164
  173   HD23  LEU  19          HD23      LEU  19  59.643   1.729   2.552
  174    H    GLN  20           HN       GLN  20  57.994   8.100   0.084
  175    HA   GLN  20           HA       GLN  20  57.228  10.126   0.727
  176    HB2  GLN  20           HB2      GLN  20  55.093   8.347   1.776
  177    HB3  GLN  20           HB1      GLN  20  54.900  10.112   1.774
  178    HG2  GLN  20           HG2      GLN  20  55.111  10.064  -0.689
  179    HG3  GLN  20           HG1      GLN  20  55.286   8.314  -0.634
  180   HE21  GLN  20          HE21      GLN  20  53.475   7.969  -1.901
  181   HE22  GLN  20          HE22      GLN  20  51.874   8.241  -1.322
  182    H    THR  21           HN       THR  21  59.087   8.853   2.362
  183    HA   THR  21           HA       THR  21  58.604  10.210   4.883
  184    HB   THR  21           HB       THR  21  57.884   7.811   5.165
  185    HG1  THR  21           HG1      THR  21  58.980   7.542   7.096
  186   HG21  THR  21          HG21      THR  21  59.587   6.040   5.219
  187   HG22  THR  21          HG22      THR  21  60.798   7.190   4.658
  188   HG23  THR  21          HG23      THR  21  59.449   6.746   3.604
  189    H    THR  22           HN       THR  22  61.001   9.344   6.119
  190    HA   THR  22           HA       THR  22  63.052  10.103   4.135
  191    HB   THR  22           HB       THR  22  63.527  10.926   6.976
  192    HG1  THR  22           HG1      THR  22  61.261  11.539   6.007
  193   HG21  THR  22          HG21      THR  22  63.980  12.231   4.280
  194   HG22  THR  22          HG22      THR  22  65.182  11.324   5.195
  195   HG23  THR  22          HG23      THR  22  64.558  12.845   5.826
  196    H    ILE  23           HN       ILE  23  65.363   9.528   5.077
  197    HA   ILE  23           HA       ILE  23  65.815   6.878   5.272
  198    HB   ILE  23           HB       ILE  23  67.370   9.046   6.586
  199   HG12  ILE  23          HG12      ILE  23  67.253   8.044   3.809
  200   HG13  ILE  23          HG11      ILE  23  67.007   9.680   4.366
  201   HG21  ILE  23          HG21      ILE  23  68.203   6.333   5.510
  202   HG22  ILE  23          HG22      ILE  23  68.146   6.796   7.215
  203   HG23  ILE  23          HG23      ILE  23  69.335   7.539   6.133
  204   HD11  ILE  23          HD11      ILE  23  69.538   8.117   4.311
  205   HD12  ILE  23          HD12      ILE  23  69.430   9.775   4.934
  206   HD13  ILE  23          HD13      ILE  23  69.146   9.434   3.204
  207    H    HIS  24           HN       HIS  24  64.857   9.054   7.613
  208    HA   HIS  24           HA       HIS  24  66.119   8.060   9.894
  209    HB2  HIS  24           HB2      HIS  24  63.872  10.054   9.745
  210    HB3  HIS  24           HB1      HIS  24  65.162  10.005  10.919
  211    HD1  HIS  24           HD1      HIS  24  67.245   9.588   8.266
  212    HD2  HIS  24           HD2      HIS  24  64.629  12.642   9.137
  213    HE1  HIS  24           HE1      HIS  24  67.929  11.398   6.773
  214    H    ASP  25           HN       ASP  25  63.305   7.342   8.150
  215    HA   ASP  25           HA       ASP  25  61.877   6.199  10.463
  216    HB2  ASP  25           HB2      ASP  25  60.804   8.266   9.601
  217    HB3  ASP  25           HB1      ASP  25  60.769   7.538   8.030
  218    H    ILE  26           HN       ILE  26  62.707   5.974   7.064
  219    HA   ILE  26           HA       ILE  26  61.132   3.902   6.183
  220    HB   ILE  26           HB       ILE  26  62.428   5.236   4.660
  221   HG12  ILE  26          HG12      ILE  26  63.502   2.456   4.526
  222   HG13  ILE  26          HG11      ILE  26  61.879   2.685   4.067
  223   HG21  ILE  26          HG21      ILE  26  64.852   4.972   4.441
  224   HG22  ILE  26          HG22      ILE  26  64.852   3.861   5.810
  225   HG23  ILE  26          HG23      ILE  26  64.411   5.551   6.051
  226   HD11  ILE  26          HD11      ILE  26  64.338   3.842   2.780
  227   HD12  ILE  26          HD12      ILE  26  62.686   4.244   2.268
  228   HD13  ILE  26          HD13      ILE  26  63.284   2.576   2.172
  229    H    ILE  27           HN       ILE  27  61.004   1.782   6.342
  230    HA   ILE  27           HA       ILE  27  63.133   0.371   7.667
  231    HB   ILE  27           HB       ILE  27  60.321  -0.418   6.911
  232   HG12  ILE  27          HG12      ILE  27  60.550   1.024   8.885
  233   HG13  ILE  27          HG11      ILE  27  59.898  -0.564   9.262
  234   HG21  ILE  27          HG21      ILE  27  61.761  -2.306   6.572
  235   HG22  ILE  27          HG22      ILE  27  60.727  -2.567   7.983
  236   HG23  ILE  27          HG23      ILE  27  62.428  -2.129   8.195
  237   HD11  ILE  27          HD11      ILE  27  61.479   0.165  10.966
  238   HD12  ILE  27          HD12      ILE  27  62.730   0.372   9.743
  239   HD13  ILE  27          HD13      ILE  27  62.111  -1.239  10.105
  240    H    LEU  28           HN       LEU  28  64.648  -0.190   6.715
  241    HA   LEU  28           HA       LEU  28  64.320  -1.245   4.044
  242    HB2  LEU  28           HB2      LEU  28  65.821   0.890   4.881
  243    HB3  LEU  28           HB1      LEU  28  66.978  -0.432   4.749
  244    HG   LEU  28           HG       LEU  28  66.360  -0.847   2.486
  245   HD11  LEU  28          HD11      LEU  28  64.631   1.042   1.679
  246   HD12  LEU  28          HD12      LEU  28  64.092   0.755   3.380
  247   HD13  LEU  28          HD13      LEU  28  64.143  -0.561   2.227
  248   HD21  LEU  28          HD21      LEU  28  66.550   2.112   2.938
  249   HD22  LEU  28          HD22      LEU  28  66.997   1.246   1.467
  250   HD23  LEU  28          HD23      LEU  28  67.934   1.032   2.946
  251    H    GLU  29           HN       GLU  29  65.226  -3.386   3.869
  252    HA   GLU  29           HA       GLU  29  66.676  -3.966   6.335
  253    HB2  GLU  29           HB2      GLU  29  66.004  -6.319   5.986
  254    HB3  GLU  29           HB1      GLU  29  64.902  -5.239   6.853
  255    HG2  GLU  29           HG2      GLU  29  64.093  -4.959   4.388
  256    HG3  GLU  29           HG1      GLU  29  64.752  -6.620   4.394
  257    H    CYS  30           HN       CYS  30  68.026  -6.253   6.125
  258    HA   CYS  30           HA       CYS  30  69.709  -5.677   3.990
  259    HB2  CYS  30           HB2      CYS  30  70.411  -6.828   6.215
  260    HB3  CYS  30           HB1      CYS  30  69.695  -8.251   5.513
  261    H    VAL  31           HN       VAL  31  69.727  -6.409   2.213
  262    HA   VAL  31           HA       VAL  31  67.733  -7.972   0.966
  263    HB   VAL  31           HB       VAL  31  68.891  -6.304  -0.371
  264   HG11  VAL  31          HG11      VAL  31  71.359  -7.548   0.622
  265   HG12  VAL  31          HG12      VAL  31  70.759  -5.851   0.818
  266   HG13  VAL  31          HG13      VAL  31  71.201  -6.509  -0.782
  267   HG21  VAL  31          HG21      VAL  31  70.085  -7.465  -2.122
  268   HG22  VAL  31          HG22      VAL  31  68.535  -8.182  -1.734
  269   HG23  VAL  31          HG23      VAL  31  70.033  -8.944  -1.155
  270    H    TYR  32           HN       TYR  32  70.741  -8.597   2.363
  271    HA   TYR  32           HA       TYR  32  70.863 -11.264   1.285
  272    HB2  TYR  32           HB2      TYR  32  72.978  -9.840   2.887
  273    HB3  TYR  32           HB1      TYR  32  73.165 -11.330   1.958
  274    HD1  TYR  32           HD2      TYR  32  71.759 -10.737  -0.580
  275    HD2  TYR  32           HD1      TYR  32  74.262  -8.201   1.817
  276    HE1  TYR  32           HE2      TYR  32  72.218  -9.493  -2.477
  277    HE2  TYR  32           HE1      TYR  32  74.751  -6.820  -0.155
  278    HH   TYR  32           HH       TYR  32  74.758  -7.019  -2.589
  279    H    CYS  33           HN       CYS  33  70.789  -9.591   4.477
  280    HA   CYS  33           HA       CYS  33  70.873 -12.185   5.863
  281    HB2  CYS  33           HB2      CYS  33  70.947  -9.421   7.070
  282    HB3  CYS  33           HB1      CYS  33  71.233 -10.942   7.896
  283    H    LYS  34           HN       LYS  34  68.623  -9.952   4.760
  284    HA   LYS  34           HA       LYS  34  66.543  -9.574   4.961
  285    HB2  LYS  34           HB2      LYS  34  66.415 -12.224   6.358
  286    HB3  LYS  34           HB1      LYS  34  65.093 -11.415   5.530
  287    HG2  LYS  34           HG2      LYS  34  67.618 -12.446   4.284
  288    HG3  LYS  34           HG1      LYS  34  66.039 -13.183   4.150
  289    HD2  LYS  34           HD2      LYS  34  65.355 -10.876   3.132
  290    HD3  LYS  34           HD1      LYS  34  67.076 -10.649   2.972
  291    HE2  LYS  34           HE2      LYS  34  65.592 -12.997   1.794
  292    HE3  LYS  34           HE1      LYS  34  66.140 -11.583   0.900
  293    HZ1  LYS  34           HZ1      LYS  34  67.939 -13.425   2.378
  294    HZ2  LYS  34           HZ2      LYS  34  68.404 -12.171   1.328
  295    HZ3  LYS  34           HZ3      LYS  34  67.637 -13.526   0.735
  296    H    GLN  35           HN       GLN  35  68.347  -8.871   7.389
  297    HA   GLN  35           HA       GLN  35  66.263  -8.591   9.335
  298    HB2  GLN  35           HB2      GLN  35  68.029  -8.037  10.740
  299    HB3  GLN  35           HB1      GLN  35  68.113  -9.702  10.171
  300    HG2  GLN  35           HG2      GLN  35  69.871  -8.828   8.577
  301    HG3  GLN  35           HG1      GLN  35  69.831  -7.333   9.534
  302   HE21  GLN  35          HE21      GLN  35  69.046  -8.842  11.859
  303   HE22  GLN  35          HE22      GLN  35  70.418  -9.610  12.480
  304    H    GLN  36           HN       GLN  36  65.762  -6.506  10.063
  305    HA   GLN  36           HA       GLN  36  66.057  -4.507   8.185
  306    HB2  GLN  36           HB2      GLN  36  64.791  -4.769  10.857
  307    HB3  GLN  36           HB1      GLN  36  64.689  -3.333   9.844
  308    HG2  GLN  36           HG2      GLN  36  63.649  -4.470   8.132
  309    HG3  GLN  36           HG1      GLN  36  64.030  -6.035   8.839
  310   HE21  GLN  36          HE21      GLN  36  61.615  -5.115   7.885
  311   HE22  GLN  36          HE22      GLN  36  60.454  -5.022   9.182
  312    H    LEU  37           HN       LEU  37  67.269  -2.953   8.067
  313    HA   LEU  37           HA       LEU  37  69.544  -2.709   9.671
  314    HB2  LEU  37           HB2      LEU  37  68.437  -1.017   7.448
  315    HB3  LEU  37           HB1      LEU  37  69.652  -0.459   8.523
  316    HG   LEU  37           HG       LEU  37  71.069  -2.422   7.923
  317   HD11  LEU  37          HD11      LEU  37  69.004  -2.814   5.797
  318   HD12  LEU  37          HD12      LEU  37  69.428  -3.937   7.091
  319   HD13  LEU  37          HD13      LEU  37  70.593  -3.562   5.818
  320   HD21  LEU  37          HD21      LEU  37  71.779  -1.484   5.770
  321   HD22  LEU  37          HD22      LEU  37  71.513  -0.249   6.998
  322   HD23  LEU  37          HD23      LEU  37  70.312  -0.508   5.735
  323    H    LEU  38           HN       LEU  38  70.101  -1.625  11.200
  324    HA   LEU  38           HA       LEU  38  68.447  -0.185  12.953
  325    HB2  LEU  38           HB2      LEU  38  70.993  -1.337  12.817
  326    HB3  LEU  38           HB1      LEU  38  71.268   0.367  12.891
  327    HG   LEU  38           HG       LEU  38  69.610  -1.088  14.882
  328   HD11  LEU  38          HD11      LEU  38  71.599  -0.986  16.319
  329   HD12  LEU  38          HD12      LEU  38  72.502  -0.266  14.975
  330   HD13  LEU  38          HD13      LEU  38  71.884  -1.912  14.840
  331   HD21  LEU  38          HD21      LEU  38  69.970   0.915  16.254
  332   HD22  LEU  38          HD22      LEU  38  69.186   1.326  14.723
  333   HD23  LEU  38          HD23      LEU  38  70.905   1.638  14.946
  334    H    ARG  39           HN       ARG  39  68.105   2.085  12.844
  335    HA   ARG  39           HA       ARG  39  68.350   3.460  10.493
  336    HB2  ARG  39           HB2      ARG  39  66.929   4.204  12.330
  337    HB3  ARG  39           HB1      ARG  39  68.336   4.658  13.273
  338    HG2  ARG  39           HG2      ARG  39  68.894   6.352  11.609
  339    HG3  ARG  39           HG1      ARG  39  67.496   5.875  10.655
  340    HD2  ARG  39           HD2      ARG  39  67.033   7.883  11.941
  341    HD3  ARG  39           HD1      ARG  39  66.017   6.558  12.478
  342    HE   ARG  39           HE       ARG  39  67.590   6.321  14.356
  343   HH11  ARG  39          HH11      ARG  39  67.769   9.432  12.641
  344   HH12  ARG  39          HH12      ARG  39  67.823  10.362  14.063
  345   HH21  ARG  39          HH21      ARG  39  67.779   7.672  16.333
  346   HH22  ARG  39          HH22      ARG  39  67.878   9.351  16.173
  347    H    ARG  40           HN       ARG  40  70.995   2.902  12.734
  348    HA   ARG  40           HA       ARG  40  72.682   5.032  12.007
  349    HB2  ARG  40           HB2      ARG  40  73.156   2.267  13.085
  350    HB3  ARG  40           HB1      ARG  40  74.408   3.473  12.913
  351    HG2  ARG  40           HG2      ARG  40  71.991   3.612  14.691
  352    HG3  ARG  40           HG1      ARG  40  73.658   3.318  15.193
  353    HD2  ARG  40           HD2      ARG  40  72.536   5.835  13.974
  354    HD3  ARG  40           HD1      ARG  40  73.084   5.610  15.634
  355    HE   ARG  40           HE       ARG  40  75.194   5.024  13.872
  356   HH11  ARG  40          HH11      ARG  40  73.392   7.795  15.128
  357   HH12  ARG  40          HH12      ARG  40  74.630   8.925  14.798
  358   HH21  ARG  40          HH21      ARG  40  76.873   6.529  13.403
  359   HH22  ARG  40          HH22      ARG  40  76.671   8.177  13.775
  360    H    GLU  41           HN       GLU  41  72.254   1.676  10.990
  361    HA   GLU  41           HA       GLU  41  74.336   1.522   9.027
  362    HB2  GLU  41           HB2      GLU  41  71.799  -0.095   9.094
  363    HB3  GLU  41           HB1      GLU  41  73.374  -0.628   8.552
  364    HG2  GLU  41           HG2      GLU  41  74.086  -0.439  11.016
  365    HG3  GLU  41           HG1      GLU  41  72.420  -0.132  11.321
  366    H    VAL  42           HN       VAL  42  70.965   2.408   9.071
  367    HA   VAL  42           HA       VAL  42  70.650   2.407   6.257
  368    HB   VAL  42           HB       VAL  42  68.968   4.187   8.046
  369   HG11  VAL  42          HG11      VAL  42  68.279   2.469   5.700
  370   HG12  VAL  42          HG12      VAL  42  68.683   4.188   5.558
  371   HG13  VAL  42          HG13      VAL  42  67.230   3.676   6.443
  372   HG21  VAL  42          HG21      VAL  42  68.579   1.230   7.648
  373   HG22  VAL  42          HG22      VAL  42  67.493   2.317   8.513
  374   HG23  VAL  42          HG23      VAL  42  69.106   1.986   9.149
  375    H    TYR  43           HN       TYR  43  71.461   5.045   8.619
  376    HA   TYR  43           HA       TYR  43  71.747   7.033   6.683
  377    HB2  TYR  43           HB2      TYR  43  73.284   6.701   9.250
  378    HB3  TYR  43           HB1      TYR  43  73.426   8.101   8.195
  379    HD1  TYR  43           HD1      TYR  43  70.816   8.729   7.388
  380    HD2  TYR  43           HD2      TYR  43  72.106   7.237  11.125
  381    HE1  TYR  43           HE1      TYR  43  68.856   9.696   8.409
  382    HE2  TYR  43           HE2      TYR  43  70.143   8.222  12.205
  383    HH   TYR  43           HH       TYR  43  67.581   9.763  10.301
  384    H    ASP  44           HN       ASP  44  74.024   4.490   7.647
  385    HA   ASP  44           HA       ASP  44  76.351   5.428   6.498
  386    HB2  ASP  44           HB2      ASP  44  75.276   2.596   6.561
  387    HB3  ASP  44           HB1      ASP  44  76.881   3.036   6.166
  388    H    PHE  45           HN       PHE  45  73.740   3.731   5.144
  389    HA   PHE  45           HA       PHE  45  74.776   3.088   2.690
  390    HB2  PHE  45           HB2      PHE  45  72.475   2.623   3.980
  391    HB3  PHE  45           HB1      PHE  45  71.997   3.927   2.923
  392    HD1  PHE  45           HD1      PHE  45  73.444   0.593   3.011
  393    HD2  PHE  45           HD2      PHE  45  71.666   3.674   0.713
  394    HE1  PHE  45           HE1      PHE  45  73.100  -0.985   1.106
  395    HE2  PHE  45           HE2      PHE  45  71.351   2.149  -1.147
  396    HZ   PHE  45           HZ       PHE  45  72.025  -0.163  -0.964
  397    H    ALA  46           HN       ALA  46  72.856   5.991   3.575
  398    HA   ALA  46           HA       ALA  46  73.263   7.128   0.924
  399    HB1  ALA  46           HB1      ALA  46  71.885   9.038   1.706
  400    HB2  ALA  46           HB2      ALA  46  71.780   8.292   3.297
  401    HB3  ALA  46           HB3      ALA  46  71.067   7.509   1.891
  402    H    ARG  47           HN       ARG  47  74.898   7.256   3.969
  403    HA   ARG  47           HA       ARG  47  75.995   9.869   3.466
  404    HB2  ARG  47           HB2      ARG  47  76.128   7.846   5.621
  405    HB3  ARG  47           HB1      ARG  47  77.514   8.893   5.525
  406    HG2  ARG  47           HG2      ARG  47  75.845   9.675   7.146
  407    HG3  ARG  47           HG1      ARG  47  76.108  10.849   5.862
  408    HD2  ARG  47           HD2      ARG  47  74.041  10.147   4.782
  409    HD3  ARG  47           HD1      ARG  47  73.824   8.883   5.984
  410    HE   ARG  47           HE       ARG  47  73.774  10.796   7.618
  411   HH11  ARG  47          HH11      ARG  47  72.636  11.208   4.288
  412   HH12  ARG  47          HH12      ARG  47  71.384  12.281   4.684
  413   HH21  ARG  47          HH21      ARG  47  72.021  12.295   8.183
  414   HH22  ARG  47          HH22      ARG  47  71.011  12.891   6.960
  415    H    ARG  48           HN       ARG  48  76.529   6.807   2.324
  416    HA   ARG  48           HA       ARG  48  79.238   7.446   1.491
  417    HB2  ARG  48           HB2      ARG  48  77.748   4.883   1.821
  418    HB3  ARG  48           HB1      ARG  48  79.415   4.983   1.260
  419    HG2  ARG  48           HG2      ARG  48  80.158   5.789   3.363
  420    HG3  ARG  48           HG1      ARG  48  78.503   6.068   3.907
  421    HD2  ARG  48           HD2      ARG  48  78.108   3.671   3.737
  422    HD3  ARG  48           HD1      ARG  48  79.804   3.446   3.341
  423    HE   ARG  48           HE       ARG  48  79.405   4.957   5.736
  424   HH11  ARG  48          HH11      ARG  48  79.695   1.656   4.549
  425   HH12  ARG  48          HH12      ARG  48  79.937   0.961   6.083
  426   HH21  ARG  48          HH21      ARG  48  79.666   3.986   7.873
  427   HH22  ARG  48          HH22      ARG  48  79.896   2.309   8.010
  428    H    ASP  49           HN       ASP  49  78.924   5.270  -0.576
  429    HA   ASP  49           HA       ASP  49  77.275   6.854  -2.391
  430    HB2  ASP  49           HB2      ASP  49  78.833   6.237  -4.203
  431    HB3  ASP  49           HB1      ASP  49  79.624   7.136  -2.919
  432    H    LEU  50           HN       LEU  50  76.664   4.331  -0.849
  433    HA   LEU  50           HA       LEU  50  76.605   2.220  -2.736
  434    HB2  LEU  50           HB2      LEU  50  75.302   2.498  -0.058
  435    HB3  LEU  50           HB1      LEU  50  75.185   1.071  -1.050
  436    HG   LEU  50           HG       LEU  50  77.692   0.912  -0.945
  437   HD11  LEU  50          HD11      LEU  50  78.196   3.175  -0.252
  438   HD12  LEU  50          HD12      LEU  50  78.858   1.979   0.856
  439   HD13  LEU  50          HD13      LEU  50  77.401   2.875   1.296
  440   HD21  LEU  50          HD21      LEU  50  77.680  -0.090   1.262
  441   HD22  LEU  50          HD22      LEU  50  76.238  -0.527   0.332
  442   HD23  LEU  50          HD23      LEU  50  76.145   0.699   1.605
  443    H    CYS  51           HN       CYS  51  74.896   1.158  -3.569
  444    HA   CYS  51           HA       CYS  51  72.467   2.727  -3.891
  445    HB2  CYS  51           HB2      CYS  51  72.284   1.473  -6.085
  446    HB3  CYS  51           HB1      CYS  51  73.563   2.701  -5.988
  447    HG   CYS  51           HG       CYS  51  73.735  -0.564  -6.539
  448    H    ILE  52           HN       ILE  52  70.550   1.474  -4.169
  449    HA   ILE  52           HA       ILE  52  70.471  -0.569  -2.159
  450    HB   ILE  52           HB       ILE  52  68.385   1.014  -3.588
  451   HG12  ILE  52          HG12      ILE  52  69.295   0.571  -0.816
  452   HG13  ILE  52          HG11      ILE  52  69.564   2.024  -1.823
  453   HG21  ILE  52          HG21      ILE  52  67.420  -1.274  -3.404
  454   HG22  ILE  52          HG22      ILE  52  66.631  -0.138  -2.310
  455   HG23  ILE  52          HG23      ILE  52  67.815  -1.284  -1.684
  456   HD11  ILE  52          HD11      ILE  52  67.169   0.866  -0.697
  457   HD12  ILE  52          HD12      ILE  52  67.182   2.231  -1.869
  458   HD13  ILE  52          HD13      ILE  52  67.946   2.396  -0.218
  459    H    VAL  53           HN       VAL  53  69.658  -2.384  -2.229
  460    HA   VAL  53           HA       VAL  53  69.923  -3.858  -4.696
  461    HB   VAL  53           HB       VAL  53  70.615  -5.660  -2.884
  462   HG11  VAL  53          HG11      VAL  53  72.954  -4.944  -3.210
  463   HG12  VAL  53          HG12      VAL  53  72.368  -3.360  -3.750
  464   HG13  VAL  53          HG13      VAL  53  72.020  -4.794  -4.703
  465   HG21  VAL  53          HG21      VAL  53  71.852  -4.597  -1.018
  466   HG22  VAL  53          HG22      VAL  53  70.142  -4.226  -0.928
  467   HG23  VAL  53          HG23      VAL  53  71.282  -3.024  -1.530
  468    H    TYR  54           HN       TYR  54  67.957  -4.493  -5.224
  469    HA   TYR  54           HA       TYR  54  66.054  -5.133  -3.176
  470    HB2  TYR  54           HB2      TYR  54  65.798  -5.056  -6.193
  471    HB3  TYR  54           HB1      TYR  54  64.502  -5.372  -5.049
  472    HD1  TYR  54           HD1      TYR  54  67.019  -2.830  -5.956
  473    HD2  TYR  54           HD2      TYR  54  63.274  -3.618  -4.105
  474    HE1  TYR  54           HE1      TYR  54  66.595  -0.415  -5.726
  475    HE2  TYR  54           HE2      TYR  54  62.866  -1.288  -3.905
  476    HH   TYR  54           HH       TYR  54  64.794   1.011  -5.474
  477    H    ARG  55           HN       ARG  55  65.898  -6.883  -2.533
  478    HA   ARG  55           HA       ARG  55  67.290  -9.040  -3.873
  479    HB2  ARG  55           HB2      ARG  55  66.777  -8.693  -1.141
  480    HB3  ARG  55           HB1      ARG  55  65.635  -9.925  -1.618
  481    HG2  ARG  55           HG2      ARG  55  68.662 -10.206  -2.058
  482    HG3  ARG  55           HG1      ARG  55  67.851 -10.790  -0.673
  483    HD2  ARG  55           HD2      ARG  55  67.283 -11.594  -3.537
  484    HD3  ARG  55           HD1      ARG  55  68.187 -12.539  -2.357
  485    HE   ARG  55           HE       ARG  55  65.461 -11.880  -1.634
  486   HH11  ARG  55          HH11      ARG  55  67.710 -14.315  -2.883
  487   HH12  ARG  55          HH12      ARG  55  66.567 -15.562  -2.913
  488   HH21  ARG  55          HH21      ARG  55  63.890 -13.640  -1.589
  489   HH22  ARG  55          HH22      ARG  55  64.353 -15.189  -2.116
  490    H    ASP  56           HN       ASP  56  65.956 -10.109  -5.404
  491    HA   ASP  56           HA       ASP  56  64.220 -10.864  -6.600
  492    HB2  ASP  56           HB2      ASP  56  63.422 -12.003  -4.505
  493    HB3  ASP  56           HB1      ASP  56  62.487 -10.563  -4.122
  494    H    GLY  57           HN       GLY  57  62.717  -8.470  -4.467
  495    HA2  GLY  57           HA2      GLY  57  62.778  -6.428  -6.355
  496    HA3  GLY  57           HA1      GLY  57  61.180  -7.182  -6.448
  497    H    ASN  58           HN       ASN  58  63.127  -6.824  -3.542
  498    HA   ASN  58           HA       ASN  58  61.156  -4.851  -2.492
  499    HB2  ASN  58           HB2      ASN  58  62.643  -6.927  -0.910
  500    HB3  ASN  58           HB1      ASN  58  61.288  -5.996  -0.347
  501   HD21  ASN  58          HD21      ASN  58  62.404  -8.691  -2.159
  502   HD22  ASN  58          HD22      ASN  58  60.932  -9.546  -2.277
  503    HA   PRO  59           HA       PRO  59  64.873  -2.830  -1.892
  504    HB2  PRO  59           HB2      PRO  59  63.800  -0.862  -0.114
  505    HB3  PRO  59           HB1      PRO  59  64.099  -0.710  -1.845
  506    HG2  PRO  59           HG2      PRO  59  61.571  -0.760  -0.727
  507    HG3  PRO  59           HG1      PRO  59  61.927  -1.202  -2.383
  508    HD2  PRO  59           HD2      PRO  59  61.540  -2.990  -0.009
  509    HD3  PRO  59           HD1      PRO  59  60.986  -3.187  -1.686
  510    H    TYR  60           HN       TYR  60  66.520  -3.297  -0.882
  511    HA   TYR  60           HA       TYR  60  66.319  -3.241   1.907
  512    HB2  TYR  60           HB2      TYR  60  67.969  -5.546   0.915
  513    HB3  TYR  60           HB1      TYR  60  67.287  -5.108   2.272
  514    HD1  TYR  60           HD1      TYR  60  65.322  -5.660   3.006
  515    HD2  TYR  60           HD2      TYR  60  66.379  -6.507  -0.882
  516    HE1  TYR  60           HE1      TYR  60  63.452  -7.353   2.894
  517    HE2  TYR  60           HE2      TYR  60  64.545  -8.153  -1.089
  518    HH   TYR  60           HH       TYR  60  62.122  -8.479   1.252
  519    H    ALA  61           HN       ALA  61  68.098  -2.900   2.750
  520    HA   ALA  61           HA       ALA  61  69.946  -1.305   1.285
  521    HB1  ALA  61           HB1      ALA  61  70.453  -0.497   3.431
  522    HB2  ALA  61           HB2      ALA  61  69.719  -1.957   4.096
  523    HB3  ALA  61           HB3      ALA  61  68.660  -0.741   3.391
  524    H    VAL  62           HN       VAL  62  72.168  -1.707   2.514
  525    HA   VAL  62           HA       VAL  62  72.681  -4.571   2.644
  526    HB   VAL  62           HB       VAL  62  74.415  -2.220   1.770
  527   HG11  VAL  62          HG11      VAL  62  75.292  -5.041   2.140
  528   HG12  VAL  62          HG12      VAL  62  75.703  -3.633   3.142
  529   HG13  VAL  62          HG13      VAL  62  76.242  -3.699   1.464
  530   HG21  VAL  62          HG21      VAL  62  73.494  -4.648   0.302
  531   HG22  VAL  62          HG22      VAL  62  74.654  -3.468  -0.316
  532   HG23  VAL  62          HG23      VAL  62  72.994  -2.976   0.001
  533    H    CYS  63           HN       CYS  63  72.692  -5.122   4.732
  534    HA   CYS  63           HA       CYS  63  72.852  -3.272   6.815
  535    HB2  CYS  63           HB2      CYS  63  72.605  -5.099   8.235
  536    HB3  CYS  63           HB1      CYS  63  71.951  -5.653   6.692
  537    H    ASP  64           HN       ASP  64  74.471  -3.545   8.683
  538    HA   ASP  64           HA       ASP  64  76.975  -2.528   7.970
  539    HB2  ASP  64           HB2      ASP  64  75.953  -2.262  10.180
  540    HB3  ASP  64           HB1      ASP  64  76.248  -3.952  10.505
  541    H    LYS  65           HN       LYS  65  76.082  -5.786   8.835
  542    HA   LYS  65           HA       LYS  65  78.557  -7.095   8.852
  543    HB2  LYS  65           HB2      LYS  65  75.917  -8.047   7.750
  544    HB3  LYS  65           HB1      LYS  65  77.273  -9.089   8.077
  545    HG2  LYS  65           HG2      LYS  65  77.050  -8.771  10.417
  546    HG3  LYS  65           HG1      LYS  65  75.880  -7.472  10.175
  547    HD2  LYS  65           HD2      LYS  65  74.701  -9.537  10.752
  548    HD3  LYS  65           HD1      LYS  65  74.365  -9.031   9.091
  549    HE2  LYS  65           HE2      LYS  65  76.062 -10.672   8.300
  550    HE3  LYS  65           HE1      LYS  65  76.217 -11.244   9.963
  551    HZ1  LYS  65           HZ1      LYS  65  73.844 -11.828   9.898
  552    HZ2  LYS  65           HZ2      LYS  65  74.707 -12.633   8.711
  553    HZ3  LYS  65           HZ3      LYS  65  73.758 -11.307   8.295
  554    H    CYS  66           HN       CYS  66  76.296  -6.530   6.232
  555    HA   CYS  66           HA       CYS  66  77.933  -7.701   4.277
  556    HB2  CYS  66           HB2      CYS  66  75.360  -6.209   4.262
  557    HB3  CYS  66           HB1      CYS  66  76.013  -6.838   2.769
  558    H    LEU  67           HN       LEU  67  77.591  -4.501   5.486
  559    HA   LEU  67           HA       LEU  67  78.554  -2.957   3.389
  560    HB2  LEU  67           HB2      LEU  67  78.913  -2.587   6.318
  561    HB3  LEU  67           HB1      LEU  67  79.403  -1.411   5.113
  562    HG   LEU  67           HG       LEU  67  76.589  -2.356   5.649
  563   HD11  LEU  67          HD11      LEU  67  77.560  -0.802   7.234
  564   HD12  LEU  67          HD12      LEU  67  76.268  -0.064   6.232
  565   HD13  LEU  67          HD13      LEU  67  77.991   0.209   5.845
  566   HD21  LEU  67          HD21      LEU  67  77.625  -0.411   3.604
  567   HD22  LEU  67          HD22      LEU  67  75.935  -0.679   4.004
  568   HD23  LEU  67          HD23      LEU  67  76.870  -1.968   3.260
  569    H    LYS  68           HN       LYS  68  80.364  -4.840   5.719
  570    HA   LYS  68           HA       LYS  68  82.843  -3.819   4.665
  571    HB2  LYS  68           HB2      LYS  68  83.955  -5.455   6.173
  572    HB3  LYS  68           HB1      LYS  68  82.842  -4.380   7.004
  573    HG2  LYS  68           HG2      LYS  68  81.158  -6.170   7.001
  574    HG3  LYS  68           HG1      LYS  68  82.331  -7.241   6.237
  575    HD2  LYS  68           HD2      LYS  68  83.786  -7.082   8.135
  576    HD3  LYS  68           HD1      LYS  68  82.744  -5.869   8.881
  577    HE2  LYS  68           HE2      LYS  68  80.927  -7.542   8.956
  578    HE3  LYS  68           HE1      LYS  68  82.038  -8.740   8.302
  579    HZ1  LYS  68           HZ1      LYS  68  81.869  -8.907  10.689
  580    HZ2  LYS  68           HZ2      LYS  68  82.352  -7.323  10.894
  581    HZ3  LYS  68           HZ3      LYS  68  83.426  -8.457  10.262
  582    H    PHE  69           HN       PHE  69  80.761  -6.577   4.029
  583    HA   PHE  69           HA       PHE  69  82.658  -8.135   2.714
  584    HB2  PHE  69           HB2      PHE  69  79.740  -7.956   2.580
  585    HB3  PHE  69           HB1      PHE  69  80.674  -9.250   1.896
  586    HD1  PHE  69           HD2      PHE  69  82.455  -9.094   4.655
  587    HD2  PHE  69           HD1      PHE  69  78.392  -9.654   3.589
  588    HE1  PHE  69           HE2      PHE  69  82.080 -10.313   6.741
  589    HE2  PHE  69           HE1      PHE  69  77.982 -10.862   5.625
  590    HZ   PHE  69           HZ       PHE  69  79.812 -11.206   7.251
  591    H    TYR  70           HN       TYR  70  79.947  -6.015   1.678
  592    HA   TYR  70           HA       TYR  70  80.849  -6.372  -1.055
  593    HB2  TYR  70           HB2      TYR  70  78.068  -6.003   0.006
  594    HB3  TYR  70           HB1      TYR  70  78.498  -6.106  -1.697
  595    HD1  TYR  70           HD1      TYR  70  79.667  -8.199  -2.491
  596    HD2  TYR  70           HD2      TYR  70  77.750  -7.940   1.284
  597    HE1  TYR  70           HE1      TYR  70  79.646 -10.649  -2.345
  598    HE2  TYR  70           HE2      TYR  70  77.728 -10.375   1.473
  599    HH   TYR  70           HH       TYR  70  77.796 -12.283   0.001
  600    H    SER  71           HN       SER  71  78.419  -4.113   0.163
  601    HA   SER  71           HA       SER  71  78.029  -1.979  -0.216
  602    HB2  SER  71           HB2      SER  71  81.018  -1.749   0.122
  603    HB3  SER  71           HB1      SER  71  79.924  -0.363   0.054
  604    HG   SER  71           HG       SER  71  80.365  -2.174   2.078
  605    H    LYS  72           HN       LYS  72  81.083  -2.124  -2.026
  606    HA   LYS  72           HA       LYS  72  80.066  -0.589  -4.191
  607    HB2  LYS  72           HB2      LYS  72  82.458  -0.748  -3.523
  608    HB3  LYS  72           HB1      LYS  72  82.471  -2.404  -4.090
  609    HG2  LYS  72           HG2      LYS  72  83.453  -1.067  -5.793
  610    HG3  LYS  72           HG1      LYS  72  81.862  -1.611  -6.330
  611    HD2  LYS  72           HD2      LYS  72  80.899   0.559  -5.776
  612    HD3  LYS  72           HD1      LYS  72  82.459   1.118  -5.167
  613    HE2  LYS  72           HE2      LYS  72  83.400   0.779  -7.440
  614    HE3  LYS  72           HE1      LYS  72  81.794   0.333  -8.000
  615    HZ1  LYS  72           HZ1      LYS  72  81.003   2.536  -7.411
  616    HZ2  LYS  72           HZ2      LYS  72  82.305   2.660  -8.468
  617    HZ3  LYS  72           HZ3      LYS  72  82.528   2.965  -6.834
  618    H    ILE  73           HN       ILE  73  80.476  -3.929  -3.515
  619    HA   ILE  73           HA       ILE  73  79.699  -4.911  -6.112
  620    HB   ILE  73           HB       ILE  73  79.433  -6.487  -3.568
  621   HG12  ILE  73          HG12      ILE  73  82.027  -5.919  -5.066
  622   HG13  ILE  73          HG11      ILE  73  81.601  -5.531  -3.399
  623   HG21  ILE  73          HG21      ILE  73  78.604  -7.528  -5.615
  624   HG22  ILE  73          HG22      ILE  73  80.034  -8.392  -5.045
  625   HG23  ILE  73          HG23      ILE  73  80.162  -7.270  -6.399
  626   HD11  ILE  73          HD11      ILE  73  81.667  -7.829  -2.763
  627   HD12  ILE  73          HD12      ILE  73  83.171  -7.414  -3.587
  628   HD13  ILE  73          HD13      ILE  73  81.918  -8.321  -4.436
  629    H    SER  74           HN       SER  74  77.720  -4.012  -6.609
  630    HA   SER  74           HA       SER  74  75.537  -4.856  -4.901
  631    HB2  SER  74           HB2      SER  74  75.886  -2.486  -4.470
  632    HB3  SER  74           HB1      SER  74  75.853  -2.128  -6.186
  633    HG   SER  74           HG       SER  74  73.862  -2.145  -4.486
  634    H    GLU  75           HN       GLU  75  76.335  -3.592  -8.033
  635    HA   GLU  75           HA       GLU  75  74.036  -4.697  -9.317
  636    HB2  GLU  75           HB2      GLU  75  76.561  -3.510 -10.445
  637    HB3  GLU  75           HB1      GLU  75  75.263  -4.126 -11.463
  638    HG2  GLU  75           HG2      GLU  75  74.987  -1.924  -9.425
  639    HG3  GLU  75           HG1      GLU  75  75.159  -1.691 -11.165
  640    H    TYR  76           HN       TYR  76  77.412  -5.683  -9.076
  641    HA   TYR  76           HA       TYR  76  76.865  -8.194 -10.414
  642    HB2  TYR  76           HB2      TYR  76  79.125  -7.117 -10.542
  643    HB3  TYR  76           HB1      TYR  76  79.289  -7.346  -8.800
  644    HD1  TYR  76           HD1      TYR  76  78.255  -9.391 -11.723
  645    HD2  TYR  76           HD2      TYR  76  80.610  -9.152  -8.201
  646    HE1  TYR  76           HE1      TYR  76  79.043 -11.627 -12.139
  647    HE2  TYR  76           HE2      TYR  76  81.442 -11.432  -8.603
  648    HH   TYR  76           HH       TYR  76  81.036 -13.001 -11.542
  649    H    ARG  77           HN       ARG  77  76.205 -10.005  -9.436
  650    HA   ARG  77           HA       ARG  77  76.230 -10.087  -6.567
  651    HB2  ARG  77           HB2      ARG  77  73.835 -10.631  -8.307
  652    HB3  ARG  77           HB1      ARG  77  73.938 -10.951  -6.577
  653    HG2  ARG  77           HG2      ARG  77  74.395  -8.538  -6.226
  654    HG3  ARG  77           HG1      ARG  77  74.068  -8.289  -7.940
  655    HD2  ARG  77           HD2      ARG  77  71.863  -9.317  -7.587
  656    HD3  ARG  77           HD1      ARG  77  72.256  -9.358  -5.857
  657    HE   ARG  77           HE       ARG  77  72.719  -6.796  -6.707
  658   HH11  ARG  77          HH11      ARG  77  69.908  -8.902  -6.265
  659   HH12  ARG  77          HH12      ARG  77  68.781  -7.642  -6.141
  660   HH21  ARG  77          HH21      ARG  77  71.187  -5.073  -6.584
  661   HH22  ARG  77          HH22      ARG  77  69.522  -5.417  -6.403
  662    H    HIS  78           HN       HIS  78  77.408 -11.690  -6.259
  663    HA   HIS  78           HA       HIS  78  77.304 -13.899  -8.108
  664    HB2  HIS  78           HB2      HIS  78  79.611 -14.412  -7.226
  665    HB3  HIS  78           HB1      HIS  78  79.363 -12.868  -8.095
  666    HD1  HIS  78           HD1      HIS  78  80.726 -14.278  -4.951
  667    HD2  HIS  78           HD2      HIS  78  79.402 -10.722  -6.484
  668    HE1  HIS  78           HE1      HIS  78  81.621 -12.520  -3.372
  669    H    TYR  79           HN       TYR  79  75.442 -14.546  -7.161
  670    HA   TYR  79           HA       TYR  79  75.717 -15.883  -4.579
  671    HB2  TYR  79           HB2      TYR  79  73.454 -14.213  -5.661
  672    HB3  TYR  79           HB1      TYR  79  73.255 -15.330  -4.321
  673    HD1  TYR  79           HD2      TYR  79  75.435 -12.445  -5.377
  674    HD2  TYR  79           HD1      TYR  79  73.537 -14.561  -2.203
  675    HE1  TYR  79           HE2      TYR  79  76.159 -10.737  -3.807
  676    HE2  TYR  79           HE1      TYR  79  74.270 -12.871  -0.630
  677    HH   TYR  79           HH       TYR  79  75.467  -9.878  -1.626
  678    H    SER  80           HN       SER  80  73.876 -17.521  -4.425
  679    HA   SER  80           HA       SER  80  73.049 -18.506  -7.006
  680    HB2  SER  80           HB2      SER  80  75.077 -19.793  -6.161
  681    HB3  SER  80           HB1      SER  80  74.108 -20.269  -4.771
  682    HG   SER  80           HG       SER  80  72.965 -21.600  -5.988
  Start of MODEL    5
    1    H1   GLY  -1           HT1      GLY  -1  56.343  -0.273   5.064
    2    H2   GLY  -1           HT2      GLY  -1  56.285  -1.970   5.067
    3    H3   GLY  -1           HT3      GLY  -1  56.271  -1.144   3.615
    4    HA2  GLY  -1           HA1      GLY  -1  58.512  -0.364   3.999
    5    HA3  GLY  -1           HA2      GLY  -1  58.469  -1.203   5.558
    6    H    ALA   0           HN       ALA   0  59.972  -1.489   2.867
    7    HA   ALA   0           HA       ALA   0  61.020  -3.078   1.739
    8    HB1  ALA   0           HB1      ALA   0  61.381  -4.129   3.939
    9    HB2  ALA   0           HB2      ALA   0  61.291  -5.310   2.631
   10    HB3  ALA   0           HB3      ALA   0  59.910  -5.073   3.704
   11    H    MET   1           HN       MET   1  57.692  -4.078   2.391
   12    HA   MET   1           HA       MET   1  57.544  -5.685  -0.026
   13    HB2  MET   1           HB2      MET   1  56.168  -5.947   2.181
   14    HB3  MET   1           HB1      MET   1  55.191  -4.641   1.558
   15    HG2  MET   1           HG2      MET   1  55.534  -7.369   0.289
   16    HG3  MET   1           HG1      MET   1  54.161  -6.850   1.233
   17    HE1  MET   1           HE1      MET   1  55.802  -7.215  -2.179
   18    HE2  MET   1           HE2      MET   1  56.146  -5.464  -2.077
   19    HE3  MET   1           HE3      MET   1  54.964  -6.059  -3.221
   20    H    PHE   2           HN       PHE   2  58.055  -4.282  -1.738
   21    HA   PHE   2           HA       PHE   2  56.323  -2.016  -1.997
   22    HB2  PHE   2           HB2      PHE   2  59.106  -2.313  -2.365
   23    HB3  PHE   2           HB1      PHE   2  58.413  -2.145  -3.949
   24    HD1  PHE   2           HD1      PHE   2  56.438  -0.322  -1.524
   25    HD2  PHE   2           HD2      PHE   2  59.939  -0.201  -3.909
   26    HE1  PHE   2           HE1      PHE   2  56.429   2.101  -1.392
   27    HE2  PHE   2           HE2      PHE   2  59.956   2.229  -3.795
   28    HZ   PHE   2           HZ       PHE   2  58.170   3.406  -2.513
   29    H    GLN   3           HN       GLN   3  54.716  -2.174  -3.199
   30    HA   GLN   3           HA       GLN   3  54.582  -4.283  -5.220
   31    HB2  GLN   3           HB2      GLN   3  52.783  -3.343  -3.333
   32    HB3  GLN   3           HB1      GLN   3  52.209  -2.594  -4.816
   33    HG2  GLN   3           HG2      GLN   3  52.615  -5.544  -4.341
   34    HG3  GLN   3           HG1      GLN   3  51.072  -4.701  -4.339
   35   HE21  GLN   3          HE21      GLN   3  51.670  -3.042  -6.633
   36   HE22  GLN   3          HE22      GLN   3  51.806  -4.061  -8.004
   37    H    ASP   4           HN       ASP   4  54.146  -3.759  -7.409
   38    HA   ASP   4           HA       ASP   4  55.141  -1.367  -8.393
   39    HB2  ASP   4           HB2      ASP   4  54.511  -2.180 -10.590
   40    HB3  ASP   4           HB1      ASP   4  55.117  -3.521  -9.652
   41    HA   PRO   5           HA       PRO   5  53.894  -0.377 -11.160
   42    HB2  PRO   5           HB2      PRO   5  54.131   2.509 -10.662
   43    HB3  PRO   5           HB1      PRO   5  53.479   1.668 -12.072
   44    HG2  PRO   5           HG2      PRO   5  51.926   2.971 -10.319
   45    HG3  PRO   5           HG1      PRO   5  51.367   1.506 -11.155
   46    HD2  PRO   5           HD2      PRO   5  52.357   1.881  -8.368
   47    HD3  PRO   5           HD1      PRO   5  51.052   0.842  -8.956
   48    H    GLN   6           HN       GLN   6  54.742   1.924  -8.631
   49    HA   GLN   6           HA       GLN   6  56.939   2.608  -8.116
   50    HB2  GLN   6           HB2      GLN   6  56.037   0.264  -6.485
   51    HB3  GLN   6           HB1      GLN   6  57.388   1.295  -6.015
   52    HG2  GLN   6           HG2      GLN   6  54.509   2.121  -6.365
   53    HG3  GLN   6           HG1      GLN   6  55.370   1.941  -4.835
   54   HE21  GLN   6          HE21      GLN   6  56.935   3.468  -4.289
   55   HE22  GLN   6          HE22      GLN   6  57.045   4.991  -5.113
   56    H    GLU   7           HN       GLU   7  58.010   2.208  -9.830
   57    HA   GLU   7           HA       GLU   7  59.279  -0.233 -10.401
   58    HB2  GLU   7           HB2      GLU   7  58.960   1.451 -12.154
   59    HB3  GLU   7           HB1      GLU   7  60.144   2.492 -11.376
   60    HG2  GLU   7           HG2      GLU   7  61.859   0.962 -11.780
   61    HG3  GLU   7           HG1      GLU   7  60.757  -0.255 -12.421
   62    H    ARG   8           HN       ARG   8  59.925   1.996  -8.213
   63    HA   ARG   8           HA       ARG   8  61.332   2.200  -6.449
   64    HB2  ARG   8           HB2      ARG   8  62.627  -0.447  -7.255
   65    HB3  ARG   8           HB1      ARG   8  62.734   0.333  -5.697
   66    HG2  ARG   8           HG2      ARG   8  61.176  -1.100  -5.055
   67    HG3  ARG   8           HG1      ARG   8  60.036  -0.074  -5.944
   68    HD2  ARG   8           HD2      ARG   8  60.374  -1.464  -7.958
   69    HD3  ARG   8           HD1      ARG   8  61.485  -2.485  -7.054
   70    HE   ARG   8           HE       ARG   8  59.167  -2.595  -5.622
   71   HH11  ARG   8          HH11      ARG   8  60.026  -3.306  -8.966
   72   HH12  ARG   8          HH12      ARG   8  58.804  -4.480  -9.184
   73   HH21  ARG   8          HH21      ARG   8  57.494  -4.268  -5.931
   74   HH22  ARG   8          HH22      ARG   8  57.375  -5.037  -7.448
   75    HA   PRO   9           HA       PRO   9  65.005   3.992  -8.394
   76    HB2  PRO   9           HB2      PRO   9  66.070   5.121  -6.221
   77    HB3  PRO   9           HB1      PRO   9  64.658   5.860  -6.900
   78    HG2  PRO   9           HG2      PRO   9  65.009   4.159  -4.528
   79    HG3  PRO   9           HG1      PRO   9  63.794   5.433  -4.799
   80    HD2  PRO   9           HD2      PRO   9  63.468   2.716  -4.847
   81    HD3  PRO   9           HD1      PRO   9  62.282   3.833  -5.529
   82    H    ARG  10           HN       ARG  10  67.491   4.234  -7.339
   83    HA   ARG  10           HA       ARG  10  67.988   1.973  -5.632
   84    HB2  ARG  10           HB2      ARG  10  69.452   2.770  -8.081
   85    HB3  ARG  10           HB1      ARG  10  70.307   2.023  -6.733
   86    HG2  ARG  10           HG2      ARG  10  68.420   0.267  -6.799
   87    HG3  ARG  10           HG1      ARG  10  68.093   0.900  -8.413
   88    HD2  ARG  10           HD2      ARG  10  70.715   0.052  -7.454
   89    HD3  ARG  10           HD1      ARG  10  69.589  -1.110  -8.173
   90    HE   ARG  10           HE       ARG  10  69.669   0.606 -10.107
   91   HH11  ARG  10          HH11      ARG  10  72.452  -0.326  -8.122
   92   HH12  ARG  10          HH12      ARG  10  73.580  -0.217  -9.387
   93   HH21  ARG  10          HH21      ARG  10  71.195   0.654 -11.883
   94   HH22  ARG  10          HH22      ARG  10  72.839   0.341 -11.595
   95    H    LYS  11           HN       LYS  11  67.709   5.187  -5.693
   96    HA   LYS  11           HA       LYS  11  70.030   5.624  -4.010
   97    HB2  LYS  11           HB2      LYS  11  67.948   7.716  -4.655
   98    HB3  LYS  11           HB1      LYS  11  69.533   7.899  -4.031
   99    HG2  LYS  11           HG2      LYS  11  69.696   8.736  -6.236
  100    HG3  LYS  11           HG1      LYS  11  70.478   7.162  -6.253
  101    HD2  LYS  11           HD2      LYS  11  68.534   6.152  -7.230
  102    HD3  LYS  11           HD1      LYS  11  67.644   7.667  -7.123
  103    HE2  LYS  11           HE2      LYS  11  70.133   7.217  -8.780
  104    HE3  LYS  11           HE1      LYS  11  68.487   7.228  -9.404
  105    HZ1  LYS  11           HZ1      LYS  11  69.966   9.525  -8.225
  106    HZ2  LYS  11           HZ2      LYS  11  68.343   9.588  -8.643
  107    HZ3  LYS  11           HZ3      LYS  11  69.496   9.303  -9.820
  108    H    LEU  12           HN       LEU  12  69.742   5.743  -1.883
  109    HA   LEU  12           HA       LEU  12  67.465   4.792  -0.646
  110    HB2  LEU  12           HB2      LEU  12  69.499   4.577   0.469
  111    HB3  LEU  12           HB1      LEU  12  69.835   6.295   0.392
  112    HG   LEU  12           HG       LEU  12  68.035   6.721   1.978
  113   HD11  LEU  12          HD11      LEU  12  66.662   4.714   1.429
  114   HD12  LEU  12          HD12      LEU  12  67.011   4.933   3.164
  115   HD13  LEU  12          HD13      LEU  12  67.917   3.732   2.227
  116   HD21  LEU  12          HD21      LEU  12  69.148   5.964   3.899
  117   HD22  LEU  12          HD22      LEU  12  70.408   6.167   2.647
  118   HD23  LEU  12          HD23      LEU  12  69.754   4.575   3.025
  119    HA   PRO  13           HA       PRO  13  66.306   9.299   0.740
  120    HB2  PRO  13           HB2      PRO  13  67.088  11.386  -0.830
  121    HB3  PRO  13           HB1      PRO  13  68.113  10.675   0.449
  122    HG2  PRO  13           HG2      PRO  13  68.163  10.027  -2.466
  123    HG3  PRO  13           HG1      PRO  13  69.500  10.594  -1.444
  124    HD2  PRO  13           HD2      PRO  13  69.186   8.006  -1.891
  125    HD3  PRO  13           HD1      PRO  13  69.593   8.567  -0.265
  126    H    GLN  14           HN       GLN  14  66.557   8.802  -2.751
  127    HA   GLN  14           HA       GLN  14  64.099   9.920  -3.471
  128    HB2  GLN  14           HB2      GLN  14  65.925   9.313  -5.069
  129    HB3  GLN  14           HB1      GLN  14  65.501   7.622  -4.832
  130    HG2  GLN  14           HG2      GLN  14  63.216   8.120  -5.585
  131    HG3  GLN  14           HG1      GLN  14  63.760   9.772  -5.887
  132   HE21  GLN  14          HE21      GLN  14  66.328   8.980  -6.945
  133   HE22  GLN  14          HE22      GLN  14  66.026   8.304  -8.498
  134    H    LEU  15           HN       LEU  15  65.003   6.594  -2.466
  135    HA   LEU  15           HA       LEU  15  62.548   5.414  -2.939
  136    HB2  LEU  15           HB2      LEU  15  64.638   4.214  -2.514
  137    HB3  LEU  15           HB1      LEU  15  64.680   4.861  -0.943
  138    HG   LEU  15           HG       LEU  15  62.728   3.712  -0.258
  139   HD11  LEU  15          HD11      LEU  15  61.539   3.630  -2.436
  140   HD12  LEU  15          HD12      LEU  15  61.677   2.026  -1.730
  141   HD13  LEU  15          HD13      LEU  15  62.746   2.495  -3.051
  142   HD21  LEU  15          HD21      LEU  15  64.741   2.026  -1.654
  143   HD22  LEU  15          HD22      LEU  15  63.700   1.488  -0.312
  144   HD23  LEU  15          HD23      LEU  15  64.910   2.782  -0.083
  145    H    CYS  16           HN       CYS  16  63.910   6.979  -0.140
  146    HA   CYS  16           HA       CYS  16  61.815   6.532   1.648
  147    HB2  CYS  16           HB2      CYS  16  63.619   8.969   1.434
  148    HB3  CYS  16           HB1      CYS  16  62.676   8.546   2.852
  149    HG   CYS  16           HG       CYS  16  65.239   6.689   1.551
  150    H    THR  17           HN       THR  17  62.279   9.026  -0.773
  151    HA   THR  17           HA       THR  17  60.035  10.618  -0.370
  152    HB   THR  17           HB       THR  17  61.785   9.934  -2.642
  153    HG1  THR  17           HG1      THR  17  62.144  11.499  -0.835
  154   HG21  THR  17          HG21      THR  17  59.722  10.198  -3.798
  155   HG22  THR  17          HG22      THR  17  60.674  11.653  -4.100
  156   HG23  THR  17          HG23      THR  17  59.331  11.694  -2.940
  157    H    GLU  18           HN       GLU  18  60.453   7.670  -2.191
  158    HA   GLU  18           HA       GLU  18  57.941   7.493  -3.329
  159    HB2  GLU  18           HB2      GLU  18  60.084   5.657  -2.645
  160    HB3  GLU  18           HB1      GLU  18  58.618   5.060  -3.442
  161    HG2  GLU  18           HG2      GLU  18  60.468   7.248  -4.366
  162    HG3  GLU  18           HG1      GLU  18  60.403   5.655  -5.080
  163    H    LEU  19           HN       LEU  19  59.215   5.870  -0.441
  164    HA   LEU  19           HA       LEU  19  56.751   4.999   0.532
  165    HB2  LEU  19           HB2      LEU  19  59.422   5.498   1.696
  166    HB3  LEU  19           HB1      LEU  19  58.159   4.986   2.730
  167    HG   LEU  19           HG       LEU  19  57.917   3.042   0.985
  168   HD11  LEU  19          HD11      LEU  19  60.742   3.865   0.540
  169   HD12  LEU  19          HD12      LEU  19  59.436   3.858  -0.644
  170   HD13  LEU  19          HD13      LEU  19  60.021   2.339   0.037
  171   HD21  LEU  19          HD21      LEU  19  59.534   1.726   2.285
  172   HD22  LEU  19          HD22      LEU  19  58.470   2.741   3.286
  173   HD23  LEU  19          HD23      LEU  19  60.123   3.259   2.943
  174    H    GLN  20           HN       GLN  20  57.626   8.158   0.153
  175    HA   GLN  20           HA       GLN  20  56.765  10.119   0.903
  176    HB2  GLN  20           HB2      GLN  20  54.776   8.179   1.966
  177    HB3  GLN  20           HB1      GLN  20  54.503   9.929   2.089
  178    HG2  GLN  20           HG2      GLN  20  54.625  10.023  -0.395
  179    HG3  GLN  20           HG1      GLN  20  54.787   8.269  -0.420
  180   HE21  GLN  20          HE21      GLN  20  52.986   7.004  -0.012
  181   HE22  GLN  20          HE22      GLN  20  51.393   7.661   0.035
  182    H    THR  21           HN       THR  21  58.760   8.833   2.446
  183    HA   THR  21           HA       THR  21  58.270  10.061   5.019
  184    HB   THR  21           HB       THR  21  57.504   7.652   5.106
  185    HG1  THR  21           HG1      THR  21  58.572   7.261   7.070
  186   HG21  THR  21          HG21      THR  21  59.199   6.656   3.642
  187   HG22  THR  21          HG22      THR  21  59.214   5.884   5.228
  188   HG23  THR  21          HG23      THR  21  60.456   7.066   4.810
  189    H    THR  22           HN       THR  22  60.611   9.248   6.287
  190    HA   THR  22           HA       THR  22  62.678   9.978   4.333
  191    HB   THR  22           HB       THR  22  63.061  10.708   7.215
  192    HG1  THR  22           HG1      THR  22  61.048  11.591   6.864
  193   HG21  THR  22          HG21      THR  22  64.889  11.191   5.713
  194   HG22  THR  22          HG22      THR  22  64.110  12.733   6.053
  195   HG23  THR  22          HG23      THR  22  63.793  11.892   4.535
  196    H    ILE  23           HN       ILE  23  64.935   9.434   5.459
  197    HA   ILE  23           HA       ILE  23  65.419   6.789   5.521
  198    HB   ILE  23           HB       ILE  23  66.919   8.892   7.009
  199   HG12  ILE  23          HG12      ILE  23  66.809   8.120   4.151
  200   HG13  ILE  23          HG11      ILE  23  66.566   9.696   4.836
  201   HG21  ILE  23          HG21      ILE  23  68.893   7.437   6.428
  202   HG22  ILE  23          HG22      ILE  23  67.756   6.262   5.757
  203   HG23  ILE  23          HG23      ILE  23  67.726   6.630   7.485
  204   HD11  ILE  23          HD11      ILE  23  69.089   8.160   4.617
  205   HD12  ILE  23          HD12      ILE  23  68.981   9.734   5.430
  206   HD13  ILE  23          HD13      ILE  23  68.679   9.593   3.677
  207    H    HIS  24           HN       HIS  24  64.306   8.842   7.930
  208    HA   HIS  24           HA       HIS  24  65.364   7.696  10.298
  209    HB2  HIS  24           HB2      HIS  24  63.180   9.738   9.999
  210    HB3  HIS  24           HB1      HIS  24  64.329   9.616  11.302
  211    HD1  HIS  24           HD1      HIS  24  66.733   9.339   9.081
  212    HD2  HIS  24           HD2      HIS  24  63.943  12.299   9.520
  213    HE1  HIS  24           HE1      HIS  24  67.500  11.124   7.510
  214    H    ASP  25           HN       ASP  25  62.885   6.924   8.275
  215    HA   ASP  25           HA       ASP  25  61.234   5.743  10.410
  216    HB2  ASP  25           HB2      ASP  25  60.297   7.902   9.647
  217    HB3  ASP  25           HB1      ASP  25  60.284   7.274   8.032
  218    H    ILE  26           HN       ILE  26  62.226   5.784   7.041
  219    HA   ILE  26           HA       ILE  26  60.752   3.742   5.938
  220    HB   ILE  26           HB       ILE  26  62.090   5.183   4.555
  221   HG12  ILE  26          HG12      ILE  26  63.306   2.484   4.382
  222   HG13  ILE  26          HG11      ILE  26  61.683   2.634   3.859
  223   HG21  ILE  26          HG21      ILE  26  64.493   3.843   5.787
  224   HG22  ILE  26          HG22      ILE  26  63.964   5.492   6.092
  225   HG23  ILE  26          HG23      ILE  26  64.529   5.030   4.479
  226   HD11  ILE  26          HD11      ILE  26  64.134   3.966   2.714
  227   HD12  ILE  26          HD12      ILE  26  62.487   4.290   2.132
  228   HD13  ILE  26          HD13      ILE  26  63.181   2.660   2.027
  229    H    ILE  27           HN       ILE  27  60.643   1.636   6.019
  230    HA   ILE  27           HA       ILE  27  62.725   0.246   7.423
  231    HB   ILE  27           HB       ILE  27  59.979  -0.574   6.536
  232   HG12  ILE  27          HG12      ILE  27  59.967   0.896   8.465
  233   HG13  ILE  27          HG11      ILE  27  59.458  -0.729   8.895
  234   HG21  ILE  27          HG21      ILE  27  61.444  -2.464   6.344
  235   HG22  ILE  27          HG22      ILE  27  60.345  -2.696   7.711
  236   HG23  ILE  27          HG23      ILE  27  62.029  -2.221   7.991
  237   HD11  ILE  27          HD11      ILE  27  60.883   0.225  10.619
  238   HD12  ILE  27          HD12      ILE  27  62.162   0.500   9.443
  239   HD13  ILE  27          HD13      ILE  27  61.685  -1.148   9.860
  240    H    LEU  28           HN       LEU  28  64.291  -0.159   6.526
  241    HA   LEU  28           HA       LEU  28  64.202  -1.214   3.830
  242    HB2  LEU  28           HB2      LEU  28  65.506   0.950   4.885
  243    HB3  LEU  28           HB1      LEU  28  66.736  -0.301   4.794
  244    HG   LEU  28           HG       LEU  28  66.350  -0.611   2.463
  245   HD11  LEU  28          HD11      LEU  28  64.595   1.194   1.565
  246   HD12  LEU  28          HD12      LEU  28  63.931   0.852   3.217
  247   HD13  LEU  28          HD13      LEU  28  64.137  -0.438   2.057
  248   HD21  LEU  28          HD21      LEU  28  67.764   1.302   3.200
  249   HD22  LEU  28          HD22      LEU  28  66.333   2.326   3.091
  250   HD23  LEU  28          HD23      LEU  28  66.972   1.544   1.644
  251    H    GLU  29           HN       GLU  29  65.281  -3.334   3.717
  252    HA   GLU  29           HA       GLU  29  66.716  -3.834   6.270
  253    HB2  GLU  29           HB2      GLU  29  66.363  -6.163   5.899
  254    HB3  GLU  29           HB1      GLU  29  64.976  -5.262   6.674
  255    HG2  GLU  29           HG2      GLU  29  64.031  -5.327   4.460
  256    HG3  GLU  29           HG1      GLU  29  65.440  -6.337   4.028
  257    H    CYS  30           HN       CYS  30  68.339  -5.875   6.149
  258    HA   CYS  30           HA       CYS  30  69.870  -5.598   3.969
  259    HB2  CYS  30           HB2      CYS  30  69.424  -8.048   5.623
  260    HB3  CYS  30           HB1      CYS  30  70.737  -7.665   4.507
  261    H    VAL  31           HN       VAL  31  69.826  -6.413   2.246
  262    HA   VAL  31           HA       VAL  31  67.703  -7.981   1.101
  263    HB   VAL  31           HB       VAL  31  68.556  -6.464  -0.472
  264   HG11  VAL  31          HG11      VAL  31  70.295  -5.494   0.749
  265   HG12  VAL  31          HG12      VAL  31  70.918  -6.103  -0.805
  266   HG13  VAL  31          HG13      VAL  31  71.235  -7.006   0.675
  267   HG21  VAL  31          HG21      VAL  31  70.306  -8.821  -0.955
  268   HG22  VAL  31          HG22      VAL  31  70.114  -7.426  -2.022
  269   HG23  VAL  31          HG23      VAL  31  68.730  -8.450  -1.686
  270    H    TYR  32           HN       TYR  32  70.667  -8.445   2.509
  271    HA   TYR  32           HA       TYR  32  70.960 -11.138   1.510
  272    HB2  TYR  32           HB2      TYR  32  73.024  -9.533   2.980
  273    HB3  TYR  32           HB1      TYR  32  73.281 -11.033   2.081
  274    HD1  TYR  32           HD1      TYR  32  71.904 -10.729  -0.457
  275    HD2  TYR  32           HD2      TYR  32  73.950  -7.746   1.863
  276    HE1  TYR  32           HE1      TYR  32  72.242  -9.536  -2.382
  277    HE2  TYR  32           HE2      TYR  32  74.313  -6.411  -0.135
  278    HH   TYR  32           HH       TYR  32  74.409  -6.753  -2.555
  279    H    CYS  33           HN       CYS  33  70.871  -9.386   4.703
  280    HA   CYS  33           HA       CYS  33  71.181 -11.887   6.200
  281    HB2  CYS  33           HB2      CYS  33  70.765  -9.091   7.227
  282    HB3  CYS  33           HB1      CYS  33  71.205 -10.484   8.196
  283    H    LYS  34           HN       LYS  34  68.667  -9.832   4.990
  284    HA   LYS  34           HA       LYS  34  66.648  -9.436   5.396
  285    HB2  LYS  34           HB2      LYS  34  67.014 -12.270   5.802
  286    HB3  LYS  34           HB1      LYS  34  65.554 -11.654   6.570
  287    HG2  LYS  34           HG2      LYS  34  65.318 -12.470   4.236
  288    HG3  LYS  34           HG1      LYS  34  64.736 -10.813   4.560
  289    HD2  LYS  34           HD2      LYS  34  66.940 -10.040   3.578
  290    HD3  LYS  34           HD1      LYS  34  67.197 -11.715   3.091
  291    HE2  LYS  34           HE2      LYS  34  66.166 -10.198   1.358
  292    HE3  LYS  34           HE1      LYS  34  65.317 -11.710   1.684
  293    HZ1  LYS  34           HZ1      LYS  34  64.555  -9.162   3.050
  294    HZ2  LYS  34           HZ2      LYS  34  63.683 -10.583   2.936
  295    HZ3  LYS  34           HZ3      LYS  34  63.855  -9.632   1.584
  296    H    GLN  35           HN       GLN  35  68.429  -8.518   7.534
  297    HA   GLN  35           HA       GLN  35  66.498  -8.358   9.660
  298    HB2  GLN  35           HB2      GLN  35  68.214  -7.649  10.909
  299    HB3  GLN  35           HB1      GLN  35  68.634  -9.250  10.311
  300    HG2  GLN  35           HG2      GLN  35  70.205  -8.100   8.745
  301    HG3  GLN  35           HG1      GLN  35  69.764  -6.568   9.510
  302   HE21  GLN  35          HE21      GLN  35  69.376  -7.873  12.040
  303   HE22  GLN  35          HE22      GLN  35  70.901  -8.181  12.707
  304    H    GLN  36           HN       GLN  36  65.693  -6.243  10.059
  305    HA   GLN  36           HA       GLN  36  65.997  -4.313   8.146
  306    HB2  GLN  36           HB2      GLN  36  64.846  -4.553  10.865
  307    HB3  GLN  36           HB1      GLN  36  64.953  -2.998  10.075
  308    HG2  GLN  36           HG2      GLN  36  63.587  -3.684   8.300
  309    HG3  GLN  36           HG1      GLN  36  63.747  -5.371   8.753
  310   HE21  GLN  36          HE21      GLN  36  63.177  -2.898  11.164
  311   HE22  GLN  36          HE22      GLN  36  61.549  -3.323  11.492
  312    H    LEU  37           HN       LEU  37  67.303  -2.727   7.975
  313    HA   LEU  37           HA       LEU  37  69.757  -2.679   9.416
  314    HB2  LEU  37           HB2      LEU  37  68.586  -1.023   7.263
  315    HB3  LEU  37           HB1      LEU  37  69.694  -0.309   8.375
  316    HG   LEU  37           HG       LEU  37  71.312  -2.132   7.903
  317   HD11  LEU  37          HD11      LEU  37  71.045  -3.352   5.783
  318   HD12  LEU  37          HD12      LEU  37  69.354  -2.822   5.749
  319   HD13  LEU  37          HD13      LEU  37  69.939  -3.828   7.064
  320   HD21  LEU  37          HD21      LEU  37  71.607   0.052   6.963
  321   HD22  LEU  37          HD22      LEU  37  70.486  -0.316   5.659
  322   HD23  LEU  37          HD23      LEU  37  72.036  -1.160   5.752
  323    H    LEU  38           HN       LEU  38  70.633  -1.644  10.636
  324    HA   LEU  38           HA       LEU  38  69.320  -0.431  12.789
  325    HB2  LEU  38           HB2      LEU  38  71.873  -1.385  11.905
  326    HB3  LEU  38           HB1      LEU  38  72.049   0.112  12.728
  327    HG   LEU  38           HG       LEU  38  70.633  -2.304  13.892
  328   HD11  LEU  38          HD11      LEU  38  73.442  -1.309  14.340
  329   HD12  LEU  38          HD12      LEU  38  72.987  -2.802  13.516
  330   HD13  LEU  38          HD13      LEU  38  72.655  -2.606  15.237
  331   HD21  LEU  38          HD21      LEU  38  71.634   0.242  15.128
  332   HD22  LEU  38          HD22      LEU  38  70.897  -1.105  16.007
  333   HD23  LEU  38          HD23      LEU  38  69.944  -0.169  14.848
  334    H    ARG  39           HN       ARG  39  69.034   1.744  13.053
  335    HA   ARG  39           HA       ARG  39  68.679   3.374  10.876
  336    HB2  ARG  39           HB2      ARG  39  67.654   3.602  13.128
  337    HB3  ARG  39           HB1      ARG  39  69.158   4.293  13.691
  338    HG2  ARG  39           HG2      ARG  39  68.915   6.183  12.239
  339    HG3  ARG  39           HG1      ARG  39  67.476   5.482  11.504
  340    HD2  ARG  39           HD2      ARG  39  66.389   5.424  13.717
  341    HD3  ARG  39           HD1      ARG  39  67.789   6.237  14.401
  342    HE   ARG  39           HE       ARG  39  67.122   8.003  12.609
  343   HH11  ARG  39          HH11      ARG  39  64.883   6.064  14.575
  344   HH12  ARG  39          HH12      ARG  39  63.750   7.328  14.768
  345   HH21  ARG  39          HH21      ARG  39  65.510   9.737  12.889
  346   HH22  ARG  39          HH22      ARG  39  64.092   9.413  13.763
  347    H    ARG  40           HN       ARG  40  71.698   2.924  12.644
  348    HA   ARG  40           HA       ARG  40  72.835   5.393  11.868
  349    HB2  ARG  40           HB2      ARG  40  73.932   2.829  12.959
  350    HB3  ARG  40           HB1      ARG  40  74.904   4.256  12.642
  351    HG2  ARG  40           HG2      ARG  40  73.563   5.529  14.220
  352    HG3  ARG  40           HG1      ARG  40  72.565   4.104  14.516
  353    HD2  ARG  40           HD2      ARG  40  74.236   4.429  16.262
  354    HD3  ARG  40           HD1      ARG  40  74.467   2.914  15.375
  355    HE   ARG  40           HE       ARG  40  76.068   4.660  14.083
  356   HH11  ARG  40          HH11      ARG  40  75.853   3.747  17.503
  357   HH12  ARG  40          HH12      ARG  40  77.518   3.933  17.789
  358   HH21  ARG  40          HH21      ARG  40  78.336   4.917  14.493
  359   HH22  ARG  40          HH22      ARG  40  78.959   4.642  16.055
  360    H    GLU  41           HN       GLU  41  72.949   2.047  10.931
  361    HA   GLU  41           HA       GLU  41  74.756   2.109   8.784
  362    HB2  GLU  41           HB2      GLU  41  72.393   0.360   9.469
  363    HB3  GLU  41           HB1      GLU  41  73.520   0.009   8.179
  364    HG2  GLU  41           HG2      GLU  41  73.628  -1.051  10.571
  365    HG3  GLU  41           HG1      GLU  41  75.112  -0.778   9.617
  366    H    VAL  42           HN       VAL  42  71.288   2.487   9.028
  367    HA   VAL  42           HA       VAL  42  70.753   2.706   6.233
  368    HB   VAL  42           HB       VAL  42  69.053   4.265   8.199
  369   HG11  VAL  42          HG11      VAL  42  67.255   3.681   6.699
  370   HG12  VAL  42          HG12      VAL  42  68.311   2.564   5.855
  371   HG13  VAL  42          HG13      VAL  42  68.609   4.308   5.727
  372   HG21  VAL  42          HG21      VAL  42  67.752   2.295   8.719
  373   HG22  VAL  42          HG22      VAL  42  69.430   2.021   9.205
  374   HG23  VAL  42          HG23      VAL  42  68.803   1.317   7.710
  375    H    TYR  43           HN       TYR  43  71.517   5.186   8.703
  376    HA   TYR  43           HA       TYR  43  71.507   7.377   6.951
  377    HB2  TYR  43           HB2      TYR  43  73.111   6.899   9.440
  378    HB3  TYR  43           HB1      TYR  43  73.144   8.425   8.538
  379    HD1  TYR  43           HD1      TYR  43  70.137   8.217   7.845
  380    HD2  TYR  43           HD2      TYR  43  72.299   7.841  11.469
  381    HE1  TYR  43           HE1      TYR  43  68.217   8.864   8.985
  382    HE2  TYR  43           HE2      TYR  43  70.292   8.530  12.716
  383    HH   TYR  43           HH       TYR  43  68.233   9.874  12.211
  384    H    ASP  44           HN       ASP  44  74.118   5.099   7.702
  385    HA   ASP  44           HA       ASP  44  76.177   6.342   6.363
  386    HB2  ASP  44           HB2      ASP  44  75.519   3.410   6.565
  387    HB3  ASP  44           HB1      ASP  44  77.016   4.051   5.999
  388    H    PHE  45           HN       PHE  45  73.570   4.474   5.263
  389    HA   PHE  45           HA       PHE  45  74.449   3.845   2.744
  390    HB2  PHE  45           HB2      PHE  45  72.236   3.284   4.218
  391    HB3  PHE  45           HB1      PHE  45  71.654   4.435   3.043
  392    HD1  PHE  45           HD1      PHE  45  73.267   1.175   3.442
  393    HD2  PHE  45           HD2      PHE  45  71.461   3.999   0.828
  394    HE1  PHE  45           HE1      PHE  45  73.024  -0.540   1.702
  395    HE2  PHE  45           HE2      PHE  45  71.268   2.295  -0.891
  396    HZ   PHE  45           HZ       PHE  45  72.013   0.042  -0.466
  397    H    ALA  46           HN       ALA  46  72.451   6.633   3.795
  398    HA   ALA  46           HA       ALA  46  72.655   7.844   1.145
  399    HB1  ALA  46           HB1      ALA  46  71.200   9.613   1.944
  400    HB2  ALA  46           HB2      ALA  46  71.360   9.019   3.592
  401    HB3  ALA  46           HB3      ALA  46  70.509   8.061   2.381
  402    H    ARG  47           HN       ARG  47  74.291   8.042   4.146
  403    HA   ARG  47           HA       ARG  47  75.408  10.624   3.672
  404    HB2  ARG  47           HB2      ARG  47  75.626   8.495   5.699
  405    HB3  ARG  47           HB1      ARG  47  77.049   9.481   5.603
  406    HG2  ARG  47           HG2      ARG  47  75.560  10.240   7.354
  407    HG3  ARG  47           HG1      ARG  47  75.697  11.462   6.103
  408    HD2  ARG  47           HD2      ARG  47  73.400   9.514   6.208
  409    HD3  ARG  47           HD1      ARG  47  73.363  11.024   7.101
  410    HE   ARG  47           HE       ARG  47  73.957  11.383   4.321
  411   HH11  ARG  47          HH11      ARG  47  71.259  11.058   6.638
  412   HH12  ARG  47          HH12      ARG  47  70.138  11.761   5.579
  413   HH21  ARG  47          HH21      ARG  47  72.361  12.359   2.928
  414   HH22  ARG  47          HH22      ARG  47  70.754  12.501   3.449
  415    H    ARG  48           HN       ARG  48  76.075   7.467   2.707
  416    HA   ARG  48           HA       ARG  48  78.434   8.323   1.178
  417    HB2  ARG  48           HB2      ARG  48  77.542   5.669   2.223
  418    HB3  ARG  48           HB1      ARG  48  79.023   5.908   1.309
  419    HG2  ARG  48           HG2      ARG  48  80.019   7.098   3.081
  420    HG3  ARG  48           HG1      ARG  48  78.469   7.332   3.889
  421    HD2  ARG  48           HD2      ARG  48  78.338   4.936   4.280
  422    HD3  ARG  48           HD1      ARG  48  79.910   4.740   3.506
  423    HE   ARG  48           HE       ARG  48  80.203   6.643   5.481
  424   HH11  ARG  48          HH11      ARG  48  79.573   3.163   5.359
  425   HH12  ARG  48          HH12      ARG  48  79.987   2.881   6.983
  426   HH21  ARG  48          HH21      ARG  48  80.828   6.264   7.676
  427   HH22  ARG  48          HH22      ARG  48  80.738   4.701   8.329
  428    H    ASP  49           HN       ASP  49  77.976   5.640  -0.289
  429    HA   ASP  49           HA       ASP  49  75.302   5.761  -1.235
  430    HB2  ASP  49           HB2      ASP  49  76.495   7.594  -2.596
  431    HB3  ASP  49           HB1      ASP  49  77.379   6.280  -3.367
  432    H    LEU  50           HN       LEU  50  75.501   3.808  -0.323
  433    HA   LEU  50           HA       LEU  50  77.186   1.778  -1.358
  434    HB2  LEU  50           HB2      LEU  50  74.904   1.774   0.591
  435    HB3  LEU  50           HB1      LEU  50  75.857   0.366   0.204
  436    HG   LEU  50           HG       LEU  50  77.835   1.448   1.175
  437   HD11  LEU  50          HD11      LEU  50  77.579   3.433   2.608
  438   HD12  LEU  50          HD12      LEU  50  76.012   3.727   1.817
  439   HD13  LEU  50          HD13      LEU  50  77.484   3.727   0.881
  440   HD21  LEU  50          HD21      LEU  50  76.499   0.018   2.565
  441   HD22  LEU  50          HD22      LEU  50  75.452   1.388   2.966
  442   HD23  LEU  50          HD23      LEU  50  77.136   1.383   3.497
  443    H    CYS  51           HN       CYS  51  74.563   3.106  -2.497
  444    HA   CYS  51           HA       CYS  51  72.840   2.669  -3.891
  445    HB2  CYS  51           HB2      CYS  51  73.330   1.383  -5.857
  446    HB3  CYS  51           HB1      CYS  51  74.857   2.019  -5.232
  447    HG   CYS  51           HG       CYS  51  75.254  -0.493  -3.848
  448    H    ILE  52           HN       ILE  52  70.870   1.759  -3.961
  449    HA   ILE  52           HA       ILE  52  70.489  -0.266  -1.954
  450    HB   ILE  52           HB       ILE  52  68.534   1.418  -3.500
  451   HG12  ILE  52          HG12      ILE  52  69.432   0.970  -0.734
  452   HG13  ILE  52          HG11      ILE  52  69.493   2.480  -1.679
  453   HG21  ILE  52          HG21      ILE  52  67.514  -0.844  -3.413
  454   HG22  ILE  52          HG22      ILE  52  66.671   0.286  -2.356
  455   HG23  ILE  52          HG23      ILE  52  67.791  -0.892  -1.671
  456   HD11  ILE  52          HD11      ILE  52  67.031   2.518  -1.466
  457   HD12  ILE  52          HD12      ILE  52  67.964   2.594   0.071
  458   HD13  ILE  52          HD13      ILE  52  67.249   1.058  -0.461
  459    H    VAL  53           HN       VAL  53  69.859  -2.101  -2.081
  460    HA   VAL  53           HA       VAL  53  70.083  -3.434  -4.629
  461    HB   VAL  53           HB       VAL  53  70.936  -5.327  -2.979
  462   HG11  VAL  53          HG11      VAL  53  72.600  -2.902  -3.735
  463   HG12  VAL  53          HG12      VAL  53  72.262  -4.271  -4.797
  464   HG13  VAL  53          HG13      VAL  53  73.232  -4.501  -3.343
  465   HG21  VAL  53          HG21      VAL  53  72.174  -4.359  -1.095
  466   HG22  VAL  53          HG22      VAL  53  70.455  -3.989  -0.948
  467   HG23  VAL  53          HG23      VAL  53  71.578  -2.763  -1.513
  468    H    TYR  54           HN       TYR  54  68.347  -4.349  -5.138
  469    HA   TYR  54           HA       TYR  54  66.275  -5.005  -3.221
  470    HB2  TYR  54           HB2      TYR  54  66.342  -4.992  -6.243
  471    HB3  TYR  54           HB1      TYR  54  64.932  -5.355  -5.242
  472    HD1  TYR  54           HD1      TYR  54  67.389  -2.682  -6.017
  473    HD2  TYR  54           HD2      TYR  54  63.555  -3.603  -4.382
  474    HE1  TYR  54           HE1      TYR  54  66.837  -0.273  -5.788
  475    HE2  TYR  54           HE2      TYR  54  63.083  -1.280  -4.239
  476    HH   TYR  54           HH       TYR  54  64.972   1.082  -5.624
  477    H    ARG  55           HN       ARG  55  65.996  -6.785  -2.567
  478    HA   ARG  55           HA       ARG  55  67.445  -9.014  -3.826
  479    HB2  ARG  55           HB2      ARG  55  66.968  -8.622  -1.075
  480    HB3  ARG  55           HB1      ARG  55  65.728  -9.748  -1.525
  481    HG2  ARG  55           HG2      ARG  55  68.711 -10.402  -1.990
  482    HG3  ARG  55           HG1      ARG  55  67.854 -10.732  -0.562
  483    HD2  ARG  55           HD2      ARG  55  66.235 -12.156  -1.698
  484    HD3  ARG  55           HD1      ARG  55  66.901 -11.719  -3.272
  485    HE   ARG  55           HE       ARG  55  69.034 -12.751  -2.114
  486   HH11  ARG  55          HH11      ARG  55  65.731 -14.077  -2.102
  487   HH12  ARG  55          HH12      ARG  55  66.264 -15.691  -2.020
  488   HH21  ARG  55          HH21      ARG  55  69.692 -14.904  -2.039
  489   HH22  ARG  55          HH22      ARG  55  68.571 -16.195  -1.978
  490    H    ASP  56           HN       ASP  56  66.153 -10.121  -5.342
  491    HA   ASP  56           HA       ASP  56  64.384 -10.823  -6.551
  492    HB2  ASP  56           HB2      ASP  56  63.241 -11.799  -4.650
  493    HB3  ASP  56           HB1      ASP  56  62.791 -10.198  -4.053
  494    H    GLY  57           HN       GLY  57  62.998  -8.204  -4.694
  495    HA2  GLY  57           HA2      GLY  57  63.515  -6.193  -6.459
  496    HA3  GLY  57           HA1      GLY  57  61.919  -6.809  -6.919
  497    H    ASN  58           HN       ASN  58  63.329  -6.688  -3.723
  498    HA   ASN  58           HA       ASN  58  61.277  -4.728  -2.878
  499    HB2  ASN  58           HB2      ASN  58  62.624  -6.767  -1.114
  500    HB3  ASN  58           HB1      ASN  58  61.170  -5.881  -0.754
  501   HD21  ASN  58          HD21      ASN  58  62.585  -8.554  -2.401
  502   HD22  ASN  58          HD22      ASN  58  61.169  -9.473  -2.629
  503    HA   PRO  59           HA       PRO  59  64.971  -2.711  -2.053
  504    HB2  PRO  59           HB2      PRO  59  63.785  -0.645  -0.450
  505    HB3  PRO  59           HB1      PRO  59  64.198  -0.583  -2.163
  506    HG2  PRO  59           HG2      PRO  59  61.557  -0.574  -1.273
  507    HG3  PRO  59           HG1      PRO  59  62.029  -1.140  -2.821
  508    HD2  PRO  59           HD2      PRO  59  61.528  -2.751  -0.362
  509    HD3  PRO  59           HD1      PRO  59  61.047  -3.064  -2.042
  510    H    TYR  60           HN       TYR  60  66.659  -2.919  -0.983
  511    HA   TYR  60           HA       TYR  60  66.390  -2.993   1.805
  512    HB2  TYR  60           HB2      TYR  60  68.051  -5.219   0.634
  513    HB3  TYR  60           HB1      TYR  60  67.467  -4.891   2.103
  514    HD1  TYR  60           HD1      TYR  60  65.124  -5.054   2.746
  515    HD2  TYR  60           HD2      TYR  60  66.573  -6.471  -0.907
  516    HE1  TYR  60           HE1      TYR  60  63.184  -6.554   2.575
  517    HE2  TYR  60           HE2      TYR  60  64.638  -7.990  -1.102
  518    HH   TYR  60           HH       TYR  60  61.935  -7.801   0.963
  519    H    ALA  61           HN       ALA  61  68.240  -2.835   2.718
  520    HA   ALA  61           HA       ALA  61  70.017  -1.016   1.385
  521    HB1  ALA  61           HB1      ALA  61  70.307  -0.161   3.568
  522    HB2  ALA  61           HB2      ALA  61  69.554  -1.639   4.195
  523    HB3  ALA  61           HB3      ALA  61  68.542  -0.485   3.349
  524    H    VAL  62           HN       VAL  62  72.116  -1.285   3.085
  525    HA   VAL  62           HA       VAL  62  72.870  -4.094   3.138
  526    HB   VAL  62           HB       VAL  62  74.368  -1.760   1.829
  527   HG11  VAL  62          HG11      VAL  62  75.894  -2.769   3.180
  528   HG12  VAL  62          HG12      VAL  62  76.257  -3.040   1.475
  529   HG13  VAL  62          HG13      VAL  62  75.605  -4.359   2.467
  530   HG21  VAL  62          HG21      VAL  62  74.533  -3.274  -0.089
  531   HG22  VAL  62          HG22      VAL  62  72.919  -2.734   0.304
  532   HG23  VAL  62          HG23      VAL  62  73.429  -4.376   0.758
  533    H    CYS  63           HN       CYS  63  73.034  -4.392   5.262
  534    HA   CYS  63           HA       CYS  63  73.743  -2.388   7.139
  535    HB2  CYS  63           HB2      CYS  63  73.561  -4.074   8.764
  536    HB3  CYS  63           HB1      CYS  63  72.514  -4.546   7.407
  537    H    ASP  64           HN       ASP  64  75.467  -3.314   8.819
  538    HA   ASP  64           HA       ASP  64  78.073  -2.676   7.883
  539    HB2  ASP  64           HB2      ASP  64  77.313  -2.364  10.203
  540    HB3  ASP  64           HB1      ASP  64  77.236  -4.094  10.402
  541    H    LYS  65           HN       LYS  65  76.466  -5.692   8.592
  542    HA   LYS  65           HA       LYS  65  78.731  -7.376   8.182
  543    HB2  LYS  65           HB2      LYS  65  75.786  -8.028   8.030
  544    HB3  LYS  65           HB1      LYS  65  77.091  -9.194   8.153
  545    HG2  LYS  65           HG2      LYS  65  77.648  -8.404  10.361
  546    HG3  LYS  65           HG1      LYS  65  76.443  -7.122  10.236
  547    HD2  LYS  65           HD2      LYS  65  75.487  -8.884  11.541
  548    HD3  LYS  65           HD1      LYS  65  74.719  -8.869   9.949
  549    HE2  LYS  65           HE2      LYS  65  76.129 -10.728   9.225
  550    HE3  LYS  65           HE1      LYS  65  76.951 -10.720  10.785
  551    HZ1  LYS  65           HZ1      LYS  65  74.793 -11.317  11.809
  552    HZ2  LYS  65           HZ2      LYS  65  75.366 -12.453  10.711
  553    HZ3  LYS  65           HZ3      LYS  65  74.117 -11.433  10.263
  554    H    CYS  66           HN       CYS  66  75.963  -6.367   6.217
  555    HA   CYS  66           HA       CYS  66  76.620  -7.879   3.927
  556    HB2  CYS  66           HB2      CYS  66  74.956  -5.349   4.238
  557    HB3  CYS  66           HB1      CYS  66  75.187  -6.193   2.717
  558    H    LEU  67           HN       LEU  67  77.480  -4.667   5.000
  559    HA   LEU  67           HA       LEU  67  78.760  -3.578   2.871
  560    HB2  LEU  67           HB2      LEU  67  78.914  -3.253   5.742
  561    HB3  LEU  67           HB1      LEU  67  80.291  -2.643   4.835
  562    HG   LEU  67           HG       LEU  67  77.495  -1.937   4.004
  563   HD11  LEU  67          HD11      LEU  67  77.769  -1.372   6.309
  564   HD12  LEU  67          HD12      LEU  67  77.710   0.061   5.260
  565   HD13  LEU  67          HD13      LEU  67  79.272  -0.512   5.921
  566   HD21  LEU  67          HD21      LEU  67  78.647  -0.042   3.036
  567   HD22  LEU  67          HD22      LEU  67  79.333  -1.558   2.452
  568   HD23  LEU  67          HD23      LEU  67  80.171  -0.625   3.689
  569    H    LYS  68           HN       LYS  68  80.143  -5.812   5.230
  570    HA   LYS  68           HA       LYS  68  82.717  -5.588   3.978
  571    HB2  LYS  68           HB2      LYS  68  83.548  -7.152   5.614
  572    HB3  LYS  68           HB1      LYS  68  82.556  -5.949   6.417
  573    HG2  LYS  68           HG2      LYS  68  80.698  -7.617   6.425
  574    HG3  LYS  68           HG1      LYS  68  81.844  -8.804   5.801
  575    HD2  LYS  68           HD2      LYS  68  83.298  -8.329   7.770
  576    HD3  LYS  68           HD1      LYS  68  82.013  -7.305   8.405
  577    HE2  LYS  68           HE2      LYS  68  81.818  -9.448   9.443
  578    HE3  LYS  68           HE1      LYS  68  80.494  -9.262   8.298
  579    HZ1  LYS  68           HZ1      LYS  68  81.704 -10.689   6.717
  580    HZ2  LYS  68           HZ2      LYS  68  81.563 -11.465   8.215
  581    HZ3  LYS  68           HZ3      LYS  68  83.000 -10.759   7.789
  582    H    PHE  69           HN       PHE  69  79.928  -7.740   3.710
  583    HA   PHE  69           HA       PHE  69  81.149  -9.877   2.457
  584    HB2  PHE  69           HB2      PHE  69  78.520  -8.605   2.305
  585    HB3  PHE  69           HB1      PHE  69  78.840 -10.107   1.509
  586    HD1  PHE  69           HD2      PHE  69  80.543 -10.559   4.422
  587    HD2  PHE  69           HD1      PHE  69  76.581  -9.960   3.036
  588    HE1  PHE  69           HE2      PHE  69  79.676 -11.665   6.428
  589    HE2  PHE  69           HE1      PHE  69  75.688 -11.043   4.985
  590    HZ   PHE  69           HZ       PHE  69  77.219 -11.913   6.732
  591    H    TYR  70           HN       TYR  70  79.384  -7.010   1.320
  592    HA   TYR  70           HA       TYR  70  80.372  -7.516  -1.337
  593    HB2  TYR  70           HB2      TYR  70  77.807  -6.185  -0.470
  594    HB3  TYR  70           HB1      TYR  70  78.325  -6.455  -2.133
  595    HD1  TYR  70           HD1      TYR  70  78.569  -8.779  -2.966
  596    HD2  TYR  70           HD2      TYR  70  76.803  -7.919   0.790
  597    HE1  TYR  70           HE1      TYR  70  77.663 -11.025  -2.894
  598    HE2  TYR  70           HE2      TYR  70  75.862 -10.175   0.897
  599    HH   TYR  70           HH       TYR  70  76.886 -12.623  -1.203
  600    H    SER  71           HN       SER  71  82.264  -6.137  -0.573
  601    HA   SER  71           HA       SER  71  81.737  -3.415   0.129
  602    HB2  SER  71           HB2      SER  71  84.373  -4.704  -0.579
  603    HB3  SER  71           HB1      SER  71  84.143  -3.175   0.274
  604    HG   SER  71           HG       SER  71  82.783  -4.621   1.736
  605    H    LYS  72           HN       LYS  72  82.456  -5.111  -2.821
  606    HA   LYS  72           HA       LYS  72  83.252  -2.850  -4.378
  607    HB2  LYS  72           HB2      LYS  72  83.733  -5.248  -4.973
  608    HB3  LYS  72           HB1      LYS  72  82.029  -5.462  -5.264
  609    HG2  LYS  72           HG2      LYS  72  83.137  -5.201  -7.375
  610    HG3  LYS  72           HG1      LYS  72  82.092  -3.815  -7.046
  611    HD2  LYS  72           HD2      LYS  72  83.999  -2.466  -6.420
  612    HD3  LYS  72           HD1      LYS  72  85.073  -3.855  -6.554
  613    HE2  LYS  72           HE2      LYS  72  85.321  -2.452  -8.511
  614    HE3  LYS  72           HE1      LYS  72  84.571  -3.975  -8.968
  615    HZ1  LYS  72           HZ1      LYS  72  83.534  -2.075 -10.035
  616    HZ2  LYS  72           HZ2      LYS  72  83.152  -1.386  -8.579
  617    HZ3  LYS  72           HZ3      LYS  72  82.402  -2.827  -9.061
  618    H    ILE  73           HN       ILE  73  80.317  -4.465  -3.619
  619    HA   ILE  73           HA       ILE  73  78.755  -2.964  -5.471
  620    HB   ILE  73           HB       ILE  73  77.696  -4.627  -3.164
  621   HG12  ILE  73          HG12      ILE  73  78.140  -5.362  -6.082
  622   HG13  ILE  73          HG11      ILE  73  79.065  -5.959  -4.716
  623   HG21  ILE  73          HG21      ILE  73  75.589  -4.665  -4.481
  624   HG22  ILE  73          HG22      ILE  73  76.319  -3.546  -5.640
  625   HG23  ILE  73          HG23      ILE  73  76.040  -3.033  -3.986
  626   HD11  ILE  73          HD11      ILE  73  77.075  -7.093  -3.864
  627   HD12  ILE  73          HD12      ILE  73  77.470  -7.610  -5.500
  628   HD13  ILE  73          HD13      ILE  73  76.144  -6.480  -5.231
  629    H    SER  74           HN       SER  74  79.466  -2.642  -2.045
  630    HA   SER  74           HA       SER  74  77.434  -0.685  -1.615
  631    HB2  SER  74           HB2      SER  74  78.578  -0.512   0.649
  632    HB3  SER  74           HB1      SER  74  77.874  -2.070   0.218
  633    HG   SER  74           HG       SER  74  79.773  -2.924   0.020
  634    H    GLU  75           HN       GLU  75  79.705  -0.181  -3.523
  635    HA   GLU  75           HA       GLU  75  80.163   2.566  -2.641
  636    HB2  GLU  75           HB2      GLU  75  82.417   2.491  -3.641
  637    HB3  GLU  75           HB1      GLU  75  82.265   1.400  -2.272
  638    HG2  GLU  75           HG2      GLU  75  82.123  -0.495  -3.709
  639    HG3  GLU  75           HG1      GLU  75  81.996   0.529  -5.136
  640    H    TYR  76           HN       TYR  76  78.373   0.946  -4.573
  641    HA   TYR  76           HA       TYR  76  79.349   1.679  -7.099
  642    HB2  TYR  76           HB2      TYR  76  77.174   0.097  -6.159
  643    HB3  TYR  76           HB1      TYR  76  76.761   0.924  -7.655
  644    HD1  TYR  76           HD2      TYR  76  79.253   1.024  -9.015
  645    HD2  TYR  76           HD1      TYR  76  77.615  -2.069  -6.674
  646    HE1  TYR  76           HE2      TYR  76  80.671  -0.601 -10.223
  647    HE2  TYR  76           HE1      TYR  76  79.024  -3.737  -7.839
  648    HH   TYR  76           HH       TYR  76  80.190  -3.893 -10.086
  649    H    ARG  77           HN       ARG  77  79.231   3.404  -8.155
  650    HA   ARG  77           HA       ARG  77  76.821   4.874  -7.979
  651    HB2  ARG  77           HB2      ARG  77  79.551   6.209  -7.905
  652    HB3  ARG  77           HB1      ARG  77  78.071   7.071  -8.279
  653    HG2  ARG  77           HG2      ARG  77  78.223   7.565  -6.074
  654    HG3  ARG  77           HG1      ARG  77  77.335   6.047  -5.945
  655    HD2  ARG  77           HD2      ARG  77  79.068   5.874  -4.376
  656    HD3  ARG  77           HD1      ARG  77  79.614   4.933  -5.761
  657    HE   ARG  77           HE       ARG  77  80.453   7.644  -5.883
  658   HH11  ARG  77          HH11      ARG  77  81.333   4.455  -4.721
  659   HH12  ARG  77          HH12      ARG  77  82.920   4.882  -4.251
  660   HH21  ARG  77          HH21      ARG  77  82.631   8.259  -5.262
  661   HH22  ARG  77          HH22      ARG  77  83.673   7.111  -4.572
  662    H    HIS  78           HN       HIS  78  76.262   3.831  -9.635
  663    HA   HIS  78           HA       HIS  78  77.547   4.634 -12.058
  664    HB2  HIS  78           HB2      HIS  78  76.892   2.368 -13.099
  665    HB3  HIS  78           HB1      HIS  78  78.214   2.373 -11.910
  666    HD1  HIS  78           HD1      HIS  78  76.729  -0.264 -12.720
  667    HD2  HIS  78           HD2      HIS  78  75.679   2.191  -9.583
  668    HE1  HIS  78           HE1      HIS  78  75.530  -1.743 -11.111
  669    H    TYR  79           HN       TYR  79  74.582   2.869 -11.221
  670    HA   TYR  79           HA       TYR  79  72.493   3.341 -11.186
  671    HB2  TYR  79           HB2      TYR  79  73.448   6.136 -11.247
  672    HB3  TYR  79           HB1      TYR  79  71.724   5.764 -11.194
  673    HD1  TYR  79           HD2      TYR  79  74.923   4.940  -9.415
  674    HD2  TYR  79           HD1      TYR  79  70.705   5.336  -9.192
  675    HE1  TYR  79           HE2      TYR  79  75.005   4.506  -6.981
  676    HE2  TYR  79           HE1      TYR  79  70.778   4.890  -6.792
  677    HH   TYR  79           HH       TYR  79  73.674   4.836  -4.998
  678    H    SER  80           HN       SER  80  71.363   2.597 -12.419
  679    HA   SER  80           HA       SER  80  70.094   3.668 -14.614
  680    HB2  SER  80           HB2      SER  80  72.096   1.450 -15.275
  681    HB3  SER  80           HB1      SER  80  70.871   2.085 -16.366
  682    HG   SER  80           HG       SER  80  72.406   4.056 -15.372
  Start of MODEL    6
    1    H1   GLY  -1           HT1      GLY  -1  60.508  -4.678   3.576
    2    H2   GLY  -1           HT2      GLY  -1  59.711  -6.152   3.823
    3    H3   GLY  -1           HT3      GLY  -1  60.955  -5.642   4.861
    4    HA2  GLY  -1           HA1      GLY  -1  58.782  -5.322   5.864
    5    HA3  GLY  -1           HA2      GLY  -1  59.709  -3.835   5.676
    6    H    ALA   0           HN       ALA   0  59.295  -2.694   3.544
    7    HA   ALA   0           HA       ALA   0  56.445  -2.403   3.316
    8    HB1  ALA   0           HB1      ALA   0  58.697  -0.910   1.969
    9    HB2  ALA   0           HB2      ALA   0  57.889  -0.426   3.459
   10    HB3  ALA   0           HB3      ALA   0  56.993  -0.457   1.939
   11    H    MET   1           HN       MET   1  55.342  -3.614   1.955
   12    HA   MET   1           HA       MET   1  56.465  -5.065  -0.231
   13    HB2  MET   1           HB2      MET   1  54.266  -5.539   1.041
   14    HB3  MET   1           HB1      MET   1  53.562  -4.243   0.095
   15    HG2  MET   1           HG2      MET   1  54.705  -6.826  -0.981
   16    HG3  MET   1           HG1      MET   1  53.003  -6.450  -0.793
   17    HE1  MET   1           HE1      MET   1  53.079  -3.313  -1.962
   18    HE2  MET   1           HE2      MET   1  51.784  -4.486  -2.250
   19    HE3  MET   1           HE3      MET   1  52.561  -3.663  -3.608
   20    H    PHE   2           HN       PHE   2  57.030  -4.178  -2.127
   21    HA   PHE   2           HA       PHE   2  55.989  -1.530  -2.564
   22    HB2  PHE   2           HB2      PHE   2  58.675  -2.457  -2.572
   23    HB3  PHE   2           HB1      PHE   2  58.286  -1.795  -4.160
   24    HD1  PHE   2           HD2      PHE   2  56.638  -0.576  -1.080
   25    HD2  PHE   2           HD1      PHE   2  59.727   0.069  -3.914
   26    HE1  PHE   2           HE2      PHE   2  56.843   1.733  -0.328
   27    HE2  PHE   2           HE1      PHE   2  59.942   2.343  -3.197
   28    HZ   PHE   2           HZ       PHE   2  58.487   3.221  -1.382
   29    H    GLN   3           HN       GLN   3  55.215  -0.764  -4.232
   30    HA   GLN   3           HA       GLN   3  53.673  -2.559  -5.770
   31    HB2  GLN   3           HB2      GLN   3  52.594  -0.550  -6.641
   32    HB3  GLN   3           HB1      GLN   3  52.713  -0.538  -4.892
   33    HG2  GLN   3           HG2      GLN   3  53.222   1.644  -5.464
   34    HG3  GLN   3           HG1      GLN   3  54.822   0.921  -5.296
   35   HE21  GLN   3          HE21      GLN   3  55.972   0.415  -7.139
   36   HE22  GLN   3          HE22      GLN   3  55.507   1.010  -8.681
   37    H    ASP   4           HN       ASP   4  53.139  -2.220  -7.947
   38    HA   ASP   4           HA       ASP   4  55.431  -3.062  -9.518
   39    HB2  ASP   4           HB2      ASP   4  53.404  -4.450  -9.489
   40    HB3  ASP   4           HB1      ASP   4  52.423  -3.081  -9.961
   41    HA   PRO   5           HA       PRO   5  55.695  -3.343 -11.673
   42    HB2  PRO   5           HB2      PRO   5  57.497  -2.215 -13.575
   43    HB3  PRO   5           HB1      PRO   5  55.951  -3.009 -13.880
   44    HG2  PRO   5           HG2      PRO   5  56.446  -0.312 -14.313
   45    HG3  PRO   5           HG1      PRO   5  54.844  -1.037 -14.107
   46    HD2  PRO   5           HD2      PRO   5  56.562   0.368 -12.095
   47    HD3  PRO   5           HD1      PRO   5  54.810   0.496 -12.352
   48    H    GLN   6           HN       GLN   6  58.290  -1.064 -12.216
   49    HA   GLN   6           HA       GLN   6  59.916  -2.297 -10.096
   50    HB2  GLN   6           HB2      GLN   6  60.745  -1.622 -12.938
   51    HB3  GLN   6           HB1      GLN   6  61.825  -2.186 -11.675
   52    HG2  GLN   6           HG2      GLN   6  60.707  -4.322 -11.627
   53    HG3  GLN   6           HG1      GLN   6  59.526  -3.755 -12.806
   54   HE21  GLN   6          HE21      GLN   6  62.840  -4.719 -12.306
   55   HE22  GLN   6          HE22      GLN   6  63.203  -4.942 -13.972
   56    H    GLU   7           HN       GLU   7  58.390  -0.064  -9.915
   57    HA   GLU   7           HA       GLU   7  59.666   2.347 -10.783
   58    HB2  GLU   7           HB2      GLU   7  57.247   1.726 -10.523
   59    HB3  GLU   7           HB1      GLU   7  57.445   2.027  -8.814
   60    HG2  GLU   7           HG2      GLU   7  58.150   4.313  -9.288
   61    HG3  GLU   7           HG1      GLU   7  57.867   4.046 -11.011
   62    H    ARG   8           HN       ARG   8  60.787   0.431  -8.676
   63    HA   ARG   8           HA       ARG   8  61.131   2.225  -6.409
   64    HB2  ARG   8           HB2      ARG   8  62.528  -0.432  -6.824
   65    HB3  ARG   8           HB1      ARG   8  62.353   0.445  -5.330
   66    HG2  ARG   8           HG2      ARG   8  60.824  -1.194  -4.961
   67    HG3  ARG   8           HG1      ARG   8  59.805  -0.006  -5.793
   68    HD2  ARG   8           HD2      ARG   8  60.145  -1.102  -7.934
   69    HD3  ARG   8           HD1      ARG   8  61.177  -2.305  -7.169
   70    HE   ARG   8           HE       ARG   8  58.454  -2.067  -6.192
   71   HH11  ARG   8          HH11      ARG   8  60.747  -3.869  -8.241
   72   HH12  ARG   8          HH12      ARG   8  59.750  -5.248  -8.313
   73   HH21  ARG   8          HH21      ARG   8  57.131  -4.033  -6.310
   74   HH22  ARG   8          HH22      ARG   8  57.711  -5.343  -7.228
   75    HA   PRO   9           HA       PRO   9  64.894   3.873  -8.292
   76    HB2  PRO   9           HB2      PRO   9  66.055   4.904  -6.104
   77    HB3  PRO   9           HB1      PRO   9  64.697   5.729  -6.787
   78    HG2  PRO   9           HG2      PRO   9  64.908   3.944  -4.459
   79    HG3  PRO   9           HG1      PRO   9  63.847   5.353  -4.690
   80    HD2  PRO   9           HD2      PRO   9  63.119   2.766  -4.763
   81    HD3  PRO   9           HD1      PRO   9  62.182   4.001  -5.600
   82    H    ARG  10           HN       ARG  10  67.431   4.076  -7.367
   83    HA   ARG  10           HA       ARG  10  68.067   1.591  -5.993
   84    HB2  ARG  10           HB2      ARG  10  69.582   3.061  -8.125
   85    HB3  ARG  10           HB1      ARG  10  70.251   1.784  -7.132
   86    HG2  ARG  10           HG2      ARG  10  68.048   1.559  -9.194
   87    HG3  ARG  10           HG1      ARG  10  69.680   0.869  -9.195
   88    HD2  ARG  10           HD2      ARG  10  69.102  -0.538  -7.286
   89    HD3  ARG  10           HD1      ARG  10  67.485   0.159  -7.299
   90    HE   ARG  10           HE       ARG  10  68.605  -1.643  -9.302
   91   HH11  ARG  10          HH11      ARG  10  65.785   0.081  -8.014
   92   HH12  ARG  10          HH12      ARG  10  64.639  -0.895  -8.805
   93   HH21  ARG  10          HH21      ARG  10  67.011  -3.010 -10.408
   94   HH22  ARG  10          HH22      ARG  10  65.362  -2.681 -10.232
   95    H    LYS  11           HN       LYS  11  67.623   4.749  -5.541
   96    HA   LYS  11           HA       LYS  11  70.030   5.049  -3.929
   97    HB2  LYS  11           HB2      LYS  11  68.109   7.218  -4.744
   98    HB3  LYS  11           HB1      LYS  11  69.657   7.346  -4.006
   99    HG2  LYS  11           HG2      LYS  11  69.486   6.072  -6.670
  100    HG3  LYS  11           HG1      LYS  11  69.540   7.824  -6.554
  101    HD2  LYS  11           HD2      LYS  11  71.626   7.576  -5.205
  102    HD3  LYS  11           HD1      LYS  11  71.541   5.835  -5.472
  103    HE2  LYS  11           HE2      LYS  11  71.756   6.155  -7.861
  104    HE3  LYS  11           HE1      LYS  11  71.719   7.903  -7.657
  105    HZ1  LYS  11           HZ1      LYS  11  73.811   6.108  -6.565
  106    HZ2  LYS  11           HZ2      LYS  11  73.803   7.786  -6.457
  107    HZ3  LYS  11           HZ3      LYS  11  73.973   7.035  -7.952
  108    H    LEU  12           HN       LEU  12  69.761   5.332  -1.852
  109    HA   LEU  12           HA       LEU  12  67.495   4.501  -0.508
  110    HB2  LEU  12           HB2      LEU  12  69.531   4.233   0.531
  111    HB3  LEU  12           HB1      LEU  12  69.970   5.923   0.362
  112    HG   LEU  12           HG       LEU  12  68.223   6.502   1.984
  113   HD11  LEU  12          HD11      LEU  12  67.205   4.805   3.308
  114   HD12  LEU  12          HD12      LEU  12  68.032   3.537   2.372
  115   HD13  LEU  12          HD13      LEU  12  66.780   4.531   1.600
  116   HD21  LEU  12          HD21      LEU  12  70.563   6.055   2.591
  117   HD22  LEU  12          HD22      LEU  12  70.037   4.409   3.030
  118   HD23  LEU  12          HD23      LEU  12  69.393   5.805   3.888
  119    HA   PRO  13           HA       PRO  13  66.518   8.977   0.860
  120    HB2  PRO  13           HB2      PRO  13  67.458  11.118  -0.539
  121    HB3  PRO  13           HB1      PRO  13  68.433  10.265   0.684
  122    HG2  PRO  13           HG2      PRO  13  68.485   9.891  -2.268
  123    HG3  PRO  13           HG1      PRO  13  69.840  10.210  -1.164
  124    HD2  PRO  13           HD2      PRO  13  69.214   7.724  -1.964
  125    HD3  PRO  13           HD1      PRO  13  69.827   8.025  -0.346
  126    H    GLN  14           HN       GLN  14  66.873   8.521  -2.555
  127    HA   GLN  14           HA       GLN  14  64.509   9.753  -3.424
  128    HB2  GLN  14           HB2      GLN  14  66.491   9.113  -4.855
  129    HB3  GLN  14           HB1      GLN  14  65.980   7.448  -4.670
  130    HG2  GLN  14           HG2      GLN  14  63.929   7.866  -5.787
  131    HG3  GLN  14           HG1      GLN  14  64.305   9.593  -5.826
  132   HE21  GLN  14          HE21      GLN  14  66.805   7.270  -6.426
  133   HE22  GLN  14          HE22      GLN  14  66.931   7.555  -8.122
  134    H    LEU  15           HN       LEU  15  65.233   6.402  -2.352
  135    HA   LEU  15           HA       LEU  15  62.747   5.291  -2.939
  136    HB2  LEU  15           HB2      LEU  15  64.815   4.030  -2.404
  137    HB3  LEU  15           HB1      LEU  15  64.770   4.700  -0.857
  138    HG   LEU  15           HG       LEU  15  62.777   3.597  -0.234
  139   HD11  LEU  15          HD11      LEU  15  62.911   2.258  -2.946
  140   HD12  LEU  15          HD12      LEU  15  61.718   3.486  -2.492
  141   HD13  LEU  15          HD13      LEU  15  61.733   1.928  -1.678
  142   HD21  LEU  15          HD21      LEU  15  64.905   2.630   0.080
  143   HD22  LEU  15          HD22      LEU  15  64.822   1.872  -1.506
  144   HD23  LEU  15          HD23      LEU  15  63.699   1.360  -0.219
  145    H    CYS  16           HN       CYS  16  64.036   6.914  -0.172
  146    HA   CYS  16           HA       CYS  16  61.961   6.456   1.634
  147    HB2  CYS  16           HB2      CYS  16  63.702   8.938   1.383
  148    HB3  CYS  16           HB1      CYS  16  62.754   8.502   2.788
  149    HG   CYS  16           HG       CYS  16  65.376   6.693   1.532
  150    H    THR  17           HN       THR  17  62.286   8.815  -0.889
  151    HA   THR  17           HA       THR  17  60.072  10.450  -0.549
  152    HB   THR  17           HB       THR  17  61.635   9.463  -2.853
  153    HG1  THR  17           HG1      THR  17  61.459  11.930  -1.528
  154   HG21  THR  17          HG21      THR  17  60.553  11.178  -4.338
  155   HG22  THR  17          HG22      THR  17  59.289  11.364  -3.103
  156   HG23  THR  17          HG23      THR  17  59.561   9.797  -3.895
  157    H    GLU  18           HN       GLU  18  60.407   7.331  -2.037
  158    HA   GLU  18           HA       GLU  18  57.879   7.100  -3.198
  159    HB2  GLU  18           HB2      GLU  18  60.005   5.307  -2.374
  160    HB3  GLU  18           HB1      GLU  18  58.598   4.683  -3.237
  161    HG2  GLU  18           HG2      GLU  18  60.633   6.757  -4.093
  162    HG3  GLU  18           HG1      GLU  18  60.424   5.180  -4.810
  163    H    LEU  19           HN       LEU  19  59.301   5.673  -0.275
  164    HA   LEU  19           HA       LEU  19  56.896   4.774   0.890
  165    HB2  LEU  19           HB2      LEU  19  59.596   5.449   1.890
  166    HB3  LEU  19           HB1      LEU  19  58.404   4.931   3.009
  167    HG   LEU  19           HG       LEU  19  58.336   2.867   1.253
  168   HD11  LEU  19          HD11      LEU  19  61.150   3.883   1.186
  169   HD12  LEU  19          HD12      LEU  19  60.038   3.862  -0.176
  170   HD13  LEU  19          HD13      LEU  19  60.579   2.343   0.549
  171   HD21  LEU  19          HD21      LEU  19  58.625   2.663   3.601
  172   HD22  LEU  19          HD22      LEU  19  60.231   3.382   3.454
  173   HD23  LEU  19          HD23      LEU  19  59.928   1.767   2.777
  174    H    GLN  20           HN       GLN  20  57.741   7.913   0.285
  175    HA   GLN  20           HA       GLN  20  56.893   9.915   0.924
  176    HB2  GLN  20           HB2      GLN  20  54.984   8.067   2.241
  177    HB3  GLN  20           HB1      GLN  20  54.740   9.826   2.344
  178    HG2  GLN  20           HG2      GLN  20  54.698   9.775  -0.180
  179    HG3  GLN  20           HG1      GLN  20  54.689   8.015  -0.065
  180   HE21  GLN  20          HE21      GLN  20  52.704   9.856  -1.133
  181   HE22  GLN  20          HE22      GLN  20  51.245   9.539  -0.274
  182    H    THR  21           HN       THR  21  58.972   8.662   2.494
  183    HA   THR  21           HA       THR  21  58.562  10.086   4.984
  184    HB   THR  21           HB       THR  21  57.851   7.691   5.286
  185    HG1  THR  21           HG1      THR  21  58.880   7.470   7.210
  186   HG21  THR  21          HG21      THR  21  59.614   5.956   5.419
  187   HG22  THR  21          HG22      THR  21  60.787   7.129   4.825
  188   HG23  THR  21          HG23      THR  21  59.460   6.614   3.788
  189    H    THR  22           HN       THR  22  60.973   9.254   6.202
  190    HA   THR  22           HA       THR  22  62.994  10.037   4.209
  191    HB   THR  22           HB       THR  22  63.436  10.707   7.079
  192    HG1  THR  22           HG1      THR  22  61.461  11.761   5.353
  193   HG21  THR  22          HG21      THR  22  63.914  12.071   4.427
  194   HG22  THR  22          HG22      THR  22  65.117  11.217   5.396
  195   HG23  THR  22          HG23      THR  22  64.418  12.722   5.987
  196    H    ILE  23           HN       ILE  23  65.287   9.448   5.115
  197    HA   ILE  23           HA       ILE  23  65.788   6.835   5.330
  198    HB   ILE  23           HB       ILE  23  67.343   8.971   6.687
  199   HG12  ILE  23          HG12      ILE  23  67.134   8.125   3.848
  200   HG13  ILE  23          HG11      ILE  23  66.959   9.713   4.528
  201   HG21  ILE  23          HG21      ILE  23  68.123   6.296   5.473
  202   HG22  ILE  23          HG22      ILE  23  68.128   6.689   7.197
  203   HG23  ILE  23          HG23      ILE  23  69.295   7.456   6.110
  204   HD11  ILE  23          HD11      ILE  23  69.384   9.767   4.991
  205   HD12  ILE  23          HD12      ILE  23  69.049   9.469   3.262
  206   HD13  ILE  23          HD13      ILE  23  69.470   8.126   4.338
  207    H    HIS  24           HN       HIS  24  64.791   8.990   7.729
  208    HA   HIS  24           HA       HIS  24  65.941   7.891  10.071
  209    HB2  HIS  24           HB2      HIS  24  63.743   9.928   9.860
  210    HB3  HIS  24           HB1      HIS  24  64.976   9.827  11.091
  211    HD1  HIS  24           HD1      HIS  24  67.243   9.495   8.788
  212    HD2  HIS  24           HD2      HIS  24  64.464  12.441   9.235
  213    HE1  HIS  24           HE1      HIS  24  67.928  11.227   7.106
  214    H    ASP  25           HN       ASP  25  63.332   7.131   8.181
  215    HA   ASP  25           HA       ASP  25  61.851   5.893  10.407
  216    HB2  ASP  25           HB2      ASP  25  60.714   7.973   9.710
  217    HB3  ASP  25           HB1      ASP  25  60.732   7.391   8.084
  218    H    ILE  26           HN       ILE  26  62.596   5.936   6.966
  219    HA   ILE  26           HA       ILE  26  61.153   3.910   5.896
  220    HB   ILE  26           HB       ILE  26  62.598   5.261   4.523
  221   HG12  ILE  26          HG12      ILE  26  63.637   2.470   4.410
  222   HG13  ILE  26          HG11      ILE  26  62.063   2.763   3.796
  223   HG21  ILE  26          HG21      ILE  26  64.456   5.495   6.091
  224   HG22  ILE  26          HG22      ILE  26  65.025   4.967   4.501
  225   HG23  ILE  26          HG23      ILE  26  64.895   3.808   5.826
  226   HD11  ILE  26          HD11      ILE  26  63.602   2.666   2.040
  227   HD12  ILE  26          HD12      ILE  26  64.685   3.835   2.800
  228   HD13  ILE  26          HD13      ILE  26  63.114   4.363   2.157
  229    H    ILE  27           HN       ILE  27  60.937   1.803   6.018
  230    HA   ILE  27           HA       ILE  27  62.958   0.356   7.442
  231    HB   ILE  27           HB       ILE  27  60.169  -0.416   6.596
  232   HG12  ILE  27          HG12      ILE  27  60.211   1.178   8.449
  233   HG13  ILE  27          HG11      ILE  27  59.650  -0.400   8.975
  234   HG21  ILE  27          HG21      ILE  27  60.532  -2.482   7.883
  235   HG22  ILE  27          HG22      ILE  27  62.210  -1.979   8.155
  236   HG23  ILE  27          HG23      ILE  27  61.648  -2.319   6.519
  237   HD11  ILE  27          HD11      ILE  27  62.401   0.757   9.434
  238   HD12  ILE  27          HD12      ILE  27  61.863  -0.841   9.948
  239   HD13  ILE  27          HD13      ILE  27  61.116   0.601  10.633
  240    H    LEU  28           HN       LEU  28  64.454  -0.319   6.597
  241    HA   LEU  28           HA       LEU  28  64.247  -1.285   3.879
  242    HB2  LEU  28           HB2      LEU  28  65.632   0.864   4.807
  243    HB3  LEU  28           HB1      LEU  28  66.833  -0.422   4.776
  244    HG   LEU  28           HG       LEU  28  66.392  -0.873   2.479
  245   HD11  LEU  28          HD11      LEU  28  64.080   0.763   3.180
  246   HD12  LEU  28          HD12      LEU  28  64.170  -0.599   2.043
  247   HD13  LEU  28          HD13      LEU  28  64.705   1.022   1.547
  248   HD21  LEU  28          HD21      LEU  28  67.902   0.991   3.067
  249   HD22  LEU  28          HD22      LEU  28  66.525   2.086   2.940
  250   HD23  LEU  28          HD23      LEU  28  67.091   1.200   1.513
  251    H    GLU  29           HN       GLU  29  65.025  -3.482   3.843
  252    HA   GLU  29           HA       GLU  29  66.615  -3.892   6.243
  253    HB2  GLU  29           HB2      GLU  29  66.233  -6.195   6.195
  254    HB3  GLU  29           HB1      GLU  29  64.912  -5.178   6.890
  255    HG2  GLU  29           HG2      GLU  29  65.035  -6.310   4.268
  256    HG3  GLU  29           HG1      GLU  29  64.480  -7.295   5.607
  257    H    CYS  30           HN       CYS  30  68.026  -6.181   6.175
  258    HA   CYS  30           HA       CYS  30  69.624  -5.629   3.982
  259    HB2  CYS  30           HB2      CYS  30  70.359  -6.897   6.155
  260    HB3  CYS  30           HB1      CYS  30  69.586  -8.253   5.406
  261    H    VAL  31           HN       VAL  31  69.493  -6.262   2.163
  262    HA   VAL  31           HA       VAL  31  67.442  -7.797   1.017
  263    HB   VAL  31           HB       VAL  31  68.634  -6.161  -0.353
  264   HG11  VAL  31          HG11      VAL  31  71.039  -7.633   0.460
  265   HG12  VAL  31          HG12      VAL  31  70.595  -5.902   0.755
  266   HG13  VAL  31          HG13      VAL  31  70.899  -6.524  -0.896
  267   HG21  VAL  31          HG21      VAL  31  69.542  -7.397  -2.206
  268   HG22  VAL  31          HG22      VAL  31  68.027  -8.084  -1.646
  269   HG23  VAL  31          HG23      VAL  31  69.563  -8.860  -1.221
  270    H    TYR  32           HN       TYR  32  70.567  -8.528   2.254
  271    HA   TYR  32           HA       TYR  32  70.506 -11.185   1.121
  272    HB2  TYR  32           HB2      TYR  32  72.750  -9.881   2.654
  273    HB3  TYR  32           HB1      TYR  32  72.836 -11.373   1.712
  274    HD1  TYR  32           HD2      TYR  32  71.392 -10.780  -0.725
  275    HD2  TYR  32           HD1      TYR  32  74.005  -8.246   1.537
  276    HE1  TYR  32           HE2      TYR  32  71.767  -9.557  -2.651
  277    HE2  TYR  32           HE1      TYR  32  74.419  -6.876  -0.446
  278    HH   TYR  32           HH       TYR  32  74.321  -7.176  -2.930
  279    H    CYS  33           HN       CYS  33  70.476  -9.622   4.288
  280    HA   CYS  33           HA       CYS  33  70.452 -12.270   5.560
  281    HB2  CYS  33           HB2      CYS  33  70.751  -9.592   6.915
  282    HB3  CYS  33           HB1      CYS  33  71.007 -11.182   7.590
  283    H    LYS  34           HN       LYS  34  68.302  -9.777   4.677
  284    HA   LYS  34           HA       LYS  34  66.308  -9.300   4.953
  285    HB2  LYS  34           HB2      LYS  34  66.178 -12.090   5.898
  286    HB3  LYS  34           HB1      LYS  34  64.745 -11.078   5.988
  287    HG2  LYS  34           HG2      LYS  34  64.788 -12.390   4.009
  288    HG3  LYS  34           HG1      LYS  34  64.881 -10.679   3.559
  289    HD2  LYS  34           HD2      LYS  34  67.328 -11.070   3.233
  290    HD3  LYS  34           HD1      LYS  34  67.063 -12.774   3.599
  291    HE2  LYS  34           HE2      LYS  34  65.811 -11.228   1.328
  292    HE3  LYS  34           HE1      LYS  34  67.131 -12.373   1.178
  293    HZ1  LYS  34           HZ1      LYS  34  65.629 -14.138   1.918
  294    HZ2  LYS  34           HZ2      LYS  34  65.026 -13.372   0.568
  295    HZ3  LYS  34           HZ3      LYS  34  64.372 -13.031   2.070
  296    H    GLN  35           HN       GLN  35  68.096  -9.225   7.867
  297    HA   GLN  35           HA       GLN  35  65.746  -8.386   9.155
  298    HB2  GLN  35           HB2      GLN  35  67.031  -8.118  11.061
  299    HB3  GLN  35           HB1      GLN  35  67.257  -9.754  10.486
  300    HG2  GLN  35           HG2      GLN  35  69.163  -7.537   9.956
  301    HG3  GLN  35           HG1      GLN  35  69.277  -8.450  11.467
  302   HE21  GLN  35          HE21      GLN  35  68.496 -10.901   9.910
  303   HE22  GLN  35          HE22      GLN  35  69.916 -11.322   9.065
  304    H    GLN  36           HN       GLN  36  65.450  -6.300   9.934
  305    HA   GLN  36           HA       GLN  36  66.052  -4.267   8.247
  306    HB2  GLN  36           HB2      GLN  36  64.949  -4.520  10.993
  307    HB3  GLN  36           HB1      GLN  36  65.135  -2.973  10.195
  308    HG2  GLN  36           HG2      GLN  36  63.649  -3.530   8.505
  309    HG3  GLN  36           HG1      GLN  36  63.763  -5.238   8.875
  310   HE21  GLN  36          HE21      GLN  36  63.307  -2.795  11.378
  311   HE22  GLN  36          HE22      GLN  36  61.689  -3.249  11.748
  312    H    LEU  37           HN       LEU  37  67.472  -2.810   8.171
  313    HA   LEU  37           HA       LEU  37  69.941  -3.015   9.519
  314    HB2  LEU  37           HB2      LEU  37  68.758  -1.070   7.609
  315    HB3  LEU  37           HB1      LEU  37  70.084  -0.605   8.611
  316    HG   LEU  37           HG       LEU  37  71.353  -2.556   7.784
  317   HD11  LEU  37          HD11      LEU  37  69.607  -3.975   7.024
  318   HD12  LEU  37          HD12      LEU  37  70.619  -3.555   5.634
  319   HD13  LEU  37          HD13      LEU  37  69.058  -2.770   5.869
  320   HD21  LEU  37          HD21      LEU  37  71.787  -0.345   6.942
  321   HD22  LEU  37          HD22      LEU  37  70.481  -0.505   5.769
  322   HD23  LEU  37          HD23      LEU  37  71.920  -1.516   5.630
  323    H    LEU  38           HN       LEU  38  70.976  -1.887  10.958
  324    HA   LEU  38           HA       LEU  38  69.678  -0.611  13.060
  325    HB2  LEU  38           HB2      LEU  38  72.142  -1.653  12.369
  326    HB3  LEU  38           HB1      LEU  38  72.378   0.060  12.286
  327    HG   LEU  38           HG       LEU  38  71.349  -1.360  14.677
  328   HD11  LEU  38          HD11      LEU  38  73.643  -1.072  15.581
  329   HD12  LEU  38          HD12      LEU  38  74.122  -0.385  14.019
  330   HD13  LEU  38          HD13      LEU  38  73.594  -2.065  14.116
  331   HD21  LEU  38          HD21      LEU  38  72.403   1.441  14.312
  332   HD22  LEU  38          HD22      LEU  38  71.952   0.722  15.855
  333   HD23  LEU  38          HD23      LEU  38  70.726   0.990  14.616
  334    H    ARG  39           HN       ARG  39  69.145   1.652  13.091
  335    HA   ARG  39           HA       ARG  39  68.812   3.006  10.733
  336    HB2  ARG  39           HB2      ARG  39  67.708   3.551  12.915
  337    HB3  ARG  39           HB1      ARG  39  69.197   4.330  13.413
  338    HG2  ARG  39           HG2      ARG  39  67.692   6.008  12.661
  339    HG3  ARG  39           HG1      ARG  39  69.019   5.828  11.498
  340    HD2  ARG  39           HD2      ARG  39  66.837   6.058  10.374
  341    HD3  ARG  39           HD1      ARG  39  67.614   4.522  10.019
  342    HE   ARG  39           HE       ARG  39  65.771   4.398  12.223
  343   HH11  ARG  39          HH11      ARG  39  65.972   4.296   8.709
  344   HH12  ARG  39          HH12      ARG  39  64.601   3.305   8.504
  345   HH21  ARG  39          HH21      ARG  39  63.855   3.110  11.962
  346   HH22  ARG  39          HH22      ARG  39  63.308   2.657  10.420
  347    H    ARG  40           HN       ARG  40  71.659   3.047  12.846
  348    HA   ARG  40           HA       ARG  40  73.119   5.101  11.734
  349    HB2  ARG  40           HB2      ARG  40  74.033   2.435  12.795
  350    HB3  ARG  40           HB1      ARG  40  75.052   3.825  12.499
  351    HG2  ARG  40           HG2      ARG  40  72.868   3.584  14.547
  352    HG3  ARG  40           HG1      ARG  40  74.601   3.636  14.847
  353    HD2  ARG  40           HD2      ARG  40  72.907   5.853  13.709
  354    HD3  ARG  40           HD1      ARG  40  73.613   5.794  15.322
  355    HE   ARG  40           HE       ARG  40  75.737   5.534  13.660
  356   HH11  ARG  40          HH11      ARG  40  73.189   7.967  14.052
  357   HH12  ARG  40          HH12      ARG  40  74.137   9.231  13.409
  358   HH21  ARG  40          HH21      ARG  40  77.011   7.300  12.771
  359   HH22  ARG  40          HH22      ARG  40  76.339   8.859  12.692
  360    H    GLU  41           HN       GLU  41  73.034   1.643  10.848
  361    HA   GLU  41           HA       GLU  41  74.870   1.772   8.680
  362    HB2  GLU  41           HB2      GLU  41  72.599  -0.160   9.139
  363    HB3  GLU  41           HB1      GLU  41  73.982  -0.488   8.137
  364    HG2  GLU  41           HG2      GLU  41  73.847  -0.282  11.129
  365    HG3  GLU  41           HG1      GLU  41  74.234  -1.688  10.150
  366    H    VAL  42           HN       VAL  42  71.427   2.270   8.967
  367    HA   VAL  42           HA       VAL  42  70.851   2.300   6.177
  368    HB   VAL  42           HB       VAL  42  69.302   4.002   8.162
  369   HG11  VAL  42          HG11      VAL  42  67.423   3.542   6.719
  370   HG12  VAL  42          HG12      VAL  42  68.390   2.378   5.836
  371   HG13  VAL  42          HG13      VAL  42  68.777   4.108   5.711
  372   HG21  VAL  42          HG21      VAL  42  67.893   2.096   8.692
  373   HG22  VAL  42          HG22      VAL  42  69.565   1.762   9.157
  374   HG23  VAL  42          HG23      VAL  42  68.898   1.063   7.681
  375    H    TYR  43           HN       TYR  43  71.791   4.873   8.489
  376    HA   TYR  43           HA       TYR  43  71.747   6.993   6.657
  377    HB2  TYR  43           HB2      TYR  43  73.362   6.560   9.148
  378    HB3  TYR  43           HB1      TYR  43  73.436   8.068   8.213
  379    HD1  TYR  43           HD1      TYR  43  70.687   8.403   7.472
  380    HD2  TYR  43           HD2      TYR  43  72.320   7.043  11.126
  381    HE1  TYR  43           HE1      TYR  43  68.724   9.122   8.557
  382    HE2  TYR  43           HE2      TYR  43  70.294   7.773  12.299
  383    HH   TYR  43           HH       TYR  43  68.476   9.471  11.876
  384    H    ASP  44           HN       ASP  44  74.297   4.642   7.387
  385    HA   ASP  44           HA       ASP  44  76.417   5.752   6.033
  386    HB2  ASP  44           HB2      ASP  44  75.585   2.901   6.443
  387    HB3  ASP  44           HB1      ASP  44  76.935   3.327   5.513
  388    H    PHE  45           HN       PHE  45  73.723   4.042   4.913
  389    HA   PHE  45           HA       PHE  45  74.650   3.314   2.419
  390    HB2  PHE  45           HB2      PHE  45  72.438   2.885   3.893
  391    HB3  PHE  45           HB1      PHE  45  71.877   4.068   2.727
  392    HD1  PHE  45           HD1      PHE  45  73.491   0.757   3.051
  393    HD2  PHE  45           HD2      PHE  45  71.432   3.578   0.614
  394    HE1  PHE  45           HE1      PHE  45  73.103  -0.962   1.314
  395    HE2  PHE  45           HE2      PHE  45  71.093   1.877  -1.088
  396    HZ   PHE  45           HZ       PHE  45  71.874  -0.363  -0.755
  397    H    ALA  46           HN       ALA  46  72.902   6.267   3.450
  398    HA   ALA  46           HA       ALA  46  73.168   7.404   0.784
  399    HB1  ALA  46           HB1      ALA  46  72.011   8.644   3.276
  400    HB2  ALA  46           HB2      ALA  46  71.063   7.892   1.973
  401    HB3  ALA  46           HB3      ALA  46  71.951   9.362   1.675
  402    H    ARG  47           HN       ARG  47  74.715   7.585   3.863
  403    HA   ARG  47           HA       ARG  47  76.153   9.988   3.385
  404    HB2  ARG  47           HB2      ARG  47  75.834   8.076   5.490
  405    HB3  ARG  47           HB1      ARG  47  77.526   8.437   5.355
  406    HG2  ARG  47           HG2      ARG  47  76.513   9.874   6.991
  407    HG3  ARG  47           HG1      ARG  47  76.986  10.842   5.604
  408    HD2  ARG  47           HD2      ARG  47  74.200   9.782   5.979
  409    HD3  ARG  47           HD1      ARG  47  74.716  11.341   6.625
  410    HE   ARG  47           HE       ARG  47  75.365  11.403   3.971
  411   HH11  ARG  47          HH11      ARG  47  72.374  10.981   5.807
  412   HH12  ARG  47          HH12      ARG  47  71.352  11.622   4.607
  413   HH21  ARG  47          HH21      ARG  47  73.999  12.241   2.287
  414   HH22  ARG  47          HH22      ARG  47  72.329  12.340   2.518
  415    H    ARG  48           HN       ARG  48  76.594   6.752   2.495
  416    HA   ARG  48           HA       ARG  48  79.259   7.351   1.432
  417    HB2  ARG  48           HB2      ARG  48  77.823   4.800   1.979
  418    HB3  ARG  48           HB1      ARG  48  79.435   4.881   1.306
  419    HG2  ARG  48           HG2      ARG  48  80.284   5.776   3.383
  420    HG3  ARG  48           HG1      ARG  48  78.640   5.887   4.037
  421    HD2  ARG  48           HD2      ARG  48  78.360   3.528   3.845
  422    HD3  ARG  48           HD1      ARG  48  79.917   3.377   3.058
  423    HE   ARG  48           HE       ARG  48  79.444   4.029   5.904
  424   HH11  ARG  48          HH11      ARG  48  81.742   3.114   3.395
  425   HH12  ARG  48          HH12      ARG  48  82.743   2.190   4.416
  426   HH21  ARG  48          HH21      ARG  48  80.867   2.817   7.352
  427   HH22  ARG  48          HH22      ARG  48  82.219   1.998   6.740
  428    H    ASP  49           HN       ASP  49  78.993   5.101  -0.465
  429    HA   ASP  49           HA       ASP  49  76.757   6.078  -2.055
  430    HB2  ASP  49           HB2      ASP  49  78.826   7.099  -2.939
  431    HB3  ASP  49           HB1      ASP  49  79.495   5.492  -3.194
  432    H    LEU  50           HN       LEU  50  75.801   4.139  -1.050
  433    HA   LEU  50           HA       LEU  50  76.523   1.832  -2.597
  434    HB2  LEU  50           HB2      LEU  50  74.846   2.043  -0.111
  435    HB3  LEU  50           HB1      LEU  50  75.158   0.564  -0.984
  436    HG   LEU  50           HG       LEU  50  77.619   1.045  -0.562
  437   HD11  LEU  50          HD11      LEU  50  77.436   3.269   0.120
  438   HD12  LEU  50          HD12      LEU  50  78.167   2.308   1.417
  439   HD13  LEU  50          HD13      LEU  50  76.478   2.838   1.538
  440   HD21  LEU  50          HD21      LEU  50  77.548   0.011   1.621
  441   HD22  LEU  50          HD22      LEU  50  76.415  -0.756   0.483
  442   HD23  LEU  50          HD23      LEU  50  75.825   0.386   1.715
  443    H    CYS  51           HN       CYS  51  74.855   0.682  -3.625
  444    HA   CYS  51           HA       CYS  51  72.507   2.304  -4.273
  445    HB2  CYS  51           HB2      CYS  51  72.334   0.823  -6.264
  446    HB3  CYS  51           HB1      CYS  51  73.868   1.688  -6.191
  447    HG   CYS  51           HG       CYS  51  73.892  -1.360  -4.811
  448    H    ILE  52           HN       ILE  52  70.488   1.351  -4.266
  449    HA   ILE  52           HA       ILE  52  70.239  -0.593  -2.180
  450    HB   ILE  52           HB       ILE  52  68.234   1.087  -3.641
  451   HG12  ILE  52          HG12      ILE  52  69.264   0.689  -0.916
  452   HG13  ILE  52          HG11      ILE  52  69.420   2.137  -1.954
  453   HG21  ILE  52          HG21      ILE  52  67.558  -1.126  -1.673
  454   HG22  ILE  52          HG22      ILE  52  67.130  -1.122  -3.382
  455   HG23  ILE  52          HG23      ILE  52  66.432   0.080  -2.297
  456   HD11  ILE  52          HD11      ILE  52  67.939   2.508  -0.203
  457   HD12  ILE  52          HD12      ILE  52  67.170   0.953  -0.584
  458   HD13  ILE  52          HD13      ILE  52  67.016   2.327  -1.746
  459    H    VAL  53           HN       VAL  53  69.396  -2.364  -2.181
  460    HA   VAL  53           HA       VAL  53  69.585  -3.875  -4.632
  461    HB   VAL  53           HB       VAL  53  70.381  -5.647  -2.849
  462   HG11  VAL  53          HG11      VAL  53  72.688  -4.900  -3.246
  463   HG12  VAL  53          HG12      VAL  53  72.101  -3.304  -3.720
  464   HG13  VAL  53          HG13      VAL  53  71.736  -4.714  -4.718
  465   HG21  VAL  53          HG21      VAL  53  69.903  -4.194  -0.899
  466   HG22  VAL  53          HG22      VAL  53  71.047  -3.002  -1.520
  467   HG23  VAL  53          HG23      VAL  53  71.613  -4.579  -1.015
  468    H    TYR  54           HN       TYR  54  67.762  -4.642  -5.088
  469    HA   TYR  54           HA       TYR  54  65.707  -5.144  -3.133
  470    HB2  TYR  54           HB2      TYR  54  65.749  -5.182  -6.149
  471    HB3  TYR  54           HB1      TYR  54  64.325  -5.445  -5.138
  472    HD1  TYR  54           HD1      TYR  54  66.912  -2.951  -6.022
  473    HD2  TYR  54           HD2      TYR  54  63.167  -3.675  -4.192
  474    HE1  TYR  54           HE1      TYR  54  66.549  -0.533  -5.755
  475    HE2  TYR  54           HE2      TYR  54  62.809  -1.336  -3.983
  476    HH   TYR  54           HH       TYR  54  64.843   0.970  -5.464
  477    H    ARG  55           HN       ARG  55  65.505  -6.901  -2.376
  478    HA   ARG  55           HA       ARG  55  66.787  -9.123  -3.713
  479    HB2  ARG  55           HB2      ARG  55  66.283  -8.739  -0.965
  480    HB3  ARG  55           HB1      ARG  55  65.178 -10.011  -1.434
  481    HG2  ARG  55           HG2      ARG  55  68.208 -10.240  -1.956
  482    HG3  ARG  55           HG1      ARG  55  67.480 -10.711  -0.481
  483    HD2  ARG  55           HD2      ARG  55  67.643 -12.674  -1.754
  484    HD3  ARG  55           HD1      ARG  55  65.948 -12.214  -1.837
  485    HE   ARG  55           HE       ARG  55  67.563 -11.255  -4.004
  486   HH11  ARG  55          HH11      ARG  55  65.465 -13.869  -2.832
  487   HH12  ARG  55          HH12      ARG  55  65.230 -14.572  -4.350
  488   HH21  ARG  55          HH21      ARG  55  67.276 -12.255  -6.099
  489   HH22  ARG  55          HH22      ARG  55  66.311 -13.654  -6.265
  490    H    ASP  56           HN       ASP  56  65.413 -10.122  -5.215
  491    HA   ASP  56           HA       ASP  56  63.615 -10.771  -6.400
  492    HB2  ASP  56           HB2      ASP  56  62.046 -10.282  -3.886
  493    HB3  ASP  56           HB1      ASP  56  61.304 -10.853  -5.369
  494    H    GLY  57           HN       GLY  57  61.989  -8.395  -4.401
  495    HA2  GLY  57           HA2      GLY  57  62.411  -6.340  -6.264
  496    HA3  GLY  57           HA1      GLY  57  60.763  -6.974  -6.423
  497    H    ASN  58           HN       ASN  58  62.604  -6.771  -3.447
  498    HA   ASN  58           HA       ASN  58  60.736  -4.669  -2.490
  499    HB2  ASN  58           HB2      ASN  58  62.116  -6.710  -0.772
  500    HB3  ASN  58           HB1      ASN  58  60.729  -5.765  -0.328
  501   HD21  ASN  58          HD21      ASN  58  61.957  -8.486  -2.012
  502   HD22  ASN  58          HD22      ASN  58  60.531  -9.407  -2.120
  503    HA   PRO  59           HA       PRO  59  64.552  -2.821  -1.915
  504    HB2  PRO  59           HB2      PRO  59  63.454  -0.711  -0.288
  505    HB3  PRO  59           HB1      PRO  59  63.846  -0.661  -2.008
  506    HG2  PRO  59           HG2      PRO  59  61.211  -0.552  -1.157
  507    HG3  PRO  59           HG1      PRO  59  61.657  -1.259  -2.642
  508    HD2  PRO  59           HD2      PRO  59  61.182  -2.636  -0.075
  509    HD3  PRO  59           HD1      PRO  59  60.593  -3.029  -1.695
  510    H    TYR  60           HN       TYR  60  66.276  -3.050  -0.870
  511    HA   TYR  60           HA       TYR  60  66.095  -2.999   1.924
  512    HB2  TYR  60           HB2      TYR  60  67.654  -5.361   0.888
  513    HB3  TYR  60           HB1      TYR  60  67.043  -4.923   2.313
  514    HD1  TYR  60           HD2      TYR  60  64.781  -5.140   2.986
  515    HD2  TYR  60           HD1      TYR  60  66.147  -6.531  -0.714
  516    HE1  TYR  60           HE2      TYR  60  62.834  -6.670   2.845
  517    HE2  TYR  60           HE1      TYR  60  64.196  -8.062  -0.877
  518    HH   TYR  60           HH       TYR  60  62.712  -9.190   0.683
  519    H    ALA  61           HN       ALA  61  68.012  -2.913   2.734
  520    HA   ALA  61           HA       ALA  61  69.878  -1.285   1.283
  521    HB1  ALA  61           HB1      ALA  61  69.656  -2.012   4.093
  522    HB2  ALA  61           HB2      ALA  61  68.624  -0.792   3.400
  523    HB3  ALA  61           HB3      ALA  61  70.423  -0.546   3.431
  524    H    VAL  62           HN       VAL  62  72.079  -1.798   2.526
  525    HA   VAL  62           HA       VAL  62  72.551  -4.672   2.512
  526    HB   VAL  62           HB       VAL  62  74.299  -2.310   1.654
  527   HG11  VAL  62          HG11      VAL  62  75.167  -5.102   1.991
  528   HG12  VAL  62          HG12      VAL  62  75.600  -3.635   2.917
  529   HG13  VAL  62          HG13      VAL  62  76.056  -3.761   1.220
  530   HG21  VAL  62          HG21      VAL  62  74.468  -3.486  -0.459
  531   HG22  VAL  62          HG22      VAL  62  72.822  -3.002  -0.078
  532   HG23  VAL  62          HG23      VAL  62  73.336  -4.693   0.157
  533    H    CYS  63           HN       CYS  63  72.634  -5.310   4.589
  534    HA   CYS  63           HA       CYS  63  72.680  -3.544   6.734
  535    HB2  CYS  63           HB2      CYS  63  72.418  -5.357   8.096
  536    HB3  CYS  63           HB1      CYS  63  71.803  -5.865   6.521
  537    H    ASP  64           HN       ASP  64  74.014  -4.172   8.691
  538    HA   ASP  64           HA       ASP  64  76.439  -2.969   8.855
  539    HB2  ASP  64           HB2      ASP  64  75.245  -3.583  10.817
  540    HB3  ASP  64           HB1      ASP  64  75.316  -5.282  10.406
  541    H    LYS  65           HN       LYS  65  76.036  -6.512   8.642
  542    HA   LYS  65           HA       LYS  65  78.738  -7.174   8.474
  543    HB2  LYS  65           HB2      LYS  65  76.269  -8.569   7.492
  544    HB3  LYS  65           HB1      LYS  65  77.844  -9.317   7.698
  545    HG2  LYS  65           HG2      LYS  65  77.758  -9.170  10.018
  546    HG3  LYS  65           HG1      LYS  65  76.482  -7.953   9.984
  547    HD2  LYS  65           HD2      LYS  65  76.062 -10.672   8.871
  548    HD3  LYS  65           HD1      LYS  65  75.853 -10.341  10.616
  549    HE2  LYS  65           HE2      LYS  65  74.173  -8.702  10.094
  550    HE3  LYS  65           HE1      LYS  65  74.425  -8.913   8.364
  551    HZ1  LYS  65           HZ1      LYS  65  73.435 -11.037  10.192
  552    HZ2  LYS  65           HZ2      LYS  65  73.444 -11.075   8.475
  553    HZ3  LYS  65           HZ3      LYS  65  72.449 -10.014   9.292
  554    H    CYS  66           HN       CYS  66  76.249  -6.834   6.019
  555    HA   CYS  66           HA       CYS  66  77.882  -7.666   3.865
  556    HB2  CYS  66           HB2      CYS  66  75.179  -6.345   4.006
  557    HB3  CYS  66           HB1      CYS  66  75.841  -7.012   2.535
  558    H    LEU  67           HN       LEU  67  76.994  -4.499   5.160
  559    HA   LEU  67           HA       LEU  67  77.529  -2.820   3.125
  560    HB2  LEU  67           HB2      LEU  67  76.709  -2.567   5.596
  561    HB3  LEU  67           HB1      LEU  67  78.383  -2.122   5.864
  562    HG   LEU  67           HG       LEU  67  76.800  -0.863   3.715
  563   HD11  LEU  67          HD11      LEU  67  76.185   0.914   5.331
  564   HD12  LEU  67          HD12      LEU  67  76.826  -0.128   6.626
  565   HD13  LEU  67          HD13      LEU  67  75.465  -0.670   5.627
  566   HD21  LEU  67          HD21      LEU  67  79.085   0.156   5.419
  567   HD22  LEU  67          HD22      LEU  67  78.291   1.062   4.131
  568   HD23  LEU  67          HD23      LEU  67  79.196  -0.402   3.749
  569    H    LYS  68           HN       LYS  68  79.815  -3.927   5.599
  570    HA   LYS  68           HA       LYS  68  81.986  -2.522   4.456
  571    HB2  LYS  68           HB2      LYS  68  83.427  -3.769   5.999
  572    HB3  LYS  68           HB1      LYS  68  82.034  -3.084   6.809
  573    HG2  LYS  68           HG2      LYS  68  80.955  -5.285   6.794
  574    HG3  LYS  68           HG1      LYS  68  82.377  -5.964   5.996
  575    HD2  LYS  68           HD2      LYS  68  83.756  -5.305   7.886
  576    HD3  LYS  68           HD1      LYS  68  82.351  -4.608   8.688
  577    HE2  LYS  68           HE2      LYS  68  81.300  -6.858   8.671
  578    HE3  LYS  68           HE1      LYS  68  82.794  -7.504   7.991
  579    HZ1  LYS  68           HZ1      LYS  68  83.975  -6.773   9.955
  580    HZ2  LYS  68           HZ2      LYS  68  82.713  -7.783  10.405
  581    HZ3  LYS  68           HZ3      LYS  68  82.572  -6.113  10.598
  582    H    PHE  69           HN       PHE  69  80.635  -5.706   3.774
  583    HA   PHE  69           HA       PHE  69  82.895  -6.786   2.540
  584    HB2  PHE  69           HB2      PHE  69  80.005  -7.174   2.328
  585    HB3  PHE  69           HB1      PHE  69  81.098  -8.252   1.548
  586    HD1  PHE  69           HD1      PHE  69  82.819  -7.875   4.415
  587    HD2  PHE  69           HD2      PHE  69  79.005  -9.216   3.119
  588    HE1  PHE  69           HE1      PHE  69  82.635  -9.277   6.412
  589    HE2  PHE  69           HE2      PHE  69  78.776 -10.594   5.074
  590    HZ   PHE  69           HZ       PHE  69  80.584 -10.651   6.766
  591    H    TYR  70           HN       TYR  70  79.839  -5.310   1.472
  592    HA   TYR  70           HA       TYR  70  80.720  -5.672  -1.211
  593    HB2  TYR  70           HB2      TYR  70  77.985  -5.016  -0.166
  594    HB3  TYR  70           HB1      TYR  70  78.391  -5.340  -1.855
  595    HD1  TYR  70           HD2      TYR  70  79.926  -7.570  -2.118
  596    HD2  TYR  70           HD1      TYR  70  77.144  -6.850   1.013
  597    HE1  TYR  70           HE2      TYR  70  79.798  -9.982  -1.685
  598    HE2  TYR  70           HE1      TYR  70  77.042  -9.281   1.484
  599    HH   TYR  70           HH       TYR  70  79.255 -11.467   0.209
  600    H    SER  71           HN       SER  71  80.693  -3.030   0.891
  601    HA   SER  71           HA       SER  71  80.527  -1.078  -1.196
  602    HB2  SER  71           HB2      SER  71  82.063  -0.935   1.415
  603    HB3  SER  71           HB1      SER  71  81.658   0.441   0.390
  604    HG   SER  71           HG       SER  71  79.886  -1.240   1.833
  605    H    LYS  72           HN       LYS  72  82.829  -3.347  -0.104
  606    HA   LYS  72           HA       LYS  72  85.056  -2.173  -1.513
  607    HB2  LYS  72           HB2      LYS  72  85.265  -3.288   0.725
  608    HB3  LYS  72           HB1      LYS  72  84.832  -4.800  -0.041
  609    HG2  LYS  72           HG2      LYS  72  87.133  -4.943   0.119
  610    HG3  LYS  72           HG1      LYS  72  86.901  -4.376  -1.529
  611    HD2  LYS  72           HD2      LYS  72  87.425  -2.515   0.771
  612    HD3  LYS  72           HD1      LYS  72  88.753  -3.235  -0.134
  613    HE2  LYS  72           HE2      LYS  72  87.766  -2.100  -2.182
  614    HE3  LYS  72           HE1      LYS  72  86.630  -1.308  -1.085
  615    HZ1  LYS  72           HZ1      LYS  72  88.470   0.130  -1.507
  616    HZ2  LYS  72           HZ2      LYS  72  89.578  -1.021  -1.009
  617    HZ3  LYS  72           HZ3      LYS  72  88.525  -0.350   0.104
  618    H    ILE  73           HN       ILE  73  83.217  -5.264  -1.544
  619    HA   ILE  73           HA       ILE  73  84.511  -6.257  -3.851
  620    HB   ILE  73           HB       ILE  73  81.783  -7.237  -2.974
  621   HG12  ILE  73          HG12      ILE  73  84.499  -7.948  -1.804
  622   HG13  ILE  73          HG11      ILE  73  83.142  -7.127  -1.019
  623   HG21  ILE  73          HG21      ILE  73  82.635  -8.148  -5.081
  624   HG22  ILE  73          HG22      ILE  73  82.652  -9.399  -3.837
  625   HG23  ILE  73          HG23      ILE  73  84.149  -8.594  -4.299
  626   HD11  ILE  73          HD11      ILE  73  83.341  -9.456  -0.316
  627   HD12  ILE  73          HD12      ILE  73  83.072  -9.967  -1.984
  628   HD13  ILE  73          HD13      ILE  73  81.804  -9.110  -1.107
  629    H    SER  74           HN       SER  74  81.546  -4.299  -3.601
  630    HA   SER  74           HA       SER  74  80.704  -4.890  -6.238
  631    HB2  SER  74           HB2      SER  74  80.102  -2.446  -4.568
  632    HB3  SER  74           HB1      SER  74  79.225  -2.931  -6.024
  633    HG   SER  74           HG       SER  74  79.019  -3.782  -3.481
  634    H    GLU  75           HN       GLU  75  82.917  -2.659  -4.923
  635    HA   GLU  75           HA       GLU  75  83.377  -1.265  -7.404
  636    HB2  GLU  75           HB2      GLU  75  84.909  -1.346  -4.807
  637    HB3  GLU  75           HB1      GLU  75  85.349  -0.332  -6.176
  638    HG2  GLU  75           HG2      GLU  75  82.711  -0.196  -4.750
  639    HG3  GLU  75           HG1      GLU  75  84.089   0.841  -4.388
  640    H    TYR  76           HN       TYR  76  84.974  -3.621  -5.386
  641    HA   TYR  76           HA       TYR  76  86.659  -4.972  -5.579
  642    HB2  TYR  76           HB2      TYR  76  84.844  -6.183  -6.700
  643    HB3  TYR  76           HB1      TYR  76  85.435  -5.615  -8.260
  644    HD1  TYR  76           HD1      TYR  76  87.934  -6.433  -5.765
  645    HD2  TYR  76           HD2      TYR  76  85.549  -8.048  -8.887
  646    HE1  TYR  76           HE1      TYR  76  89.374  -8.318  -5.837
  647    HE2  TYR  76           HE2      TYR  76  87.022 -10.002  -8.988
  648    HH   TYR  76           HH       TYR  76  89.283 -10.696  -6.588
  649    H    ARG  77           HN       ARG  77  88.230  -3.627  -5.516
  650    HA   ARG  77           HA       ARG  77  89.816  -3.145  -7.886
  651    HB2  ARG  77           HB2      ARG  77  88.873  -0.913  -6.057
  652    HB3  ARG  77           HB1      ARG  77  90.104  -0.761  -7.293
  653    HG2  ARG  77           HG2      ARG  77  87.224  -1.453  -7.847
  654    HG3  ARG  77           HG1      ARG  77  87.883   0.180  -7.900
  655    HD2  ARG  77           HD2      ARG  77  88.841  -2.128  -9.589
  656    HD3  ARG  77           HD1      ARG  77  87.707  -0.890 -10.121
  657    HE   ARG  77           HE       ARG  77  90.131   0.228  -9.127
  658   HH11  ARG  77          HH11      ARG  77  88.736  -1.354 -11.991
  659   HH12  ARG  77          HH12      ARG  77  89.765  -0.553 -13.087
  660   HH21  ARG  77          HH21      ARG  77  91.544   1.322 -10.675
  661   HH22  ARG  77          HH22      ARG  77  91.374   0.973 -12.343
  662    H    HIS  78           HN       HIS  78  91.315  -4.514  -6.886
  663    HA   HIS  78           HA       HIS  78  92.433  -3.313  -4.505
  664    HB2  HIS  78           HB2      HIS  78  93.461  -5.506  -3.939
  665    HB3  HIS  78           HB1      HIS  78  91.692  -5.537  -3.957
  666    HD1  HIS  78           HD1      HIS  78  94.538  -7.507  -4.830
  667    HD2  HIS  78           HD2      HIS  78  90.894  -6.634  -6.469
  668    HE1  HIS  78           HE1      HIS  78  94.098  -9.401  -6.436
  669    H    TYR  79           HN       TYR  79  93.414  -1.843  -5.688
  670    HA   TYR  79           HA       TYR  79  95.487  -2.807  -7.484
  671    HB2  TYR  79           HB2      TYR  79  93.848  -0.304  -7.543
  672    HB3  TYR  79           HB1      TYR  79  95.321  -0.477  -8.485
  673    HD1  TYR  79           HD1      TYR  79  92.303  -2.676  -7.821
  674    HD2  TYR  79           HD2      TYR  79  94.948  -0.936 -10.675
  675    HE1  TYR  79           HE1      TYR  79  91.077  -3.768  -9.628
  676    HE2  TYR  79           HE2      TYR  79  93.723  -2.044 -12.486
  677    HH   TYR  79           HH       TYR  79  92.285  -3.988 -12.786
  678    H    SER  80           HN       SER  80  97.436  -2.458  -6.979
  679    HA   SER  80           HA       SER  80  98.333  -0.197  -5.523
  680    HB2  SER  80           HB2      SER  80  99.365  -1.619  -3.697
  681    HB3  SER  80           HB1      SER  80  97.613  -1.458  -3.609
  682    HG   SER  80           HG       SER  80  98.830  -3.601  -4.957
  Start of MODEL    7
    1    H1   GLY  -1           HT1      GLY  -1  60.457  -2.292   5.428
    2    H2   GLY  -1           HT2      GLY  -1  61.226  -3.662   4.762
    3    H3   GLY  -1           HT3      GLY  -1  59.556  -3.547   4.820
    4    HA2  GLY  -1           HA1      GLY  -1  59.429  -1.781   3.302
    5    HA3  GLY  -1           HA2      GLY  -1  61.181  -1.618   3.306
    6    H    ALA   0           HN       ALA   0  59.166  -4.580   3.049
    7    HA   ALA   0           HA       ALA   0  60.486  -5.029   0.472
    8    HB1  ALA   0           HB1      ALA   0  59.792  -7.043   2.608
    9    HB2  ALA   0           HB2      ALA   0  61.410  -6.481   2.188
   10    HB3  ALA   0           HB3      ALA   0  60.474  -7.425   1.028
   11    H    MET   1           HN       MET   1  57.881  -3.825   1.178
   12    HA   MET   1           HA       MET   1  55.990  -5.756   0.034
   13    HB2  MET   1           HB2      MET   1  54.285  -4.508   1.158
   14    HB3  MET   1           HB1      MET   1  55.570  -4.752   2.330
   15    HG2  MET   1           HG2      MET   1  55.048  -2.217   0.768
   16    HG3  MET   1           HG1      MET   1  54.659  -2.489   2.461
   17    HE1  MET   1           HE1      MET   1  57.667   0.173   2.107
   18    HE2  MET   1           HE2      MET   1  55.933   0.002   2.423
   19    HE3  MET   1           HE3      MET   1  56.571  -0.232   0.787
   20    H    PHE   2           HN       PHE   2  57.964  -4.060  -1.318
   21    HA   PHE   2           HA       PHE   2  56.744  -1.730  -2.234
   22    HB2  PHE   2           HB2      PHE   2  59.309  -2.943  -2.771
   23    HB3  PHE   2           HB1      PHE   2  58.637  -2.187  -4.213
   24    HD1  PHE   2           HD1      PHE   2  58.562  -1.384  -0.596
   25    HD2  PHE   2           HD2      PHE   2  59.498   0.010  -4.543
   26    HE1  PHE   2           HE1      PHE   2  59.111   0.828   0.269
   27    HE2  PHE   2           HE2      PHE   2  60.030   2.129  -3.682
   28    HZ   PHE   2           HZ       PHE   2  59.836   2.601  -1.275
   29    H    GLN   3           HN       GLN   3  55.470  -1.227  -3.735
   30    HA   GLN   3           HA       GLN   3  54.473  -3.326  -5.473
   31    HB2  GLN   3           HB2      GLN   3  52.570  -1.751  -5.910
   32    HB3  GLN   3           HB1      GLN   3  52.685  -2.361  -4.276
   33    HG2  GLN   3           HG2      GLN   3  52.061  -0.036  -4.225
   34    HG3  GLN   3           HG1      GLN   3  53.682  -0.210  -3.565
   35   HE21  GLN   3          HE21      GLN   3  52.764  -0.228  -6.936
   36   HE22  GLN   3          HE22      GLN   3  53.700   1.119  -7.379
   37    H    ASP   4           HN       ASP   4  54.008  -3.148  -7.520
   38    HA   ASP   4           HA       ASP   4  56.023  -1.712  -9.069
   39    HB2  ASP   4           HB2      ASP   4  55.721  -4.131  -9.514
   40    HB3  ASP   4           HB1      ASP   4  54.007  -3.888  -9.796
   41    HA   PRO   5           HA       PRO   5  56.211  -1.141 -11.049
   42    HB2  PRO   5           HB2      PRO   5  56.386   1.244 -12.468
   43    HB3  PRO   5           HB1      PRO   5  55.784  -0.292 -13.093
   44    HG2  PRO   5           HG2      PRO   5  54.280   2.087 -12.642
   45    HG3  PRO   5           HG1      PRO   5  53.645   0.506 -13.106
   46    HD2  PRO   5           HD2      PRO   5  53.782   1.794 -10.441
   47    HD3  PRO   5           HD1      PRO   5  52.620   0.602 -11.056
   48    H    GLN   6           HN       GLN   6  56.011   2.346 -10.828
   49    HA   GLN   6           HA       GLN   6  57.276   3.954  -9.932
   50    HB2  GLN   6           HB2      GLN   6  56.976   1.971  -7.867
   51    HB3  GLN   6           HB1      GLN   6  57.901   3.443  -7.439
   52    HG2  GLN   6           HG2      GLN   6  55.020   3.091  -8.264
   53    HG3  GLN   6           HG1      GLN   6  55.629   3.707  -6.726
   54   HE21  GLN   6          HE21      GLN   6  56.555   5.763  -6.685
   55   HE22  GLN   6          HE22      GLN   6  56.191   6.959  -7.870
   56    H    GLU   7           HN       GLU   7  58.788   1.345 -10.999
   57    HA   GLU   7           HA       GLU   7  60.654   0.494 -11.325
   58    HB2  GLU   7           HB2      GLU   7  60.980   2.480 -12.546
   59    HB3  GLU   7           HB1      GLU   7  61.495   3.306 -11.075
   60    HG2  GLU   7           HG2      GLU   7  63.312   1.697 -10.925
   61    HG3  GLU   7           HG1      GLU   7  62.876   1.042 -12.489
   62    H    ARG   8           HN       ARG   8  60.854   2.352  -8.607
   63    HA   ARG   8           HA       ARG   8  61.928   2.228  -6.582
   64    HB2  ARG   8           HB2      ARG   8  62.840  -0.557  -7.487
   65    HB3  ARG   8           HB1      ARG   8  63.193   0.169  -5.919
   66    HG2  ARG   8           HG2      ARG   8  61.298  -0.367  -5.066
   67    HG3  ARG   8           HG1      ARG   8  60.347   0.126  -6.501
   68    HD2  ARG   8           HD2      ARG   8  61.918  -2.446  -6.163
   69    HD3  ARG   8           HD1      ARG   8  60.178  -2.299  -5.929
   70    HE   ARG   8           HE       ARG   8  61.031  -1.373  -8.486
   71   HH11  ARG   8          HH11      ARG   8  60.385  -4.418  -6.745
   72   HH12  ARG   8          HH12      ARG   8  59.768  -5.228  -8.094
   73   HH21  ARG   8          HH21      ARG   8  60.137  -2.510 -10.362
   74   HH22  ARG   8          HH22      ARG   8  59.624  -4.114 -10.207
   75    HA   PRO   9           HA       PRO   9  65.603   4.128  -8.179
   76    HB2  PRO   9           HB2      PRO   9  66.507   5.156  -5.853
   77    HB3  PRO   9           HB1      PRO   9  65.219   5.941  -6.706
   78    HG2  PRO   9           HG2      PRO   9  65.231   4.252  -4.327
   79    HG3  PRO   9           HG1      PRO   9  64.031   5.495  -4.777
   80    HD2  PRO   9           HD2      PRO   9  63.857   2.768  -4.799
   81    HD3  PRO   9           HD1      PRO   9  62.656   3.763  -5.599
   82    H    ARG  10           HN       ARG  10  68.042   4.420  -7.301
   83    HA   ARG  10           HA       ARG  10  68.810   1.904  -6.043
   84    HB2  ARG  10           HB2      ARG  10  70.287   3.703  -7.932
   85    HB3  ARG  10           HB1      ARG  10  70.980   2.306  -7.121
   86    HG2  ARG  10           HG2      ARG  10  68.623   2.204  -8.997
   87    HG3  ARG  10           HG1      ARG  10  70.311   1.902  -9.407
   88    HD2  ARG  10           HD2      ARG  10  68.920   0.313  -7.273
   89    HD3  ARG  10           HD1      ARG  10  68.825  -0.128  -8.973
   90    HE   ARG  10           HE       ARG  10  71.513   0.262  -8.131
   91   HH11  ARG  10          HH11      ARG  10  68.887  -2.122  -8.246
   92   HH12  ARG  10          HH12      ARG  10  69.898  -3.468  -8.013
   93   HH21  ARG  10          HH21      ARG  10  72.906  -1.564  -7.885
   94   HH22  ARG  10          HH22      ARG  10  72.261  -3.154  -7.865
   95    H    LYS  11           HN       LYS  11  68.171   5.008  -5.437
   96    HA   LYS  11           HA       LYS  11  70.460   5.377  -3.664
   97    HB2  LYS  11           HB2      LYS  11  68.573   7.535  -4.562
   98    HB3  LYS  11           HB1      LYS  11  70.143   7.642  -3.844
   99    HG2  LYS  11           HG2      LYS  11  69.772   6.466  -6.558
  100    HG3  LYS  11           HG1      LYS  11  70.074   8.176  -6.334
  101    HD2  LYS  11           HD2      LYS  11  72.148   7.547  -5.102
  102    HD3  LYS  11           HD1      LYS  11  71.808   5.860  -5.510
  103    HE2  LYS  11           HE2      LYS  11  71.897   6.443  -7.910
  104    HE3  LYS  11           HE1      LYS  11  72.283   8.107  -7.478
  105    HZ1  LYS  11           HZ1      LYS  11  73.974   5.708  -6.982
  106    HZ2  LYS  11           HZ2      LYS  11  74.331   7.215  -6.375
  107    HZ3  LYS  11           HZ3      LYS  11  74.287   6.970  -8.048
  108    H    LEU  12           HN       LEU  12  70.025   5.617  -1.601
  109    HA   LEU  12           HA       LEU  12  67.714   4.703  -0.428
  110    HB2  LEU  12           HB2      LEU  12  69.694   4.492   0.723
  111    HB3  LEU  12           HB1      LEU  12  70.074   6.201   0.602
  112    HG   LEU  12           HG       LEU  12  68.266   6.693   2.166
  113   HD11  LEU  12          HD11      LEU  12  66.861   4.729   1.658
  114   HD12  LEU  12          HD12      LEU  12  67.227   4.937   3.390
  115   HD13  LEU  12          HD13      LEU  12  68.102   3.719   2.434
  116   HD21  LEU  12          HD21      LEU  12  70.579   6.211   2.874
  117   HD22  LEU  12          HD22      LEU  12  70.011   4.568   3.242
  118   HD23  LEU  12          HD23      LEU  12  69.331   5.950   4.092
  119    HA   PRO  13           HA       PRO  13  66.466   9.166   0.933
  120    HB2  PRO  13           HB2      PRO  13  67.278  11.292  -0.571
  121    HB3  PRO  13           HB1      PRO  13  68.249  10.623   0.759
  122    HG2  PRO  13           HG2      PRO  13  68.516  10.077  -2.171
  123    HG3  PRO  13           HG1      PRO  13  69.768  10.547  -1.007
  124    HD2  PRO  13           HD2      PRO  13  69.404   7.988  -1.703
  125    HD3  PRO  13           HD1      PRO  13  69.845   8.420  -0.051
  126    H    GLN  14           HN       GLN  14  66.951   8.648  -2.458
  127    HA   GLN  14           HA       GLN  14  64.532   9.811  -3.323
  128    HB2  GLN  14           HB2      GLN  14  66.298   7.773  -4.677
  129    HB3  GLN  14           HB1      GLN  14  64.998   8.654  -5.460
  130    HG2  GLN  14           HG2      GLN  14  66.195  10.777  -4.888
  131    HG3  GLN  14           HG1      GLN  14  67.543   9.793  -4.333
  132   HE21  GLN  14          HE21      GLN  14  67.112   7.805  -6.521
  133   HE22  GLN  14          HE22      GLN  14  67.694   8.595  -7.928
  134    H    LEU  15           HN       LEU  15  65.402   6.548  -2.242
  135    HA   LEU  15           HA       LEU  15  62.986   5.308  -2.943
  136    HB2  LEU  15           HB2      LEU  15  65.090   4.163  -2.378
  137    HB3  LEU  15           HB1      LEU  15  64.988   4.803  -0.807
  138    HG   LEU  15           HG       LEU  15  62.985   3.632  -0.315
  139   HD11  LEU  15          HD11      LEU  15  62.093   3.424  -2.648
  140   HD12  LEU  15          HD12      LEU  15  62.152   1.885  -1.815
  141   HD13  LEU  15          HD13      LEU  15  63.373   2.256  -3.019
  142   HD21  LEU  15          HD21      LEU  15  65.098   2.765   0.214
  143   HD22  LEU  15          HD22      LEU  15  65.251   2.052  -1.385
  144   HD23  LEU  15          HD23      LEU  15  64.034   1.416  -0.247
  145    H    CYS  16           HN       CYS  16  64.127   6.977  -0.110
  146    HA   CYS  16           HA       CYS  16  62.030   6.432   1.641
  147    HB2  CYS  16           HB2      CYS  16  63.619   9.013   1.392
  148    HB3  CYS  16           HB1      CYS  16  62.659   8.563   2.772
  149    HG   CYS  16           HG       CYS  16  65.382   6.791   1.666
  150    H    THR  17           HN       THR  17  62.225   8.734  -0.939
  151    HA   THR  17           HA       THR  17  59.925  10.248  -0.699
  152    HB   THR  17           HB       THR  17  61.450   9.146  -2.982
  153    HG1  THR  17           HG1      THR  17  62.172  11.239  -3.220
  154   HG21  THR  17          HG21      THR  17  59.045  10.965  -3.250
  155   HG22  THR  17          HG22      THR  17  59.306   9.342  -3.941
  156   HG23  THR  17          HG23      THR  17  60.247  10.704  -4.529
  157    H    GLU  18           HN       GLU  18  60.390   7.061  -2.096
  158    HA   GLU  18           HA       GLU  18  57.831   6.620  -3.065
  159    HB2  GLU  18           HB2      GLU  18  60.177   5.079  -2.360
  160    HB3  GLU  18           HB1      GLU  18  58.751   4.219  -2.921
  161    HG2  GLU  18           HG2      GLU  18  60.296   6.411  -4.277
  162    HG3  GLU  18           HG1      GLU  18  60.303   4.733  -4.767
  163    H    LEU  19           HN       LEU  19  59.478   5.497  -0.124
  164    HA   LEU  19           HA       LEU  19  57.219   4.307   1.030
  165    HB2  LEU  19           HB2      LEU  19  59.802   5.299   2.045
  166    HB3  LEU  19           HB1      LEU  19  58.683   4.580   3.141
  167    HG   LEU  19           HG       LEU  19  58.893   2.655   1.222
  168   HD11  LEU  19          HD11      LEU  19  61.215   2.427   0.639
  169   HD12  LEU  19          HD12      LEU  19  61.587   3.937   1.464
  170   HD13  LEU  19          HD13      LEU  19  60.583   3.953   0.017
  171   HD21  LEU  19          HD21      LEU  19  59.024   2.244   3.523
  172   HD22  LEU  19          HD22      LEU  19  60.503   3.193   3.624
  173   HD23  LEU  19          HD23      LEU  19  60.523   1.623   2.784
  174    H    GLN  20           HN       GLN  20  57.779   7.558   0.517
  175    HA   GLN  20           HA       GLN  20  56.776   9.447   1.231
  176    HB2  GLN  20           HB2      GLN  20  54.920   7.369   2.207
  177    HB3  GLN  20           HB1      GLN  20  54.560   9.076   2.527
  178    HG2  GLN  20           HG2      GLN  20  54.933   7.773  -0.161
  179    HG3  GLN  20           HG1      GLN  20  53.381   8.248   0.548
  180   HE21  GLN  20          HE21      GLN  20  52.936  10.458   0.749
  181   HE22  GLN  20          HE22      GLN  20  53.755  11.637  -0.203
  182    H    THR  21           HN       THR  21  58.834   8.371   2.747
  183    HA   THR  21           HA       THR  21  58.319   9.645   5.287
  184    HB   THR  21           HB       THR  21  57.790   7.165   5.515
  185    HG1  THR  21           HG1      THR  21  58.851   7.022   7.496
  186   HG21  THR  21          HG21      THR  21  59.577   6.285   4.029
  187   HG22  THR  21          HG22      THR  21  59.664   5.576   5.642
  188   HG23  THR  21          HG23      THR  21  60.787   6.850   5.180
  189    H    THR  22           HN       THR  22  60.787   9.052   6.460
  190    HA   THR  22           HA       THR  22  62.703   9.939   4.407
  191    HB   THR  22           HB       THR  22  63.236  10.813   7.146
  192    HG1  THR  22           HG1      THR  22  61.118  12.036   5.615
  193   HG21  THR  22          HG21      THR  22  63.743  12.927   5.923
  194   HG22  THR  22          HG22      THR  22  63.129  12.170   4.440
  195   HG23  THR  22          HG23      THR  22  64.555  11.522   5.236
  196    H    ILE  23           HN       ILE  23  65.061   9.759   5.573
  197    HA   ILE  23           HA       ILE  23  65.649   7.115   5.739
  198    HB   ILE  23           HB       ILE  23  67.244   9.315   6.947
  199   HG12  ILE  23          HG12      ILE  23  66.741   8.489   4.146
  200   HG13  ILE  23          HG11      ILE  23  66.679  10.050   4.866
  201   HG21  ILE  23          HG21      ILE  23  67.983   6.659   5.660
  202   HG22  ILE  23          HG22      ILE  23  68.088   7.022   7.388
  203   HG23  ILE  23          HG23      ILE  23  69.162   7.840   6.243
  204   HD11  ILE  23          HD11      ILE  23  69.134   8.454   4.338
  205   HD12  ILE  23          HD12      ILE  23  69.145  10.061   5.078
  206   HD13  ILE  23          HD13      ILE  23  68.626   9.847   3.385
  207    H    HIS  24           HN       HIS  24  64.557   9.265   8.032
  208    HA   HIS  24           HA       HIS  24  65.810   8.458  10.430
  209    HB2  HIS  24           HB2      HIS  24  63.348  10.167  10.110
  210    HB3  HIS  24           HB1      HIS  24  64.586  10.342  11.325
  211    HD1  HIS  24           HD1      HIS  24  66.896  10.203   9.050
  212    HD2  HIS  24           HD2      HIS  24  63.694  12.730   9.293
  213    HE1  HIS  24           HE1      HIS  24  67.281  11.841   7.194
  214    H    ASP  25           HN       ASP  25  63.333   7.323   8.566
  215    HA   ASP  25           HA       ASP  25  61.882   6.024  10.788
  216    HB2  ASP  25           HB2      ASP  25  60.750   8.122   9.982
  217    HB3  ASP  25           HB1      ASP  25  60.655   7.377   8.425
  218    H    ILE  26           HN       ILE  26  62.854   6.026   7.415
  219    HA   ILE  26           HA       ILE  26  61.432   3.967   6.296
  220    HB   ILE  26           HB       ILE  26  62.822   5.427   4.943
  221   HG12  ILE  26          HG12      ILE  26  63.933   2.661   4.736
  222   HG13  ILE  26          HG11      ILE  26  62.341   2.973   4.143
  223   HG21  ILE  26          HG21      ILE  26  64.669   5.637   6.538
  224   HG22  ILE  26          HG22      ILE  26  65.247   5.217   4.911
  225   HG23  ILE  26          HG23      ILE  26  65.160   3.984   6.172
  226   HD11  ILE  26          HD11      ILE  26  64.934   4.147   3.170
  227   HD12  ILE  26          HD12      ILE  26  63.348   4.640   2.560
  228   HD13  ILE  26          HD13      ILE  26  63.907   2.968   2.362
  229    H    ILE  27           HN       ILE  27  61.345   1.867   6.351
  230    HA   ILE  27           HA       ILE  27  63.460   0.456   7.686
  231    HB   ILE  27           HB       ILE  27  60.616  -0.315   7.067
  232   HG12  ILE  27          HG12      ILE  27  60.852   1.259   8.920
  233   HG13  ILE  27          HG11      ILE  27  60.271  -0.314   9.440
  234   HG21  ILE  27          HG21      ILE  27  62.754  -1.910   8.444
  235   HG22  ILE  27          HG22      ILE  27  62.074  -2.217   6.843
  236   HG23  ILE  27          HG23      ILE  27  61.057  -2.382   8.281
  237   HD11  ILE  27          HD11      ILE  27  63.082   0.756   9.748
  238   HD12  ILE  27          HD12      ILE  27  62.549  -0.845  10.247
  239   HD13  ILE  27          HD13      ILE  27  61.884   0.586  11.033
  240    H    LEU  28           HN       LEU  28  64.916   0.228   6.515
  241    HA   LEU  28           HA       LEU  28  64.499  -1.055   3.943
  242    HB2  LEU  28           HB2      LEU  28  66.092   1.047   4.785
  243    HB3  LEU  28           HB1      LEU  28  67.169  -0.327   4.564
  244    HG   LEU  28           HG       LEU  28  66.478  -0.621   2.321
  245   HD11  LEU  28          HD11      LEU  28  64.718   1.290   1.629
  246   HD12  LEU  28          HD12      LEU  28  64.257   0.988   3.353
  247   HD13  LEU  28          HD13      LEU  28  64.237  -0.312   2.183
  248   HD21  LEU  28          HD21      LEU  28  67.118   1.501   1.363
  249   HD22  LEU  28          HD22      LEU  28  68.082   1.255   2.834
  250   HD23  LEU  28          HD23      LEU  28  66.690   2.318   2.854
  251    H    GLU  29           HN       GLU  29  65.369  -3.153   3.717
  252    HA   GLU  29           HA       GLU  29  66.641  -3.777   6.278
  253    HB2  GLU  29           HB2      GLU  29  65.880  -6.064   5.928
  254    HB3  GLU  29           HB1      GLU  29  64.728  -4.896   6.627
  255    HG2  GLU  29           HG2      GLU  29  64.300  -4.654   4.068
  256    HG3  GLU  29           HG1      GLU  29  64.746  -6.394   4.235
  257    H    CYS  30           HN       CYS  30  67.960  -6.031   6.196
  258    HA   CYS  30           HA       CYS  30  69.715  -5.663   4.100
  259    HB2  CYS  30           HB2      CYS  30  70.337  -6.681   6.364
  260    HB3  CYS  30           HB1      CYS  30  69.513  -8.117   5.803
  261    H    VAL  31           HN       VAL  31  69.641  -6.357   2.374
  262    HA   VAL  31           HA       VAL  31  67.697  -7.886   1.067
  263    HB   VAL  31           HB       VAL  31  68.915  -6.349  -0.280
  264   HG11  VAL  31          HG11      VAL  31  71.352  -7.433   0.993
  265   HG12  VAL  31          HG12      VAL  31  70.698  -5.752   1.033
  266   HG13  VAL  31          HG13      VAL  31  71.296  -6.481  -0.473
  267   HG21  VAL  31          HG21      VAL  31  68.752  -8.293  -1.565
  268   HG22  VAL  31          HG22      VAL  31  70.212  -8.966  -0.823
  269   HG23  VAL  31          HG23      VAL  31  70.309  -7.523  -1.850
  270    H    TYR  32           HN       TYR  32  70.698  -8.630   2.463
  271    HA   TYR  32           HA       TYR  32  70.727 -11.336   1.510
  272    HB2  TYR  32           HB2      TYR  32  72.830  -9.995   3.200
  273    HB3  TYR  32           HB1      TYR  32  73.006 -11.461   2.236
  274    HD1  TYR  32           HD2      TYR  32  71.851 -10.870  -0.331
  275    HD2  TYR  32           HD1      TYR  32  74.044  -8.259   2.252
  276    HE1  TYR  32           HE2      TYR  32  72.391  -9.583  -2.176
  277    HE2  TYR  32           HE1      TYR  32  74.614  -6.820   0.333
  278    HH   TYR  32           HH       TYR  32  74.826  -7.246  -2.226
  279    H    CYS  33           HN       CYS  33  70.576  -9.603   4.685
  280    HA   CYS  33           HA       CYS  33  70.518 -12.155   6.186
  281    HB2  CYS  33           HB2      CYS  33  70.593  -9.342   7.210
  282    HB3  CYS  33           HB1      CYS  33  70.686 -10.798   8.191
  283    H    LYS  34           HN       LYS  34  68.401  -9.744   5.037
  284    HA   LYS  34           HA       LYS  34  66.369  -9.285   5.201
  285    HB2  LYS  34           HB2      LYS  34  66.176 -11.948   6.568
  286    HB3  LYS  34           HB1      LYS  34  64.767 -10.972   6.181
  287    HG2  LYS  34           HG2      LYS  34  65.056 -12.611   4.497
  288    HG3  LYS  34           HG1      LYS  34  65.440 -11.036   3.800
  289    HD2  LYS  34           HD2      LYS  34  67.781 -11.552   3.921
  290    HD3  LYS  34           HD1      LYS  34  67.445 -13.045   4.786
  291    HE2  LYS  34           HE2      LYS  34  67.934 -13.510   2.447
  292    HE3  LYS  34           HE1      LYS  34  66.248 -13.877   2.802
  293    HZ1  LYS  34           HZ1      LYS  34  66.461 -12.742   0.729
  294    HZ2  LYS  34           HZ2      LYS  34  67.254 -11.439   1.444
  295    HZ3  LYS  34           HZ3      LYS  34  65.625 -11.756   1.808
  296    H    GLN  35           HN       GLN  35  68.316  -8.719   7.580
  297    HA   GLN  35           HA       GLN  35  66.432  -8.229   9.670
  298    HB2  GLN  35           HB2      GLN  35  68.202  -7.695  10.886
  299    HB3  GLN  35           HB1      GLN  35  68.577  -9.228  10.129
  300    HG2  GLN  35           HG2      GLN  35  70.110  -8.054   8.607
  301    HG3  GLN  35           HG1      GLN  35  69.682  -6.529   9.395
  302   HE21  GLN  35          HE21      GLN  35  69.385  -7.777  11.960
  303   HE22  GLN  35          HE22      GLN  35  70.916  -8.124  12.549
  304    H    GLN  36           HN       GLN  36  65.589  -6.240  10.005
  305    HA   GLN  36           HA       GLN  36  65.894  -4.207   8.196
  306    HB2  GLN  36           HB2      GLN  36  64.726  -4.519  10.903
  307    HB3  GLN  36           HB1      GLN  36  64.607  -3.042   9.962
  308    HG2  GLN  36           HG2      GLN  36  63.438  -4.069   8.253
  309    HG3  GLN  36           HG1      GLN  36  63.867  -5.661   8.844
  310   HE21  GLN  36          HE21      GLN  36  63.158  -4.958  11.644
  311   HE22  GLN  36          HE22      GLN  36  61.440  -4.878  11.694
  312    H    LEU  37           HN       LEU  37  67.320  -2.781   8.073
  313    HA   LEU  37           HA       LEU  37  69.537  -2.564   9.805
  314    HB2  LEU  37           HB2      LEU  37  68.603  -0.865   7.506
  315    HB3  LEU  37           HB1      LEU  37  69.802  -0.367   8.626
  316    HG   LEU  37           HG       LEU  37  71.114  -2.427   8.118
  317   HD11  LEU  37          HD11      LEU  37  69.106  -2.711   5.917
  318   HD12  LEU  37          HD12      LEU  37  69.476  -3.865   7.201
  319   HD13  LEU  37          HD13      LEU  37  70.670  -3.512   5.949
  320   HD21  LEU  37          HD21      LEU  37  70.608  -0.457   5.909
  321   HD22  LEU  37          HD22      LEU  37  71.996  -1.538   5.994
  322   HD23  LEU  37          HD23      LEU  37  71.767  -0.297   7.228
  323    H    LEU  38           HN       LEU  38  70.247  -1.255  11.199
  324    HA   LEU  38           HA       LEU  38  68.523   0.083  12.981
  325    HB2  LEU  38           HB2      LEU  38  71.116  -0.935  12.794
  326    HB3  LEU  38           HB1      LEU  38  71.307   0.781  12.786
  327    HG   LEU  38           HG       LEU  38  69.846  -0.715  14.905
  328   HD11  LEU  38          HD11      LEU  38  71.885  -0.385  16.264
  329   HD12  LEU  38          HD12      LEU  38  72.665   0.342  14.850
  330   HD13  LEU  38          HD13      LEU  38  72.169  -1.351  14.805
  331   HD21  LEU  38          HD21      LEU  38  70.872   2.125  14.813
  332   HD22  LEU  38          HD22      LEU  38  70.113   1.364  16.214
  333   HD23  LEU  38          HD23      LEU  38  69.182   1.627  14.736
  334    H    ARG  39           HN       ARG  39  67.986   2.326  12.762
  335    HA   ARG  39           HA       ARG  39  68.174   3.556  10.307
  336    HB2  ARG  39           HB2      ARG  39  67.323   5.557  11.196
  337    HB3  ARG  39           HB1      ARG  39  66.730   4.333  12.295
  338    HG2  ARG  39           HG2      ARG  39  69.191   5.962  12.804
  339    HG3  ARG  39           HG1      ARG  39  67.594   6.480  13.333
  340    HD2  ARG  39           HD2      ARG  39  67.400   4.519  14.765
  341    HD3  ARG  39           HD1      ARG  39  68.924   3.882  14.140
  342    HE   ARG  39           HE       ARG  39  69.666   6.244  15.062
  343   HH11  ARG  39          HH11      ARG  39  67.733   3.704  16.692
  344   HH12  ARG  39          HH12      ARG  39  68.318   4.124  18.232
  345   HH21  ARG  39          HH21      ARG  39  70.424   6.744  17.230
  346   HH22  ARG  39          HH22      ARG  39  69.843   5.838  18.538
  347    H    ARG  40           HN       ARG  40  70.641   3.644  12.851
  348    HA   ARG  40           HA       ARG  40  72.203   5.714  11.956
  349    HB2  ARG  40           HB2      ARG  40  72.246   4.311  14.077
  350    HB3  ARG  40           HB1      ARG  40  73.153   3.156  13.105
  351    HG2  ARG  40           HG2      ARG  40  74.770   4.901  12.607
  352    HG3  ARG  40           HG1      ARG  40  73.885   5.972  13.701
  353    HD2  ARG  40           HD2      ARG  40  75.698   5.022  14.972
  354    HD3  ARG  40           HD1      ARG  40  74.176   4.249  15.462
  355    HE   ARG  40           HE       ARG  40  74.944   2.550  13.620
  356   HH11  ARG  40          HH11      ARG  40  76.936   3.946  16.196
  357   HH12  ARG  40          HH12      ARG  40  78.055   2.652  16.163
  358   HH21  ARG  40          HH21      ARG  40  76.400   0.903  13.572
  359   HH22  ARG  40          HH22      ARG  40  77.763   0.863  14.609
  360    H    GLU  41           HN       GLU  41  72.147   2.249  11.108
  361    HA   GLU  41           HA       GLU  41  74.391   2.321   9.270
  362    HB2  GLU  41           HB2      GLU  41  72.143   0.312   9.427
  363    HB3  GLU  41           HB1      GLU  41  73.727  -0.027   8.819
  364    HG2  GLU  41           HG2      GLU  41  72.773   0.166  11.648
  365    HG3  GLU  41           HG1      GLU  41  73.661  -1.091  10.832
  366    H    VAL  42           HN       VAL  42  70.936   2.685   9.126
  367    HA   VAL  42           HA       VAL  42  70.720   2.589   6.298
  368    HB   VAL  42           HB       VAL  42  68.888   4.232   8.086
  369   HG11  VAL  42          HG11      VAL  42  67.234   3.731   6.418
  370   HG12  VAL  42          HG12      VAL  42  68.342   2.605   5.658
  371   HG13  VAL  42          HG13      VAL  42  68.683   4.359   5.590
  372   HG21  VAL  42          HG21      VAL  42  68.691   1.287   7.509
  373   HG22  VAL  42          HG22      VAL  42  67.496   2.255   8.370
  374   HG23  VAL  42          HG23      VAL  42  69.098   1.996   9.070
  375    H    TYR  43           HN       TYR  43  71.123   5.318   8.627
  376    HA   TYR  43           HA       TYR  43  71.305   7.379   6.799
  377    HB2  TYR  43           HB2      TYR  43  72.690   6.973   9.416
  378    HB3  TYR  43           HB1      TYR  43  72.995   8.421   8.432
  379    HD1  TYR  43           HD2      TYR  43  70.569   9.368   7.566
  380    HD2  TYR  43           HD1      TYR  43  71.308   7.203  11.117
  381    HE1  TYR  43           HE2      TYR  43  68.529  10.286   8.551
  382    HE2  TYR  43           HE1      TYR  43  69.277   8.098  12.105
  383    HH   TYR  43           HH       TYR  43  67.884  10.077  11.822
  384    H    ASP  44           HN       ASP  44  73.834   5.073   7.707
  385    HA   ASP  44           HA       ASP  44  76.049   6.271   6.616
  386    HB2  ASP  44           HB2      ASP  44  75.253   3.383   6.753
  387    HB3  ASP  44           HB1      ASP  44  76.802   3.895   6.274
  388    H    PHE  45           HN       PHE  45  73.590   4.418   5.192
  389    HA   PHE  45           HA       PHE  45  74.761   3.813   2.776
  390    HB2  PHE  45           HB2      PHE  45  72.493   3.170   4.087
  391    HB3  PHE  45           HB1      PHE  45  71.907   4.347   2.939
  392    HD1  PHE  45           HD2      PHE  45  73.692   1.099   3.230
  393    HD2  PHE  45           HD1      PHE  45  71.622   3.916   0.779
  394    HE1  PHE  45           HE2      PHE  45  73.503  -0.561   1.434
  395    HE2  PHE  45           HE1      PHE  45  71.470   2.258  -0.993
  396    HZ   PHE  45           HZ       PHE  45  72.358   0.046  -0.683
  397    H    ALA  46           HN       ALA  46  72.582   6.515   3.688
  398    HA   ALA  46           HA       ALA  46  72.954   7.840   1.120
  399    HB1  ALA  46           HB1      ALA  46  71.440   9.554   1.971
  400    HB2  ALA  46           HB2      ALA  46  71.400   8.716   3.525
  401    HB3  ALA  46           HB3      ALA  46  70.737   7.946   2.074
  402    H    ARG  47           HN       ARG  47  74.361   7.997   4.274
  403    HA   ARG  47           HA       ARG  47  75.318  10.654   4.051
  404    HB2  ARG  47           HB2      ARG  47  75.698   8.369   5.843
  405    HB3  ARG  47           HB1      ARG  47  77.135   9.337   5.777
  406    HG2  ARG  47           HG2      ARG  47  75.714   9.981   7.613
  407    HG3  ARG  47           HG1      ARG  47  75.853  11.301   6.459
  408    HD2  ARG  47           HD2      ARG  47  73.684  10.743   5.525
  409    HD3  ARG  47           HD1      ARG  47  73.547   9.366   6.605
  410    HE   ARG  47           HE       ARG  47  73.668  11.093   8.430
  411   HH11  ARG  47          HH11      ARG  47  72.369  11.914   5.244
  412   HH12  ARG  47          HH12      ARG  47  71.209  12.996   5.814
  413   HH21  ARG  47          HH21      ARG  47  72.048  12.618   9.233
  414   HH22  ARG  47          HH22      ARG  47  71.039  13.438   8.147
  415    H    ARG  48           HN       ARG  48  76.349   7.621   2.927
  416    HA   ARG  48           HA       ARG  48  78.547   8.840   1.395
  417    HB2  ARG  48           HB2      ARG  48  77.659   6.033   1.853
  418    HB3  ARG  48           HB1      ARG  48  79.084   6.484   0.926
  419    HG2  ARG  48           HG2      ARG  48  80.175   7.256   2.892
  420    HG3  ARG  48           HG1      ARG  48  78.691   7.085   3.839
  421    HD2  ARG  48           HD2      ARG  48  80.064   4.799   2.452
  422    HD3  ARG  48           HD1      ARG  48  80.321   5.218   4.133
  423    HE   ARG  48           HE       ARG  48  77.596   4.853   3.511
  424   HH11  ARG  48          HH11      ARG  48  80.583   3.326   4.529
  425   HH12  ARG  48          HH12      ARG  48  79.893   1.942   5.215
  426   HH21  ARG  48          HH21      ARG  48  76.541   2.904   4.375
  427   HH22  ARG  48          HH22      ARG  48  77.491   1.699   5.106
  428    H    ASP  49           HN       ASP  49  78.183   6.738  -0.718
  429    HA   ASP  49           HA       ASP  49  75.408   7.093  -1.500
  430    HB2  ASP  49           HB2      ASP  49  76.786   8.868  -2.702
  431    HB3  ASP  49           HB1      ASP  49  77.598   7.549  -3.538
  432    H    LEU  50           HN       LEU  50  75.354   4.966  -0.788
  433    HA   LEU  50           HA       LEU  50  76.668   3.078  -2.528
  434    HB2  LEU  50           HB2      LEU  50  75.051   2.570  -0.001
  435    HB3  LEU  50           HB1      LEU  50  75.890   1.341  -0.922
  436    HG   LEU  50           HG       LEU  50  78.026   2.608  -0.414
  437   HD11  LEU  50          HD11      LEU  50  78.043   4.007   1.529
  438   HD12  LEU  50          HD12      LEU  50  76.269   3.978   1.535
  439   HD13  LEU  50          HD13      LEU  50  77.144   4.659   0.159
  440   HD21  LEU  50          HD21      LEU  50  77.665   0.572   0.804
  441   HD22  LEU  50          HD22      LEU  50  76.491   1.397   1.844
  442   HD23  LEU  50          HD23      LEU  50  78.196   1.852   1.930
  443    H    CYS  51           HN       CYS  51  75.237   1.295  -3.357
  444    HA   CYS  51           HA       CYS  51  72.742   2.553  -4.188
  445    HB2  CYS  51           HB2      CYS  51  72.813   0.927  -6.078
  446    HB3  CYS  51           HB1      CYS  51  74.159   2.063  -6.060
  447    HG   CYS  51           HG       CYS  51  74.765  -0.777  -4.448
  448    H    ILE  52           HN       ILE  52  70.878   1.476  -4.132
  449    HA   ILE  52           HA       ILE  52  70.736  -0.433  -2.014
  450    HB   ILE  52           HB       ILE  52  68.658   1.046  -3.588
  451   HG12  ILE  52          HG12      ILE  52  69.597   0.826  -0.810
  452   HG13  ILE  52          HG11      ILE  52  69.822   2.209  -1.926
  453   HG21  ILE  52          HG21      ILE  52  66.912  -0.035  -2.222
  454   HG22  ILE  52          HG22      ILE  52  68.117  -1.097  -1.500
  455   HG23  ILE  52          HG23      ILE  52  67.734  -1.241  -3.213
  456   HD11  ILE  52          HD11      ILE  52  67.467   1.099  -0.681
  457   HD12  ILE  52          HD12      ILE  52  67.449   2.438  -1.896
  458   HD13  ILE  52          HD13      ILE  52  68.253   2.640  -0.274
  459    H    VAL  53           HN       VAL  53  70.117  -2.263  -2.030
  460    HA   VAL  53           HA       VAL  53  70.440  -3.698  -4.498
  461    HB   VAL  53           HB       VAL  53  71.154  -5.544  -2.796
  462   HG11  VAL  53          HG11      VAL  53  72.650  -4.379  -4.419
  463   HG12  VAL  53          HG12      VAL  53  73.469  -4.673  -2.881
  464   HG13  VAL  53          HG13      VAL  53  72.849  -3.065  -3.262
  465   HG21  VAL  53          HG21      VAL  53  70.410  -4.273  -0.801
  466   HG22  VAL  53          HG22      VAL  53  71.594  -3.023  -1.183
  467   HG23  VAL  53          HG23      VAL  53  72.131  -4.632  -0.759
  468    H    TYR  54           HN       TYR  54  68.675  -4.362  -5.130
  469    HA   TYR  54           HA       TYR  54  66.504  -4.973  -3.350
  470    HB2  TYR  54           HB2      TYR  54  66.754  -4.849  -6.345
  471    HB3  TYR  54           HB1      TYR  54  65.273  -5.255  -5.479
  472    HD1  TYR  54           HD2      TYR  54  67.784  -2.558  -5.943
  473    HD2  TYR  54           HD1      TYR  54  63.889  -3.588  -4.602
  474    HE1  TYR  54           HE2      TYR  54  67.192  -0.154  -5.660
  475    HE2  TYR  54           HE1      TYR  54  63.336  -1.287  -4.392
  476    HH   TYR  54           HH       TYR  54  65.413   1.185  -5.491
  477    H    ARG  55           HN       ARG  55  66.296  -6.759  -2.685
  478    HA   ARG  55           HA       ARG  55  67.778  -8.945  -3.888
  479    HB2  ARG  55           HB2      ARG  55  66.941  -8.670  -1.208
  480    HB3  ARG  55           HB1      ARG  55  65.816  -9.822  -1.849
  481    HG2  ARG  55           HG2      ARG  55  68.838 -10.281  -1.962
  482    HG3  ARG  55           HG1      ARG  55  67.874 -10.823  -0.659
  483    HD2  ARG  55           HD2      ARG  55  68.032 -12.714  -2.102
  484    HD3  ARG  55           HD1      ARG  55  66.457 -12.050  -2.524
  485    HE   ARG  55           HE       ARG  55  68.732 -11.161  -4.080
  486   HH11  ARG  55          HH11      ARG  55  65.894 -13.318  -3.997
  487   HH12  ARG  55          HH12      ARG  55  65.954 -13.686  -5.650
  488   HH21  ARG  55          HH21      ARG  55  68.797 -11.680  -6.318
  489   HH22  ARG  55          HH22      ARG  55  67.674 -12.771  -7.011
  490    H    ASP  56           HN       ASP  56  66.723  -9.702  -5.676
  491    HA   ASP  56           HA       ASP  56  65.175 -10.368  -7.157
  492    HB2  ASP  56           HB2      ASP  56  64.105 -11.776  -5.453
  493    HB3  ASP  56           HB1      ASP  56  63.258 -10.375  -4.809
  494    H    GLY  57           HN       GLY  57  63.105  -8.338  -5.112
  495    HA2  GLY  57           HA2      GLY  57  63.489  -6.115  -6.826
  496    HA3  GLY  57           HA1      GLY  57  61.899  -6.851  -7.081
  497    H    ASN  58           HN       ASN  58  63.552  -6.723  -4.013
  498    HA   ASN  58           HA       ASN  58  61.528  -4.773  -3.076
  499    HB2  ASN  58           HB2      ASN  58  62.902  -6.856  -1.401
  500    HB3  ASN  58           HB1      ASN  58  61.488  -5.932  -0.972
  501   HD21  ASN  58          HD21      ASN  58  62.772  -8.570  -2.779
  502   HD22  ASN  58          HD22      ASN  58  61.303  -9.418  -3.005
  503    HA   PRO  59           HA       PRO  59  65.231  -2.710  -2.148
  504    HB2  PRO  59           HB2      PRO  59  64.008  -0.720  -0.509
  505    HB3  PRO  59           HB1      PRO  59  64.494  -0.587  -2.196
  506    HG2  PRO  59           HG2      PRO  59  61.831  -0.602  -1.357
  507    HG3  PRO  59           HG1      PRO  59  62.348  -1.000  -2.946
  508    HD2  PRO  59           HD2      PRO  59  61.615  -2.831  -0.729
  509    HD3  PRO  59           HD1      PRO  59  61.374  -2.989  -2.478
  510    H    TYR  60           HN       TYR  60  66.856  -3.094  -0.990
  511    HA   TYR  60           HA       TYR  60  66.464  -3.073   1.789
  512    HB2  TYR  60           HB2      TYR  60  68.187  -5.382   0.963
  513    HB3  TYR  60           HB1      TYR  60  67.355  -4.942   2.221
  514    HD1  TYR  60           HD2      TYR  60  65.388  -5.502   2.803
  515    HD2  TYR  60           HD1      TYR  60  66.662  -6.328  -1.027
  516    HE1  TYR  60           HE2      TYR  60  63.458  -7.110   2.546
  517    HE2  TYR  60           HE1      TYR  60  64.759  -7.928  -1.373
  518    HH   TYR  60           HH       TYR  60  62.191  -8.170   0.826
  519    H    ALA  61           HN       ALA  61  68.164  -2.664   2.779
  520    HA   ALA  61           HA       ALA  61  70.162  -1.080   1.484
  521    HB1  ALA  61           HB1      ALA  61  68.880  -0.418   3.446
  522    HB2  ALA  61           HB2      ALA  61  70.652  -0.494   3.715
  523    HB3  ALA  61           HB3      ALA  61  69.589  -1.815   4.261
  524    H    VAL  62           HN       VAL  62  72.364  -1.568   2.408
  525    HA   VAL  62           HA       VAL  62  72.853  -4.431   2.659
  526    HB   VAL  62           HB       VAL  62  74.583  -2.047   1.946
  527   HG11  VAL  62          HG11      VAL  62  76.446  -3.546   1.673
  528   HG12  VAL  62          HG12      VAL  62  75.522  -4.795   2.570
  529   HG13  VAL  62          HG13      VAL  62  75.891  -3.209   3.302
  530   HG21  VAL  62          HG21      VAL  62  73.843  -4.487   0.419
  531   HG22  VAL  62          HG22      VAL  62  75.015  -3.270  -0.114
  532   HG23  VAL  62          HG23      VAL  62  73.323  -2.820   0.097
  533    H    CYS  63           HN       CYS  63  72.712  -5.041   4.765
  534    HA   CYS  63           HA       CYS  63  72.935  -3.267   6.874
  535    HB2  CYS  63           HB2      CYS  63  72.566  -5.101   8.234
  536    HB3  CYS  63           HB1      CYS  63  72.006  -5.642   6.657
  537    H    ASP  64           HN       ASP  64  74.481  -3.499   8.687
  538    HA   ASP  64           HA       ASP  64  77.041  -2.548   8.149
  539    HB2  ASP  64           HB2      ASP  64  76.016  -2.287  10.322
  540    HB3  ASP  64           HB1      ASP  64  75.995  -4.018  10.551
  541    H    LYS  65           HN       LYS  65  75.990  -5.749   8.836
  542    HA   LYS  65           HA       LYS  65  78.542  -6.968   8.998
  543    HB2  LYS  65           HB2      LYS  65  75.861  -8.208   8.409
  544    HB3  LYS  65           HB1      LYS  65  77.304  -9.077   8.909
  545    HG2  LYS  65           HG2      LYS  65  77.283  -7.998  11.056
  546    HG3  LYS  65           HG1      LYS  65  75.946  -6.961  10.564
  547    HD2  LYS  65           HD2      LYS  65  75.021  -8.709  11.897
  548    HD3  LYS  65           HD1      LYS  65  74.599  -9.017  10.212
  549    HE2  LYS  65           HE2      LYS  65  75.255 -11.090  11.284
  550    HE3  LYS  65           HE1      LYS  65  76.447 -10.643  10.065
  551    HZ1  LYS  65           HZ1      LYS  65  77.857  -9.778  11.841
  552    HZ2  LYS  65           HZ2      LYS  65  77.492 -11.393  12.102
  553    HZ3  LYS  65           HZ3      LYS  65  76.707 -10.207  12.985
  554    H    CYS  66           HN       CYS  66  76.119  -6.772   6.448
  555    HA   CYS  66           HA       CYS  66  77.591  -8.340   4.631
  556    HB2  CYS  66           HB2      CYS  66  75.148  -6.719   4.482
  557    HB3  CYS  66           HB1      CYS  66  75.742  -7.416   3.003
  558    H    LEU  67           HN       LEU  67  77.665  -4.980   5.370
  559    HA   LEU  67           HA       LEU  67  78.296  -3.755   3.068
  560    HB2  LEU  67           HB2      LEU  67  78.092  -3.033   5.558
  561    HB3  LEU  67           HB1      LEU  67  79.843  -3.131   5.507
  562    HG   LEU  67           HG       LEU  67  78.363  -1.642   3.441
  563   HD11  LEU  67          HD11      LEU  67  79.099  -0.697   6.187
  564   HD12  LEU  67          HD12      LEU  67  77.481  -0.855   5.474
  565   HD13  LEU  67          HD13      LEU  67  78.606   0.370   4.858
  566   HD21  LEU  67          HD21      LEU  67  80.413  -0.259   3.404
  567   HD22  LEU  67          HD22      LEU  67  80.757  -1.962   3.100
  568   HD23  LEU  67          HD23      LEU  67  81.093  -1.262   4.686
  569    H    LYS  68           HN       LYS  68  80.569  -5.551   5.154
  570    HA   LYS  68           HA       LYS  68  82.617  -5.129   3.203
  571    HB2  LYS  68           HB2      LYS  68  84.041  -6.644   4.619
  572    HB3  LYS  68           HB1      LYS  68  83.565  -5.104   5.317
  573    HG2  LYS  68           HG2      LYS  68  83.514  -6.790   7.021
  574    HG3  LYS  68           HG1      LYS  68  81.852  -6.352   6.649
  575    HD2  LYS  68           HD2      LYS  68  81.543  -8.364   5.404
  576    HD3  LYS  68           HD1      LYS  68  83.263  -8.741   5.484
  577    HE2  LYS  68           HE2      LYS  68  81.879 -10.058   7.066
  578    HE3  LYS  68           HE1      LYS  68  83.148  -9.115   7.845
  579    HZ1  LYS  68           HZ1      LYS  68  80.303  -8.292   7.648
  580    HZ2  LYS  68           HZ2      LYS  68  81.502  -7.524   8.562
  581    HZ3  LYS  68           HZ3      LYS  68  80.968  -9.061   8.987
  582    H    PHE  69           HN       PHE  69  80.183  -7.329   3.436
  583    HA   PHE  69           HA       PHE  69  81.347  -9.643   2.291
  584    HB2  PHE  69           HB2      PHE  69  78.741  -8.524   2.799
  585    HB3  PHE  69           HB1      PHE  69  78.810  -9.743   1.554
  586    HD1  PHE  69           HD1      PHE  69  79.622  -9.012   5.056
  587    HD2  PHE  69           HD2      PHE  69  78.742 -11.947   2.154
  588    HE1  PHE  69           HE1      PHE  69  79.370 -10.646   6.817
  589    HE2  PHE  69           HE2      PHE  69  78.478 -13.609   3.865
  590    HZ   PHE  69           HZ       PHE  69  78.782 -12.948   6.277
  591    H    TYR  70           HN       TYR  70  79.203  -7.021   1.116
  592    HA   TYR  70           HA       TYR  70  80.042  -7.617  -1.578
  593    HB2  TYR  70           HB2      TYR  70  77.242  -7.215  -0.557
  594    HB3  TYR  70           HB1      TYR  70  77.698  -7.208  -2.256
  595    HD1  TYR  70           HD1      TYR  70  78.797  -9.273  -3.191
  596    HD2  TYR  70           HD2      TYR  70  76.849  -9.259   0.576
  597    HE1  TYR  70           HE1      TYR  70  78.704 -11.709  -3.246
  598    HE2  TYR  70           HE2      TYR  70  76.758 -11.721   0.550
  599    HH   TYR  70           HH       TYR  70  76.777 -13.496  -1.162
  600    H    SER  71           HN       SER  71  81.432  -5.811  -1.076
  601    HA   SER  71           HA       SER  71  80.012  -3.297  -1.426
  602    HB2  SER  71           HB2      SER  71  82.473  -2.448  -0.888
  603    HB3  SER  71           HB1      SER  71  81.363  -2.923   0.400
  604    HG   SER  71           HG       SER  71  82.490  -4.592   0.809
  605    H    LYS  72           HN       LYS  72  82.268  -5.506  -2.831
  606    HA   LYS  72           HA       LYS  72  82.945  -3.811  -5.036
  607    HB2  LYS  72           HB2      LYS  72  84.432  -5.642  -4.279
  608    HB3  LYS  72           HB1      LYS  72  83.205  -6.811  -4.709
  609    HG2  LYS  72           HG2      LYS  72  84.958  -6.728  -6.403
  610    HG3  LYS  72           HG1      LYS  72  83.403  -6.217  -7.057
  611    HD2  LYS  72           HD2      LYS  72  84.082  -3.866  -6.833
  612    HD3  LYS  72           HD1      LYS  72  85.636  -4.380  -6.174
  613    HE2  LYS  72           HE2      LYS  72  85.789  -3.803  -8.558
  614    HE3  LYS  72           HE1      LYS  72  86.183  -5.492  -8.261
  615    HZ1  LYS  72           HZ1      LYS  72  83.914  -6.067  -8.981
  616    HZ2  LYS  72           HZ2      LYS  72  84.776  -5.309 -10.184
  617    HZ3  LYS  72           HZ3      LYS  72  83.600  -4.454  -9.347
  618    H    ILE  73           HN       ILE  73  80.792  -6.516  -4.475
  619    HA   ILE  73           HA       ILE  73  79.534  -6.232  -7.080
  620    HB   ILE  73           HB       ILE  73  78.670  -7.898  -4.719
  621   HG12  ILE  73          HG12      ILE  73  80.341  -8.706  -7.125
  622   HG13  ILE  73          HG11      ILE  73  80.916  -8.566  -5.471
  623   HG21  ILE  73          HG21      ILE  73  76.863  -7.506  -6.314
  624   HG22  ILE  73          HG22      ILE  73  77.363  -9.193  -6.372
  625   HG23  ILE  73          HG23      ILE  73  77.878  -8.085  -7.636
  626   HD11  ILE  73          HD11      ILE  73  80.580 -10.888  -6.136
  627   HD12  ILE  73          HD12      ILE  73  78.880 -10.555  -6.461
  628   HD13  ILE  73          HD13      ILE  73  79.506 -10.440  -4.816
  629    H    SER  74           HN       SER  74  78.288  -4.480  -7.268
  630    HA   SER  74           HA       SER  74  76.435  -4.066  -5.094
  631    HB2  SER  74           HB2      SER  74  77.713  -1.924  -6.796
  632    HB3  SER  74           HB1      SER  74  76.518  -1.636  -5.529
  633    HG   SER  74           HG       SER  74  78.523  -3.183  -4.639
  634    H    GLU  75           HN       GLU  75  76.941  -3.437  -8.458
  635    HA   GLU  75           HA       GLU  75  74.075  -3.842  -8.932
  636    HB2  GLU  75           HB2      GLU  75  74.958  -1.575  -9.564
  637    HB3  GLU  75           HB1      GLU  75  76.030  -2.365 -10.711
  638    HG2  GLU  75           HG2      GLU  75  74.070  -3.261 -11.897
  639    HG3  GLU  75           HG1      GLU  75  73.019  -2.412 -10.770
  640    H    TYR  76           HN       TYR  76  73.794  -5.860  -9.602
  641    HA   TYR  76           HA       TYR  76  75.347  -6.956 -11.757
  642    HB2  TYR  76           HB2      TYR  76  76.070  -7.468  -9.083
  643    HB3  TYR  76           HB1      TYR  76  75.379  -8.950  -9.748
  644    HD1  TYR  76           HD2      TYR  76  76.241  -9.546 -12.132
  645    HD2  TYR  76           HD1      TYR  76  78.281  -7.047  -9.403
  646    HE1  TYR  76           HE2      TYR  76  78.328 -10.011 -13.314
  647    HE2  TYR  76           HE1      TYR  76  80.410  -7.491 -10.563
  648    HH   TYR  76           HH       TYR  76  80.561  -8.847 -13.605
  649    H    ARG  77           HN       ARG  77  74.315  -8.890 -12.608
  650    HA   ARG  77           HA       ARG  77  71.829  -9.616 -11.351
  651    HB2  ARG  77           HB2      ARG  77  72.176  -9.097 -14.318
  652    HB3  ARG  77           HB1      ARG  77  70.763  -9.820 -13.572
  653    HG2  ARG  77           HG2      ARG  77  70.141  -7.601 -14.069
  654    HG3  ARG  77           HG1      ARG  77  70.484  -7.594 -12.343
  655    HD2  ARG  77           HD2      ARG  77  72.687  -6.655 -12.770
  656    HD3  ARG  77           HD1      ARG  77  72.396  -6.728 -14.503
  657    HE   ARG  77           HE       ARG  77  70.487  -5.193 -12.990
  658   HH11  ARG  77          HH11      ARG  77  73.449  -5.119 -14.968
  659   HH12  ARG  77          HH12      ARG  77  73.367  -3.443 -15.243
  660   HH21  ARG  77          HH21      ARG  77  70.407  -2.904 -13.388
  661   HH22  ARG  77          HH22      ARG  77  71.621  -2.160 -14.334
  662    H    HIS  78           HN       HIS  78  73.262 -11.214 -10.624
  663    HA   HIS  78           HA       HIS  78  73.565 -13.279 -12.594
  664    HB2  HIS  78           HB2      HIS  78  75.755 -13.884 -11.691
  665    HB3  HIS  78           HB1      HIS  78  75.774 -12.286 -12.494
  666    HD1  HIS  78           HD1      HIS  78  78.026 -13.282 -10.541
  667    HD2  HIS  78           HD2      HIS  78  74.696 -11.138  -9.438
  668    HE1  HIS  78           HE1      HIS  78  78.667 -12.101  -8.401
  669    H    TYR  79           HN       TYR  79  71.803 -12.735 -10.304
  670    HA   TYR  79           HA       TYR  79  72.785 -14.173  -8.034
  671    HB2  TYR  79           HB2      TYR  79  70.233 -12.657  -8.494
  672    HB3  TYR  79           HB1      TYR  79  70.654 -13.450  -6.982
  673    HD1  TYR  79           HD2      TYR  79  72.229 -11.128  -9.422
  674    HD2  TYR  79           HD1      TYR  79  71.603 -12.154  -5.381
  675    HE1  TYR  79           HE2      TYR  79  73.462  -9.164  -8.787
  676    HE2  TYR  79           HE1      TYR  79  72.879 -10.176  -4.676
  677    HH   TYR  79           HH       TYR  79  73.693  -7.688  -6.838
  678    H    SER  80           HN       SER  80  72.405 -16.153  -7.615
  679    HA   SER  80           HA       SER  80  69.931 -17.430  -8.104
  680    HB2  SER  80           HB2      SER  80  71.232 -17.651 -10.338
  681    HB3  SER  80           HB1      SER  80  72.394 -18.620  -9.446
  682    HG   SER  80           HG       SER  80  70.877 -20.176  -9.120
  Start of MODEL    8
    1    H1   GLY  -1           HT1      GLY  -1  55.319  -6.144   6.493
    2    H2   GLY  -1           HT2      GLY  -1  55.566  -5.463   4.973
    3    H3   GLY  -1           HT3      GLY  -1  55.549  -4.470   6.340
    4    HA2  GLY  -1           HA1      GLY  -1  57.524  -5.588   7.166
    5    HA3  GLY  -1           HA2      GLY  -1  57.561  -6.504   5.670
    6    H    ALA   0           HN       ALA   0  58.887  -5.707   4.210
    7    HA   ALA   0           HA       ALA   0  59.272  -2.801   3.985
    8    HB1  ALA   0           HB1      ALA   0  61.654  -3.249   3.467
    9    HB2  ALA   0           HB2      ALA   0  61.391  -4.963   3.790
   10    HB3  ALA   0           HB3      ALA   0  61.237  -3.788   5.094
   11    H    MET   1           HN       MET   1  57.610  -4.848   2.712
   12    HA   MET   1           HA       MET   1  58.727  -5.270   0.123
   13    HB2  MET   1           HB2      MET   1  57.501  -7.122   0.606
   14    HB3  MET   1           HB1      MET   1  56.330  -6.244   1.569
   15    HG2  MET   1           HG2      MET   1  56.382  -5.903  -1.395
   16    HG3  MET   1           HG1      MET   1  55.622  -7.328  -0.693
   17    HE1  MET   1           HE1      MET   1  53.498  -6.304  -2.153
   18    HE2  MET   1           HE2      MET   1  54.303  -4.750  -2.461
   19    HE3  MET   1           HE3      MET   1  52.699  -4.783  -1.734
   20    H    PHE   2           HN       PHE   2  58.456  -4.209  -1.623
   21    HA   PHE   2           HA       PHE   2  56.389  -2.171  -1.765
   22    HB2  PHE   2           HB2      PHE   2  59.104  -2.339  -2.965
   23    HB3  PHE   2           HB1      PHE   2  57.882  -1.525  -3.906
   24    HD1  PHE   2           HD2      PHE   2  57.702  -1.308  -0.223
   25    HD2  PHE   2           HD1      PHE   2  59.159   0.579  -3.773
   26    HE1  PHE   2           HE2      PHE   2  58.085   0.757   0.960
   27    HE2  PHE   2           HE1      PHE   2  59.569   2.498  -2.628
   28    HZ   PHE   2           HZ       PHE   2  59.017   2.713  -0.253
   29    H    GLN   3           HN       GLN   3  55.155  -1.998  -3.581
   30    HA   GLN   3           HA       GLN   3  54.168  -4.446  -4.626
   31    HB2  GLN   3           HB2      GLN   3  53.035  -2.172  -4.115
   32    HB3  GLN   3           HB1      GLN   3  53.672  -1.641  -5.649
   33    HG2  GLN   3           HG2      GLN   3  51.730  -3.913  -5.264
   34    HG3  GLN   3           HG1      GLN   3  51.293  -2.263  -5.661
   35   HE21  GLN   3          HE21      GLN   3  53.546  -1.945  -7.541
   36   HE22  GLN   3          HE22      GLN   3  53.120  -2.910  -8.910
   37    H    ASP   4           HN       ASP   4  55.114  -5.573  -6.299
   38    HA   ASP   4           HA       ASP   4  57.000  -4.347  -8.182
   39    HB2  ASP   4           HB2      ASP   4  57.486  -6.601  -7.245
   40    HB3  ASP   4           HB1      ASP   4  55.955  -7.202  -7.847
   41    HA   PRO   5           HA       PRO   5  57.700  -5.020 -10.578
   42    HB2  PRO   5           HB2      PRO   5  57.609  -4.472 -13.063
   43    HB3  PRO   5           HB1      PRO   5  56.547  -5.714 -12.305
   44    HG2  PRO   5           HG2      PRO   5  55.758  -2.901 -12.937
   45    HG3  PRO   5           HG1      PRO   5  55.035  -4.377 -13.632
   46    HD2  PRO   5           HD2      PRO   5  54.184  -3.121 -11.316
   47    HD3  PRO   5           HD1      PRO   5  53.905  -4.834 -11.682
   48    H    GLN   6           HN       GLN   6  56.433  -2.870  -9.562
   49    HA   GLN   6           HA       GLN   6  57.577  -0.400 -10.499
   50    HB2  GLN   6           HB2      GLN   6  56.389  -0.931  -7.770
   51    HB3  GLN   6           HB1      GLN   6  56.808   0.653  -8.386
   52    HG2  GLN   6           HG2      GLN   6  54.708  -1.187  -9.498
   53    HG3  GLN   6           HG1      GLN   6  54.418   0.235  -8.501
   54   HE21  GLN   6          HE21      GLN   6  56.463   1.830  -9.835
   55   HE22  GLN   6          HE22      GLN   6  55.840   2.230 -11.380
   56    H    GLU   7           HN       GLU   7  59.416  -1.186 -10.739
   57    HA   GLU   7           HA       GLU   7  61.401  -2.194  -9.363
   58    HB2  GLU   7           HB2      GLU   7  61.384  -0.113 -11.424
   59    HB3  GLU   7           HB1      GLU   7  62.855  -0.803 -10.777
   60    HG2  GLU   7           HG2      GLU   7  60.635  -2.294 -12.125
   61    HG3  GLU   7           HG1      GLU   7  62.222  -1.896 -12.793
   62    H    ARG   8           HN       ARG   8  60.212   0.805  -8.639
   63    HA   ARG   8           HA       ARG   8  60.838   2.593  -7.232
   64    HB2  ARG   8           HB2      ARG   8  62.490   0.444  -5.852
   65    HB3  ARG   8           HB1      ARG   8  61.700   1.824  -5.122
   66    HG2  ARG   8           HG2      ARG   8  60.428  -0.548  -6.315
   67    HG3  ARG   8           HG1      ARG   8  60.540  -0.107  -4.610
   68    HD2  ARG   8           HD2      ARG   8  59.096   1.933  -5.084
   69    HD3  ARG   8           HD1      ARG   8  59.197   1.573  -6.788
   70    HE   ARG   8           HE       ARG   8  58.122  -0.620  -6.007
   71   HH11  ARG   8          HH11      ARG   8  57.190   2.755  -5.245
   72   HH12  ARG   8          HH12      ARG   8  55.580   2.352  -4.909
   73   HH21  ARG   8          HH21      ARG   8  55.873  -1.092  -5.637
   74   HH22  ARG   8          HH22      ARG   8  54.812   0.156  -5.113
   75    HA   PRO   9           HA       PRO   9  64.730   4.387  -8.364
   76    HB2  PRO   9           HB2      PRO   9  65.830   5.251  -6.029
   77    HB3  PRO   9           HB1      PRO   9  64.614   6.198  -6.815
   78    HG2  PRO   9           HG2      PRO   9  64.510   4.429  -4.499
   79    HG3  PRO   9           HG1      PRO   9  63.463   5.824  -4.873
   80    HD2  PRO   9           HD2      PRO   9  62.883   3.189  -4.942
   81    HD3  PRO   9           HD1      PRO   9  61.867   4.306  -5.784
   82    H    ARG  10           HN       ARG  10  67.195   4.546  -7.247
   83    HA   ARG  10           HA       ARG  10  67.717   1.944  -6.044
   84    HB2  ARG  10           HB2      ARG  10  68.250   2.101  -8.504
   85    HB3  ARG  10           HB1      ARG  10  69.517   3.233  -8.043
   86    HG2  ARG  10           HG2      ARG  10  70.705   1.648  -6.893
   87    HG3  ARG  10           HG1      ARG  10  69.320   0.556  -6.752
   88    HD2  ARG  10           HD2      ARG  10  69.275   0.266  -9.036
   89    HD3  ARG  10           HD1      ARG  10  70.685   1.316  -9.294
   90    HE   ARG  10           HE       ARG  10  70.866  -1.098  -7.615
   91   HH11  ARG  10          HH11      ARG  10  71.921   0.649 -10.523
   92   HH12  ARG  10          HH12      ARG  10  73.208  -0.421 -10.851
   93   HH21  ARG  10          HH21      ARG  10  72.584  -2.556  -8.107
   94   HH22  ARG  10          HH22      ARG  10  73.610  -2.295  -9.442
   95    H    LYS  11           HN       LYS  11  67.510   5.068  -5.556
   96    HA   LYS  11           HA       LYS  11  69.940   5.203  -3.951
   97    HB2  LYS  11           HB2      LYS  11  68.200   7.506  -4.827
   98    HB3  LYS  11           HB1      LYS  11  69.694   7.539  -3.981
   99    HG2  LYS  11           HG2      LYS  11  69.664   6.279  -6.652
  100    HG3  LYS  11           HG1      LYS  11  69.768   8.029  -6.538
  101    HD2  LYS  11           HD2      LYS  11  71.734   7.701  -5.017
  102    HD3  LYS  11           HD1      LYS  11  71.630   5.966  -5.330
  103    HE2  LYS  11           HE2      LYS  11  71.990   6.386  -7.712
  104    HE3  LYS  11           HE1      LYS  11  72.081   8.116  -7.398
  105    HZ1  LYS  11           HZ1      LYS  11  74.092   7.688  -6.034
  106    HZ2  LYS  11           HZ2      LYS  11  74.255   7.169  -7.624
  107    HZ3  LYS  11           HZ3      LYS  11  73.988   6.048  -6.416
  108    H    LEU  12           HN       LEU  12  69.675   5.555  -1.873
  109    HA   LEU  12           HA       LEU  12  67.402   4.751  -0.556
  110    HB2  LEU  12           HB2      LEU  12  69.467   4.517   0.487
  111    HB3  LEU  12           HB1      LEU  12  69.838   6.226   0.350
  112    HG   LEU  12           HG       LEU  12  68.110   6.727   1.976
  113   HD11  LEU  12          HD11      LEU  12  67.911   3.745   2.261
  114   HD12  LEU  12          HD12      LEU  12  66.673   4.775   1.513
  115   HD13  LEU  12          HD13      LEU  12  67.090   4.971   3.243
  116   HD21  LEU  12          HD21      LEU  12  69.248   5.954   3.887
  117   HD22  LEU  12          HD22      LEU  12  70.463   6.192   2.604
  118   HD23  LEU  12          HD23      LEU  12  69.855   4.578   2.991
  119    HA   PRO  13           HA       PRO  13  66.338   9.299   0.716
  120    HB2  PRO  13           HB2      PRO  13  67.205  11.353  -0.849
  121    HB3  PRO  13           HB1      PRO  13  68.187  10.643   0.457
  122    HG2  PRO  13           HG2      PRO  13  68.323  10.043  -2.470
  123    HG3  PRO  13           HG1      PRO  13  69.635  10.495  -1.363
  124    HD2  PRO  13           HD2      PRO  13  69.145   7.927  -1.968
  125    HD3  PRO  13           HD1      PRO  13  69.658   8.392  -0.351
  126    H    GLN  14           HN       GLN  14  66.662   8.645  -2.663
  127    HA   GLN  14           HA       GLN  14  64.213   9.902  -3.430
  128    HB2  GLN  14           HB2      GLN  14  65.937   7.909  -4.905
  129    HB3  GLN  14           HB1      GLN  14  64.628   8.846  -5.611
  130    HG2  GLN  14           HG2      GLN  14  65.836  10.923  -5.055
  131    HG3  GLN  14           HG1      GLN  14  67.158   9.958  -4.414
  132   HE21  GLN  14          HE21      GLN  14  66.892   7.972  -6.616
  133   HE22  GLN  14          HE22      GLN  14  67.576   8.752  -7.974
  134    H    LEU  15           HN       LEU  15  65.104   6.652  -2.363
  135    HA   LEU  15           HA       LEU  15  62.653   5.415  -3.013
  136    HB2  LEU  15           HB2      LEU  15  64.778   4.248  -2.509
  137    HB3  LEU  15           HB1      LEU  15  64.720   4.910  -0.963
  138    HG   LEU  15           HG       LEU  15  62.716   3.767  -0.385
  139   HD11  LEU  15          HD11      LEU  15  61.909   1.916  -1.816
  140   HD12  LEU  15          HD12      LEU  15  63.088   2.350  -3.049
  141   HD13  LEU  15          HD13      LEU  15  61.767   3.457  -2.659
  142   HD21  LEU  15          HD21      LEU  15  64.950   2.119  -1.425
  143   HD22  LEU  15          HD22      LEU  15  63.759   1.584  -0.222
  144   HD23  LEU  15          HD23      LEU  15  64.863   2.949   0.120
  145    H    CYS  16           HN       CYS  16  63.900   7.128  -0.272
  146    HA   CYS  16           HA       CYS  16  61.908   6.588   1.598
  147    HB2  CYS  16           HB2      CYS  16  63.433   9.212   1.224
  148    HB3  CYS  16           HB1      CYS  16  62.535   8.768   2.639
  149    HG   CYS  16           HG       CYS  16  65.206   6.963   1.505
  150    H    THR  17           HN       THR  17  61.913   8.837  -1.030
  151    HA   THR  17           HA       THR  17  59.574  10.283  -0.725
  152    HB   THR  17           HB       THR  17  61.123   9.231  -3.012
  153    HG1  THR  17           HG1      THR  17  61.914  11.265  -3.154
  154   HG21  THR  17          HG21      THR  17  59.844  10.712  -4.570
  155   HG22  THR  17          HG22      THR  17  58.612  10.902  -3.300
  156   HG23  THR  17          HG23      THR  17  58.983   9.300  -3.974
  157    H    GLU  18           HN       GLU  18  60.093   7.074  -1.989
  158    HA   GLU  18           HA       GLU  18  57.519   6.540  -2.975
  159    HB2  GLU  18           HB2      GLU  18  59.909   5.069  -2.242
  160    HB3  GLU  18           HB1      GLU  18  58.482   4.181  -2.781
  161    HG2  GLU  18           HG2      GLU  18  59.906   6.401  -4.238
  162    HG3  GLU  18           HG1      GLU  18  60.152   4.702  -4.571
  163    H    LEU  19           HN       LEU  19  59.287   5.522  -0.036
  164    HA   LEU  19           HA       LEU  19  57.077   4.390   1.302
  165    HB2  LEU  19           HB2      LEU  19  59.683   5.499   2.139
  166    HB3  LEU  19           HB1      LEU  19  58.613   4.848   3.320
  167    HG   LEU  19           HG       LEU  19  58.861   2.743   1.608
  168   HD11  LEU  19          HD11      LEU  19  61.194   2.580   0.982
  169   HD12  LEU  19          HD12      LEU  19  61.503   4.186   1.633
  170   HD13  LEU  19          HD13      LEU  19  60.485   4.000   0.211
  171   HD21  LEU  19          HD21      LEU  19  60.508   3.637   3.873
  172   HD22  LEU  19          HD22      LEU  19  60.568   1.986   3.208
  173   HD23  LEU  19          HD23      LEU  19  59.065   2.619   3.928
  174    H    GLN  20           HN       GLN  20  57.672   7.577   0.534
  175    HA   GLN  20           HA       GLN  20  56.622   9.526   1.079
  176    HB2  GLN  20           HB2      GLN  20  54.884   7.558   2.479
  177    HB3  GLN  20           HB1      GLN  20  54.429   9.277   2.346
  178    HG2  GLN  20           HG2      GLN  20  54.471   8.971  -0.121
  179    HG3  GLN  20           HG1      GLN  20  54.834   7.268   0.134
  180   HE21  GLN  20          HE21      GLN  20  52.464   9.729   0.391
  181   HE22  GLN  20          HE22      GLN  20  51.102   8.682   0.615
  182    H    THR  21           HN       THR  21  58.802   8.587   2.624
  183    HA   THR  21           HA       THR  21  58.333  10.021   5.081
  184    HB   THR  21           HB       THR  21  57.730   7.598   5.498
  185    HG1  THR  21           HG1      THR  21  58.894   7.495   7.416
  186   HG21  THR  21          HG21      THR  21  59.517   5.929   5.640
  187   HG22  THR  21          HG22      THR  21  60.694   7.126   5.113
  188   HG23  THR  21          HG23      THR  21  59.451   6.589   3.999
  189    H    THR  22           HN       THR  22  60.751   9.463   6.298
  190    HA   THR  22           HA       THR  22  62.718  10.184   4.222
  191    HB   THR  22           HB       THR  22  63.273  11.020   6.994
  192    HG1  THR  22           HG1      THR  22  61.531  12.724   5.541
  193   HG21  THR  22          HG21      THR  22  63.356  12.353   4.285
  194   HG22  THR  22          HG22      THR  22  64.715  11.608   5.119
  195   HG23  THR  22          HG23      THR  22  63.973  13.071   5.772
  196    H    ILE  23           HN       ILE  23  65.082   9.855   5.318
  197    HA   ILE  23           HA       ILE  23  65.575   7.203   5.590
  198    HB   ILE  23           HB       ILE  23  67.229   9.383   6.750
  199   HG12  ILE  23          HG12      ILE  23  66.795   8.455   3.969
  200   HG13  ILE  23          HG11      ILE  23  66.712  10.061   4.606
  201   HG21  ILE  23          HG21      ILE  23  67.894   6.665   5.546
  202   HG22  ILE  23          HG22      ILE  23  67.990   7.077   7.265
  203   HG23  ILE  23          HG23      ILE  23  69.109   7.818   6.111
  204   HD11  ILE  23          HD11      ILE  23  69.170  10.069   4.891
  205   HD12  ILE  23          HD12      ILE  23  68.700   9.731   3.202
  206   HD13  ILE  23          HD13      ILE  23  69.165   8.409   4.281
  207    H    HIS  24           HN       HIS  24  64.527   9.482   7.752
  208    HA   HIS  24           HA       HIS  24  65.739   8.717  10.188
  209    HB2  HIS  24           HB2      HIS  24  63.440  10.595   9.733
  210    HB3  HIS  24           HB1      HIS  24  64.639  10.679  10.998
  211    HD1  HIS  24           HD1      HIS  24  66.986  10.262   8.767
  212    HD2  HIS  24           HD2      HIS  24  64.050  13.099   8.909
  213    HE1  HIS  24           HE1      HIS  24  67.578  11.849   6.905
  214    H    ASP  25           HN       ASP  25  63.390   7.430   8.430
  215    HA   ASP  25           HA       ASP  25  61.825   6.354  10.680
  216    HB2  ASP  25           HB2      ASP  25  60.710   8.451   9.886
  217    HB3  ASP  25           HB1      ASP  25  60.625   7.728   8.314
  218    H    ILE  26           HN       ILE  26  62.652   6.267   7.251
  219    HA   ILE  26           HA       ILE  26  61.242   4.227   6.129
  220    HB   ILE  26           HB       ILE  26  62.752   5.574   4.811
  221   HG12  ILE  26          HG12      ILE  26  63.827   2.795   4.784
  222   HG13  ILE  26          HG11      ILE  26  62.299   3.092   4.054
  223   HG21  ILE  26          HG21      ILE  26  64.496   5.827   6.493
  224   HG22  ILE  26          HG22      ILE  26  65.174   5.291   4.940
  225   HG23  ILE  26          HG23      ILE  26  64.963   4.144   6.262
  226   HD11  ILE  26          HD11      ILE  26  63.965   3.020   2.392
  227   HD12  ILE  26          HD12      ILE  26  64.972   4.194   3.240
  228   HD13  ILE  26          HD13      ILE  26  63.442   4.706   2.502
  229    H    ILE  27           HN       ILE  27  61.041   2.073   6.241
  230    HA   ILE  27           HA       ILE  27  63.137   0.624   7.572
  231    HB   ILE  27           HB       ILE  27  60.309  -0.134   6.871
  232   HG12  ILE  27          HG12      ILE  27  60.484   1.383   8.763
  233   HG13  ILE  27          HG11      ILE  27  59.946  -0.211   9.262
  234   HG21  ILE  27          HG21      ILE  27  60.736  -2.232   8.046
  235   HG22  ILE  27          HG22      ILE  27  62.437  -1.775   8.210
  236   HG23  ILE  27          HG23      ILE  27  61.746  -2.036   6.606
  237   HD11  ILE  27          HD11      ILE  27  61.541   0.685  10.866
  238   HD12  ILE  27          HD12      ILE  27  62.714   0.955   9.587
  239   HD13  ILE  27          HD13      ILE  27  62.258  -0.691  10.031
  240    H    LEU  28           HN       LEU  28  64.597   0.029   6.612
  241    HA   LEU  28           HA       LEU  28  64.233  -1.046   3.940
  242    HB2  LEU  28           HB2      LEU  28  65.734   1.095   4.767
  243    HB3  LEU  28           HB1      LEU  28  66.881  -0.230   4.617
  244    HG   LEU  28           HG       LEU  28  66.244  -0.628   2.360
  245   HD11  LEU  28          HD11      LEU  28  63.977  -0.328   2.177
  246   HD12  LEU  28          HD12      LEU  28  64.481   1.272   1.566
  247   HD13  LEU  28          HD13      LEU  28  64.034   1.023   3.278
  248   HD21  LEU  28          HD21      LEU  28  66.910   1.444   1.362
  249   HD22  LEU  28          HD22      LEU  28  67.814   1.257   2.882
  250   HD23  LEU  28          HD23      LEU  28  66.424   2.327   2.801
  251    H    GLU  29           HN       GLU  29  65.047  -3.209   3.808
  252    HA   GLU  29           HA       GLU  29  66.590  -3.739   6.268
  253    HB2  GLU  29           HB2      GLU  29  66.171  -6.036   5.998
  254    HB3  GLU  29           HB1      GLU  29  64.798  -5.098   6.743
  255    HG2  GLU  29           HG2      GLU  29  63.828  -5.283   4.553
  256    HG3  GLU  29           HG1      GLU  29  65.211  -6.331   4.130
  257    H    CYS  30           HN       CYS  30  68.074  -5.865   6.069
  258    HA   CYS  30           HA       CYS  30  69.540  -5.551   3.822
  259    HB2  CYS  30           HB2      CYS  30  70.346  -6.582   5.918
  260    HB3  CYS  30           HB1      CYS  30  69.299  -7.958   5.589
  261    H    VAL  31           HN       VAL  31  69.635  -6.621   2.172
  262    HA   VAL  31           HA       VAL  31  67.372  -8.007   0.978
  263    HB   VAL  31           HB       VAL  31  68.231  -6.369  -0.479
  264   HG11  VAL  31          HG11      VAL  31  70.101  -5.625   0.690
  265   HG12  VAL  31          HG12      VAL  31  70.562  -6.180  -0.948
  266   HG13  VAL  31          HG13      VAL  31  70.913  -7.202   0.446
  267   HG21  VAL  31          HG21      VAL  31  69.622  -7.315  -2.200
  268   HG22  VAL  31          HG22      VAL  31  68.181  -8.229  -1.828
  269   HG23  VAL  31          HG23      VAL  31  69.764  -8.799  -1.243
  270    H    TYR  32           HN       TYR  32  70.503  -8.633   2.134
  271    HA   TYR  32           HA       TYR  32  70.695 -11.214   0.770
  272    HB2  TYR  32           HB2      TYR  32  72.883  -9.711   2.169
  273    HB3  TYR  32           HB1      TYR  32  73.065 -11.148   1.172
  274    HD1  TYR  32           HD1      TYR  32  71.431 -10.635  -1.175
  275    HD2  TYR  32           HD2      TYR  32  73.839  -7.921   1.104
  276    HE1  TYR  32           HE1      TYR  32  71.658  -9.336  -3.064
  277    HE2  TYR  32           HE2      TYR  32  74.102  -6.485  -0.850
  278    HH   TYR  32           HH       TYR  32  73.943  -6.606  -3.210
  279    H    CYS  33           HN       CYS  33  71.402  -9.782   3.990
  280    HA   CYS  33           HA       CYS  33  71.929 -12.435   5.110
  281    HB2  CYS  33           HB2      CYS  33  72.203  -9.917   6.700
  282    HB3  CYS  33           HB1      CYS  33  73.198 -11.372   6.741
  283    H    LYS  34           HN       LYS  34  69.418 -10.162   4.911
  284    HA   LYS  34           HA       LYS  34  67.576  -9.760   5.820
  285    HB2  LYS  34           HB2      LYS  34  67.760 -12.611   5.872
  286    HB3  LYS  34           HB1      LYS  34  66.546 -11.976   6.981
  287    HG2  LYS  34           HG2      LYS  34  65.746 -12.496   4.750
  288    HG3  LYS  34           HG1      LYS  34  65.460 -10.799   5.211
  289    HD2  LYS  34           HD2      LYS  34  67.537 -10.307   3.834
  290    HD3  LYS  34           HD1      LYS  34  67.456 -11.983   3.283
  291    HE2  LYS  34           HE2      LYS  34  66.356 -10.553   1.688
  292    HE3  LYS  34           HE1      LYS  34  65.166 -11.585   2.479
  293    HZ1  LYS  34           HZ1      LYS  34  64.300  -9.374   2.364
  294    HZ2  LYS  34           HZ2      LYS  34  65.710  -8.724   3.062
  295    HZ3  LYS  34           HZ3      LYS  34  64.685  -9.605   3.994
  296    H    GLN  35           HN       GLN  35  68.617  -8.201   7.374
  297    HA   GLN  35           HA       GLN  35  66.891  -8.479   9.452
  298    HB2  GLN  35           HB2      GLN  35  68.512  -7.347  10.831
  299    HB3  GLN  35           HB1      GLN  35  68.699  -9.127  10.745
  300    HG2  GLN  35           HG2      GLN  35  70.274  -7.298   9.063
  301    HG3  GLN  35           HG1      GLN  35  70.758  -7.445  10.774
  302   HE21  GLN  35          HE21      GLN  35  70.694  -8.785   7.727
  303   HE22  GLN  35          HE22      GLN  35  71.461 -10.293   8.083
  304    H    GLN  36           HN       GLN  36  66.127  -6.494   9.944
  305    HA   GLN  36           HA       GLN  36  66.186  -4.454   8.161
  306    HB2  GLN  36           HB2      GLN  36  64.630  -5.230  10.084
  307    HB3  GLN  36           HB1      GLN  36  65.664  -4.207  11.065
  308    HG2  GLN  36           HG2      GLN  36  65.177  -2.358   9.487
  309    HG3  GLN  36           HG1      GLN  36  64.106  -3.555   8.725
  310   HE21  GLN  36          HE21      GLN  36  62.203  -4.115   9.640
  311   HE22  GLN  36          HE22      GLN  36  61.513  -3.305  11.002
  312    H    LEU  37           HN       LEU  37  67.591  -2.738   8.008
  313    HA   LEU  37           HA       LEU  37  69.984  -2.737   9.450
  314    HB2  LEU  37           HB2      LEU  37  68.707  -0.828   7.537
  315    HB3  LEU  37           HB1      LEU  37  70.062  -0.385   8.510
  316    HG   LEU  37           HG       LEU  37  71.297  -2.339   7.565
  317   HD11  LEU  37          HD11      LEU  37  69.507  -3.687   6.807
  318   HD12  LEU  37          HD12      LEU  37  70.491  -3.232   5.417
  319   HD13  LEU  37          HD13      LEU  37  68.947  -2.428   5.717
  320   HD21  LEU  37          HD21      LEU  37  70.391  -0.172   5.689
  321   HD22  LEU  37          HD22      LEU  37  71.807  -1.196   5.453
  322   HD23  LEU  37          HD23      LEU  37  71.737  -0.090   6.827
  323    H    LEU  38           HN       LEU  38  70.758  -1.662  11.008
  324    HA   LEU  38           HA       LEU  38  69.231  -0.464  12.988
  325    HB2  LEU  38           HB2      LEU  38  71.822  -1.372  12.534
  326    HB3  LEU  38           HB1      LEU  38  71.954   0.356  12.535
  327    HG   LEU  38           HG       LEU  38  70.700  -1.137  14.759
  328   HD11  LEU  38          HD11      LEU  38  73.550  -0.203  14.425
  329   HD12  LEU  38          HD12      LEU  38  72.987  -1.869  14.419
  330   HD13  LEU  38          HD13      LEU  38  72.890  -0.911  15.910
  331   HD21  LEU  38          HD21      LEU  38  71.864   1.651  14.582
  332   HD22  LEU  38          HD22      LEU  38  71.192   0.926  16.042
  333   HD23  LEU  38          HD23      LEU  38  70.150   1.246  14.654
  334    H    ARG  39           HN       ARG  39  68.651   1.706  13.038
  335    HA   ARG  39           HA       ARG  39  68.320   3.222  10.781
  336    HB2  ARG  39           HB2      ARG  39  67.300   3.545  13.028
  337    HB3  ARG  39           HB1      ARG  39  68.787   4.318  13.542
  338    HG2  ARG  39           HG2      ARG  39  68.445   6.021  11.799
  339    HG3  ARG  39           HG1      ARG  39  66.888   5.284  11.417
  340    HD2  ARG  39           HD2      ARG  39  66.351   5.490  13.909
  341    HD3  ARG  39           HD1      ARG  39  67.730   6.574  14.008
  342    HE   ARG  39           HE       ARG  39  65.435   7.052  12.257
  343   HH11  ARG  39          HH11      ARG  39  67.806   8.285  14.580
  344   HH12  ARG  39          HH12      ARG  39  67.067   9.810  14.736
  345   HH21  ARG  39          HH21      ARG  39  64.397   9.122  12.535
  346   HH22  ARG  39          HH22      ARG  39  65.088  10.309  13.556
  347    H    ARG  40           HN       ARG  40  71.152   3.197  12.932
  348    HA   ARG  40           HA       ARG  40  72.627   5.318  11.996
  349    HB2  ARG  40           HB2      ARG  40  73.389   2.590  12.989
  350    HB3  ARG  40           HB1      ARG  40  74.555   3.841  12.631
  351    HG2  ARG  40           HG2      ARG  40  72.354   4.078  14.636
  352    HG3  ARG  40           HG1      ARG  40  74.002   3.577  15.021
  353    HD2  ARG  40           HD2      ARG  40  73.090   6.221  13.914
  354    HD3  ARG  40           HD1      ARG  40  73.810   5.924  15.501
  355    HE   ARG  40           HE       ARG  40  75.166   5.939  12.906
  356   HH11  ARG  40          HH11      ARG  40  75.521   5.615  16.430
  357   HH12  ARG  40          HH12      ARG  40  77.202   5.916  16.383
  358   HH21  ARG  40          HH21      ARG  40  77.437   6.403  12.919
  359   HH22  ARG  40          HH22      ARG  40  78.291   6.374  14.380
  360    H    GLU  41           HN       GLU  41  72.602   1.924  10.942
  361    HA   GLU  41           HA       GLU  41  74.514   2.117   8.824
  362    HB2  GLU  41           HB2      GLU  41  72.275   0.106   9.051
  363    HB3  GLU  41           HB1      GLU  41  73.794  -0.166   8.259
  364    HG2  GLU  41           HG2      GLU  41  73.150  -0.127  11.174
  365    HG3  GLU  41           HG1      GLU  41  73.880  -1.401  10.219
  366    H    VAL  42           HN       VAL  42  71.055   2.532   9.034
  367    HA   VAL  42           HA       VAL  42  70.536   2.520   6.238
  368    HB   VAL  42           HB       VAL  42  68.939   4.191   8.213
  369   HG11  VAL  42          HG11      VAL  42  67.092   3.717   6.727
  370   HG12  VAL  42          HG12      VAL  42  68.108   2.612   5.821
  371   HG13  VAL  42          HG13      VAL  42  68.451   4.355   5.768
  372   HG21  VAL  42          HG21      VAL  42  68.611   1.246   7.679
  373   HG22  VAL  42          HG22      VAL  42  67.538   2.244   8.661
  374   HG23  VAL  42          HG23      VAL  42  69.199   1.952   9.184
  375    H    TYR  43           HN       TYR  43  71.250   5.156   8.557
  376    HA   TYR  43           HA       TYR  43  71.289   7.234   6.704
  377    HB2  TYR  43           HB2      TYR  43  72.722   6.842   9.290
  378    HB3  TYR  43           HB1      TYR  43  72.989   8.306   8.309
  379    HD1  TYR  43           HD1      TYR  43  70.594   9.233   7.478
  380    HD2  TYR  43           HD2      TYR  43  71.343   6.996  10.975
  381    HE1  TYR  43           HE1      TYR  43  68.563  10.129   8.452
  382    HE2  TYR  43           HE2      TYR  43  69.324   7.864  11.996
  383    HH   TYR  43           HH       TYR  43  67.887   9.894  11.721
  384    H    ASP  44           HN       ASP  44  73.869   4.903   7.498
  385    HA   ASP  44           HA       ASP  44  76.044   6.100   6.314
  386    HB2  ASP  44           HB2      ASP  44  75.230   3.195   6.403
  387    HB3  ASP  44           HB1      ASP  44  76.696   3.748   5.746
  388    H    PHE  45           HN       PHE  45  73.540   4.239   4.957
  389    HA   PHE  45           HA       PHE  45  74.574   3.712   2.490
  390    HB2  PHE  45           HB2      PHE  45  72.322   3.102   3.826
  391    HB3  PHE  45           HB1      PHE  45  71.743   4.335   2.730
  392    HD1  PHE  45           HD1      PHE  45  73.382   1.036   2.906
  393    HD2  PHE  45           HD2      PHE  45  71.458   3.992   0.511
  394    HE1  PHE  45           HE1      PHE  45  73.120  -0.580   1.064
  395    HE2  PHE  45           HE2      PHE  45  71.240   2.391  -1.302
  396    HZ   PHE  45           HZ       PHE  45  72.027   0.125  -1.041
  397    H    ALA  46           HN       ALA  46  72.479   6.477   3.435
  398    HA   ALA  46           HA       ALA  46  72.877   7.730   0.836
  399    HB1  ALA  46           HB1      ALA  46  70.652   7.956   1.840
  400    HB2  ALA  46           HB2      ALA  46  71.401   9.526   1.636
  401    HB3  ALA  46           HB3      ALA  46  71.379   8.764   3.228
  402    H    ARG  47           HN       ARG  47  74.397   7.830   3.913
  403    HA   ARG  47           HA       ARG  47  75.431  10.486   3.602
  404    HB2  ARG  47           HB2      ARG  47  75.534   8.332   5.585
  405    HB3  ARG  47           HB1      ARG  47  76.973   9.311   5.590
  406    HG2  ARG  47           HG2      ARG  47  75.249  10.053   7.230
  407    HG3  ARG  47           HG1      ARG  47  75.631  11.305   6.052
  408    HD2  ARG  47           HD2      ARG  47  73.591  10.803   4.827
  409    HD3  ARG  47           HD1      ARG  47  73.246   9.456   5.906
  410    HE   ARG  47           HE       ARG  47  73.098  11.170   7.698
  411   HH11  ARG  47          HH11      ARG  47  72.465  12.174   4.343
  412   HH12  ARG  47          HH12      ARG  47  71.358  13.384   4.787
  413   HH21  ARG  47          HH21      ARG  47  71.520  12.838   8.259
  414   HH22  ARG  47          HH22      ARG  47  70.831  13.772   7.036
  415    H    ARG  48           HN       ARG  48  76.189   7.415   2.526
  416    HA   ARG  48           HA       ARG  48  78.716   8.322   1.356
  417    HB2  ARG  48           HB2      ARG  48  77.415   5.650   1.575
  418    HB3  ARG  48           HB1      ARG  48  79.034   5.921   0.961
  419    HG2  ARG  48           HG2      ARG  48  79.814   6.519   3.130
  420    HG3  ARG  48           HG1      ARG  48  78.167   6.549   3.783
  421    HD2  ARG  48           HD2      ARG  48  77.997   4.139   3.094
  422    HD3  ARG  48           HD1      ARG  48  79.721   4.222   2.739
  423    HE   ARG  48           HE       ARG  48  79.107   5.046   5.390
  424   HH11  ARG  48          HH11      ARG  48  79.746   2.185   3.397
  425   HH12  ARG  48          HH12      ARG  48  79.965   1.150   4.740
  426   HH21  ARG  48          HH21      ARG  48  79.325   3.570   7.198
  427   HH22  ARG  48          HH22      ARG  48  79.718   1.936   6.900
  428    H    ASP  49           HN       ASP  49  78.197   6.193  -0.759
  429    HA   ASP  49           HA       ASP  49  75.701   7.067  -1.888
  430    HB2  ASP  49           HB2      ASP  49  77.157   8.725  -2.878
  431    HB3  ASP  49           HB1      ASP  49  78.323   7.495  -3.347
  432    H    LEU  50           HN       LEU  50  75.314   4.915  -1.186
  433    HA   LEU  50           HA       LEU  50  76.389   2.903  -2.938
  434    HB2  LEU  50           HB2      LEU  50  74.608   2.683  -0.524
  435    HB3  LEU  50           HB1      LEU  50  75.135   1.320  -1.486
  436    HG   LEU  50           HG       LEU  50  77.496   2.056  -0.917
  437   HD11  LEU  50          HD11      LEU  50  77.045   4.221  -0.141
  438   HD12  LEU  50          HD12      LEU  50  77.802   3.266   1.142
  439   HD13  LEU  50          HD13      LEU  50  76.064   3.608   1.190
  440   HD21  LEU  50          HD21      LEU  50  77.464   0.905   1.215
  441   HD22  LEU  50          HD22      LEU  50  76.464   0.073   0.011
  442   HD23  LEU  50          HD23      LEU  50  75.711   1.070   1.267
  443    H    CYS  51           HN       CYS  51  74.698   1.206  -3.588
  444    HA   CYS  51           HA       CYS  51  72.337   2.566  -4.607
  445    HB2  CYS  51           HB2      CYS  51  72.513   0.795  -6.427
  446    HB3  CYS  51           HB1      CYS  51  73.760   2.045  -6.438
  447    HG   CYS  51           HG       CYS  51  75.460   0.207  -6.874
  448    H    ILE  52           HN       ILE  52  70.447   1.586  -4.381
  449    HA   ILE  52           HA       ILE  52  70.317  -0.379  -2.298
  450    HB   ILE  52           HB       ILE  52  68.252   1.270  -3.720
  451   HG12  ILE  52          HG12      ILE  52  69.345   0.891  -1.020
  452   HG13  ILE  52          HG11      ILE  52  69.481   2.331  -2.063
  453   HG21  ILE  52          HG21      ILE  52  67.194  -0.962  -3.431
  454   HG22  ILE  52          HG22      ILE  52  66.489   0.242  -2.350
  455   HG23  ILE  52          HG23      ILE  52  67.642  -0.936  -1.724
  456   HD11  ILE  52          HD11      ILE  52  67.194   1.178  -0.686
  457   HD12  ILE  52          HD12      ILE  52  67.099   2.601  -1.787
  458   HD13  ILE  52          HD13      ILE  52  68.041   2.669  -0.243
  459    H    VAL  53           HN       VAL  53  69.486  -2.189  -2.326
  460    HA   VAL  53           HA       VAL  53  69.579  -3.602  -4.829
  461    HB   VAL  53           HB       VAL  53  70.404  -5.474  -3.148
  462   HG11  VAL  53          HG11      VAL  53  72.107  -3.103  -3.993
  463   HG12  VAL  53          HG12      VAL  53  71.700  -4.476  -5.025
  464   HG13  VAL  53          HG13      VAL  53  72.712  -4.713  -3.600
  465   HG21  VAL  53          HG21      VAL  53  71.149  -2.887  -1.745
  466   HG22  VAL  53          HG22      VAL  53  71.736  -4.469  -1.309
  467   HG23  VAL  53          HG23      VAL  53  70.023  -4.085  -1.117
  468    H    TYR  54           HN       TYR  54  67.748  -4.312  -5.297
  469    HA   TYR  54           HA       TYR  54  65.684  -4.831  -3.322
  470    HB2  TYR  54           HB2      TYR  54  65.669  -4.722  -6.330
  471    HB3  TYR  54           HB1      TYR  54  64.256  -5.025  -5.322
  472    HD1  TYR  54           HD1      TYR  54  66.848  -2.496  -6.107
  473    HD2  TYR  54           HD2      TYR  54  63.089  -3.288  -4.338
  474    HE1  TYR  54           HE1      TYR  54  66.448  -0.054  -5.830
  475    HE2  TYR  54           HE2      TYR  54  62.665  -0.917  -4.099
  476    HH   TYR  54           HH       TYR  54  64.717   1.388  -5.583
  477    H    ARG  55           HN       ARG  55  65.554  -6.584  -2.600
  478    HA   ARG  55           HA       ARG  55  66.769  -8.833  -3.994
  479    HB2  ARG  55           HB2      ARG  55  66.440  -8.470  -1.222
  480    HB3  ARG  55           HB1      ARG  55  65.205  -9.624  -1.644
  481    HG2  ARG  55           HG2      ARG  55  68.169 -10.141  -2.313
  482    HG3  ARG  55           HG1      ARG  55  67.422 -10.628  -0.849
  483    HD2  ARG  55           HD2      ARG  55  65.750 -11.956  -2.134
  484    HD3  ARG  55           HD1      ARG  55  66.518 -11.436  -3.629
  485    HE   ARG  55           HE       ARG  55  68.586 -12.540  -2.595
  486   HH11  ARG  55          HH11      ARG  55  65.266 -13.748  -2.195
  487   HH12  ARG  55          HH12      ARG  55  65.742 -15.372  -2.031
  488   HH21  ARG  55          HH21      ARG  55  69.210 -14.810  -2.319
  489   HH22  ARG  55          HH22      ARG  55  68.005 -15.976  -2.087
  490    H    ASP  56           HN       ASP  56  65.302 -10.008  -5.380
  491    HA   ASP  56           HA       ASP  56  63.442 -10.860  -6.299
  492    HB2  ASP  56           HB2      ASP  56  62.723 -11.782  -4.155
  493    HB3  ASP  56           HB1      ASP  56  62.148 -10.183  -3.668
  494    H    GLY  57           HN       GLY  57  62.224  -8.159  -4.405
  495    HA2  GLY  57           HA2      GLY  57  62.240  -6.324  -6.438
  496    HA3  GLY  57           HA1      GLY  57  60.619  -7.040  -6.446
  497    H    ASN  58           HN       ASN  58  62.748  -6.427  -3.660
  498    HA   ASN  58           HA       ASN  58  60.821  -4.422  -2.670
  499    HB2  ASN  58           HB2      ASN  58  62.178  -6.459  -0.949
  500    HB3  ASN  58           HB1      ASN  58  60.807  -5.481  -0.519
  501   HD21  ASN  58          HD21      ASN  58  61.982  -8.285  -2.115
  502   HD22  ASN  58          HD22      ASN  58  60.523  -9.137  -2.316
  503    HA   PRO  59           HA       PRO  59  64.660  -2.547  -2.012
  504    HB2  PRO  59           HB2      PRO  59  63.652  -0.491  -0.317
  505    HB3  PRO  59           HB1      PRO  59  63.964  -0.406  -2.050
  506    HG2  PRO  59           HG2      PRO  59  61.400  -0.305  -0.966
  507    HG3  PRO  59           HG1      PRO  59  61.740  -0.796  -2.577
  508    HD2  PRO  59           HD2      PRO  59  61.244  -2.493  -0.200
  509    HD3  PRO  59           HD1      PRO  59  60.729  -2.720  -1.875
  510    H    TYR  60           HN       TYR  60  66.377  -2.867  -0.993
  511    HA   TYR  60           HA       TYR  60  66.198  -2.893   1.798
  512    HB2  TYR  60           HB2      TYR  60  67.765  -5.205   0.693
  513    HB3  TYR  60           HB1      TYR  60  67.163  -4.814   2.114
  514    HD1  TYR  60           HD1      TYR  60  64.880  -4.990   2.840
  515    HD2  TYR  60           HD2      TYR  60  66.154  -6.343  -0.924
  516    HE1  TYR  60           HE1      TYR  60  62.899  -6.414   2.692
  517    HE2  TYR  60           HE2      TYR  60  64.173  -7.786  -1.079
  518    HH   TYR  60           HH       TYR  60  61.584  -7.547   1.174
  519    H    ALA  61           HN       ALA  61  68.025  -2.665   2.639
  520    HA   ALA  61           HA       ALA  61  69.869  -1.048   1.164
  521    HB1  ALA  61           HB1      ALA  61  70.357  -0.204   3.306
  522    HB2  ALA  61           HB2      ALA  61  69.636  -1.664   3.989
  523    HB3  ALA  61           HB3      ALA  61  68.568  -0.474   3.266
  524    H    VAL  62           HN       VAL  62  72.098  -1.463   2.361
  525    HA   VAL  62           HA       VAL  62  72.610  -4.340   2.555
  526    HB   VAL  62           HB       VAL  62  74.246  -2.014   1.433
  527   HG11  VAL  62          HG11      VAL  62  75.697  -3.131   2.792
  528   HG12  VAL  62          HG12      VAL  62  76.082  -3.507   1.103
  529   HG13  VAL  62          HG13      VAL  62  75.264  -4.713   2.133
  530   HG21  VAL  62          HG21      VAL  62  74.434  -3.436  -0.525
  531   HG22  VAL  62          HG22      VAL  62  72.791  -2.939  -0.163
  532   HG23  VAL  62          HG23      VAL  62  73.344  -4.593   0.253
  533    H    CYS  63           HN       CYS  63  72.755  -4.921   4.528
  534    HA   CYS  63           HA       CYS  63  73.071  -2.965   6.580
  535    HB2  CYS  63           HB2      CYS  63  72.470  -4.662   8.143
  536    HB3  CYS  63           HB1      CYS  63  71.551  -4.918   6.664
  537    H    ASP  64           HN       ASP  64  74.466  -3.793   8.505
  538    HA   ASP  64           HA       ASP  64  77.133  -3.091   8.040
  539    HB2  ASP  64           HB2      ASP  64  76.049  -3.057  10.246
  540    HB3  ASP  64           HB1      ASP  64  76.038  -4.808  10.266
  541    H    LYS  65           HN       LYS  65  75.631  -6.160   8.190
  542    HA   LYS  65           HA       LYS  65  77.922  -7.802   8.177
  543    HB2  LYS  65           HB2      LYS  65  75.048  -8.366   7.473
  544    HB3  LYS  65           HB1      LYS  65  76.253  -9.627   7.652
  545    HG2  LYS  65           HG2      LYS  65  76.613  -9.038   9.946
  546    HG3  LYS  65           HG1      LYS  65  75.535  -7.658   9.790
  547    HD2  LYS  65           HD2      LYS  65  74.385  -9.479  10.906
  548    HD3  LYS  65           HD1      LYS  65  73.699  -9.159   9.311
  549    HE2  LYS  65           HE2      LYS  65  74.688 -11.105   8.386
  550    HE3  LYS  65           HE1      LYS  65  75.684 -11.360   9.818
  551    HZ1  LYS  65           HZ1      LYS  65  73.630 -12.813   9.666
  552    HZ2  LYS  65           HZ2      LYS  65  72.707 -11.427  10.007
  553    HZ3  LYS  65           HZ3      LYS  65  73.853 -11.967  11.076
  554    H    CYS  66           HN       CYS  66  75.745  -6.775   5.490
  555    HA   CYS  66           HA       CYS  66  77.373  -8.210   3.651
  556    HB2  CYS  66           HB2      CYS  66  75.813  -6.728   1.997
  557    HB3  CYS  66           HB1      CYS  66  75.132  -8.134   2.766
  558    H    LEU  67           HN       LEU  67  77.115  -4.943   4.793
  559    HA   LEU  67           HA       LEU  67  78.686  -3.556   3.024
  560    HB2  LEU  67           HB2      LEU  67  78.396  -3.299   5.954
  561    HB3  LEU  67           HB1      LEU  67  79.478  -2.259   5.050
  562    HG   LEU  67           HG       LEU  67  76.505  -2.510   4.581
  563   HD11  LEU  67          HD11      LEU  67  77.092  -1.412   6.615
  564   HD12  LEU  67          HD12      LEU  67  76.499  -0.238   5.400
  565   HD13  LEU  67          HD13      LEU  67  78.249  -0.433   5.707
  566   HD21  LEU  67          HD21      LEU  67  77.663  -1.995   2.489
  567   HD22  LEU  67          HD22      LEU  67  78.591  -0.742   3.306
  568   HD23  LEU  67          HD23      LEU  67  76.854  -0.558   3.112
  569    H    LYS  68           HN       LYS  68  79.777  -5.659   5.631
  570    HA   LYS  68           HA       LYS  68  82.464  -5.009   4.949
  571    HB2  LYS  68           HB2      LYS  68  83.181  -6.687   6.650
  572    HB3  LYS  68           HB1      LYS  68  82.221  -5.346   7.247
  573    HG2  LYS  68           HG2      LYS  68  81.515  -7.231   8.439
  574    HG3  LYS  68           HG1      LYS  68  80.264  -6.967   7.231
  575    HD2  LYS  68           HD2      LYS  68  81.156  -8.736   5.865
  576    HD3  LYS  68           HD1      LYS  68  82.534  -8.922   6.947
  577    HE2  LYS  68           HE2      LYS  68  79.652  -9.376   7.719
  578    HE3  LYS  68           HE1      LYS  68  80.783 -10.651   7.279
  579    HZ1  LYS  68           HZ1      LYS  68  82.161  -9.991   9.162
  580    HZ2  LYS  68           HZ2      LYS  68  80.629 -10.471   9.643
  581    HZ3  LYS  68           HZ3      LYS  68  81.027  -8.825   9.619
  582    H    PHE  69           HN       PHE  69  80.290  -7.435   3.865
  583    HA   PHE  69           HA       PHE  69  82.192  -9.230   2.815
  584    HB2  PHE  69           HB2      PHE  69  79.431  -8.487   2.206
  585    HB3  PHE  69           HB1      PHE  69  80.207  -9.761   1.334
  586    HD1  PHE  69           HD1      PHE  69  81.505 -10.767   4.134
  587    HD2  PHE  69           HD2      PHE  69  77.630  -9.842   2.689
  588    HE1  PHE  69           HE1      PHE  69  80.522 -12.313   5.770
  589    HE2  PHE  69           HE2      PHE  69  76.635 -11.310   4.276
  590    HZ   PHE  69           HZ       PHE  69  78.055 -12.588   5.864
  591    H    TYR  70           HN       TYR  70  80.145  -6.657   1.586
  592    HA   TYR  70           HA       TYR  70  81.329  -6.833  -1.037
  593    HB2  TYR  70           HB2      TYR  70  78.889  -5.383  -0.010
  594    HB3  TYR  70           HB1      TYR  70  79.418  -5.378  -1.693
  595    HD1  TYR  70           HD2      TYR  70  79.479  -7.501  -2.959
  596    HD2  TYR  70           HD1      TYR  70  77.729  -7.273   0.900
  597    HE1  TYR  70           HE2      TYR  70  78.378  -9.634  -3.346
  598    HE2  TYR  70           HE1      TYR  70  76.620  -9.432   0.550
  599    HH   TYR  70           HH       TYR  70  75.882 -10.844  -1.389
  600    H    SER  71           HN       SER  71  82.624  -5.571   1.372
  601    HA   SER  71           HA       SER  71  82.776  -2.777   0.970
  602    HB2  SER  71           HB2      SER  71  84.843  -3.041   2.420
  603    HB3  SER  71           HB1      SER  71  83.353  -3.686   3.113
  604    HG   SER  71           HG       SER  71  84.180  -5.641   3.047
  605    H    LYS  72           HN       LYS  72  84.018  -5.418  -0.650
  606    HA   LYS  72           HA       LYS  72  86.367  -4.382  -1.821
  607    HB2  LYS  72           HB2      LYS  72  85.652  -6.755  -1.804
  608    HB3  LYS  72           HB1      LYS  72  84.403  -6.366  -2.978
  609    HG2  LYS  72           HG2      LYS  72  86.225  -7.317  -4.163
  610    HG3  LYS  72           HG1      LYS  72  86.170  -5.576  -4.490
  611    HD2  LYS  72           HD2      LYS  72  88.467  -6.081  -4.160
  612    HD3  LYS  72           HD1      LYS  72  87.947  -5.330  -2.665
  613    HE2  LYS  72           HE2      LYS  72  88.299  -8.302  -3.147
  614    HE3  LYS  72           HE1      LYS  72  89.395  -7.269  -2.250
  615    HZ1  LYS  72           HZ1      LYS  72  87.504  -6.931  -0.608
  616    HZ2  LYS  72           HZ2      LYS  72  88.099  -8.482  -0.725
  617    HZ3  LYS  72           HZ3      LYS  72  86.660  -8.152  -1.439
  618    H    ILE  73           HN       ILE  73  82.993  -4.262  -2.590
  619    HA   ILE  73           HA       ILE  73  83.360  -2.745  -5.035
  620    HB   ILE  73           HB       ILE  73  80.762  -3.231  -3.605
  621   HG12  ILE  73          HG12      ILE  73  82.045  -5.045  -5.680
  622   HG13  ILE  73          HG11      ILE  73  81.907  -5.416  -3.966
  623   HG21  ILE  73          HG21      ILE  73  80.711  -1.570  -5.390
  624   HG22  ILE  73          HG22      ILE  73  79.818  -3.004  -5.898
  625   HG23  ILE  73          HG23      ILE  73  81.444  -2.716  -6.513
  626   HD11  ILE  73          HD11      ILE  73  79.630  -5.044  -5.886
  627   HD12  ILE  73          HD12      ILE  73  79.480  -5.402  -4.166
  628   HD13  ILE  73          HD13      ILE  73  80.223  -6.580  -5.252
  629    H    SER  74           HN       SER  74  84.299  -0.914  -4.164
  630    HA   SER  74           HA       SER  74  82.371   0.875  -3.038
  631    HB2  SER  74           HB2      SER  74  85.057   0.464  -1.682
  632    HB3  SER  74           HB1      SER  74  83.894   1.718  -1.243
  633    HG   SER  74           HG       SER  74  82.665  -0.622  -1.371
  634    H    GLU  75           HN       GLU  75  85.391   0.254  -4.539
  635    HA   GLU  75           HA       GLU  75  86.053   2.959  -5.153
  636    HB2  GLU  75           HB2      GLU  75  87.092   0.397  -6.372
  637    HB3  GLU  75           HB1      GLU  75  87.807   1.989  -6.554
  638    HG2  GLU  75           HG2      GLU  75  88.182   2.060  -4.113
  639    HG3  GLU  75           HG1      GLU  75  87.571   0.413  -4.007
  640    H    TYR  76           HN       TYR  76  84.298   0.360  -6.590
  641    HA   TYR  76           HA       TYR  76  83.777   1.582  -9.103
  642    HB2  TYR  76           HB2      TYR  76  83.275  -0.810  -8.639
  643    HB3  TYR  76           HB1      TYR  76  82.036  -0.304  -7.487
  644    HD1  TYR  76           HD2      TYR  76  83.062   0.419 -10.968
  645    HD2  TYR  76           HD1      TYR  76  79.869  -0.245  -8.266
  646    HE1  TYR  76           HE2      TYR  76  81.512   0.665 -12.794
  647    HE2  TYR  76           HE1      TYR  76  78.254  -0.004 -10.114
  648    HH   TYR  76           HH       TYR  76  79.254   0.063 -13.375
  649    H    ARG  77           HN       ARG  77  82.714   3.370  -9.434
  650    HA   ARG  77           HA       ARG  77  81.011   4.314  -7.286
  651    HB2  ARG  77           HB2      ARG  77  82.917   5.878  -9.028
  652    HB3  ARG  77           HB1      ARG  77  81.688   6.629  -8.033
  653    HG2  ARG  77           HG2      ARG  77  83.846   4.848  -6.899
  654    HG3  ARG  77           HG1      ARG  77  84.042   6.587  -7.095
  655    HD2  ARG  77           HD2      ARG  77  83.374   6.047  -4.813
  656    HD3  ARG  77           HD1      ARG  77  82.111   6.964  -5.622
  657    HE   ARG  77           HE       ARG  77  82.078   4.074  -5.142
  658   HH11  ARG  77          HH11      ARG  77  80.334   7.169  -5.552
  659   HH12  ARG  77          HH12      ARG  77  78.793   6.520  -5.290
  660   HH21  ARG  77          HH21      ARG  77  79.933   3.184  -4.753
  661   HH22  ARG  77          HH22      ARG  77  78.571   4.228  -4.726
  662    H    HIS  78           HN       HIS  78  81.598   4.007 -10.688
  663    HA   HIS  78           HA       HIS  78  80.663   4.491 -12.463
  664    HB2  HIS  78           HB2      HIS  78  78.220   4.030 -12.906
  665    HB3  HIS  78           HB1      HIS  78  79.119   2.881 -11.932
  666    HD1  HIS  78           HD1      HIS  78  76.282   5.393 -11.556
  667    HD2  HIS  78           HD2      HIS  78  78.218   2.290  -9.706
  668    HE1  HIS  78           HE1      HIS  78  74.757   4.736  -9.657
  669    H    TYR  79           HN       TYR  79  81.515   6.488 -11.130
  670    HA   TYR  79           HA       TYR  79  80.001   8.776 -12.153
  671    HB2  TYR  79           HB2      TYR  79  81.479   8.504  -9.534
  672    HB3  TYR  79           HB1      TYR  79  81.114  10.065 -10.244
  673    HD1  TYR  79           HD1      TYR  79  79.460   6.914  -9.221
  674    HD2  TYR  79           HD2      TYR  79  79.162  11.116  -9.631
  675    HE1  TYR  79           HE1      TYR  79  77.337   6.857  -8.069
  676    HE2  TYR  79           HE2      TYR  79  77.013  11.084  -8.490
  677    HH   TYR  79           HH       TYR  79  76.011   8.456  -6.692
  678    H    SER  80           HN       SER  80  81.908  10.687 -11.874
  679    HA   SER  80           HA       SER  80  84.493   9.556 -12.504
  680    HB2  SER  80           HB2      SER  80  83.157  11.853 -13.967
  681    HB3  SER  80           HB1      SER  80  84.814  11.297 -14.230
  682    HG   SER  80           HG       SER  80  83.218   9.218 -14.322
  Start of MODEL    9
    1    H1   GLY  -1           HT1      GLY  -1  58.705  -0.766   5.105
    2    H2   GLY  -1           HT2      GLY  -1  60.353  -0.781   5.484
    3    H3   GLY  -1           HT3      GLY  -1  59.294  -1.956   6.133
    4    HA2  GLY  -1           HA1      GLY  -1  59.952  -1.667   3.299
    5    HA3  GLY  -1           HA2      GLY  -1  60.609  -2.885   4.395
    6    H    ALA   0           HN       ALA   0  58.814  -2.992   1.924
    7    HA   ALA   0           HA       ALA   0  57.070  -5.027   2.767
    8    HB1  ALA   0           HB1      ALA   0  54.934  -3.864   2.288
    9    HB2  ALA   0           HB2      ALA   0  55.812  -2.349   2.095
   10    HB3  ALA   0           HB3      ALA   0  55.763  -3.141   3.668
   11    H    MET   1           HN       MET   1  55.367  -5.174   0.826
   12    HA   MET   1           HA       MET   1  56.572  -5.735  -1.589
   13    HB2  MET   1           HB2      MET   1  54.229  -5.349  -2.582
   14    HB3  MET   1           HB1      MET   1  54.382  -6.562  -1.323
   15    HG2  MET   1           HG2      MET   1  53.015  -5.443   0.082
   16    HG3  MET   1           HG1      MET   1  53.742  -3.891  -0.309
   17    HE1  MET   1           HE1      MET   1  51.816  -2.687  -3.404
   18    HE2  MET   1           HE2      MET   1  53.492  -3.156  -3.000
   19    HE3  MET   1           HE3      MET   1  52.586  -2.127  -1.934
   20    H    PHE   2           HN       PHE   2  57.770  -4.355  -2.749
   21    HA   PHE   2           HA       PHE   2  56.707  -1.688  -2.988
   22    HB2  PHE   2           HB2      PHE   2  59.229  -2.463  -2.263
   23    HB3  PHE   2           HB1      PHE   2  59.421  -1.968  -3.929
   24    HD1  PHE   2           HD1      PHE   2  57.199  -0.649  -1.272
   25    HD2  PHE   2           HD2      PHE   2  60.391   0.093  -3.940
   26    HE1  PHE   2           HE1      PHE   2  57.175   1.739  -0.652
   27    HE2  PHE   2           HE2      PHE   2  60.399   2.393  -3.379
   28    HZ   PHE   2           HZ       PHE   2  58.763   3.277  -1.707
   29    H    GLN   3           HN       GLN   3  55.468  -1.674  -4.597
   30    HA   GLN   3           HA       GLN   3  56.597  -2.368  -7.178
   31    HB2  GLN   3           HB2      GLN   3  54.335  -3.097  -7.944
   32    HB3  GLN   3           HB1      GLN   3  55.080  -4.131  -6.749
   33    HG2  GLN   3           HG2      GLN   3  52.738  -3.965  -6.250
   34    HG3  GLN   3           HG1      GLN   3  53.634  -3.083  -5.016
   35   HE21  GLN   3          HE21      GLN   3  53.128  -1.931  -8.206
   36   HE22  GLN   3          HE22      GLN   3  52.218  -0.566  -7.801
   37    H    ASP   4           HN       ASP   4  55.476  -1.338  -9.072
   38    HA   ASP   4           HA       ASP   4  55.841   1.405  -8.880
   39    HB2  ASP   4           HB2      ASP   4  56.213   0.411 -10.981
   40    HB3  ASP   4           HB1      ASP   4  54.576  -0.239 -11.076
   41    HA   PRO   5           HA       PRO   5  54.851   3.796 -10.129
   42    HB2  PRO   5           HB2      PRO   5  54.638   5.954  -8.604
   43    HB3  PRO   5           HB1      PRO   5  53.371   5.273  -9.667
   44    HG2  PRO   5           HG2      PRO   5  53.648   4.809  -6.727
   45    HG3  PRO   5           HG1      PRO   5  52.272   5.549  -7.576
   46    HD2  PRO   5           HD2      PRO   5  52.268   2.952  -7.042
   47    HD3  PRO   5           HD1      PRO   5  51.679   3.547  -8.609
   48    H    GLN   6           HN       GLN   6  55.140   2.710  -7.205
   49    HA   GLN   6           HA       GLN   6  57.739   3.837  -6.590
   50    HB2  GLN   6           HB2      GLN   6  56.395   1.518  -5.168
   51    HB3  GLN   6           HB1      GLN   6  57.956   2.171  -4.709
   52    HG2  GLN   6           HG2      GLN   6  56.418   3.113  -3.214
   53    HG3  GLN   6           HG1      GLN   6  56.792   4.386  -4.365
   54   HE21  GLN   6          HE21      GLN   6  54.597   1.683  -4.971
   55   HE22  GLN   6          HE22      GLN   6  53.168   2.637  -5.003
   56    H    GLU   7           HN       GLU   7  58.210   3.350  -8.627
   57    HA   GLU   7           HA       GLU   7  58.975   0.934  -9.830
   58    HB2  GLU   7           HB2      GLU   7  58.698   3.100 -10.932
   59    HB3  GLU   7           HB1      GLU   7  60.243   3.591 -10.259
   60    HG2  GLU   7           HG2      GLU   7  60.228   2.854 -12.536
   61    HG3  GLU   7           HG1      GLU   7  61.416   1.959 -11.555
   62    H    ARG   8           HN       ARG   8  60.398   2.526  -7.385
   63    HA   ARG   8           HA       ARG   8  62.105   2.023  -5.935
   64    HB2  ARG   8           HB2      ARG   8  62.646  -0.552  -7.520
   65    HB3  ARG   8           HB1      ARG   8  63.117  -0.130  -5.872
   66    HG2  ARG   8           HG2      ARG   8  61.379  -1.012  -5.038
   67    HG3  ARG   8           HG1      ARG   8  60.287  -0.006  -6.034
   68    HD2  ARG   8           HD2      ARG   8  61.574  -2.634  -6.816
   69    HD3  ARG   8           HD1      ARG   8  59.907  -2.432  -6.291
   70    HE   ARG   8           HE       ARG   8  60.888  -1.012  -8.661
   71   HH11  ARG   8          HH11      ARG   8  58.623  -3.325  -7.237
   72   HH12  ARG   8          HH12      ARG   8  57.730  -3.535  -8.673
   73   HH21  ARG   8          HH21      ARG   8  59.577  -1.269 -10.640
   74   HH22  ARG   8          HH22      ARG   8  58.285  -2.366 -10.615
   75    HA   PRO   9           HA       PRO   9  65.465   3.836  -8.395
   76    HB2  PRO   9           HB2      PRO   9  66.703   4.912  -6.269
   77    HB3  PRO   9           HB1      PRO   9  65.323   5.720  -6.921
   78    HG2  PRO   9           HG2      PRO   9  65.605   4.029  -4.538
   79    HG3  PRO   9           HG1      PRO   9  64.520   5.404  -4.810
   80    HD2  PRO   9           HD2      PRO   9  63.821   2.775  -4.808
   81    HD3  PRO   9           HD1      PRO   9  62.857   4.009  -5.612
   82    H    ARG  10           HN       ARG  10  67.997   4.040  -7.417
   83    HA   ARG  10           HA       ARG  10  68.642   1.531  -6.024
   84    HB2  ARG  10           HB2      ARG  10  69.909   2.810  -8.366
   85    HB3  ARG  10           HB1      ARG  10  70.969   2.094  -7.161
   86    HG2  ARG  10           HG2      ARG  10  70.583   0.498  -8.796
   87    HG3  ARG  10           HG1      ARG  10  69.680  -0.018  -7.390
   88    HD2  ARG  10           HD2      ARG  10  67.642   0.999  -8.418
   89    HD3  ARG  10           HD1      ARG  10  68.580   1.286  -9.878
   90    HE   ARG  10           HE       ARG  10  68.946  -1.162  -9.892
   91   HH11  ARG  10          HH11      ARG  10  66.055   0.181  -8.299
   92   HH12  ARG  10          HH12      ARG  10  65.076  -1.174  -8.626
   93   HH21  ARG  10          HH21      ARG  10  67.556  -3.053 -10.288
   94   HH22  ARG  10          HH22      ARG  10  65.939  -3.040  -9.754
   95    H    LYS  11           HN       LYS  11  68.134   4.589  -5.501
   96    HA   LYS  11           HA       LYS  11  70.515   4.941  -3.853
   97    HB2  LYS  11           HB2      LYS  11  68.604   7.076  -4.772
   98    HB3  LYS  11           HB1      LYS  11  70.108   7.237  -3.957
   99    HG2  LYS  11           HG2      LYS  11  70.099   5.944  -6.631
  100    HG3  LYS  11           HG1      LYS  11  70.165   7.697  -6.495
  101    HD2  LYS  11           HD2      LYS  11  72.128   7.457  -5.030
  102    HD3  LYS  11           HD1      LYS  11  72.070   5.707  -5.263
  103    HE2  LYS  11           HE2      LYS  11  72.492   5.976  -7.622
  104    HE3  LYS  11           HE1      LYS  11  72.412   7.731  -7.476
  105    HZ1  LYS  11           HZ1      LYS  11  74.700   6.986  -7.532
  106    HZ2  LYS  11           HZ2      LYS  11  74.460   5.979  -6.206
  107    HZ3  LYS  11           HZ3      LYS  11  74.356   7.640  -6.032
  108    H    LEU  12           HN       LEU  12  70.187   5.268  -1.777
  109    HA   LEU  12           HA       LEU  12  67.859   4.434  -0.509
  110    HB2  LEU  12           HB2      LEU  12  69.862   4.174   0.627
  111    HB3  LEU  12           HB1      LEU  12  70.294   5.865   0.455
  112    HG   LEU  12           HG       LEU  12  68.479   6.463   1.986
  113   HD11  LEU  12          HD11      LEU  12  67.040   4.501   1.589
  114   HD12  LEU  12          HD12      LEU  12  67.407   4.777   3.305
  115   HD13  LEU  12          HD13      LEU  12  68.258   3.501   2.410
  116   HD21  LEU  12          HD21      LEU  12  70.223   4.382   3.142
  117   HD22  LEU  12          HD22      LEU  12  69.585   5.830   3.948
  118   HD23  LEU  12          HD23      LEU  12  70.805   5.971   2.668
  119    HA   PRO  13           HA       PRO  13  66.897   8.984   0.724
  120    HB2  PRO  13           HB2      PRO  13  67.835  11.035  -0.795
  121    HB3  PRO  13           HB1      PRO  13  68.804  10.257   0.483
  122    HG2  PRO  13           HG2      PRO  13  68.884   9.696  -2.448
  123    HG3  PRO  13           HG1      PRO  13  70.220  10.109  -1.348
  124    HD2  PRO  13           HD2      PRO  13  69.657   7.570  -1.972
  125    HD3  PRO  13           HD1      PRO  13  70.203   7.999  -0.356
  126    H    GLN  14           HN       GLN  14  67.248   8.353  -2.669
  127    HA   GLN  14           HA       GLN  14  64.859   9.590  -3.532
  128    HB2  GLN  14           HB2      GLN  14  66.867   8.905  -4.926
  129    HB3  GLN  14           HB1      GLN  14  66.244   7.266  -4.835
  130    HG2  GLN  14           HG2      GLN  14  64.124   8.086  -5.801
  131    HG3  GLN  14           HG1      GLN  14  64.919   9.650  -6.014
  132   HE21  GLN  14          HE21      GLN  14  67.503   8.426  -6.709
  133   HE22  GLN  14          HE22      GLN  14  67.327   7.779  -8.290
  134    H    LEU  15           HN       LEU  15  65.676   6.269  -2.448
  135    HA   LEU  15           HA       LEU  15  63.232   5.097  -3.003
  136    HB2  LEU  15           HB2      LEU  15  65.307   3.918  -2.447
  137    HB3  LEU  15           HB1      LEU  15  65.232   4.594  -0.868
  138    HG   LEU  15           HG       LEU  15  63.166   3.479  -0.397
  139   HD11  LEU  15          HD11      LEU  15  62.354   3.195  -2.744
  140   HD12  LEU  15          HD12      LEU  15  62.362   1.679  -1.858
  141   HD13  LEU  15          HD13      LEU  15  63.631   2.006  -3.028
  142   HD21  LEU  15          HD21      LEU  15  65.411   1.789  -1.329
  143   HD22  LEU  15          HD22      LEU  15  64.176   1.286  -0.147
  144   HD23  LEU  15          HD23      LEU  15  65.291   2.638   0.201
  145    H    CYS  16           HN       CYS  16  64.473   6.790  -0.236
  146    HA   CYS  16           HA       CYS  16  62.337   6.335   1.511
  147    HB2  CYS  16           HB2      CYS  16  64.101   8.782   1.256
  148    HB3  CYS  16           HB1      CYS  16  63.115   8.437   2.664
  149    HG   CYS  16           HG       CYS  16  65.726   6.539   1.545
  150    H    THR  17           HN       THR  17  62.799   8.758  -0.984
  151    HA   THR  17           HA       THR  17  60.520  10.291  -0.734
  152    HB   THR  17           HB       THR  17  62.225   9.397  -2.987
  153    HG1  THR  17           HG1      THR  17  61.992  11.803  -1.542
  154   HG21  THR  17          HG21      THR  17  59.948  11.367  -3.184
  155   HG22  THR  17          HG22      THR  17  60.162   9.806  -4.019
  156   HG23  THR  17          HG23      THR  17  61.213  11.160  -4.413
  157    H    GLU  18           HN       GLU  18  61.063   7.298  -2.493
  158    HA   GLU  18           HA       GLU  18  58.611   6.819  -3.657
  159    HB2  GLU  18           HB2      GLU  18  60.780   5.176  -2.602
  160    HB3  GLU  18           HB1      GLU  18  59.416   4.426  -3.437
  161    HG2  GLU  18           HG2      GLU  18  60.742   6.750  -4.600
  162    HG3  GLU  18           HG1      GLU  18  61.658   5.286  -4.699
  163    H    LEU  19           HN       LEU  19  59.876   5.519  -0.546
  164    HA   LEU  19           HA       LEU  19  57.439   4.484   0.367
  165    HB2  LEU  19           HB2      LEU  19  60.019   5.198   1.593
  166    HB3  LEU  19           HB1      LEU  19  58.753   4.649   2.614
  167    HG   LEU  19           HG       LEU  19  58.779   2.664   0.791
  168   HD11  LEU  19          HD11      LEU  19  61.604   3.606   0.965
  169   HD12  LEU  19          HD12      LEU  19  60.591   3.622  -0.477
  170   HD13  LEU  19          HD13      LEU  19  61.057   2.087   0.260
  171   HD21  LEU  19          HD21      LEU  19  60.476   3.053   3.150
  172   HD22  LEU  19          HD22      LEU  19  60.230   1.474   2.368
  173   HD23  LEU  19          HD23      LEU  19  58.860   2.336   3.114
  174    H    GLN  20           HN       GLN  20  58.075   7.648  -0.109
  175    HA   GLN  20           HA       GLN  20  56.990   9.539   0.486
  176    HB2  GLN  20           HB2      GLN  20  55.215   7.513   1.758
  177    HB3  GLN  20           HB1      GLN  20  54.791   9.232   1.760
  178    HG2  GLN  20           HG2      GLN  20  55.275   7.532  -0.664
  179    HG3  GLN  20           HG1      GLN  20  53.659   7.882  -0.020
  180   HE21  GLN  20          HE21      GLN  20  56.334   9.004  -1.897
  181   HE22  GLN  20          HE22      GLN  20  55.621  10.501  -2.373
  182    H    THR  21           HN       THR  21  59.134   8.505   2.130
  183    HA   THR  21           HA       THR  21  58.539   9.849   4.630
  184    HB   THR  21           HB       THR  21  57.953   7.392   4.866
  185    HG1  THR  21           HG1      THR  21  58.886   7.277   6.877
  186   HG21  THR  21          HG21      THR  21  59.703   6.423   3.454
  187   HG22  THR  21          HG22      THR  21  59.821   5.785   5.103
  188   HG23  THR  21          HG23      THR  21  60.936   7.033   4.562
  189    H    THR  22           HN       THR  22  60.905   9.204   5.948
  190    HA   THR  22           HA       THR  22  63.006   9.910   4.009
  191    HB   THR  22           HB       THR  22  63.291  10.865   6.806
  192    HG1  THR  22           HG1      THR  22  61.092  11.438   5.947
  193   HG21  THR  22          HG21      THR  22  63.934  12.022   4.078
  194   HG22  THR  22          HG22      THR  22  65.081  11.263   5.191
  195   HG23  THR  22          HG23      THR  22  64.325  12.790   5.612
  196    H    ILE  23           HN       ILE  23  65.248   9.480   5.148
  197    HA   ILE  23           HA       ILE  23  65.695   6.876   5.531
  198    HB   ILE  23           HB       ILE  23  67.213   9.055   6.834
  199   HG12  ILE  23          HG12      ILE  23  67.098   8.091   4.020
  200   HG13  ILE  23          HG11      ILE  23  66.937   9.703   4.634
  201   HG21  ILE  23          HG21      ILE  23  69.156   7.462   6.407
  202   HG22  ILE  23          HG22      ILE  23  67.990   6.309   5.746
  203   HG23  ILE  23          HG23      ILE  23  67.921   6.749   7.455
  204   HD11  ILE  23          HD11      ILE  23  69.330   9.755   5.163
  205   HD12  ILE  23          HD12      ILE  23  69.055   9.345   3.449
  206   HD13  ILE  23          HD13      ILE  23  69.429   8.077   4.614
  207    H    HIS  24           HN       HIS  24  64.698   9.237   7.737
  208    HA   HIS  24           HA       HIS  24  65.685   8.308  10.188
  209    HB2  HIS  24           HB2      HIS  24  63.486  10.311   9.706
  210    HB3  HIS  24           HB1      HIS  24  64.634  10.331  11.017
  211    HD1  HIS  24           HD1      HIS  24  67.110   9.874   9.017
  212    HD2  HIS  24           HD2      HIS  24  64.205  12.738   8.846
  213    HE1  HIS  24           HE1      HIS  24  67.844  11.369   7.121
  214    H    ASP  25           HN       ASP  25  63.065   7.472   8.248
  215    HA   ASP  25           HA       ASP  25  61.512   6.344  10.502
  216    HB2  ASP  25           HB2      ASP  25  60.458   8.344   9.437
  217    HB3  ASP  25           HB1      ASP  25  60.488   7.481   7.935
  218    H    ILE  26           HN       ILE  26  62.619   6.028   7.204
  219    HA   ILE  26           HA       ILE  26  61.180   3.810   6.335
  220    HB   ILE  26           HB       ILE  26  62.388   5.244   4.794
  221   HG12  ILE  26          HG12      ILE  26  63.650   2.545   4.719
  222   HG13  ILE  26          HG11      ILE  26  62.005   2.716   4.211
  223   HG21  ILE  26          HG21      ILE  26  64.811   5.164   4.596
  224   HG22  ILE  26          HG22      ILE  26  64.884   4.031   5.945
  225   HG23  ILE  26          HG23      ILE  26  64.322   5.681   6.220
  226   HD11  ILE  26          HD11      ILE  26  64.476   3.930   2.990
  227   HD12  ILE  26          HD12      ILE  26  62.836   4.344   2.468
  228   HD13  ILE  26          HD13      ILE  26  63.431   2.679   2.319
  229    H    ILE  27           HN       ILE  27  61.277   1.676   6.643
  230    HA   ILE  27           HA       ILE  27  63.664   0.618   7.860
  231    HB   ILE  27           HB       ILE  27  60.860  -0.482   7.696
  232   HG12  ILE  27          HG12      ILE  27  61.213   1.324   9.335
  233   HG13  ILE  27          HG11      ILE  27  60.758  -0.210  10.059
  234   HG21  ILE  27          HG21      ILE  27  63.320  -1.712   8.921
  235   HG22  ILE  27          HG22      ILE  27  62.470  -2.255   7.471
  236   HG23  ILE  27          HG23      ILE  27  61.676  -2.359   9.048
  237   HD11  ILE  27          HD11      ILE  27  63.542   0.975   9.968
  238   HD12  ILE  27          HD12      ILE  27  63.102  -0.572  10.700
  239   HD13  ILE  27          HD13      ILE  27  62.477   0.928  11.375
  240    H    LEU  28           HN       LEU  28  65.009  -0.012   6.713
  241    HA   LEU  28           HA       LEU  28  64.382  -1.180   4.129
  242    HB2  LEU  28           HB2      LEU  28  66.082   0.834   4.941
  243    HB3  LEU  28           HB1      LEU  28  67.115  -0.569   4.708
  244    HG   LEU  28           HG       LEU  28  66.406  -0.817   2.454
  245   HD11  LEU  28          HD11      LEU  28  64.146  -0.404   2.380
  246   HD12  LEU  28          HD12      LEU  28  64.712   1.190   1.802
  247   HD13  LEU  28          HD13      LEU  28  64.320   0.906   3.520
  248   HD21  LEU  28          HD21      LEU  28  68.089   0.964   2.950
  249   HD22  LEU  28          HD22      LEU  28  66.761   2.108   3.040
  250   HD23  LEU  28          HD23      LEU  28  67.109   1.284   1.520
  251    H    GLU  29           HN       GLU  29  65.234  -3.400   3.872
  252    HA   GLU  29           HA       GLU  29  66.720  -3.970   6.338
  253    HB2  GLU  29           HB2      GLU  29  66.207  -6.264   6.107
  254    HB3  GLU  29           HB1      GLU  29  64.924  -5.231   6.840
  255    HG2  GLU  29           HG2      GLU  29  63.967  -5.318   4.621
  256    HG3  GLU  29           HG1      GLU  29  65.147  -6.619   4.277
  257    H    CYS  30           HN       CYS  30  68.092  -6.143   6.217
  258    HA   CYS  30           HA       CYS  30  69.764  -5.701   4.101
  259    HB2  CYS  30           HB2      CYS  30  70.295  -6.799   6.380
  260    HB3  CYS  30           HB1      CYS  30  69.565  -8.220   5.666
  261    H    VAL  31           HN       VAL  31  69.631  -6.342   2.318
  262    HA   VAL  31           HA       VAL  31  67.688  -7.914   1.049
  263    HB   VAL  31           HB       VAL  31  68.927  -6.298  -0.266
  264   HG11  VAL  31          HG11      VAL  31  71.333  -7.583   0.829
  265   HG12  VAL  31          HG12      VAL  31  70.770  -5.873   0.989
  266   HG13  VAL  31          HG13      VAL  31  71.263  -6.550  -0.583
  267   HG21  VAL  31          HG21      VAL  31  70.155  -7.521  -1.956
  268   HG22  VAL  31          HG22      VAL  31  68.573  -8.183  -1.630
  269   HG23  VAL  31          HG23      VAL  31  70.016  -8.987  -0.981
  270    H    TYR  32           HN       TYR  32  70.790  -8.600   2.407
  271    HA   TYR  32           HA       TYR  32  70.874 -11.253   1.278
  272    HB2  TYR  32           HB2      TYR  32  73.009  -9.867   2.873
  273    HB3  TYR  32           HB1      TYR  32  73.190 -11.347   1.929
  274    HD1  TYR  32           HD2      TYR  32  71.769 -10.791  -0.557
  275    HD2  TYR  32           HD1      TYR  32  74.197  -8.199   1.828
  276    HE1  TYR  32           HE2      TYR  32  72.163  -9.525  -2.455
  277    HE2  TYR  32           HE1      TYR  32  74.634  -6.795  -0.090
  278    HH   TYR  32           HH       TYR  32  72.891  -7.183  -3.074
  279    H    CYS  33           HN       CYS  33  71.174  -9.886   4.616
  280    HA   CYS  33           HA       CYS  33  70.737 -12.662   5.459
  281    HB2  CYS  33           HB2      CYS  33  71.691 -12.165   7.631
  282    HB3  CYS  33           HB1      CYS  33  72.864 -11.834   6.344
  283    H    LYS  34           HN       LYS  34  68.981 -10.125   4.947
  284    HA   LYS  34           HA       LYS  34  67.062  -9.396   5.449
  285    HB2  LYS  34           HB2      LYS  34  66.706 -12.138   6.614
  286    HB3  LYS  34           HB1      LYS  34  65.391 -10.994   6.402
  287    HG2  LYS  34           HG2      LYS  34  65.344 -12.523   4.600
  288    HG3  LYS  34           HG1      LYS  34  65.902 -10.990   3.947
  289    HD2  LYS  34           HD2      LYS  34  68.154 -11.805   3.915
  290    HD3  LYS  34           HD1      LYS  34  67.685 -13.255   4.780
  291    HE2  LYS  34           HE2      LYS  34  66.287 -13.892   2.816
  292    HE3  LYS  34           HE1      LYS  34  66.870 -12.455   1.972
  293    HZ1  LYS  34           HZ1      LYS  34  68.503 -14.773   2.873
  294    HZ2  LYS  34           HZ2      LYS  34  69.158 -13.391   2.236
  295    HZ3  LYS  34           HZ3      LYS  34  68.161 -14.354   1.285
  296    H    GLN  35           HN       GLN  35  68.954  -8.481   7.287
  297    HA   GLN  35           HA       GLN  35  67.360  -8.327   9.692
  298    HB2  GLN  35           HB2      GLN  35  70.185  -7.752   9.097
  299    HB3  GLN  35           HB1      GLN  35  69.402  -7.181  10.539
  300    HG2  GLN  35           HG2      GLN  35  69.474 -10.006   9.721
  301    HG3  GLN  35           HG1      GLN  35  70.677  -9.305  10.857
  302   HE21  GLN  35          HE21      GLN  35  67.577 -10.582  10.352
  303   HE22  GLN  35          HE22      GLN  35  66.977 -10.474  11.968
  304    H    GLN  36           HN       GLN  36  66.563  -6.622  10.147
  305    HA   GLN  36           HA       GLN  36  66.257  -4.503   8.336
  306    HB2  GLN  36           HB2      GLN  36  65.263  -5.231  11.012
  307    HB3  GLN  36           HB1      GLN  36  65.027  -3.614  10.400
  308    HG2  GLN  36           HG2      GLN  36  63.796  -4.388   8.564
  309    HG3  GLN  36           HG1      GLN  36  64.316  -6.046   8.844
  310   HE21  GLN  36          HE21      GLN  36  63.267  -3.891  11.384
  311   HE22  GLN  36          HE22      GLN  36  61.789  -4.671  11.744
  312    H    LEU  37           HN       LEU  37  67.524  -2.923   8.125
  313    HA   LEU  37           HA       LEU  37  69.697  -2.486   9.805
  314    HB2  LEU  37           HB2      LEU  37  68.591  -0.890   7.503
  315    HB3  LEU  37           HB1      LEU  37  69.816  -0.332   8.570
  316    HG   LEU  37           HG       LEU  37  71.181  -2.341   8.012
  317   HD11  LEU  37          HD11      LEU  37  70.680  -3.479   5.892
  318   HD12  LEU  37          HD12      LEU  37  69.084  -2.717   5.905
  319   HD13  LEU  37          HD13      LEU  37  69.543  -3.829   7.189
  320   HD21  LEU  37          HD21      LEU  37  70.496  -0.413   5.810
  321   HD22  LEU  37          HD22      LEU  37  71.938  -1.422   5.860
  322   HD23  LEU  37          HD23      LEU  37  71.689  -0.178   7.085
  323    H    LEU  38           HN       LEU  38  70.104  -1.270  11.369
  324    HA   LEU  38           HA       LEU  38  68.180   0.160  12.838
  325    HB2  LEU  38           HB2      LEU  38  70.731  -0.901  13.084
  326    HB3  LEU  38           HB1      LEU  38  71.004   0.812  13.003
  327    HG   LEU  38           HG       LEU  38  69.234  -0.556  14.961
  328   HD11  LEU  38          HD11      LEU  38  72.025   0.550  15.227
  329   HD12  LEU  38          HD12      LEU  38  71.560  -1.146  15.187
  330   HD13  LEU  38          HD13      LEU  38  71.069  -0.130  16.556
  331   HD21  LEU  38          HD21      LEU  38  68.581   1.767  14.558
  332   HD22  LEU  38          HD22      LEU  38  70.239   2.291  14.860
  333   HD23  LEU  38          HD23      LEU  38  69.281   1.596  16.168
  334    H    ARG  39           HN       ARG  39  67.714   2.407  12.417
  335    HA   ARG  39           HA       ARG  39  68.338   3.442   9.959
  336    HB2  ARG  39           HB2      ARG  39  67.340   5.467  10.527
  337    HB3  ARG  39           HB1      ARG  39  66.564   4.295  11.572
  338    HG2  ARG  39           HG2      ARG  39  68.017   5.004  13.401
  339    HG3  ARG  39           HG1      ARG  39  68.729   6.209  12.306
  340    HD2  ARG  39           HD2      ARG  39  66.459   7.160  11.963
  341    HD3  ARG  39           HD1      ARG  39  65.825   6.029  13.151
  342    HE   ARG  39           HE       ARG  39  67.945   7.546  14.234
  343   HH11  ARG  39          HH11      ARG  39  64.477   7.739  13.462
  344   HH12  ARG  39          HH12      ARG  39  64.200   9.064  14.478
  345   HH21  ARG  39          HH21      ARG  39  67.548   9.348  15.612
  346   HH22  ARG  39          HH22      ARG  39  65.984  10.005  15.744
  347    H    ARG  40           HN       ARG  40  70.395   3.628  12.819
  348    HA   ARG  40           HA       ARG  40  72.260   5.440  12.118
  349    HB2  ARG  40           HB2      ARG  40  72.086   4.005  14.143
  350    HB3  ARG  40           HB1      ARG  40  72.654   2.677  13.145
  351    HG2  ARG  40           HG2      ARG  40  74.692   3.906  12.702
  352    HG3  ARG  40           HG1      ARG  40  74.113   5.175  13.800
  353    HD2  ARG  40           HD2      ARG  40  75.585   3.727  15.080
  354    HD3  ARG  40           HD1      ARG  40  73.893   3.482  15.556
  355    HE   ARG  40           HE       ARG  40  74.719   1.654  13.528
  356   HH11  ARG  40          HH11      ARG  40  74.751   2.181  17.041
  357   HH12  ARG  40          HH12      ARG  40  74.955   0.540  17.419
  358   HH21  ARG  40          HH21      ARG  40  74.952  -0.597  14.052
  359   HH22  ARG  40          HH22      ARG  40  75.083  -1.074  15.693
  360    H    GLU  41           HN       GLU  41  72.047   1.993  11.147
  361    HA   GLU  41           HA       GLU  41  74.368   1.938   9.386
  362    HB2  GLU  41           HB2      GLU  41  72.014   0.064   9.238
  363    HB3  GLU  41           HB1      GLU  41  73.669  -0.359   8.972
  364    HG2  GLU  41           HG2      GLU  41  72.237   0.003  11.594
  365    HG3  GLU  41           HG1      GLU  41  72.900  -1.445  10.899
  366    H    VAL  42           HN       VAL  42  70.949   2.541   9.081
  367    HA   VAL  42           HA       VAL  42  70.904   2.475   6.226
  368    HB   VAL  42           HB       VAL  42  68.975   4.162   7.871
  369   HG11  VAL  42          HG11      VAL  42  68.579   2.469   5.446
  370   HG12  VAL  42          HG12      VAL  42  68.918   4.209   5.367
  371   HG13  VAL  42          HG13      VAL  42  67.416   3.615   6.110
  372   HG21  VAL  42          HG21      VAL  42  67.555   2.232   8.178
  373   HG22  VAL  42          HG22      VAL  42  69.137   1.906   8.908
  374   HG23  VAL  42          HG23      VAL  42  68.720   1.218   7.344
  375    H    TYR  43           HN       TYR  43  71.421   5.071   8.646
  376    HA   TYR  43           HA       TYR  43  71.762   7.173   6.878
  377    HB2  TYR  43           HB2      TYR  43  72.986   6.640   9.572
  378    HB3  TYR  43           HB1      TYR  43  73.332   8.147   8.682
  379    HD1  TYR  43           HD1      TYR  43  70.593   8.515   7.591
  380    HD2  TYR  43           HD2      TYR  43  71.924   7.340  11.417
  381    HE1  TYR  43           HE1      TYR  43  68.530   9.315   8.518
  382    HE2  TYR  43           HE2      TYR  43  69.823   8.157  12.402
  383    HH   TYR  43           HH       TYR  43  68.022   9.786  11.808
  384    H    ASP  44           HN       ASP  44  74.096   4.699   7.834
  385    HA   ASP  44           HA       ASP  44  76.422   5.679   6.723
  386    HB2  ASP  44           HB2      ASP  44  75.296   2.886   6.878
  387    HB3  ASP  44           HB1      ASP  44  76.840   3.187   6.260
  388    H    PHE  45           HN       PHE  45  73.830   4.020   5.310
  389    HA   PHE  45           HA       PHE  45  74.911   3.375   2.866
  390    HB2  PHE  45           HB2      PHE  45  72.599   2.895   4.170
  391    HB3  PHE  45           HB1      PHE  45  72.113   4.128   3.025
  392    HD1  PHE  45           HD1      PHE  45  73.523   0.753   3.367
  393    HD2  PHE  45           HD2      PHE  45  71.939   3.757   0.794
  394    HE1  PHE  45           HE1      PHE  45  73.259  -0.899   1.551
  395    HE2  PHE  45           HE2      PHE  45  71.714   2.120  -0.986
  396    HZ   PHE  45           HZ       PHE  45  72.331  -0.190  -0.617
  397    H    ALA  46           HN       ALA  46  72.969   6.232   3.799
  398    HA   ALA  46           HA       ALA  46  73.432   7.459   1.206
  399    HB1  ALA  46           HB1      ALA  46  71.955   8.563   3.586
  400    HB2  ALA  46           HB2      ALA  46  71.206   7.801   2.161
  401    HB3  ALA  46           HB3      ALA  46  72.038   9.324   2.006
  402    H    ARG  47           HN       ARG  47  74.804   7.667   4.441
  403    HA   ARG  47           HA       ARG  47  75.949  10.249   4.052
  404    HB2  ARG  47           HB2      ARG  47  75.894   8.215   6.139
  405    HB3  ARG  47           HB1      ARG  47  77.441   8.997   6.068
  406    HG2  ARG  47           HG2      ARG  47  76.179  10.128   7.701
  407    HG3  ARG  47           HG1      ARG  47  76.225  11.195   6.312
  408    HD2  ARG  47           HD2      ARG  47  73.907   9.360   6.912
  409    HD3  ARG  47           HD1      ARG  47  74.023  10.998   7.538
  410    HE   ARG  47           HE       ARG  47  74.275  10.954   4.701
  411   HH11  ARG  47          HH11      ARG  47  71.892  10.867   7.340
  412   HH12  ARG  47          HH12      ARG  47  70.610  11.415   6.349
  413   HH21  ARG  47          HH21      ARG  47  72.491  11.705   3.382
  414   HH22  ARG  47          HH22      ARG  47  70.946  11.863   4.071
  415    H    ARG  48           HN       ARG  48  76.762   7.103   3.130
  416    HA   ARG  48           HA       ARG  48  79.371   8.008   2.137
  417    HB2  ARG  48           HB2      ARG  48  78.234   5.316   2.723
  418    HB3  ARG  48           HB1      ARG  48  79.810   5.553   1.990
  419    HG2  ARG  48           HG2      ARG  48  80.636   6.572   3.986
  420    HG3  ARG  48           HG1      ARG  48  79.012   6.577   4.694
  421    HD2  ARG  48           HD2      ARG  48  78.930   4.234   4.718
  422    HD3  ARG  48           HD1      ARG  48  80.410   4.106   3.794
  423    HE   ARG  48           HE       ARG  48  81.060   5.501   6.079
  424   HH11  ARG  48          HH11      ARG  48  79.726   2.296   5.403
  425   HH12  ARG  48          HH12      ARG  48  80.354   1.581   6.819
  426   HH21  ARG  48          HH21      ARG  48  81.900   4.510   8.056
  427   HH22  ARG  48          HH22      ARG  48  81.604   2.877   8.364
  428    H    ASP  49           HN       ASP  49  79.326   5.628   0.277
  429    HA   ASP  49           HA       ASP  49  77.184   6.501  -1.481
  430    HB2  ASP  49           HB2      ASP  49  79.226   7.643  -2.226
  431    HB3  ASP  49           HB1      ASP  49  80.047   6.095  -2.364
  432    H    LEU  50           HN       LEU  50  76.293   4.578  -0.466
  433    HA   LEU  50           HA       LEU  50  77.122   2.145  -1.782
  434    HB2  LEU  50           HB2      LEU  50  75.213   2.622   0.509
  435    HB3  LEU  50           HB1      LEU  50  75.576   1.053  -0.172
  436    HG   LEU  50           HG       LEU  50  77.981   1.506   0.478
  437   HD11  LEU  50          HD11      LEU  50  76.755   3.630   2.178
  438   HD12  LEU  50          HD12      LEU  50  77.861   3.813   0.817
  439   HD13  LEU  50          HD13      LEU  50  78.415   3.012   2.293
  440   HD21  LEU  50          HD21      LEU  50  75.922   1.214   2.624
  441   HD22  LEU  50          HD22      LEU  50  77.640   0.850   2.796
  442   HD23  LEU  50          HD23      LEU  50  76.643  -0.096   1.674
  443    H    CYS  51           HN       CYS  51  75.412   0.855  -2.786
  444    HA   CYS  51           HA       CYS  51  73.134   2.494  -3.664
  445    HB2  CYS  51           HB2      CYS  51  73.222   1.179  -5.784
  446    HB3  CYS  51           HB1      CYS  51  74.646   2.186  -5.500
  447    HG   CYS  51           HG       CYS  51  75.045  -0.836  -4.267
  448    H    ILE  52           HN       ILE  52  71.168   1.412  -4.016
  449    HA   ILE  52           HA       ILE  52  70.804  -0.568  -1.981
  450    HB   ILE  52           HB       ILE  52  68.910   1.132  -3.537
  451   HG12  ILE  52          HG12      ILE  52  69.643   0.587  -0.737
  452   HG13  ILE  52          HG11      ILE  52  69.969   2.067  -1.690
  453   HG21  ILE  52          HG21      ILE  52  67.793  -1.089  -3.484
  454   HG22  ILE  52          HG22      ILE  52  66.996   0.065  -2.415
  455   HG23  ILE  52          HG23      ILE  52  68.062  -1.168  -1.742
  456   HD11  ILE  52          HD11      ILE  52  67.516   0.930  -0.653
  457   HD12  ILE  52          HD12      ILE  52  67.584   2.319  -1.790
  458   HD13  ILE  52          HD13      ILE  52  68.308   2.434  -0.126
  459    H    VAL  53           HN       VAL  53  69.865  -2.344  -2.055
  460    HA   VAL  53           HA       VAL  53  70.221  -3.874  -4.476
  461    HB   VAL  53           HB       VAL  53  70.874  -5.659  -2.660
  462   HG11  VAL  53          HG11      VAL  53  72.673  -3.312  -3.325
  463   HG12  VAL  53          HG12      VAL  53  72.355  -4.670  -4.400
  464   HG13  VAL  53          HG13      VAL  53  73.211  -4.937  -2.874
  465   HG21  VAL  53          HG21      VAL  53  71.965  -4.619  -0.721
  466   HG22  VAL  53          HG22      VAL  53  70.250  -4.247  -0.737
  467   HG23  VAL  53          HG23      VAL  53  71.423  -3.036  -1.254
  468    H    TYR  54           HN       TYR  54  68.385  -4.577  -5.033
  469    HA   TYR  54           HA       TYR  54  66.226  -5.103  -3.184
  470    HB2  TYR  54           HB2      TYR  54  66.402  -5.094  -6.194
  471    HB3  TYR  54           HB1      TYR  54  64.936  -5.392  -5.257
  472    HD1  TYR  54           HD2      TYR  54  67.525  -2.853  -6.005
  473    HD2  TYR  54           HD1      TYR  54  63.682  -3.611  -4.327
  474    HE1  TYR  54           HE2      TYR  54  67.109  -0.435  -5.766
  475    HE2  TYR  54           HE1      TYR  54  63.307  -1.294  -4.138
  476    HH   TYR  54           HH       TYR  54  64.594   0.713  -3.838
  477    H    ARG  55           HN       ARG  55  65.994  -6.853  -2.454
  478    HA   ARG  55           HA       ARG  55  67.396  -9.092  -3.657
  479    HB2  ARG  55           HB2      ARG  55  66.883  -8.628  -0.953
  480    HB3  ARG  55           HB1      ARG  55  65.624  -9.750  -1.406
  481    HG2  ARG  55           HG2      ARG  55  68.580 -10.416  -1.883
  482    HG3  ARG  55           HG1      ARG  55  67.742 -10.769  -0.425
  483    HD2  ARG  55           HD2      ARG  55  66.855 -11.701  -3.164
  484    HD3  ARG  55           HD1      ARG  55  67.637 -12.714  -1.946
  485    HE   ARG  55           HE       ARG  55  65.419 -11.671  -0.708
  486   HH11  ARG  55          HH11      ARG  55  65.950 -13.714  -3.552
  487   HH12  ARG  55          HH12      ARG  55  64.416 -14.455  -3.429
  488   HH21  ARG  55          HH21      ARG  55  63.358 -12.664  -0.579
  489   HH22  ARG  55          HH22      ARG  55  62.900 -13.835  -1.724
  490    H    ASP  56           HN       ASP  56  66.118 -10.352  -5.098
  491    HA   ASP  56           HA       ASP  56  64.409 -10.986  -6.399
  492    HB2  ASP  56           HB2      ASP  56  63.323 -12.030  -4.451
  493    HB3  ASP  56           HB1      ASP  56  62.684 -10.468  -3.950
  494    H    GLY  57           HN       GLY  57  62.577  -8.543  -4.617
  495    HA2  GLY  57           HA2      GLY  57  63.175  -6.523  -6.500
  496    HA3  GLY  57           HA1      GLY  57  61.559  -7.182  -6.786
  497    H    ASN  58           HN       ASN  58  63.265  -6.738  -3.731
  498    HA   ASN  58           HA       ASN  58  61.259  -4.712  -2.891
  499    HB2  ASN  58           HB2      ASN  58  62.539  -6.743  -1.095
  500    HB3  ASN  58           HB1      ASN  58  61.120  -5.806  -0.748
  501   HD21  ASN  58          HD21      ASN  58  62.462  -8.576  -2.277
  502   HD22  ASN  58          HD22      ASN  58  61.015  -9.451  -2.515
  503    HA   PRO  59           HA       PRO  59  65.019  -2.802  -1.974
  504    HB2  PRO  59           HB2      PRO  59  63.815  -0.764  -0.348
  505    HB3  PRO  59           HB1      PRO  59  64.308  -0.657  -2.040
  506    HG2  PRO  59           HG2      PRO  59  61.651  -0.603  -1.273
  507    HG3  PRO  59           HG1      PRO  59  62.159  -1.180  -2.813
  508    HD2  PRO  59           HD2      PRO  59  61.538  -2.774  -0.359
  509    HD3  PRO  59           HD1      PRO  59  61.086  -3.070  -2.048
  510    H    TYR  60           HN       TYR  60  66.644  -3.142  -0.858
  511    HA   TYR  60           HA       TYR  60  66.333  -3.089   1.917
  512    HB2  TYR  60           HB2      TYR  60  67.904  -5.461   0.889
  513    HB3  TYR  60           HB1      TYR  60  67.276  -5.046   2.324
  514    HD1  TYR  60           HD1      TYR  60  65.007  -5.263   2.948
  515    HD2  TYR  60           HD2      TYR  60  66.435  -6.542  -0.752
  516    HE1  TYR  60           HE1      TYR  60  63.017  -6.723   2.700
  517    HE2  TYR  60           HE2      TYR  60  64.494  -7.998  -1.044
  518    HH   TYR  60           HH       TYR  60  62.851  -9.178   0.529
  519    H    ALA  61           HN       ALA  61  68.171  -2.887   2.810
  520    HA   ALA  61           HA       ALA  61  70.103  -1.309   1.387
  521    HB1  ALA  61           HB1      ALA  61  69.776  -1.924   4.214
  522    HB2  ALA  61           HB2      ALA  61  68.732  -0.769   3.444
  523    HB3  ALA  61           HB3      ALA  61  70.518  -0.462   3.518
  524    H    VAL  62           HN       VAL  62  72.207  -1.744   2.720
  525    HA   VAL  62           HA       VAL  62  72.715  -4.603   2.861
  526    HB   VAL  62           HB       VAL  62  74.474  -2.270   2.038
  527   HG11  VAL  62          HG11      VAL  62  76.268  -3.828   1.820
  528   HG12  VAL  62          HG12      VAL  62  75.273  -5.060   2.649
  529   HG13  VAL  62          HG13      VAL  62  75.694  -3.526   3.454
  530   HG21  VAL  62          HG21      VAL  62  74.816  -3.538  -0.009
  531   HG22  VAL  62          HG22      VAL  62  73.152  -3.044   0.222
  532   HG23  VAL  62          HG23      VAL  62  73.639  -4.727   0.556
  533    H    CYS  63           HN       CYS  63  72.814  -5.171   4.935
  534    HA   CYS  63           HA       CYS  63  72.833  -3.217   6.947
  535    HB2  CYS  63           HB2      CYS  63  72.630  -4.988   8.453
  536    HB3  CYS  63           HB1      CYS  63  71.921  -5.571   6.934
  537    H    ASP  64           HN       ASP  64  74.346  -3.608   8.862
  538    HA   ASP  64           HA       ASP  64  76.871  -2.502   8.389
  539    HB2  ASP  64           HB2      ASP  64  75.701  -2.401  10.554
  540    HB3  ASP  64           HB1      ASP  64  75.902  -4.118  10.722
  541    H    LYS  65           HN       LYS  65  75.912  -5.790   8.870
  542    HA   LYS  65           HA       LYS  65  78.546  -6.908   9.077
  543    HB2  LYS  65           HB2      LYS  65  75.882  -8.228   8.561
  544    HB3  LYS  65           HB1      LYS  65  77.346  -9.066   9.037
  545    HG2  LYS  65           HG2      LYS  65  77.363  -7.917  11.158
  546    HG3  LYS  65           HG1      LYS  65  75.965  -6.964  10.680
  547    HD2  LYS  65           HD2      LYS  65  75.208  -8.731  12.114
  548    HD3  LYS  65           HD1      LYS  65  74.684  -9.049  10.459
  549    HE2  LYS  65           HE2      LYS  65  76.454 -10.686  10.167
  550    HE3  LYS  65           HE1      LYS  65  77.095 -10.316  11.767
  551    HZ1  LYS  65           HZ1      LYS  65  75.776 -12.329  11.775
  552    HZ2  LYS  65           HZ2      LYS  65  74.437 -11.511  11.198
  553    HZ3  LYS  65           HZ3      LYS  65  75.060 -11.154  12.738
  554    H    CYS  66           HN       CYS  66  76.084  -6.956   6.577
  555    HA   CYS  66           HA       CYS  66  77.672  -8.324   4.608
  556    HB2  CYS  66           HB2      CYS  66  75.042  -6.892   4.470
  557    HB3  CYS  66           HB1      CYS  66  75.626  -7.853   3.169
  558    H    LEU  67           HN       LEU  67  77.533  -5.075   5.600
  559    HA   LEU  67           HA       LEU  67  77.762  -3.533   3.417
  560    HB2  LEU  67           HB2      LEU  67  77.869  -3.162   6.017
  561    HB3  LEU  67           HB1      LEU  67  79.576  -2.976   5.661
  562    HG   LEU  67           HG       LEU  67  77.550  -1.477   4.110
  563   HD11  LEU  67          HD11      LEU  67  77.769   0.362   5.753
  564   HD12  LEU  67          HD12      LEU  67  78.666  -0.761   6.807
  565   HD13  LEU  67          HD13      LEU  67  76.986  -1.101   6.355
  566   HD21  LEU  67          HD21      LEU  67  79.377   0.187   3.940
  567   HD22  LEU  67          HD22      LEU  67  79.847  -1.394   3.320
  568   HD23  LEU  67          HD23      LEU  67  80.401  -0.873   4.910
  569    H    LYS  68           HN       LYS  68  80.426  -5.521   4.755
  570    HA   LYS  68           HA       LYS  68  82.204  -4.349   2.807
  571    HB2  LYS  68           HB2      LYS  68  83.979  -5.852   3.500
  572    HB3  LYS  68           HB1      LYS  68  83.242  -5.084   4.894
  573    HG2  LYS  68           HG2      LYS  68  82.475  -7.868   4.068
  574    HG3  LYS  68           HG1      LYS  68  83.937  -7.575   4.997
  575    HD2  LYS  68           HD2      LYS  68  82.538  -6.442   6.713
  576    HD3  LYS  68           HD1      LYS  68  81.104  -6.911   5.795
  577    HE2  LYS  68           HE2      LYS  68  81.479  -8.490   7.612
  578    HE3  LYS  68           HE1      LYS  68  81.734  -9.277   6.060
  579    HZ1  LYS  68           HZ1      LYS  68  83.436  -9.873   7.675
  580    HZ2  LYS  68           HZ2      LYS  68  83.899  -8.264   7.837
  581    HZ3  LYS  68           HZ3      LYS  68  84.130  -9.054   6.376
  582    H    PHE  69           HN       PHE  69  80.018  -6.898   2.781
  583    HA   PHE  69           HA       PHE  69  81.157  -8.716   0.969
  584    HB2  PHE  69           HB2      PHE  69  78.625  -8.036   2.141
  585    HB3  PHE  69           HB1      PHE  69  78.486  -9.019   0.730
  586    HD1  PHE  69           HD1      PHE  69  80.062  -8.738   4.043
  587    HD2  PHE  69           HD2      PHE  69  78.692 -11.270   0.942
  588    HE1  PHE  69           HE1      PHE  69  80.315 -10.662   5.511
  589    HE2  PHE  69           HE2      PHE  69  78.928 -13.187   2.349
  590    HZ   PHE  69           HZ       PHE  69  79.744 -12.892   4.711
  591    H    TYR  70           HN       TYR  70  78.517  -6.284   0.683
  592    HA   TYR  70           HA       TYR  70  79.019  -5.894  -2.128
  593    HB2  TYR  70           HB2      TYR  70  76.441  -6.772  -0.873
  594    HB3  TYR  70           HB1      TYR  70  76.637  -6.224  -2.527
  595    HD1  TYR  70           HD2      TYR  70  78.251  -7.599  -3.966
  596    HD2  TYR  70           HD1      TYR  70  76.626  -9.007  -0.317
  597    HE1  TYR  70           HE2      TYR  70  78.789  -9.841  -4.625
  598    HE2  TYR  70           HE1      TYR  70  77.174 -11.311  -0.940
  599    HH   TYR  70           HH       TYR  70  77.488 -12.512  -3.202
  600    H    SER  71           HN       SER  71  79.181  -3.625  -1.888
  601    HA   SER  71           HA       SER  71  76.794  -2.341  -0.838
  602    HB2  SER  71           HB2      SER  71  78.363  -0.602   0.260
  603    HB3  SER  71           HB1      SER  71  78.118  -2.146   1.081
  604    HG   SER  71           HG       SER  71  80.077  -2.613   0.811
  605    H    LYS  72           HN       LYS  72  79.789  -2.029  -2.592
  606    HA   LYS  72           HA       LYS  72  78.936   0.312  -4.031
  607    HB2  LYS  72           HB2      LYS  72  81.307  -0.191  -3.563
  608    HB3  LYS  72           HB1      LYS  72  81.183  -1.646  -4.524
  609    HG2  LYS  72           HG2      LYS  72  82.295   0.163  -5.757
  610    HG3  LYS  72           HG1      LYS  72  80.796  -0.368  -6.531
  611    HD2  LYS  72           HD2      LYS  72  79.617   1.515  -5.556
  612    HD3  LYS  72           HD1      LYS  72  81.092   2.060  -4.760
  613    HE2  LYS  72           HE2      LYS  72  80.650   1.828  -7.734
  614    HE3  LYS  72           HE1      LYS  72  80.582   3.317  -6.800
  615    HZ1  LYS  72           HZ1      LYS  72  82.702   3.167  -7.824
  616    HZ2  LYS  72           HZ2      LYS  72  82.945   1.602  -7.287
  617    HZ3  LYS  72           HZ3      LYS  72  82.944   2.882  -6.179
  618    H    ILE  73           HN       ILE  73  79.031  -3.078  -4.385
  619    HA   ILE  73           HA       ILE  73  78.069  -3.055  -7.089
  620    HB   ILE  73           HB       ILE  73  78.230  -5.547  -6.640
  621   HG12  ILE  73          HG12      ILE  73  80.156  -4.451  -4.588
  622   HG13  ILE  73          HG11      ILE  73  78.744  -5.460  -4.275
  623   HG21  ILE  73          HG21      ILE  73  79.513  -4.352  -8.330
  624   HG22  ILE  73          HG22      ILE  73  80.592  -5.456  -7.480
  625   HG23  ILE  73          HG23      ILE  73  80.619  -3.732  -7.098
  626   HD11  ILE  73          HD11      ILE  73  79.810  -7.258  -5.463
  627   HD12  ILE  73          HD12      ILE  73  80.846  -6.674  -4.135
  628   HD13  ILE  73          HD13      ILE  73  81.159  -6.193  -5.821
  629    H    SER  74           HN       SER  74  75.910  -2.761  -7.192
  630    HA   SER  74           HA       SER  74  74.198  -4.252  -5.399
  631    HB2  SER  74           HB2      SER  74  73.598  -1.897  -5.932
  632    HB3  SER  74           HB1      SER  74  73.521  -2.304  -7.643
  633    HG   SER  74           HG       SER  74  71.604  -2.459  -5.824
  634    H    GLU  75           HN       GLU  75  75.508  -4.244  -8.497
  635    HA   GLU  75           HA       GLU  75  74.055  -6.656  -9.291
  636    HB2  GLU  75           HB2      GLU  75  73.483  -4.578 -10.534
  637    HB3  GLU  75           HB1      GLU  75  75.168  -4.433 -10.988
  638    HG2  GLU  75           HG2      GLU  75  74.975  -6.536 -12.236
  639    HG3  GLU  75           HG1      GLU  75  73.257  -6.598 -11.811
  640    H    TYR  76           HN       TYR  76  75.581  -8.056  -8.649
  641    HA   TYR  76           HA       TYR  76  78.314  -7.796  -9.714
  642    HB2  TYR  76           HB2      TYR  76  78.008  -7.559  -7.185
  643    HB3  TYR  76           HB1      TYR  76  77.445  -9.218  -7.185
  644    HD1  TYR  76           HD2      TYR  76  80.247  -7.271  -8.594
  645    HD2  TYR  76           HD1      TYR  76  79.032 -10.788  -6.588
  646    HE1  TYR  76           HE2      TYR  76  82.563  -7.961  -8.468
  647    HE2  TYR  76           HE1      TYR  76  81.378 -11.522  -6.435
  648    HH   TYR  76           HH       TYR  76  83.503 -11.104  -7.635
  649    H    ARG  77           HN       ARG  77  79.139  -9.873 -10.438
  650    HA   ARG  77           HA       ARG  77  77.054 -11.785 -10.710
  651    HB2  ARG  77           HB2      ARG  77  77.686 -12.281 -13.083
  652    HB3  ARG  77           HB1      ARG  77  76.863 -10.755 -12.842
  653    HG2  ARG  77           HG2      ARG  77  79.781 -10.848 -12.855
  654    HG3  ARG  77           HG1      ARG  77  78.948 -10.966 -14.414
  655    HD2  ARG  77           HD2      ARG  77  78.644  -8.750 -12.368
  656    HD3  ARG  77           HD1      ARG  77  79.606  -8.626 -13.841
  657    HE   ARG  77           HE       ARG  77  77.146  -9.295 -14.746
  658   HH11  ARG  77          HH11      ARG  77  78.352  -6.678 -12.696
  659   HH12  ARG  77          HH12      ARG  77  77.107  -5.586 -13.119
  660   HH21  ARG  77          HH21      ARG  77  75.469  -7.779 -15.352
  661   HH22  ARG  77          HH22      ARG  77  75.421  -6.231 -14.634
  662    H    HIS  78           HN       HIS  78  77.988 -12.768  -9.137
  663    HA   HIS  78           HA       HIS  78  80.504 -13.967  -9.817
  664    HB2  HIS  78           HB2      HIS  78  80.550 -14.789  -7.402
  665    HB3  HIS  78           HB1      HIS  78  80.403 -13.029  -7.597
  666    HD1  HIS  78           HD1      HIS  78  79.025 -15.866  -5.753
  667    HD2  HIS  78           HD2      HIS  78  77.794 -12.227  -7.173
  668    HE1  HIS  78           HE1      HIS  78  76.892 -15.386  -4.514
  669    H    TYR  79           HN       TYR  79  77.993 -15.573  -7.956
  670    HA   TYR  79           HA       TYR  79  76.707 -17.353  -8.253
  671    HB2  TYR  79           HB2      TYR  79  76.319 -15.940 -10.885
  672    HB3  TYR  79           HB1      TYR  79  75.254 -17.207 -10.279
  673    HD1  TYR  79           HD1      TYR  79  76.329 -13.697  -9.837
  674    HD2  TYR  79           HD2      TYR  79  73.822 -16.816  -8.370
  675    HE1  TYR  79           HE1      TYR  79  75.059 -12.057  -8.511
  676    HE2  TYR  79           HE2      TYR  79  72.563 -15.182  -7.040
  677    HH   TYR  79           HH       TYR  79  72.848 -13.048  -6.092
  678    H    SER  80           HN       SER  80  75.962 -18.890 -10.429
  679    HA   SER  80           HA       SER  80  78.293 -19.965 -11.693
  680    HB2  SER  80           HB2      SER  80  76.646 -21.622  -9.754
  681    HB3  SER  80           HB1      SER  80  77.956 -22.217 -10.775
  682    HG   SER  80           HG       SER  80  78.935 -20.192  -9.506
  Start of MODEL   10
    1    H1   GLY  -1           HT1      GLY  -1  54.062   2.350   0.869
    2    H2   GLY  -1           HT2      GLY  -1  52.551   1.659   0.477
    3    H3   GLY  -1           HT3      GLY  -1  53.957   1.194  -0.342
    4    HA2  GLY  -1           HA1      GLY  -1  53.534   0.776   2.529
    5    HA3  GLY  -1           HA2      GLY  -1  53.305  -0.456   1.287
    6    H    ALA   0           HN       ALA   0  55.112  -1.058   3.163
    7    HA   ALA   0           HA       ALA   0  57.741  -0.146   2.519
    8    HB1  ALA   0           HB1      ALA   0  58.488  -1.898   4.074
    9    HB2  ALA   0           HB2      ALA   0  56.852  -2.553   4.118
   10    HB3  ALA   0           HB3      ALA   0  57.173  -0.949   4.770
   11    H    MET   1           HN       MET   1  55.689  -2.784   1.562
   12    HA   MET   1           HA       MET   1  57.792  -4.152   0.130
   13    HB2  MET   1           HB2      MET   1  55.861  -5.408   1.073
   14    HB3  MET   1           HB1      MET   1  54.803  -4.562  -0.052
   15    HG2  MET   1           HG2      MET   1  56.654  -5.511  -1.768
   16    HG3  MET   1           HG1      MET   1  56.697  -6.766  -0.537
   17    HE1  MET   1           HE1      MET   1  53.058  -5.595  -3.112
   18    HE2  MET   1           HE2      MET   1  54.671  -4.854  -3.200
   19    HE3  MET   1           HE3      MET   1  53.631  -4.543  -1.827
   20    H    PHE   2           HN       PHE   2  58.425  -3.537  -1.789
   21    HA   PHE   2           HA       PHE   2  56.575  -1.973  -3.389
   22    HB2  PHE   2           HB2      PHE   2  59.550  -2.038  -3.294
   23    HB3  PHE   2           HB1      PHE   2  58.737  -1.567  -4.776
   24    HD1  PHE   2           HD1      PHE   2  56.583  -0.407  -2.263
   25    HD2  PHE   2           HD2      PHE   2  60.406   0.310  -3.950
   26    HE1  PHE   2           HE1      PHE   2  56.431   1.916  -1.580
   27    HE2  PHE   2           HE2      PHE   2  60.286   2.625  -3.272
   28    HZ   PHE   2           HZ       PHE   2  58.273   3.467  -2.071
   29    H    GLN   3           HN       GLN   3  56.502  -2.260  -5.598
   30    HA   GLN   3           HA       GLN   3  56.509  -5.111  -6.182
   31    HB2  GLN   3           HB2      GLN   3  54.753  -4.511  -7.868
   32    HB3  GLN   3           HB1      GLN   3  54.309  -4.467  -6.178
   33    HG2  GLN   3           HG2      GLN   3  53.257  -2.580  -7.049
   34    HG3  GLN   3           HG1      GLN   3  54.722  -1.930  -6.348
   35   HE21  GLN   3          HE21      GLN   3  56.447  -2.660  -8.482
   36   HE22  GLN   3          HE22      GLN   3  56.050  -1.798  -9.866
   37    H    ASP   4           HN       ASP   4  56.441  -5.738  -8.374
   38    HA   ASP   4           HA       ASP   4  58.911  -4.857  -9.652
   39    HB2  ASP   4           HB2      ASP   4  58.530  -7.263  -9.254
   40    HB3  ASP   4           HB1      ASP   4  57.002  -7.174 -10.108
   41    HA   PRO   5           HA       PRO   5  59.743  -5.103 -11.509
   42    HB2  PRO   5           HB2      PRO   5  60.701  -3.488 -13.587
   43    HB3  PRO   5           HB1      PRO   5  60.017  -5.094 -13.748
   44    HG2  PRO   5           HG2      PRO   5  58.865  -2.700 -14.718
   45    HG3  PRO   5           HG1      PRO   5  58.098  -4.296 -14.646
   46    HD2  PRO   5           HD2      PRO   5  57.933  -2.022 -12.720
   47    HD3  PRO   5           HD1      PRO   5  56.665  -3.142 -13.220
   48    H    GLN   6           HN       GLN   6  60.410  -1.981 -12.693
   49    HA   GLN   6           HA       GLN   6  61.935  -1.568 -10.240
   50    HB2  GLN   6           HB2      GLN   6  62.530  -0.727 -13.057
   51    HB3  GLN   6           HB1      GLN   6  63.383  -0.075 -11.677
   52    HG2  GLN   6           HG2      GLN   6  64.700  -1.785 -12.730
   53    HG3  GLN   6           HG1      GLN   6  64.153  -2.314 -11.134
   54   HE21  GLN   6          HE21      GLN   6  63.719  -2.699 -14.568
   55   HE22  GLN   6          HE22      GLN   6  63.021  -4.268 -14.510
   56    H    GLU   7           HN       GLU   7  59.624  -0.756  -9.746
   57    HA   GLU   7           HA       GLU   7  59.511   2.066 -10.447
   58    HB2  GLU   7           HB2      GLU   7  57.564   0.514 -10.595
   59    HB3  GLU   7           HB1      GLU   7  57.492   0.516  -8.835
   60    HG2  GLU   7           HG2      GLU   7  57.168   2.836  -8.757
   61    HG3  GLU   7           HG1      GLU   7  57.414   3.027 -10.484
   62    H    ARG   8           HN       ARG   8  61.334   0.708  -8.764
   63    HA   ARG   8           HA       ARG   8  61.162   2.385  -6.348
   64    HB2  ARG   8           HB2      ARG   8  63.078   0.069  -6.615
   65    HB3  ARG   8           HB1      ARG   8  62.515   0.842  -5.167
   66    HG2  ARG   8           HG2      ARG   8  61.476  -1.188  -4.978
   67    HG3  ARG   8           HG1      ARG   8  60.252  -0.239  -5.787
   68    HD2  ARG   8           HD2      ARG   8  60.588  -2.511  -6.809
   69    HD3  ARG   8           HD1      ARG   8  60.691  -1.155  -7.923
   70    HE   ARG   8           HE       ARG   8  63.241  -1.450  -7.502
   71   HH11  ARG   8          HH11      ARG   8  60.960  -4.146  -7.692
   72   HH12  ARG   8          HH12      ARG   8  62.040  -5.197  -8.468
   73   HH21  ARG   8          HH21      ARG   8  64.746  -2.900  -8.550
   74   HH22  ARG   8          HH22      ARG   8  64.235  -4.468  -8.934
   75    HA   PRO   9           HA       PRO   9  64.910   4.248  -8.183
   76    HB2  PRO   9           HB2      PRO   9  66.142   5.091  -5.890
   77    HB3  PRO   9           HB1      PRO   9  64.878   6.031  -6.599
   78    HG2  PRO   9           HG2      PRO   9  64.942   4.298  -4.274
   79    HG3  PRO   9           HG1      PRO   9  63.815   5.627  -4.643
   80    HD2  PRO   9           HD2      PRO   9  63.364   2.926  -4.662
   81    HD3  PRO   9           HD1      PRO   9  62.278   4.105  -5.394
   82    H    ARG  10           HN       ARG  10  67.398   4.468  -6.976
   83    HA   ARG  10           HA       ARG  10  68.180   1.859  -6.010
   84    HB2  ARG  10           HB2      ARG  10  69.372   3.558  -8.160
   85    HB3  ARG  10           HB1      ARG  10  70.344   2.406  -7.252
   86    HG2  ARG  10           HG2      ARG  10  67.796   1.563  -8.567
   87    HG3  ARG  10           HG1      ARG  10  69.298   1.701  -9.477
   88    HD2  ARG  10           HD2      ARG  10  69.144   0.105  -6.937
   89    HD3  ARG  10           HD1      ARG  10  68.716  -0.599  -8.499
   90    HE   ARG  10           HE       ARG  10  71.137   0.630  -8.843
   91   HH11  ARG  10          HH11      ARG  10  70.138  -1.826  -6.537
   92   HH12  ARG  10          HH12      ARG  10  71.469  -2.846  -6.812
   93   HH21  ARG  10          HH21      ARG  10  73.009  -0.749  -9.204
   94   HH22  ARG  10          HH22      ARG  10  73.149  -2.190  -8.349
   95    H    LYS  11           HN       LYS  11  67.852   5.141  -5.362
   96    HA   LYS  11           HA       LYS  11  70.124   4.947  -3.564
   97    HB2  LYS  11           HB2      LYS  11  68.765   7.451  -4.500
   98    HB3  LYS  11           HB1      LYS  11  70.117   7.295  -3.423
   99    HG2  LYS  11           HG2      LYS  11  71.371   6.126  -5.276
  100    HG3  LYS  11           HG1      LYS  11  70.072   6.698  -6.340
  101    HD2  LYS  11           HD2      LYS  11  70.493   8.972  -5.658
  102    HD3  LYS  11           HD1      LYS  11  71.750   8.385  -4.560
  103    HE2  LYS  11           HE2      LYS  11  73.032   7.549  -6.461
  104    HE3  LYS  11           HE1      LYS  11  71.783   8.115  -7.566
  105    HZ1  LYS  11           HZ1      LYS  11  73.430   9.801  -5.785
  106    HZ2  LYS  11           HZ2      LYS  11  72.214  10.373  -6.798
  107    HZ3  LYS  11           HZ3      LYS  11  73.603   9.665  -7.451
  108    H    LEU  12           HN       LEU  12  69.870   5.395  -1.494
  109    HA   LEU  12           HA       LEU  12  67.564   4.651  -0.221
  110    HB2  LEU  12           HB2      LEU  12  69.590   4.390   0.863
  111    HB3  LEU  12           HB1      LEU  12  69.992   6.095   0.740
  112    HG   LEU  12           HG       LEU  12  68.171   6.604   2.277
  113   HD11  LEU  12          HD11      LEU  12  67.112   4.815   3.539
  114   HD12  LEU  12          HD12      LEU  12  68.044   3.635   2.614
  115   HD13  LEU  12          HD13      LEU  12  66.799   4.596   1.800
  116   HD21  LEU  12          HD21      LEU  12  70.467   6.249   3.035
  117   HD22  LEU  12          HD22      LEU  12  70.030   4.553   3.354
  118   HD23  LEU  12          HD23      LEU  12  69.251   5.850   4.251
  119    HA   PRO  13           HA       PRO  13  66.518   9.118   1.142
  120    HB2  PRO  13           HB2      PRO  13  67.482  11.264  -0.230
  121    HB3  PRO  13           HB1      PRO  13  68.443  10.409   1.007
  122    HG2  PRO  13           HG2      PRO  13  68.547  10.027  -1.953
  123    HG3  PRO  13           HG1      PRO  13  69.874  10.393  -0.831
  124    HD2  PRO  13           HD2      PRO  13  69.348   7.882  -1.585
  125    HD3  PRO  13           HD1      PRO  13  69.873   8.233   0.063
  126    H    GLN  14           HN       GLN  14  66.957   8.636  -2.243
  127    HA   GLN  14           HA       GLN  14  64.581   9.877  -3.130
  128    HB2  GLN  14           HB2      GLN  14  66.251   7.720  -4.411
  129    HB3  GLN  14           HB1      GLN  14  64.978   8.639  -5.205
  130    HG2  GLN  14           HG2      GLN  14  66.211  10.685  -4.921
  131    HG3  GLN  14           HG1      GLN  14  67.456   9.841  -4.006
  132   HE21  GLN  14          HE21      GLN  14  65.925   8.538  -6.897
  133   HE22  GLN  14          HE22      GLN  14  67.340   8.643  -7.861
  134    H    LEU  15           HN       LEU  15  65.363   6.522  -2.148
  135    HA   LEU  15           HA       LEU  15  62.921   5.383  -2.814
  136    HB2  LEU  15           HB2      LEU  15  64.985   4.154  -2.256
  137    HB3  LEU  15           HB1      LEU  15  64.893   4.780  -0.683
  138    HG   LEU  15           HG       LEU  15  62.851   3.654  -0.204
  139   HD11  LEU  15          HD11      LEU  15  62.003   3.532  -2.559
  140   HD12  LEU  15          HD12      LEU  15  61.945   1.997  -1.706
  141   HD13  LEU  15          HD13      LEU  15  63.225   2.286  -2.879
  142   HD21  LEU  15          HD21      LEU  15  65.027   1.985  -1.315
  143   HD22  LEU  15          HD22      LEU  15  63.817   1.443  -0.129
  144   HD23  LEU  15          HD23      LEU  15  64.976   2.746   0.266
  145    H    CYS  16           HN       CYS  16  64.093   6.955   0.031
  146    HA   CYS  16           HA       CYS  16  61.899   6.445   1.709
  147    HB2  CYS  16           HB2      CYS  16  63.705   8.886   1.633
  148    HB3  CYS  16           HB1      CYS  16  62.711   8.426   2.994
  149    HG   CYS  16           HG       CYS  16  65.323   6.620   1.746
  150    H    THR  17           HN       THR  17  62.511   8.930  -0.651
  151    HA   THR  17           HA       THR  17  60.252  10.529  -0.402
  152    HB   THR  17           HB       THR  17  62.135   9.801  -2.550
  153    HG1  THR  17           HG1      THR  17  62.280  11.465  -0.670
  154   HG21  THR  17          HG21      THR  17  61.156  11.601  -4.025
  155   HG22  THR  17          HG22      THR  17  59.724  11.577  -2.971
  156   HG23  THR  17          HG23      THR  17  60.224  10.120  -3.851
  157    H    GLU  18           HN       GLU  18  60.814   7.550  -2.097
  158    HA   GLU  18           HA       GLU  18  58.458   7.379  -3.563
  159    HB2  GLU  18           HB2      GLU  18  60.452   5.510  -2.585
  160    HB3  GLU  18           HB1      GLU  18  59.177   4.973  -3.684
  161    HG2  GLU  18           HG2      GLU  18  61.265   7.130  -4.103
  162    HG3  GLU  18           HG1      GLU  18  61.254   5.583  -4.902
  163    H    LEU  19           HN       LEU  19  59.470   5.671  -0.593
  164    HA   LEU  19           HA       LEU  19  56.920   4.818   0.194
  165    HB2  LEU  19           HB2      LEU  19  59.498   5.305   1.535
  166    HB3  LEU  19           HB1      LEU  19  58.189   4.813   2.511
  167    HG   LEU  19           HG       LEU  19  58.157   2.820   0.644
  168   HD11  LEU  19          HD11      LEU  19  59.979   3.734  -0.611
  169   HD12  LEU  19          HD12      LEU  19  60.398   2.182   0.117
  170   HD13  LEU  19          HD13      LEU  19  60.999   3.683   0.824
  171   HD21  LEU  19          HD21      LEU  19  59.933   3.068   3.003
  172   HD22  LEU  19          HD22      LEU  19  59.507   1.537   2.223
  173   HD23  LEU  19          HD23      LEU  19  58.256   2.515   3.034
  174    H    GLN  20           HN       GLN  20  57.897   7.930  -0.122
  175    HA   GLN  20           HA       GLN  20  57.061   9.946   0.532
  176    HB2  GLN  20           HB2      GLN  20  54.918   8.095   1.361
  177    HB3  GLN  20           HB1      GLN  20  54.678   9.859   1.382
  178    HG2  GLN  20           HG2      GLN  20  55.102   9.849  -1.053
  179    HG3  GLN  20           HG1      GLN  20  55.287   8.098  -0.995
  180   HE21  GLN  20          HE21      GLN  20  52.919   9.914   0.851
  181   HE22  GLN  20          HE22      GLN  20  51.553   9.270   0.004
  182    H    THR  21           HN       THR  21  58.840   8.815   2.201
  183    HA   THR  21           HA       THR  21  58.108   9.964   4.742
  184    HB   THR  21           HB       THR  21  57.452   7.529   4.801
  185    HG1  THR  21           HG1      THR  21  58.384   7.208   6.810
  186   HG21  THR  21          HG21      THR  21  59.222   5.830   4.937
  187   HG22  THR  21          HG22      THR  21  60.428   7.060   4.578
  188   HG23  THR  21          HG23      THR  21  59.222   6.626   3.358
  189    H    THR  22           HN       THR  22  60.408   9.177   6.107
  190    HA   THR  22           HA       THR  22  62.548  10.056   4.290
  191    HB   THR  22           HB       THR  22  62.855  10.632   7.172
  192    HG1  THR  22           HG1      THR  22  60.776  11.579   5.540
  193   HG21  THR  22          HG21      THR  22  64.569  11.282   5.596
  194   HG22  THR  22          HG22      THR  22  63.788  12.749   6.185
  195   HG23  THR  22          HG23      THR  22  63.383  12.102   4.591
  196    H    ILE  23           HN       ILE  23  64.786   9.502   5.465
  197    HA   ILE  23           HA       ILE  23  65.166   6.816   5.494
  198    HB   ILE  23           HB       ILE  23  66.763   8.860   6.937
  199   HG12  ILE  23          HG12      ILE  23  66.638   8.056   4.069
  200   HG13  ILE  23          HG11      ILE  23  66.414   9.638   4.751
  201   HG21  ILE  23          HG21      ILE  23  67.482   6.188   5.651
  202   HG22  ILE  23          HG22      ILE  23  67.423   6.501   7.385
  203   HG23  ILE  23          HG23      ILE  23  68.663   7.276   6.392
  204   HD11  ILE  23          HD11      ILE  23  68.558   9.404   3.580
  205   HD12  ILE  23          HD12      ILE  23  68.990   8.125   4.751
  206   HD13  ILE  23          HD13      ILE  23  68.729   9.768   5.303
  207    H    HIS  24           HN       HIS  24  64.180   8.963   7.894
  208    HA   HIS  24           HA       HIS  24  65.175   7.759  10.221
  209    HB2  HIS  24           HB2      HIS  24  63.067   9.888   9.963
  210    HB3  HIS  24           HB1      HIS  24  64.207   9.724  11.270
  211    HD1  HIS  24           HD1      HIS  24  66.706   9.405   9.301
  212    HD2  HIS  24           HD2      HIS  24  63.856  12.320   9.300
  213    HE1  HIS  24           HE1      HIS  24  67.462  10.995   7.491
  214    H    ASP  25           HN       ASP  25  62.635   7.142   8.187
  215    HA   ASP  25           HA       ASP  25  60.987   5.902  10.287
  216    HB2  ASP  25           HB2      ASP  25  59.901   7.978   9.501
  217    HB3  ASP  25           HB1      ASP  25  59.981   7.362   7.876
  218    H    ILE  26           HN       ILE  26  62.034   5.886   6.949
  219    HA   ILE  26           HA       ILE  26  60.648   3.766   5.885
  220    HB   ILE  26           HB       ILE  26  62.072   5.194   4.528
  221   HG12  ILE  26          HG12      ILE  26  63.200   2.442   4.427
  222   HG13  ILE  26          HG11      ILE  26  61.624   2.647   3.816
  223   HG21  ILE  26          HG21      ILE  26  64.502   4.975   4.549
  224   HG22  ILE  26          HG22      ILE  26  64.385   3.779   5.837
  225   HG23  ILE  26          HG23      ILE  26  63.900   5.444   6.147
  226   HD11  ILE  26          HD11      ILE  26  62.612   4.321   2.179
  227   HD12  ILE  26          HD12      ILE  26  63.159   2.635   2.048
  228   HD13  ILE  26          HD13      ILE  26  64.193   3.831   2.817
  229    H    ILE  27           HN       ILE  27  60.692   1.600   5.935
  230    HA   ILE  27           HA       ILE  27  62.715   0.369   7.562
  231    HB   ILE  27           HB       ILE  27  60.083  -0.676   6.531
  232   HG12  ILE  27          HG12      ILE  27  59.775   0.974   8.281
  233   HG13  ILE  27          HG11      ILE  27  59.361  -0.636   8.853
  234   HG21  ILE  27          HG21      ILE  27  62.099  -1.978   8.334
  235   HG22  ILE  27          HG22      ILE  27  61.710  -2.432   6.673
  236   HG23  ILE  27          HG23      ILE  27  60.499  -2.628   7.952
  237   HD11  ILE  27          HD11      ILE  27  61.884   0.897   9.474
  238   HD12  ILE  27          HD12      ILE  27  61.522  -0.736  10.033
  239   HD13  ILE  27          HD13      ILE  27  60.531   0.617  10.568
  240    H    LEU  28           HN       LEU  28  64.357  -0.131   6.716
  241    HA   LEU  28           HA       LEU  28  64.222  -1.175   4.031
  242    HB2  LEU  28           HB2      LEU  28  65.572   1.008   4.946
  243    HB3  LEU  28           HB1      LEU  28  66.801  -0.250   4.894
  244    HG   LEU  28           HG       LEU  28  66.317  -0.723   2.601
  245   HD11  LEU  28          HD11      LEU  28  64.090  -0.483   2.221
  246   HD12  LEU  28          HD12      LEU  28  64.565   1.157   1.699
  247   HD13  LEU  28          HD13      LEU  28  64.003   0.834   3.361
  248   HD21  LEU  28          HD21      LEU  28  66.959   1.371   1.598
  249   HD22  LEU  28          HD22      LEU  28  67.826   1.181   3.129
  250   HD23  LEU  28          HD23      LEU  28  66.429   2.246   3.027
  251    H    GLU  29           HN       GLU  29  65.126  -3.327   3.929
  252    HA   GLU  29           HA       GLU  29  66.573  -3.791   6.428
  253    HB2  GLU  29           HB2      GLU  29  66.093  -6.172   6.159
  254    HB3  GLU  29           HB1      GLU  29  64.840  -5.133   6.936
  255    HG2  GLU  29           HG2      GLU  29  63.927  -5.110   4.679
  256    HG3  GLU  29           HG1      GLU  29  65.001  -6.523   4.388
  257    H    CYS  30           HN       CYS  30  68.057  -6.051   6.315
  258    HA   CYS  30           HA       CYS  30  69.680  -5.498   4.123
  259    HB2  CYS  30           HB2      CYS  30  70.435  -6.623   6.383
  260    HB3  CYS  30           HB1      CYS  30  69.780  -8.058   5.659
  261    H    VAL  31           HN       VAL  31  69.430  -6.103   2.323
  262    HA   VAL  31           HA       VAL  31  67.545  -7.757   1.101
  263    HB   VAL  31           HB       VAL  31  68.773  -6.131  -0.227
  264   HG11  VAL  31          HG11      VAL  31  71.185  -7.409   0.857
  265   HG12  VAL  31          HG12      VAL  31  70.625  -5.696   1.013
  266   HG13  VAL  31          HG13      VAL  31  71.092  -6.395  -0.567
  267   HG21  VAL  31          HG21      VAL  31  69.896  -8.800  -0.938
  268   HG22  VAL  31          HG22      VAL  31  70.030  -7.331  -1.895
  269   HG23  VAL  31          HG23      VAL  31  68.445  -8.031  -1.606
  270    H    TYR  32           HN       TYR  32  70.651  -8.393   2.410
  271    HA   TYR  32           HA       TYR  32  70.754 -11.101   1.409
  272    HB2  TYR  32           HB2      TYR  32  72.895  -9.636   2.940
  273    HB3  TYR  32           HB1      TYR  32  73.078 -11.129   2.021
  274    HD1  TYR  32           HD2      TYR  32  71.611 -10.580  -0.465
  275    HD2  TYR  32           HD1      TYR  32  74.127  -7.992   1.845
  276    HE1  TYR  32           HE2      TYR  32  72.007  -9.359  -2.380
  277    HE2  TYR  32           HE1      TYR  32  74.559  -6.624  -0.134
  278    HH   TYR  32           HH       TYR  32  74.545  -6.979  -2.590
  279    H    CYS  33           HN       CYS  33  70.655  -9.387   4.556
  280    HA   CYS  33           HA       CYS  33  70.793 -11.978   5.939
  281    HB2  CYS  33           HB2      CYS  33  70.973  -9.203   7.076
  282    HB3  CYS  33           HB1      CYS  33  71.217 -10.707   7.972
  283    H    LYS  34           HN       LYS  34  68.519  -9.707   4.944
  284    HA   LYS  34           HA       LYS  34  66.454  -9.390   5.178
  285    HB2  LYS  34           HB2      LYS  34  66.431 -12.142   6.384
  286    HB3  LYS  34           HB1      LYS  34  64.978 -11.256   5.961
  287    HG2  LYS  34           HG2      LYS  34  65.414 -12.779   4.229
  288    HG3  LYS  34           HG1      LYS  34  65.825 -11.195   3.581
  289    HD2  LYS  34           HD2      LYS  34  68.131 -11.653   3.813
  290    HD3  LYS  34           HD1      LYS  34  67.817 -13.077   4.786
  291    HE2  LYS  34           HE2      LYS  34  68.491 -13.717   2.534
  292    HE3  LYS  34           HE1      LYS  34  66.810 -14.160   2.796
  293    HZ1  LYS  34           HZ1      LYS  34  66.112 -12.271   1.522
  294    HZ2  LYS  34           HZ2      LYS  34  67.273 -13.144   0.635
  295    HZ3  LYS  34           HZ3      LYS  34  67.707 -11.709   1.391
  296    H    GLN  35           HN       GLN  35  68.289  -8.723   7.540
  297    HA   GLN  35           HA       GLN  35  66.281  -8.509   9.556
  298    HB2  GLN  35           HB2      GLN  35  68.057  -8.003  10.940
  299    HB3  GLN  35           HB1      GLN  35  68.198  -9.586  10.165
  300    HG2  GLN  35           HG2      GLN  35  69.933  -8.736   8.753
  301    HG3  GLN  35           HG1      GLN  35  69.659  -7.105   9.409
  302   HE21  GLN  35          HE21      GLN  35  69.392  -9.897  11.403
  303   HE22  GLN  35          HE22      GLN  35  70.732  -9.569  12.364
  304    H    GLN  36           HN       GLN  36  65.501  -6.550   9.924
  305    HA   GLN  36           HA       GLN  36  65.795  -4.313   8.398
  306    HB2  GLN  36           HB2      GLN  36  64.192  -5.124  10.358
  307    HB3  GLN  36           HB1      GLN  36  65.229  -4.031  11.264
  308    HG2  GLN  36           HG2      GLN  36  64.758  -2.349   9.428
  309    HG3  GLN  36           HG1      GLN  36  63.548  -3.545   8.941
  310   HE21  GLN  36          HE21      GLN  36  64.410  -1.290  11.471
  311   HE22  GLN  36          HE22      GLN  36  62.879  -1.326  12.257
  312    H    LEU  37           HN       LEU  37  67.410  -2.896   8.231
  313    HA   LEU  37           HA       LEU  37  69.747  -2.953   9.817
  314    HB2  LEU  37           HB2      LEU  37  68.621  -1.109   7.762
  315    HB3  LEU  37           HB1      LEU  37  69.887  -0.605   8.822
  316    HG   LEU  37           HG       LEU  37  71.246  -2.541   8.035
  317   HD11  LEU  37          HD11      LEU  37  70.634  -3.545   5.888
  318   HD12  LEU  37          HD12      LEU  37  69.052  -2.775   6.007
  319   HD13  LEU  37          HD13      LEU  37  69.541  -3.981   7.198
  320   HD21  LEU  37          HD21      LEU  37  70.387  -0.499   6.010
  321   HD22  LEU  37          HD22      LEU  37  71.849  -1.480   5.910
  322   HD23  LEU  37          HD23      LEU  37  71.654  -0.317   7.222
  323    H    LEU  38           HN       LEU  38  70.451  -2.030  11.348
  324    HA   LEU  38           HA       LEU  38  68.936  -0.640  13.256
  325    HB2  LEU  38           HB2      LEU  38  71.571  -1.608  12.768
  326    HB3  LEU  38           HB1      LEU  38  71.669   0.067  13.129
  327    HG   LEU  38           HG       LEU  38  70.310  -1.913  14.967
  328   HD11  LEU  38          HD11      LEU  38  73.094  -0.778  15.094
  329   HD12  LEU  38          HD12      LEU  38  72.664  -2.432  14.664
  330   HD13  LEU  38          HD13      LEU  38  72.338  -1.835  16.295
  331   HD21  LEU  38          HD21      LEU  38  69.607   0.417  15.241
  332   HD22  LEU  38          HD22      LEU  38  71.299   0.896  15.395
  333   HD23  LEU  38          HD23      LEU  38  70.560  -0.132  16.625
  334    H    ARG  39           HN       ARG  39  68.545   1.598  13.227
  335    HA   ARG  39           HA       ARG  39  68.517   2.818  10.763
  336    HB2  ARG  39           HB2      ARG  39  67.020   3.423  12.613
  337    HB3  ARG  39           HB1      ARG  39  68.345   4.268  13.395
  338    HG2  ARG  39           HG2      ARG  39  68.481   5.838  11.581
  339    HG3  ARG  39           HG1      ARG  39  67.259   4.949  10.682
  340    HD2  ARG  39           HD2      ARG  39  66.825   6.200  13.379
  341    HD3  ARG  39           HD1      ARG  39  66.341   6.934  11.851
  342    HE   ARG  39           HE       ARG  39  65.064   4.653  11.660
  343   HH11  ARG  39          HH11      ARG  39  65.360   6.757  14.485
  344   HH12  ARG  39          HH12      ARG  39  63.871   6.297  15.163
  345   HH21  ARG  39          HH21      ARG  39  62.993   4.040  12.581
  346   HH22  ARG  39          HH22      ARG  39  62.520   4.687  14.086
  347    H    ARG  40           HN       ARG  40  71.245   2.864  12.968
  348    HA   ARG  40           HA       ARG  40  72.607   5.079  11.949
  349    HB2  ARG  40           HB2      ARG  40  73.478   2.502  13.180
  350    HB3  ARG  40           HB1      ARG  40  74.585   3.779  12.734
  351    HG2  ARG  40           HG2      ARG  40  73.419   5.297  14.260
  352    HG3  ARG  40           HG1      ARG  40  72.347   3.957  14.697
  353    HD2  ARG  40           HD2      ARG  40  74.200   4.286  16.295
  354    HD3  ARG  40           HD1      ARG  40  74.154   2.684  15.530
  355    HE   ARG  40           HE       ARG  40  75.884   4.793  14.465
  356   HH11  ARG  40          HH11      ARG  40  75.581   1.612  15.989
  357   HH12  ARG  40          HH12      ARG  40  77.174   1.133  15.665
  358   HH21  ARG  40          HH21      ARG  40  78.067   4.144  13.998
  359   HH22  ARG  40          HH22      ARG  40  78.636   2.608  14.499
  360    H    GLU  41           HN       GLU  41  72.508   1.672  11.179
  361    HA   GLU  41           HA       GLU  41  74.480   1.610   9.125
  362    HB2  GLU  41           HB2      GLU  41  72.116  -0.237   9.477
  363    HB3  GLU  41           HB1      GLU  41  73.663  -0.661   8.778
  364    HG2  GLU  41           HG2      GLU  41  74.613  -0.138  11.156
  365    HG3  GLU  41           HG1      GLU  41  72.960  -0.095  11.595
  366    H    VAL  42           HN       VAL  42  71.057   2.236   9.277
  367    HA   VAL  42           HA       VAL  42  70.586   2.163   6.476
  368    HB   VAL  42           HB       VAL  42  68.980   3.872   8.406
  369   HG11  VAL  42          HG11      VAL  42  67.151   3.438   6.881
  370   HG12  VAL  42          HG12      VAL  42  68.162   2.316   5.991
  371   HG13  VAL  42          HG13      VAL  42  68.537   4.052   5.949
  372   HG21  VAL  42          HG21      VAL  42  68.551   0.958   7.829
  373   HG22  VAL  42          HG22      VAL  42  67.563   1.978   8.881
  374   HG23  VAL  42          HG23      VAL  42  69.229   1.585   9.325
  375    H    TYR  43           HN       TYR  43  71.391   4.818   8.769
  376    HA   TYR  43           HA       TYR  43  71.427   6.809   6.797
  377    HB2  TYR  43           HB2      TYR  43  72.994   6.688   9.370
  378    HB3  TYR  43           HB1      TYR  43  72.925   8.114   8.321
  379    HD1  TYR  43           HD1      TYR  43  70.168   8.200   7.554
  380    HD2  TYR  43           HD2      TYR  43  71.834   7.157  11.287
  381    HE1  TYR  43           HE1      TYR  43  68.076   8.839   8.636
  382    HE2  TYR  43           HE2      TYR  43  69.732   7.817  12.400
  383    HH   TYR  43           HH       TYR  43  67.789   9.265  11.943
  384    H    ASP  44           HN       ASP  44  73.955   4.511   7.793
  385    HA   ASP  44           HA       ASP  44  76.211   5.595   6.663
  386    HB2  ASP  44           HB2      ASP  44  75.271   2.732   6.787
  387    HB3  ASP  44           HB1      ASP  44  76.787   3.196   6.154
  388    H    PHE  45           HN       PHE  45  73.686   3.889   5.213
  389    HA   PHE  45           HA       PHE  45  74.672   3.386   2.734
  390    HB2  PHE  45           HB2      PHE  45  72.416   2.937   4.096
  391    HB3  PHE  45           HB1      PHE  45  71.908   4.210   3.001
  392    HD1  PHE  45           HD2      PHE  45  73.436   0.868   3.174
  393    HD2  PHE  45           HD1      PHE  45  71.525   3.855   0.828
  394    HE1  PHE  45           HE2      PHE  45  73.087  -0.759   1.342
  395    HE2  PHE  45           HE1      PHE  45  71.219   2.256  -0.980
  396    HZ   PHE  45           HZ       PHE  45  71.957  -0.029  -0.734
  397    H    ALA  46           HN       ALA  46  72.925   6.454   3.872
  398    HA   ALA  46           HA       ALA  46  73.268   7.568   1.204
  399    HB1  ALA  46           HB1      ALA  46  71.894   8.685   3.659
  400    HB2  ALA  46           HB2      ALA  46  71.077   7.991   2.243
  401    HB3  ALA  46           HB3      ALA  46  71.957   9.488   2.098
  402    H    ARG  47           HN       ARG  47  74.723   7.393   4.224
  403    HA   ARG  47           HA       ARG  47  76.053   9.902   4.333
  404    HB2  ARG  47           HB2      ARG  47  75.747   7.452   5.840
  405    HB3  ARG  47           HB1      ARG  47  77.392   8.011   5.937
  406    HG2  ARG  47           HG2      ARG  47  75.766   8.721   7.744
  407    HG3  ARG  47           HG1      ARG  47  76.780   9.963   7.025
  408    HD2  ARG  47           HD2      ARG  47  74.415  10.663   7.393
  409    HD3  ARG  47           HD1      ARG  47  74.877  10.709   5.647
  410    HE   ARG  47           HE       ARG  47  73.584   8.415   6.204
  411   HH11  ARG  47          HH11      ARG  47  73.116  11.905   6.373
  412   HH12  ARG  47          HH12      ARG  47  71.436  11.862   6.117
  413   HH21  ARG  47          HH21      ARG  47  71.206   8.363   5.813
  414   HH22  ARG  47          HH22      ARG  47  70.377   9.869   5.822
  415    H    ARG  48           HN       ARG  48  76.550   6.905   2.826
  416    HA   ARG  48           HA       ARG  48  79.132   7.766   1.757
  417    HB2  ARG  48           HB2      ARG  48  77.833   5.118   2.145
  418    HB3  ARG  48           HB1      ARG  48  79.387   5.315   1.355
  419    HG2  ARG  48           HG2      ARG  48  80.368   6.092   3.392
  420    HG3  ARG  48           HG1      ARG  48  78.787   6.207   4.165
  421    HD2  ARG  48           HD2      ARG  48  78.506   3.831   3.941
  422    HD3  ARG  48           HD1      ARG  48  80.084   3.706   3.187
  423    HE   ARG  48           HE       ARG  48  80.588   4.989   5.517
  424   HH11  ARG  48          HH11      ARG  48  79.239   1.825   4.728
  425   HH12  ARG  48          HH12      ARG  48  79.397   1.209   6.320
  426   HH21  ARG  48          HH21      ARG  48  80.864   4.103   7.676
  427   HH22  ARG  48          HH22      ARG  48  80.374   2.515   8.009
  428    H    ASP  49           HN       ASP  49  78.840   5.713  -0.336
  429    HA   ASP  49           HA       ASP  49  76.414   6.578  -1.653
  430    HB2  ASP  49           HB2      ASP  49  78.146   8.063  -2.569
  431    HB3  ASP  49           HB1      ASP  49  79.086   6.646  -3.047
  432    H    LEU  50           HN       LEU  50  75.728   4.600  -1.039
  433    HA   LEU  50           HA       LEU  50  76.720   2.462  -2.686
  434    HB2  LEU  50           HB2      LEU  50  74.883   2.435  -0.307
  435    HB3  LEU  50           HB1      LEU  50  75.312   1.007  -1.223
  436    HG   LEU  50           HG       LEU  50  77.727   1.636  -0.654
  437   HD11  LEU  50          HD11      LEU  50  78.055   2.811   1.438
  438   HD12  LEU  50          HD12      LEU  50  76.327   3.214   1.458
  439   HD13  LEU  50          HD13      LEU  50  77.363   3.798   0.147
  440   HD21  LEU  50          HD21      LEU  50  75.859   0.721   1.462
  441   HD22  LEU  50          HD22      LEU  50  77.612   0.507   1.456
  442   HD23  LEU  50          HD23      LEU  50  76.612  -0.303   0.225
  443    H    CYS  51           HN       CYS  51  74.610   0.897  -3.130
  444    HA   CYS  51           HA       CYS  51  72.455   2.569  -4.164
  445    HB2  CYS  51           HB2      CYS  51  72.374   1.103  -6.132
  446    HB3  CYS  51           HB1      CYS  51  73.949   1.887  -6.017
  447    HG   CYS  51           HG       CYS  51  75.354  -0.335  -5.228
  448    H    ILE  52           HN       ILE  52  70.482   1.526  -4.139
  449    HA   ILE  52           HA       ILE  52  70.320  -0.401  -2.026
  450    HB   ILE  52           HB       ILE  52  68.217   1.164  -3.472
  451   HG12  ILE  52          HG12      ILE  52  69.304   0.864  -0.758
  452   HG13  ILE  52          HG11      ILE  52  69.510   2.261  -1.857
  453   HG21  ILE  52          HG21      ILE  52  67.753  -0.991  -1.369
  454   HG22  ILE  52          HG22      ILE  52  67.261  -1.117  -3.059
  455   HG23  ILE  52          HG23      ILE  52  66.528   0.104  -2.018
  456   HD11  ILE  52          HD11      ILE  52  68.016   2.735  -0.146
  457   HD12  ILE  52          HD12      ILE  52  67.202   1.190  -0.501
  458   HD13  ILE  52          HD13      ILE  52  67.145   2.533  -1.720
  459    H    VAL  53           HN       VAL  53  69.727  -2.181  -2.010
  460    HA   VAL  53           HA       VAL  53  69.865  -3.635  -4.474
  461    HB   VAL  53           HB       VAL  53  70.623  -5.476  -2.769
  462   HG11  VAL  53          HG11      VAL  53  72.011  -4.405  -4.539
  463   HG12  VAL  53          HG12      VAL  53  72.941  -4.673  -3.061
  464   HG13  VAL  53          HG13      VAL  53  72.331  -3.061  -3.449
  465   HG21  VAL  53          HG21      VAL  53  70.064  -4.117  -0.762
  466   HG22  VAL  53          HG22      VAL  53  71.266  -2.920  -1.275
  467   HG23  VAL  53          HG23      VAL  53  71.772  -4.526  -0.848
  468    H    TYR  54           HN       TYR  54  68.083  -4.256  -5.018
  469    HA   TYR  54           HA       TYR  54  65.946  -4.867  -3.206
  470    HB2  TYR  54           HB2      TYR  54  66.157  -4.789  -6.206
  471    HB3  TYR  54           HB1      TYR  54  64.668  -5.035  -5.284
  472    HD1  TYR  54           HD1      TYR  54  67.267  -2.543  -6.155
  473    HD2  TYR  54           HD2      TYR  54  63.633  -3.296  -4.113
  474    HE1  TYR  54           HE1      TYR  54  66.943  -0.106  -5.778
  475    HE2  TYR  54           HE2      TYR  54  63.307  -0.975  -3.773
  476    HH   TYR  54           HH       TYR  54  64.744   1.060  -3.558
  477    H    ARG  55           HN       ARG  55  65.874  -6.592  -2.446
  478    HA   ARG  55           HA       ARG  55  67.189  -8.853  -3.696
  479    HB2  ARG  55           HB2      ARG  55  66.698  -8.359  -0.985
  480    HB3  ARG  55           HB1      ARG  55  65.458  -9.504  -1.422
  481    HG2  ARG  55           HG2      ARG  55  68.441 -10.100  -1.836
  482    HG3  ARG  55           HG1      ARG  55  67.562 -10.534  -0.428
  483    HD2  ARG  55           HD2      ARG  55  66.961 -11.410  -3.255
  484    HD3  ARG  55           HD1      ARG  55  67.591 -12.419  -1.951
  485    HE   ARG  55           HE       ARG  55  65.250 -11.507  -0.964
  486   HH11  ARG  55          HH11      ARG  55  66.085 -13.085  -4.022
  487   HH12  ARG  55          HH12      ARG  55  64.592 -13.891  -4.160
  488   HH21  ARG  55          HH21      ARG  55  63.160 -12.571  -1.205
  489   HH22  ARG  55          HH22      ARG  55  62.933 -13.614  -2.548
  490    H    ASP  56           HN       ASP  56  65.812 -10.118  -5.097
  491    HA   ASP  56           HA       ASP  56  64.032 -10.786  -6.271
  492    HB2  ASP  56           HB2      ASP  56  63.012 -11.677  -4.216
  493    HB3  ASP  56           HB1      ASP  56  62.430 -10.079  -3.779
  494    H    GLY  57           HN       GLY  57  62.430  -8.180  -4.505
  495    HA2  GLY  57           HA2      GLY  57  62.983  -6.252  -6.473
  496    HA3  GLY  57           HA1      GLY  57  61.336  -6.866  -6.683
  497    H    ASN  58           HN       ASN  58  63.070  -6.508  -3.659
  498    HA   ASN  58           HA       ASN  58  61.112  -4.459  -2.770
  499    HB2  ASN  58           HB2      ASN  58  62.373  -6.566  -1.049
  500    HB3  ASN  58           HB1      ASN  58  60.965  -5.639  -0.649
  501   HD21  ASN  58          HD21      ASN  58  62.290  -8.364  -2.260
  502   HD22  ASN  58          HD22      ASN  58  60.848  -9.238  -2.535
  503    HA   PRO  59           HA       PRO  59  64.794  -2.551  -1.845
  504    HB2  PRO  59           HB2      PRO  59  63.505  -0.627  -0.094
  505    HB3  PRO  59           HB1      PRO  59  64.018  -0.407  -1.772
  506    HG2  PRO  59           HG2      PRO  59  61.341  -0.474  -1.160
  507    HG3  PRO  59           HG1      PRO  59  61.941  -1.137  -2.628
  508    HD2  PRO  59           HD2      PRO  59  61.419  -2.604  -0.095
  509    HD3  PRO  59           HD1      PRO  59  60.837  -2.966  -1.731
  510    H    TYR  60           HN       TYR  60  66.459  -2.986  -0.777
  511    HA   TYR  60           HA       TYR  60  66.194  -2.969   2.008
  512    HB2  TYR  60           HB2      TYR  60  67.749  -5.322   0.940
  513    HB3  TYR  60           HB1      TYR  60  67.135  -4.920   2.378
  514    HD1  TYR  60           HD2      TYR  60  64.927  -5.221   3.040
  515    HD2  TYR  60           HD1      TYR  60  66.239  -6.306  -0.734
  516    HE1  TYR  60           HE2      TYR  60  62.941  -6.715   2.811
  517    HE2  TYR  60           HE1      TYR  60  64.315  -7.790  -1.033
  518    HH   TYR  60           HH       TYR  60  61.662  -7.759   1.149
  519    H    ALA  61           HN       ALA  61  67.941  -2.650   2.897
  520    HA   ALA  61           HA       ALA  61  69.903  -1.129   1.506
  521    HB1  ALA  61           HB1      ALA  61  70.385  -0.375   3.682
  522    HB2  ALA  61           HB2      ALA  61  69.584  -1.823   4.300
  523    HB3  ALA  61           HB3      ALA  61  68.584  -0.557   3.600
  524    H    VAL  62           HN       VAL  62  72.047  -1.570   2.800
  525    HA   VAL  62           HA       VAL  62  72.595  -4.437   2.866
  526    HB   VAL  62           HB       VAL  62  74.305  -2.067   1.969
  527   HG11  VAL  62          HG11      VAL  62  76.063  -3.558   1.534
  528   HG12  VAL  62          HG12      VAL  62  75.133  -4.885   2.276
  529   HG13  VAL  62          HG13      VAL  62  75.619  -3.464   3.234
  530   HG21  VAL  62          HG21      VAL  62  72.816  -2.771   0.244
  531   HG22  VAL  62          HG22      VAL  62  73.358  -4.448   0.477
  532   HG23  VAL  62          HG23      VAL  62  74.477  -3.234  -0.144
  533    H    CYS  63           HN       CYS  63  72.698  -4.989   4.936
  534    HA   CYS  63           HA       CYS  63  72.906  -3.147   7.026
  535    HB2  CYS  63           HB2      CYS  63  72.789  -4.987   8.482
  536    HB3  CYS  63           HB1      CYS  63  72.051  -5.526   6.971
  537    H    ASP  64           HN       ASP  64  74.571  -3.154   8.776
  538    HA   ASP  64           HA       ASP  64  76.999  -2.028   8.092
  539    HB2  ASP  64           HB2      ASP  64  76.071  -2.029  10.363
  540    HB3  ASP  64           HB1      ASP  64  76.464  -3.718  10.520
  541    H    LYS  65           HN       LYS  65  76.424  -5.393   8.680
  542    HA   LYS  65           HA       LYS  65  79.145  -6.149   8.493
  543    HB2  LYS  65           HB2      LYS  65  76.728  -7.888   8.165
  544    HB3  LYS  65           HB1      LYS  65  78.380  -8.418   8.469
  545    HG2  LYS  65           HG2      LYS  65  76.479  -7.043  10.331
  546    HG3  LYS  65           HG1      LYS  65  77.437  -8.530  10.482
  547    HD2  LYS  65           HD2      LYS  65  79.451  -7.352  10.803
  548    HD3  LYS  65           HD1      LYS  65  78.701  -5.827  10.324
  549    HE2  LYS  65           HE2      LYS  65  77.208  -6.026  12.267
  550    HE3  LYS  65           HE1      LYS  65  78.174  -7.392  12.823
  551    HZ1  LYS  65           HZ1      LYS  65  79.138  -4.646  12.311
  552    HZ2  LYS  65           HZ2      LYS  65  80.122  -5.935  12.817
  553    HZ3  LYS  65           HZ3      LYS  65  78.917  -5.342  13.840
  554    H    CYS  66           HN       CYS  66  76.448  -6.179   6.253
  555    HA   CYS  66           HA       CYS  66  77.956  -7.374   4.204
  556    HB2  CYS  66           HB2      CYS  66  75.279  -6.043   4.304
  557    HB3  CYS  66           HB1      CYS  66  75.885  -6.693   2.799
  558    H    LEU  67           HN       LEU  67  77.335  -4.131   5.218
  559    HA   LEU  67           HA       LEU  67  78.033  -2.538   3.099
  560    HB2  LEU  67           HB2      LEU  67  78.646  -2.249   5.992
  561    HB3  LEU  67           HB1      LEU  67  79.026  -0.993   4.842
  562    HG   LEU  67           HG       LEU  67  76.283  -2.032   5.553
  563   HD11  LEU  67          HD11      LEU  67  77.401  -0.485   7.085
  564   HD12  LEU  67          HD12      LEU  67  75.973   0.225   6.265
  565   HD13  LEU  67          HD13      LEU  67  77.623   0.569   5.685
  566   HD21  LEU  67          HD21      LEU  67  75.444  -0.331   4.044
  567   HD22  LEU  67          HD22      LEU  67  76.351  -1.548   3.165
  568   HD23  LEU  67          HD23      LEU  67  77.083   0.023   3.514
  569    H    LYS  68           HN       LYS  68  80.183  -4.051   5.414
  570    HA   LYS  68           HA       LYS  68  82.393  -3.158   3.865
  571    HB2  LYS  68           HB2      LYS  68  83.820  -4.335   5.556
  572    HB3  LYS  68           HB1      LYS  68  82.899  -2.934   6.098
  573    HG2  LYS  68           HG2      LYS  68  82.733  -4.453   7.844
  574    HG3  LYS  68           HG1      LYS  68  81.223  -4.679   6.974
  575    HD2  LYS  68           HD2      LYS  68  82.090  -6.661   5.903
  576    HD3  LYS  68           HD1      LYS  68  83.678  -6.386   6.627
  577    HE2  LYS  68           HE2      LYS  68  81.123  -6.958   8.129
  578    HE3  LYS  68           HE1      LYS  68  82.435  -8.100   7.844
  579    HZ1  LYS  68           HZ1      LYS  68  82.648  -5.582   9.405
  580    HZ2  LYS  68           HZ2      LYS  68  83.901  -6.653   9.114
  581    HZ3  LYS  68           HZ3      LYS  68  82.585  -7.136  10.047
  582    H    PHE  69           HN       PHE  69  80.582  -6.102   3.857
  583    HA   PHE  69           HA       PHE  69  82.572  -7.769   2.823
  584    HB2  PHE  69           HB2      PHE  69  79.652  -7.682   2.579
  585    HB3  PHE  69           HB1      PHE  69  80.611  -8.986   1.949
  586    HD1  PHE  69           HD2      PHE  69  82.379  -8.792   4.691
  587    HD2  PHE  69           HD1      PHE  69  78.278  -9.284   3.694
  588    HE1  PHE  69           HE2      PHE  69  81.981  -9.924   6.829
  589    HE2  PHE  69           HE1      PHE  69  77.868 -10.397   5.802
  590    HZ   PHE  69           HZ       PHE  69  79.708 -10.727   7.398
  591    H    TYR  70           HN       TYR  70  79.920  -5.882   1.419
  592    HA   TYR  70           HA       TYR  70  80.557  -6.817  -1.195
  593    HB2  TYR  70           HB2      TYR  70  78.267  -5.169  -0.148
  594    HB3  TYR  70           HB1      TYR  70  78.459  -5.605  -1.850
  595    HD1  TYR  70           HD1      TYR  70  77.838  -6.928   1.529
  596    HD2  TYR  70           HD2      TYR  70  78.129  -7.842  -2.598
  597    HE1  TYR  70           HE1      TYR  70  76.917  -9.157   1.973
  598    HE2  TYR  70           HE2      TYR  70  77.209 -10.051  -2.189
  599    HH   TYR  70           HH       TYR  70  75.777 -10.967   0.789
  600    H    SER  71           HN       SER  71  82.310  -5.908  -1.927
  601    HA   SER  71           HA       SER  71  82.232  -2.998  -2.357
  602    HB2  SER  71           HB2      SER  71  84.736  -3.086  -2.371
  603    HB3  SER  71           HB1      SER  71  84.023  -3.497  -0.811
  604    HG   SER  71           HG       SER  71  84.556  -5.511  -1.039
  605    H    LYS  72           HN       LYS  72  83.028  -6.182  -3.649
  606    HA   LYS  72           HA       LYS  72  84.039  -5.295  -6.143
  607    HB2  LYS  72           HB2      LYS  72  84.433  -7.569  -5.132
  608    HB3  LYS  72           HB1      LYS  72  82.753  -7.954  -5.458
  609    HG2  LYS  72           HG2      LYS  72  84.154  -8.947  -7.134
  610    HG3  LYS  72           HG1      LYS  72  83.186  -7.667  -7.871
  611    HD2  LYS  72           HD2      LYS  72  85.109  -6.147  -7.754
  612    HD3  LYS  72           HD1      LYS  72  86.065  -7.412  -6.986
  613    HE2  LYS  72           HE2      LYS  72  84.850  -7.576  -9.740
  614    HE3  LYS  72           HE1      LYS  72  86.533  -7.189  -9.405
  615    HZ1  LYS  72           HZ1      LYS  72  86.764  -9.385  -8.381
  616    HZ2  LYS  72           HZ2      LYS  72  86.267  -9.493  -9.988
  617    HZ3  LYS  72           HZ3      LYS  72  85.161  -9.742  -8.752
  618    H    ILE  73           HN       ILE  73  80.944  -6.620  -5.077
  619    HA   ILE  73           HA       ILE  73  79.705  -5.343  -7.322
  620    HB   ILE  73           HB       ILE  73  77.733  -6.627  -6.322
  621   HG12  ILE  73          HG12      ILE  73  80.021  -8.403  -5.507
  622   HG13  ILE  73          HG11      ILE  73  78.997  -7.520  -4.384
  623   HG21  ILE  73          HG21      ILE  73  78.565  -6.929  -8.598
  624   HG22  ILE  73          HG22      ILE  73  78.259  -8.519  -7.902
  625   HG23  ILE  73          HG23      ILE  73  79.909  -7.908  -8.009
  626   HD11  ILE  73          HD11      ILE  73  77.087  -8.762  -5.210
  627   HD12  ILE  73          HD12      ILE  73  78.339  -9.870  -4.589
  628   HD13  ILE  73          HD13      ILE  73  78.143  -9.596  -6.339
  629    H    SER  74           HN       SER  74  79.856  -3.265  -6.419
  630    HA   SER  74           HA       SER  74  78.258  -2.898  -4.030
  631    HB2  SER  74           HB2      SER  74  79.468  -0.605  -4.081
  632    HB3  SER  74           HB1      SER  74  80.406  -2.040  -3.650
  633    HG   SER  74           HG       SER  74  81.642  -1.518  -5.240
  634    H    GLU  75           HN       GLU  75  77.785  -2.932  -7.166
  635    HA   GLU  75           HA       GLU  75  75.596  -1.063  -7.040
  636    HB2  GLU  75           HB2      GLU  75  77.606   0.160  -7.999
  637    HB3  GLU  75           HB1      GLU  75  77.605  -0.973  -9.319
  638    HG2  GLU  75           HG2      GLU  75  75.362   0.969  -8.694
  639    HG3  GLU  75           HG1      GLU  75  76.649   1.274  -9.845
  640    H    TYR  76           HN       TYR  76  76.917  -2.498  -9.970
  641    HA   TYR  76           HA       TYR  76  76.244  -4.101 -11.383
  642    HB2  TYR  76           HB2      TYR  76  77.124  -5.456  -9.504
  643    HB3  TYR  76           HB1      TYR  76  75.496  -5.543  -8.841
  644    HD1  TYR  76           HD2      TYR  76  77.040  -5.990 -12.169
  645    HD2  TYR  76           HD1      TYR  76  74.520  -7.614  -9.194
  646    HE1  TYR  76           HE2      TYR  76  76.611  -7.873 -13.619
  647    HE2  TYR  76           HE1      TYR  76  74.046  -9.547 -10.641
  648    HH   TYR  76           HH       TYR  76  75.891 -10.229 -13.362
  649    H    ARG  77           HN       ARG  77  74.348  -5.557 -12.103
  650    HA   ARG  77           HA       ARG  77  71.836  -4.309 -11.426
  651    HB2  ARG  77           HB2      ARG  77  72.798  -4.966 -14.224
  652    HB3  ARG  77           HB1      ARG  77  71.099  -4.793 -13.846
  653    HG2  ARG  77           HG2      ARG  77  71.841  -2.755 -14.854
  654    HG3  ARG  77           HG1      ARG  77  71.584  -2.438 -13.142
  655    HD2  ARG  77           HD2      ARG  77  73.639  -1.406 -14.067
  656    HD3  ARG  77           HD1      ARG  77  73.944  -2.503 -12.718
  657    HE   ARG  77           HE       ARG  77  74.121  -3.644 -15.361
  658   HH11  ARG  77          HH11      ARG  77  75.933  -2.062 -12.735
  659   HH12  ARG  77          HH12      ARG  77  77.403  -2.834 -13.112
  660   HH21  ARG  77          HH21      ARG  77  76.157  -4.691 -15.863
  661   HH22  ARG  77          HH22      ARG  77  77.541  -4.360 -14.944
  662    H    HIS  78           HN       HIS  78  71.626  -5.839 -10.067
  663    HA   HIS  78           HA       HIS  78  71.876  -8.570 -10.761
  664    HB2  HIS  78           HB2      HIS  78  71.170  -8.930  -8.357
  665    HB3  HIS  78           HB1      HIS  78  72.590  -7.908  -8.733
  666    HD1  HIS  78           HD1      HIS  78  69.027  -7.586  -7.443
  667    HD2  HIS  78           HD2      HIS  78  72.534  -5.523  -7.907
  668    HE1  HIS  78           HE1      HIS  78  68.679  -5.447  -6.166
  669    H    TYR  79           HN       TYR  79  70.359  -8.338 -12.477
  670    HA   TYR  79           HA       TYR  79  67.598  -8.751 -11.657
  671    HB2  TYR  79           HB2      TYR  79  68.630  -6.832 -13.734
  672    HB3  TYR  79           HB1      TYR  79  66.957  -7.361 -13.655
  673    HD1  TYR  79           HD2      TYR  79  69.612  -5.570 -11.722
  674    HD2  TYR  79           HD1      TYR  79  65.461  -6.342 -12.215
  675    HE1  TYR  79           HE2      TYR  79  69.101  -3.756 -10.174
  676    HE2  TYR  79           HE1      TYR  79  64.937  -4.562 -10.661
  677    HH   TYR  79           HH       TYR  79  67.122  -2.209  -9.772
  678    H    SER  80           HN       SER  80  66.409  -9.763 -13.503
  679    HA   SER  80           HA       SER  80  68.080 -10.803 -15.610
  680    HB2  SER  80           HB2      SER  80  66.141 -12.446 -13.940
  681    HB3  SER  80           HB1      SER  80  67.033 -13.031 -15.351
  682    HG   SER  80           HG       SER  80  68.768 -11.912 -13.784
  Start of MODEL   11
    1    H1   GLY  -1           HT1      GLY  -1  56.350  -0.484   5.031
    2    H2   GLY  -1           HT2      GLY  -1  55.535  -1.533   6.092
    3    H3   GLY  -1           HT3      GLY  -1  55.648  -1.903   4.448
    4    HA2  GLY  -1           HA1      GLY  -1  57.918  -1.755   6.310
    5    HA3  GLY  -1           HA2      GLY  -1  57.187  -3.231   5.679
    6    H    ALA   0           HN       ALA   0  59.294  -3.709   4.810
    7    HA   ALA   0           HA       ALA   0  60.265  -1.980   2.694
    8    HB1  ALA   0           HB1      ALA   0  62.231  -3.415   2.732
    9    HB2  ALA   0           HB2      ALA   0  61.436  -4.496   3.873
   10    HB3  ALA   0           HB3      ALA   0  61.840  -2.848   4.354
   11    H    MET   1           HN       MET   1  57.779  -3.806   2.487
   12    HA   MET   1           HA       MET   1  58.735  -5.483   0.280
   13    HB2  MET   1           HB2      MET   1  57.314  -6.603   1.975
   14    HB3  MET   1           HB1      MET   1  56.012  -5.485   1.586
   15    HG2  MET   1           HG2      MET   1  56.535  -6.384  -0.874
   16    HG3  MET   1           HG1      MET   1  57.044  -7.794   0.042
   17    HE1  MET   1           HE1      MET   1  54.069  -5.231   0.893
   18    HE2  MET   1           HE2      MET   1  52.815  -5.957  -0.119
   19    HE3  MET   1           HE3      MET   1  54.296  -5.314  -0.840
   20    H    PHE   2           HN       PHE   2  58.804  -4.226  -1.481
   21    HA   PHE   2           HA       PHE   2  56.340  -2.811  -2.110
   22    HB2  PHE   2           HB2      PHE   2  59.146  -2.315  -3.122
   23    HB3  PHE   2           HB1      PHE   2  57.759  -1.787  -4.032
   24    HD1  PHE   2           HD2      PHE   2  56.332  -1.194  -1.082
   25    HD2  PHE   2           HD1      PHE   2  59.824   0.139  -3.178
   26    HE1  PHE   2           HE2      PHE   2  56.235   0.927   0.049
   27    HE2  PHE   2           HE1      PHE   2  59.738   2.173  -2.094
   28    HZ   PHE   2           HZ       PHE   2  57.921   2.674  -0.445
   29    H    GLN   3           HN       GLN   3  56.046  -2.716  -4.636
   30    HA   GLN   3           HA       GLN   3  55.746  -5.496  -5.375
   31    HB2  GLN   3           HB2      GLN   3  54.428  -4.615  -7.320
   32    HB3  GLN   3           HB1      GLN   3  53.778  -4.215  -5.748
   33    HG2  GLN   3           HG2      GLN   3  53.547  -2.327  -7.195
   34    HG3  GLN   3           HG1      GLN   3  54.741  -1.953  -5.959
   35   HE21  GLN   3          HE21      GLN   3  55.314  -3.962  -8.751
   36   HE22  GLN   3          HE22      GLN   3  56.463  -2.963  -9.470
   37    H    ASP   4           HN       ASP   4  56.217  -6.410  -7.340
   38    HA   ASP   4           HA       ASP   4  58.990  -5.978  -8.004
   39    HB2  ASP   4           HB2      ASP   4  58.748  -8.125  -9.146
   40    HB3  ASP   4           HB1      ASP   4  58.085  -8.234  -7.516
   41    HA   PRO   5           HA       PRO   5  60.260  -6.760  -9.487
   42    HB2  PRO   5           HB2      PRO   5  61.840  -5.590 -11.562
   43    HB3  PRO   5           HB1      PRO   5  61.259  -7.256 -11.475
   44    HG2  PRO   5           HG2      PRO   5  60.430  -5.407 -13.359
   45    HG3  PRO   5           HG1      PRO   5  59.497  -6.831 -12.875
   46    HD2  PRO   5           HD2      PRO   5  59.226  -3.989 -11.949
   47    HD3  PRO   5           HD1      PRO   5  57.954  -5.160 -12.361
   48    H    GLN   6           HN       GLN   6  61.252  -3.766 -11.089
   49    HA   GLN   6           HA       GLN   6  61.882  -2.634  -8.482
   50    HB2  GLN   6           HB2      GLN   6  63.860  -2.737 -10.776
   51    HB3  GLN   6           HB1      GLN   6  64.082  -1.808  -9.306
   52    HG2  GLN   6           HG2      GLN   6  64.084  -3.896  -8.010
   53    HG3  GLN   6           HG1      GLN   6  63.905  -4.811  -9.503
   54   HE21  GLN   6          HE21      GLN   6  66.027  -2.901  -7.566
   55   HE22  GLN   6          HE22      GLN   6  67.484  -3.337  -8.397
   56    H    GLU   7           HN       GLU   7  59.854  -1.568  -9.149
   57    HA   GLU   7           HA       GLU   7  60.230   0.505 -11.136
   58    HB2  GLU   7           HB2      GLU   7  58.071  -0.680 -10.941
   59    HB3  GLU   7           HB1      GLU   7  57.879  -0.061  -9.310
   60    HG2  GLU   7           HG2      GLU   7  57.744   2.190 -10.166
   61    HG3  GLU   7           HG1      GLU   7  57.982   1.615 -11.816
   62    H    ARG   8           HN       ARG   8  60.775  -0.048  -8.050
   63    HA   ARG   8           HA       ARG   8  60.603   2.648  -6.963
   64    HB2  ARG   8           HB2      ARG   8  61.816   0.230  -5.655
   65    HB3  ARG   8           HB1      ARG   8  60.971   1.571  -4.908
   66    HG2  ARG   8           HG2      ARG   8  59.627  -0.571  -6.568
   67    HG3  ARG   8           HG1      ARG   8  59.828  -0.587  -4.814
   68    HD2  ARG   8           HD2      ARG   8  57.542   0.225  -5.845
   69    HD3  ARG   8           HD1      ARG   8  58.226   1.071  -4.475
   70    HE   ARG   8           HE       ARG   8  58.925   2.821  -6.054
   71   HH11  ARG   8          HH11      ARG   8  56.461   0.590  -7.331
   72   HH12  ARG   8          HH12      ARG   8  55.743   1.783  -8.282
   73   HH21  ARG   8          HH21      ARG   8  57.892   4.382  -7.204
   74   HH22  ARG   8          HH22      ARG   8  56.532   4.066  -8.198
   75    HA   PRO   9           HA       PRO   9  64.754   3.720  -7.983
   76    HB2  PRO   9           HB2      PRO   9  65.538   5.119  -5.890
   77    HB3  PRO   9           HB1      PRO   9  64.334   5.764  -6.948
   78    HG2  PRO   9           HG2      PRO   9  64.163   4.471  -4.333
   79    HG3  PRO   9           HG1      PRO   9  63.090   5.762  -4.973
   80    HD2  PRO   9           HD2      PRO   9  62.605   3.070  -4.642
   81    HD3  PRO   9           HD1      PRO   9  61.606   4.043  -5.681
   82    H    ARG  10           HN       ARG  10  66.964   3.354  -7.752
   83    HA   ARG  10           HA       ARG  10  67.675   1.527  -5.650
   84    HB2  ARG  10           HB2      ARG  10  69.178   2.465  -8.082
   85    HB3  ARG  10           HB1      ARG  10  69.803   1.323  -6.899
   86    HG2  ARG  10           HG2      ARG  10  67.300   0.347  -7.673
   87    HG3  ARG  10           HG1      ARG  10  68.091   0.882  -9.150
   88    HD2  ARG  10           HD2      ARG  10  69.208  -1.025  -7.099
   89    HD3  ARG  10           HD1      ARG  10  68.577  -1.465  -8.678
   90    HE   ARG  10           HE       ARG  10  70.506   0.160  -9.410
   91   HH11  ARG  10          HH11      ARG  10  70.679  -2.071  -6.689
   92   HH12  ARG  10          HH12      ARG  10  72.253  -2.630  -7.019
   93   HH21  ARG  10          HH21      ARG  10  72.706  -0.590  -9.885
   94   HH22  ARG  10          HH22      ARG  10  73.422  -1.779  -8.896
   95    H    LYS  11           HN       LYS  11  67.211   4.635  -5.711
   96    HA   LYS  11           HA       LYS  11  69.691   5.369  -4.382
   97    HB2  LYS  11           HB2      LYS  11  67.436   7.287  -4.817
   98    HB3  LYS  11           HB1      LYS  11  69.102   7.555  -4.583
   99    HG2  LYS  11           HG2      LYS  11  68.692   8.210  -6.842
  100    HG3  LYS  11           HG1      LYS  11  69.633   6.736  -6.887
  101    HD2  LYS  11           HD2      LYS  11  67.638   5.451  -7.402
  102    HD3  LYS  11           HD1      LYS  11  66.665   6.924  -7.324
  103    HE2  LYS  11           HE2      LYS  11  68.033   7.886  -9.134
  104    HE3  LYS  11           HE1      LYS  11  68.926   6.377  -9.252
  105    HZ1  LYS  11           HZ1      LYS  11  66.015   6.701  -9.717
  106    HZ2  LYS  11           HZ2      LYS  11  66.865   5.261  -9.889
  107    HZ3  LYS  11           HZ3      LYS  11  67.170   6.534 -10.913
  108    H    LEU  12           HN       LEU  12  69.591   5.403  -2.261
  109    HA   LEU  12           HA       LEU  12  67.436   4.497  -0.783
  110    HB2  LEU  12           HB2      LEU  12  69.542   4.201   0.127
  111    HB3  LEU  12           HB1      LEU  12  69.957   5.894  -0.041
  112    HG   LEU  12           HG       LEU  12  68.411   6.469   1.754
  113   HD11  LEU  12          HD11      LEU  12  66.848   4.540   1.413
  114   HD12  LEU  12          HD12      LEU  12  67.391   4.823   3.084
  115   HD13  LEU  12          HD13      LEU  12  68.115   3.511   2.139
  116   HD21  LEU  12          HD21      LEU  12  70.088   4.213   2.598
  117   HD22  LEU  12          HD22      LEU  12  69.732   5.708   3.499
  118   HD23  LEU  12          HD23      LEU  12  70.776   5.730   2.059
  119    HA   PRO  13           HA       PRO  13  66.491   8.925   0.809
  120    HB2  PRO  13           HB2      PRO  13  67.203  11.094  -0.687
  121    HB3  PRO  13           HB1      PRO  13  68.298  10.317   0.482
  122    HG2  PRO  13           HG2      PRO  13  68.205   9.929  -2.482
  123    HG3  PRO  13           HG1      PRO  13  69.602  10.281  -1.445
  124    HD2  PRO  13           HD2      PRO  13  69.004   7.770  -2.232
  125    HD3  PRO  13           HD1      PRO  13  69.710   8.085  -0.660
  126    H    GLN  14           HN       GLN  14  66.548   8.435  -2.584
  127    HA   GLN  14           HA       GLN  14  64.119   9.753  -3.249
  128    HB2  GLN  14           HB2      GLN  14  66.156   8.927  -4.701
  129    HB3  GLN  14           HB1      GLN  14  65.205   7.452  -4.815
  130    HG2  GLN  14           HG2      GLN  14  63.343   8.787  -5.660
  131    HG3  GLN  14           HG1      GLN  14  64.392  10.201  -5.681
  132   HE21  GLN  14          HE21      GLN  14  66.348  10.053  -7.054
  133   HE22  GLN  14          HE22      GLN  14  66.189   9.156  -8.518
  134    H    LEU  15           HN       LEU  15  65.016   6.365  -2.482
  135    HA   LEU  15           HA       LEU  15  62.565   5.159  -2.800
  136    HB2  LEU  15           HB2      LEU  15  64.733   4.018  -2.469
  137    HB3  LEU  15           HB1      LEU  15  64.764   4.662  -0.888
  138    HG   LEU  15           HG       LEU  15  62.868   3.425  -0.194
  139   HD11  LEU  15          HD11      LEU  15  62.979   2.187  -2.955
  140   HD12  LEU  15          HD12      LEU  15  61.691   3.253  -2.374
  141   HD13  LEU  15          HD13      LEU  15  61.921   1.663  -1.647
  142   HD21  LEU  15          HD21      LEU  15  63.950   1.229  -0.309
  143   HD22  LEU  15          HD22      LEU  15  65.050   2.592   0.044
  144   HD23  LEU  15          HD23      LEU  15  65.006   1.898  -1.568
  145    H    CYS  16           HN       CYS  16  64.013   6.731  -0.047
  146    HA   CYS  16           HA       CYS  16  62.066   6.149   1.888
  147    HB2  CYS  16           HB2      CYS  16  63.710   8.656   1.508
  148    HB3  CYS  16           HB1      CYS  16  62.896   8.240   3.016
  149    HG   CYS  16           HG       CYS  16  65.420   6.448   1.559
  150    H    THR  17           HN       THR  17  62.173   8.640  -0.556
  151    HA   THR  17           HA       THR  17  59.881  10.053   0.098
  152    HB   THR  17           HB       THR  17  61.561   9.593  -2.273
  153    HG1  THR  17           HG1      THR  17  61.215  12.137  -1.331
  154   HG21  THR  17          HG21      THR  17  59.465   9.924  -3.274
  155   HG22  THR  17          HG22      THR  17  60.367  11.434  -3.477
  156   HG23  THR  17          HG23      THR  17  59.074  11.320  -2.265
  157    H    GLU  18           HN       GLU  18  60.384   7.187  -1.851
  158    HA   GLU  18           HA       GLU  18  57.865   6.813  -2.968
  159    HB2  GLU  18           HB2      GLU  18  60.071   5.087  -2.138
  160    HB3  GLU  18           HB1      GLU  18  58.695   4.411  -3.005
  161    HG2  GLU  18           HG2      GLU  18  59.928   6.844  -4.004
  162    HG3  GLU  18           HG1      GLU  18  60.960   5.476  -4.178
  163    H    LEU  19           HN       LEU  19  59.370   5.350  -0.058
  164    HA   LEU  19           HA       LEU  19  57.010   4.314   1.088
  165    HB2  LEU  19           HB2      LEU  19  59.685   5.056   2.112
  166    HB3  LEU  19           HB1      LEU  19  58.539   4.431   3.194
  167    HG   LEU  19           HG       LEU  19  58.548   2.434   1.305
  168   HD11  LEU  19          HD11      LEU  19  60.801   2.020   0.645
  169   HD12  LEU  19          HD12      LEU  19  61.315   3.543   1.372
  170   HD13  LEU  19          HD13      LEU  19  60.233   3.552  -0.018
  171   HD21  LEU  19          HD21      LEU  19  60.150   1.332   2.827
  172   HD22  LEU  19          HD22      LEU  19  58.728   2.078   3.589
  173   HD23  LEU  19          HD23      LEU  19  60.289   2.913   3.635
  174    H    GLN  20           HN       GLN  20  57.654   7.468   0.549
  175    HA   GLN  20           HA       GLN  20  56.761   9.408   1.271
  176    HB2  GLN  20           HB2      GLN  20  54.947   7.450   2.556
  177    HB3  GLN  20           HB1      GLN  20  54.594   9.193   2.596
  178    HG2  GLN  20           HG2      GLN  20  54.622   9.062   0.068
  179    HG3  GLN  20           HG1      GLN  20  54.714   7.311   0.241
  180   HE21  GLN  20          HE21      GLN  20  52.754   6.937  -0.683
  181   HE22  GLN  20          HE22      GLN  20  51.252   7.367   0.049
  182    H    THR  21           HN       THR  21  58.907   8.290   2.763
  183    HA   THR  21           HA       THR  21  58.466   9.657   5.278
  184    HB   THR  21           HB       THR  21  57.937   7.220   5.619
  185    HG1  THR  21           HG1      THR  21  59.059   7.140   7.536
  186   HG21  THR  21          HG21      THR  21  59.509   6.226   4.035
  187   HG22  THR  21          HG22      THR  21  59.795   5.605   5.670
  188   HG23  THR  21          HG23      THR  21  60.864   6.832   4.999
  189    H    THR  22           HN       THR  22  60.960   9.033   6.405
  190    HA   THR  22           HA       THR  22  62.849   9.837   4.293
  191    HB   THR  22           HB       THR  22  63.420  10.746   7.063
  192    HG1  THR  22           HG1      THR  22  61.121  11.347   5.693
  193   HG21  THR  22          HG21      THR  22  64.942  11.227   5.191
  194   HG22  THR  22          HG22      THR  22  64.249  12.719   5.806
  195   HG23  THR  22          HG23      THR  22  63.626  12.005   4.320
  196    H    ILE  23           HN       ILE  23  65.215   9.460   5.209
  197    HA   ILE  23           HA       ILE  23  65.808   6.858   5.443
  198    HB   ILE  23           HB       ILE  23  67.354   9.083   6.671
  199   HG12  ILE  23          HG12      ILE  23  67.011   8.169   3.869
  200   HG13  ILE  23          HG11      ILE  23  66.817   9.766   4.518
  201   HG21  ILE  23          HG21      ILE  23  68.188   6.429   5.440
  202   HG22  ILE  23          HG22      ILE  23  68.222   6.808   7.165
  203   HG23  ILE  23          HG23      ILE  23  69.320   7.640   6.052
  204   HD11  ILE  23          HD11      ILE  23  68.817   9.647   3.170
  205   HD12  ILE  23          HD12      ILE  23  69.332   8.250   4.116
  206   HD13  ILE  23          HD13      ILE  23  69.288   9.848   4.881
  207    H    HIS  24           HN       HIS  24  64.884   9.068   7.795
  208    HA   HIS  24           HA       HIS  24  66.176   8.154  10.103
  209    HB2  HIS  24           HB2      HIS  24  63.818  10.007   9.919
  210    HB3  HIS  24           HB1      HIS  24  65.117  10.093  11.083
  211    HD1  HIS  24           HD1      HIS  24  67.238   9.802   8.642
  212    HD2  HIS  24           HD2      HIS  24  64.296  12.580   9.167
  213    HE1  HIS  24           HE1      HIS  24  67.701  11.497   6.866
  214    H    ASP  25           HN       ASP  25  63.435   7.235   8.399
  215    HA   ASP  25           HA       ASP  25  62.122   5.988  10.742
  216    HB2  ASP  25           HB2      ASP  25  60.964   8.074   9.947
  217    HB3  ASP  25           HB1      ASP  25  60.822   7.309   8.409
  218    H    ILE  26           HN       ILE  26  62.776   5.934   7.298
  219    HA   ILE  26           HA       ILE  26  61.277   3.902   6.297
  220    HB   ILE  26           HB       ILE  26  62.642   5.276   4.855
  221   HG12  ILE  26          HG12      ILE  26  63.689   2.494   4.670
  222   HG13  ILE  26          HG11      ILE  26  62.080   2.810   4.143
  223   HG21  ILE  26          HG21      ILE  26  64.576   5.508   6.323
  224   HG22  ILE  26          HG22      ILE  26  65.063   4.982   4.705
  225   HG23  ILE  26          HG23      ILE  26  64.996   3.819   6.031
  226   HD11  ILE  26          HD11      ILE  26  64.646   3.908   3.016
  227   HD12  ILE  26          HD12      ILE  26  63.045   4.435   2.477
  228   HD13  ILE  26          HD13      ILE  26  63.545   2.746   2.282
  229    H    ILE  27           HN       ILE  27  61.054   1.819   6.504
  230    HA   ILE  27           HA       ILE  27  63.204   0.322   7.679
  231    HB   ILE  27           HB       ILE  27  60.326  -0.386   7.107
  232   HG12  ILE  27          HG12      ILE  27  60.754   1.032   9.071
  233   HG13  ILE  27          HG11      ILE  27  60.061  -0.531   9.476
  234   HG21  ILE  27          HG21      ILE  27  61.713  -2.308   6.662
  235   HG22  ILE  27          HG22      ILE  27  60.781  -2.563   8.146
  236   HG23  ILE  27          HG23      ILE  27  62.498  -2.144   8.234
  237   HD11  ILE  27          HD11      ILE  27  62.945   0.327   9.796
  238   HD12  ILE  27          HD12      ILE  27  62.342  -1.299  10.105
  239   HD13  ILE  27          HD13      ILE  27  61.774   0.046  11.088
  240    H    LEU  28           HN       LEU  28  64.630  -0.155   6.661
  241    HA   LEU  28           HA       LEU  28  64.231  -1.218   3.982
  242    HB2  LEU  28           HB2      LEU  28  65.669   0.948   4.828
  243    HB3  LEU  28           HB1      LEU  28  66.854  -0.346   4.699
  244    HG   LEU  28           HG       LEU  28  66.275  -0.756   2.433
  245   HD11  LEU  28          HD11      LEU  28  64.006  -0.533   2.193
  246   HD12  LEU  28          HD12      LEU  28  64.451   1.101   1.634
  247   HD13  LEU  28          HD13      LEU  28  63.991   0.788   3.334
  248   HD21  LEU  28          HD21      LEU  28  66.386   2.193   2.960
  249   HD22  LEU  28          HD22      LEU  28  66.839   1.374   1.465
  250   HD23  LEU  28          HD23      LEU  28  67.782   1.124   2.939
  251    H    GLU  29           HN       GLU  29  65.033  -3.344   3.817
  252    HA   GLU  29           HA       GLU  29  66.647  -3.810   6.197
  253    HB2  GLU  29           HB2      GLU  29  66.107  -6.136   6.088
  254    HB3  GLU  29           HB1      GLU  29  64.929  -5.032   6.867
  255    HG2  GLU  29           HG2      GLU  29  63.814  -5.111   4.701
  256    HG3  GLU  29           HG1      GLU  29  64.848  -6.530   4.362
  257    H    CYS  30           HN       CYS  30  68.004  -6.101   6.037
  258    HA   CYS  30           HA       CYS  30  69.593  -5.555   3.853
  259    HB2  CYS  30           HB2      CYS  30  70.323  -6.730   6.018
  260    HB3  CYS  30           HB1      CYS  30  69.538  -8.139   5.345
  261    H    VAL  31           HN       VAL  31  69.477  -6.209   2.039
  262    HA   VAL  31           HA       VAL  31  67.393  -7.694   0.852
  263    HB   VAL  31           HB       VAL  31  68.589  -6.038  -0.480
  264   HG11  VAL  31          HG11      VAL  31  70.861  -6.347  -1.024
  265   HG12  VAL  31          HG12      VAL  31  70.998  -7.530   0.296
  266   HG13  VAL  31          HG13      VAL  31  70.554  -5.817   0.633
  267   HG21  VAL  31          HG21      VAL  31  67.982  -7.933  -1.824
  268   HG22  VAL  31          HG22      VAL  31  69.516  -8.713  -1.416
  269   HG23  VAL  31          HG23      VAL  31  69.503  -7.226  -2.364
  270    H    TYR  32           HN       TYR  32  70.436  -8.491   2.131
  271    HA   TYR  32           HA       TYR  32  70.406 -11.130   0.952
  272    HB2  TYR  32           HB2      TYR  32  72.631  -9.849   2.523
  273    HB3  TYR  32           HB1      TYR  32  72.730 -11.312   1.541
  274    HD1  TYR  32           HD1      TYR  32  71.328 -10.647  -0.907
  275    HD2  TYR  32           HD2      TYR  32  73.890  -8.185   1.479
  276    HE1  TYR  32           HE1      TYR  32  71.770  -9.375  -2.801
  277    HE2  TYR  32           HE2      TYR  32  74.390  -6.788  -0.474
  278    HH   TYR  32           HH       TYR  32  72.597  -7.106  -3.426
  279    H    CYS  33           HN       CYS  33  70.469  -9.567   4.167
  280    HA   CYS  33           HA       CYS  33  70.477 -12.188   5.488
  281    HB2  CYS  33           HB2      CYS  33  70.567  -9.454   6.755
  282    HB3  CYS  33           HB1      CYS  33  70.813 -11.001   7.527
  283    H    LYS  34           HN       LYS  34  68.301  -9.671   4.595
  284    HA   LYS  34           HA       LYS  34  66.357  -9.028   5.080
  285    HB2  LYS  34           HB2      LYS  34  66.055 -11.911   5.859
  286    HB3  LYS  34           HB1      LYS  34  64.700 -10.797   5.923
  287    HG2  LYS  34           HG2      LYS  34  64.678 -12.060   3.899
  288    HG3  LYS  34           HG1      LYS  34  64.956 -10.361   3.499
  289    HD2  LYS  34           HD2      LYS  34  67.316 -10.924   3.165
  290    HD3  LYS  34           HD1      LYS  34  66.993 -12.588   3.634
  291    HE2  LYS  34           HE2      LYS  34  65.856 -11.136   1.244
  292    HE3  LYS  34           HE1      LYS  34  67.098 -12.382   1.210
  293    HZ1  LYS  34           HZ1      LYS  34  64.242 -12.728   1.968
  294    HZ2  LYS  34           HZ2      LYS  34  65.420 -13.922   2.162
  295    HZ3  LYS  34           HZ3      LYS  34  65.039 -13.377   0.639
  296    H    GLN  35           HN       GLN  35  68.336  -8.509   6.953
  297    HA   GLN  35           HA       GLN  35  66.807  -8.310   9.401
  298    HB2  GLN  35           HB2      GLN  35  69.699  -8.112   8.806
  299    HB3  GLN  35           HB1      GLN  35  68.974  -7.764  10.356
  300    HG2  GLN  35           HG2      GLN  35  68.418 -10.259   9.017
  301    HG3  GLN  35           HG1      GLN  35  69.951 -10.153   9.951
  302   HE21  GLN  35          HE21      GLN  35  67.771 -11.928  10.336
  303   HE22  GLN  35          HE22      GLN  35  67.083 -11.592  11.888
  304    H    GLN  36           HN       GLN  36  66.309  -6.493   9.938
  305    HA   GLN  36           HA       GLN  36  66.290  -4.323   8.206
  306    HB2  GLN  36           HB2      GLN  36  65.400  -4.821  10.985
  307    HB3  GLN  36           HB1      GLN  36  65.243  -3.262  10.203
  308    HG2  GLN  36           HG2      GLN  36  63.870  -4.111   8.532
  309    HG3  GLN  36           HG1      GLN  36  64.287  -5.765   8.945
  310   HE21  GLN  36          HE21      GLN  36  63.417  -3.246  11.264
  311   HE22  GLN  36          HE22      GLN  36  61.912  -3.929  11.713
  312    H    LEU  37           HN       LEU  37  67.536  -2.764   8.007
  313    HA   LEU  37           HA       LEU  37  69.978  -2.509   9.474
  314    HB2  LEU  37           HB2      LEU  37  68.687  -0.879   7.314
  315    HB3  LEU  37           HB1      LEU  37  69.992  -0.328   8.294
  316    HG   LEU  37           HG       LEU  37  71.307  -2.315   7.615
  317   HD11  LEU  37          HD11      LEU  37  69.059  -2.680   5.670
  318   HD12  LEU  37          HD12      LEU  37  69.618  -3.807   6.904
  319   HD13  LEU  37          HD13      LEU  37  70.644  -3.435   5.518
  320   HD21  LEU  37          HD21      LEU  37  70.457  -0.376   5.483
  321   HD22  LEU  37          HD22      LEU  37  71.907  -1.378   5.425
  322   HD23  LEU  37          HD23      LEU  37  71.738  -0.145   6.674
  323    H    LEU  38           HN       LEU  38  70.674  -1.546  10.777
  324    HA   LEU  38           HA       LEU  38  69.367  -0.176  12.785
  325    HB2  LEU  38           HB2      LEU  38  72.011  -0.608  11.629
  326    HB3  LEU  38           HB1      LEU  38  71.879   0.707  12.751
  327    HG   LEU  38           HG       LEU  38  71.190  -2.197  13.341
  328   HD11  LEU  38          HD11      LEU  38  73.306  -2.242  14.574
  329   HD12  LEU  38          HD12      LEU  38  73.657  -0.595  14.050
  330   HD13  LEU  38          HD13      LEU  38  73.592  -1.903  12.867
  331   HD21  LEU  38          HD21      LEU  38  70.031  -0.588  14.750
  332   HD22  LEU  38          HD22      LEU  38  71.571   0.206  15.059
  333   HD23  LEU  38          HD23      LEU  38  71.291  -1.430  15.677
  334    H    ARG  39           HN       ARG  39  68.710   2.004  12.732
  335    HA   ARG  39           HA       ARG  39  68.407   3.446  10.396
  336    HB2  ARG  39           HB2      ARG  39  67.266   3.959  12.551
  337    HB3  ARG  39           HB1      ARG  39  68.769   4.655  13.144
  338    HG2  ARG  39           HG2      ARG  39  68.705   6.272  11.277
  339    HG3  ARG  39           HG1      ARG  39  67.128   5.635  10.818
  340    HD2  ARG  39           HD2      ARG  39  66.790   7.615  12.145
  341    HD3  ARG  39           HD1      ARG  39  66.297   6.213  13.096
  342    HE   ARG  39           HE       ARG  39  68.849   6.550  13.842
  343   HH11  ARG  39          HH11      ARG  39  66.139   8.846  13.681
  344   HH12  ARG  39          HH12      ARG  39  66.728   9.840  14.926
  345   HH21  ARG  39          HH21      ARG  39  69.641   7.908  15.585
  346   HH22  ARG  39          HH22      ARG  39  68.768   9.279  16.054
  347    H    ARG  40           HN       ARG  40  71.049   3.507  12.684
  348    HA   ARG  40           HA       ARG  40  72.643   5.496  11.664
  349    HB2  ARG  40           HB2      ARG  40  73.507   4.709  13.584
  350    HB3  ARG  40           HB1      ARG  40  72.980   3.064  13.266
  351    HG2  ARG  40           HG2      ARG  40  74.798   2.749  11.771
  352    HG3  ARG  40           HG1      ARG  40  75.365   4.409  12.036
  353    HD2  ARG  40           HD2      ARG  40  75.914   3.921  14.267
  354    HD3  ARG  40           HD1      ARG  40  75.040   2.381  14.230
  355    HE   ARG  40           HE       ARG  40  76.713   1.888  12.375
  356   HH11  ARG  40          HH11      ARG  40  77.422   3.578  15.406
  357   HH12  ARG  40          HH12      ARG  40  79.046   3.097  15.478
  358   HH21  ARG  40          HH21      ARG  40  78.978   1.192  12.489
  359   HH22  ARG  40          HH22      ARG  40  79.955   1.718  13.775
  360    H    GLU  41           HN       GLU  41  72.578   2.053  10.745
  361    HA   GLU  41           HA       GLU  41  74.604   2.220   8.721
  362    HB2  GLU  41           HB2      GLU  41  72.403   0.204   9.134
  363    HB3  GLU  41           HB1      GLU  41  73.783  -0.074   8.111
  364    HG2  GLU  41           HG2      GLU  41  73.718   0.218  11.095
  365    HG3  GLU  41           HG1      GLU  41  74.081  -1.236  10.163
  366    H    VAL  42           HN       VAL  42  71.148   2.581   8.783
  367    HA   VAL  42           HA       VAL  42  70.785   2.572   5.964
  368    HB   VAL  42           HB       VAL  42  69.013   4.229   7.796
  369   HG11  VAL  42          HG11      VAL  42  68.668   4.280   5.316
  370   HG12  VAL  42          HG12      VAL  42  67.287   3.650   6.230
  371   HG13  VAL  42          HG13      VAL  42  68.379   2.530   5.419
  372   HG21  VAL  42          HG21      VAL  42  67.645   2.254   8.217
  373   HG22  VAL  42          HG22      VAL  42  69.275   2.036   8.863
  374   HG23  VAL  42          HG23      VAL  42  68.811   1.265   7.346
  375    H    TYR  43           HN       TYR  43  71.512   5.157   8.331
  376    HA   TYR  43           HA       TYR  43  71.620   7.257   6.499
  377    HB2  TYR  43           HB2      TYR  43  73.152   6.813   9.040
  378    HB3  TYR  43           HB1      TYR  43  73.335   8.290   8.075
  379    HD1  TYR  43           HD2      TYR  43  70.737   8.968   7.305
  380    HD2  TYR  43           HD1      TYR  43  72.002   7.195  10.924
  381    HE1  TYR  43           HE2      TYR  43  68.778   9.816   8.368
  382    HE2  TYR  43           HE1      TYR  43  70.014   8.034  12.045
  383    HH   TYR  43           HH       TYR  43  68.379   9.937  11.712
  384    H    ASP  44           HN       ASP  44  74.142   4.862   7.367
  385    HA   ASP  44           HA       ASP  44  76.288   6.009   6.082
  386    HB2  ASP  44           HB2      ASP  44  75.543   3.102   6.384
  387    HB3  ASP  44           HB1      ASP  44  77.016   3.665   5.747
  388    H    PHE  45           HN       PHE  45  73.803   4.016   4.910
  389    HA   PHE  45           HA       PHE  45  74.765   3.409   2.422
  390    HB2  PHE  45           HB2      PHE  45  72.533   2.843   3.863
  391    HB3  PHE  45           HB1      PHE  45  71.958   4.031   2.732
  392    HD1  PHE  45           HD1      PHE  45  73.507   0.734   3.020
  393    HD2  PHE  45           HD2      PHE  45  71.695   3.648   0.513
  394    HE1  PHE  45           HE1      PHE  45  73.191  -0.943   1.214
  395    HE2  PHE  45           HE2      PHE  45  71.428   1.998  -1.245
  396    HZ   PHE  45           HZ       PHE  45  72.118  -0.265  -0.910
  397    H    ALA  46           HN       ALA  46  72.775   6.224   3.426
  398    HA   ALA  46           HA       ALA  46  72.889   7.369   0.756
  399    HB1  ALA  46           HB1      ALA  46  70.794   7.636   2.066
  400    HB2  ALA  46           HB2      ALA  46  71.479   9.169   1.592
  401    HB3  ALA  46           HB3      ALA  46  71.704   8.581   3.240
  402    H    ARG  47           HN       ARG  47  74.501   7.760   3.799
  403    HA   ARG  47           HA       ARG  47  75.524  10.362   3.252
  404    HB2  ARG  47           HB2      ARG  47  75.852   8.299   5.345
  405    HB3  ARG  47           HB1      ARG  47  77.158   9.447   5.235
  406    HG2  ARG  47           HG2      ARG  47  75.420  10.033   6.934
  407    HG3  ARG  47           HG1      ARG  47  75.621  11.280   5.712
  408    HD2  ARG  47           HD2      ARG  47  73.594  10.614   4.608
  409    HD3  ARG  47           HD1      ARG  47  73.460   9.171   5.605
  410    HE   ARG  47           HE       ARG  47  73.281  10.903   7.493
  411   HH11  ARG  47          HH11      ARG  47  71.905  11.403   4.249
  412   HH12  ARG  47          HH12      ARG  47  70.584  12.308   4.826
  413   HH21  ARG  47          HH21      ARG  47  71.390  12.139   8.244
  414   HH22  ARG  47          HH22      ARG  47  70.286  12.720   7.090
  415    H    ARG  48           HN       ARG  48  76.395   7.181   2.383
  416    HA   ARG  48           HA       ARG  48  78.938   8.094   1.281
  417    HB2  ARG  48           HB2      ARG  48  77.748   5.408   1.683
  418    HB3  ARG  48           HB1      ARG  48  79.360   5.697   1.074
  419    HG2  ARG  48           HG2      ARG  48  80.051   6.531   3.215
  420    HG3  ARG  48           HG1      ARG  48  78.384   6.492   3.814
  421    HD2  ARG  48           HD2      ARG  48  78.372   4.058   3.288
  422    HD3  ARG  48           HD1      ARG  48  80.088   4.187   2.952
  423    HE   ARG  48           HE       ARG  48  79.170   5.109   5.526
  424   HH11  ARG  48          HH11      ARG  48  80.839   2.539   3.755
  425   HH12  ARG  48          HH12      ARG  48  81.143   1.590   5.124
  426   HH21  ARG  48          HH21      ARG  48  79.481   3.767   7.386
  427   HH22  ARG  48          HH22      ARG  48  80.349   2.296   7.245
  428    H    ASP  49           HN       ASP  49  78.942   6.000  -0.734
  429    HA   ASP  49           HA       ASP  49  76.698   6.919  -2.339
  430    HB2  ASP  49           HB2      ASP  49  79.478   6.216  -3.290
  431    HB3  ASP  49           HB1      ASP  49  78.133   6.714  -4.300
  432    H    LEU  50           HN       LEU  50  75.732   4.843  -1.282
  433    HA   LEU  50           HA       LEU  50  76.516   2.609  -2.927
  434    HB2  LEU  50           HB2      LEU  50  74.981   2.611  -0.349
  435    HB3  LEU  50           HB1      LEU  50  75.361   1.190  -1.293
  436    HG   LEU  50           HG       LEU  50  77.797   1.892  -0.987
  437   HD11  LEU  50          HD11      LEU  50  77.434   4.035  -0.188
  438   HD12  LEU  50          HD12      LEU  50  78.312   3.091   1.031
  439   HD13  LEU  50          HD13      LEU  50  76.586   3.452   1.244
  440   HD21  LEU  50          HD21      LEU  50  76.860  -0.071   0.020
  441   HD22  LEU  50          HD22      LEU  50  76.181   0.952   1.306
  442   HD23  LEU  50          HD23      LEU  50  77.936   0.784   1.149
  443    H    CYS  51           HN       CYS  51  74.877   1.366  -3.902
  444    HA   CYS  51           HA       CYS  51  72.337   2.794  -4.246
  445    HB2  CYS  51           HB2      CYS  51  72.131   1.545  -6.372
  446    HB3  CYS  51           HB1      CYS  51  73.588   2.546  -6.313
  447    HG   CYS  51           HG       CYS  51  74.579  -0.295  -5.224
  448    H    ILE  52           HN       ILE  52  70.461   1.644  -4.365
  449    HA   ILE  52           HA       ILE  52  70.411  -0.331  -2.300
  450    HB   ILE  52           HB       ILE  52  68.395   1.456  -3.521
  451   HG12  ILE  52          HG12      ILE  52  69.380   0.602  -0.893
  452   HG13  ILE  52          HG11      ILE  52  69.600   2.176  -1.698
  453   HG21  ILE  52          HG21      ILE  52  66.516   0.344  -2.415
  454   HG22  ILE  52          HG22      ILE  52  67.561  -0.996  -1.951
  455   HG23  ILE  52          HG23      ILE  52  67.202  -0.711  -3.653
  456   HD11  ILE  52          HD11      ILE  52  68.176   2.346   0.091
  457   HD12  ILE  52          HD12      ILE  52  67.277   0.930  -0.496
  458   HD13  ILE  52          HD13      ILE  52  67.191   2.474  -1.406
  459    H    VAL  53           HN       VAL  53  69.383  -2.087  -2.235
  460    HA   VAL  53           HA       VAL  53  69.635  -3.639  -4.656
  461    HB   VAL  53           HB       VAL  53  70.387  -5.405  -2.872
  462   HG11  VAL  53          HG11      VAL  53  71.794  -4.444  -4.678
  463   HG12  VAL  53          HG12      VAL  53  72.716  -4.626  -3.180
  464   HG13  VAL  53          HG13      VAL  53  72.109  -3.037  -3.666
  465   HG21  VAL  53          HG21      VAL  53  70.974  -2.772  -1.479
  466   HG22  VAL  53          HG22      VAL  53  71.550  -4.349  -0.970
  467   HG23  VAL  53          HG23      VAL  53  69.831  -3.994  -0.917
  468    H    TYR  54           HN       TYR  54  67.731  -4.250  -5.147
  469    HA   TYR  54           HA       TYR  54  65.711  -4.952  -3.159
  470    HB2  TYR  54           HB2      TYR  54  65.716  -4.801  -6.172
  471    HB3  TYR  54           HB1      TYR  54  64.335  -5.272  -5.190
  472    HD1  TYR  54           HD1      TYR  54  66.722  -2.442  -5.696
  473    HD2  TYR  54           HD2      TYR  54  62.865  -3.679  -4.433
  474    HE1  TYR  54           HE1      TYR  54  65.968  -0.058  -5.485
  475    HE2  TYR  54           HE2      TYR  54  62.178  -1.357  -4.297
  476    HH   TYR  54           HH       TYR  54  63.342   0.754  -3.815
  477    H    ARG  55           HN       ARG  55  65.445  -6.776  -2.560
  478    HA   ARG  55           HA       ARG  55  66.842  -8.877  -3.977
  479    HB2  ARG  55           HB2      ARG  55  66.282  -8.669  -1.216
  480    HB3  ARG  55           HB1      ARG  55  65.196  -9.915  -1.775
  481    HG2  ARG  55           HG2      ARG  55  68.217 -10.069  -2.268
  482    HG3  ARG  55           HG1      ARG  55  67.493 -10.696  -0.848
  483    HD2  ARG  55           HD2      ARG  55  67.690 -12.542  -2.335
  484    HD3  ARG  55           HD1      ARG  55  65.994 -12.086  -2.443
  485    HE   ARG  55           HE       ARG  55  67.804 -10.939  -4.389
  486   HH11  ARG  55          HH11      ARG  55  65.387 -13.471  -3.716
  487   HH12  ARG  55          HH12      ARG  55  65.097 -13.838  -5.342
  488   HH21  ARG  55          HH21      ARG  55  67.355 -11.438  -6.670
  489   HH22  ARG  55          HH22      ARG  55  66.280 -12.694  -7.063
  490    H    ASP  56           HN       ASP  56  65.562  -9.727  -5.609
  491    HA   ASP  56           HA       ASP  56  63.890 -10.317  -6.925
  492    HB2  ASP  56           HB2      ASP  56  63.041 -11.771  -5.136
  493    HB3  ASP  56           HB1      ASP  56  62.177 -10.413  -4.425
  494    H    GLY  57           HN       GLY  57  61.918  -8.395  -4.674
  495    HA2  GLY  57           HA2      GLY  57  62.109  -6.175  -6.444
  496    HA3  GLY  57           HA1      GLY  57  60.514  -6.944  -6.487
  497    H    ASN  58           HN       ASN  58  62.568  -6.699  -3.674
  498    HA   ASN  58           HA       ASN  58  60.640  -4.772  -2.536
  499    HB2  ASN  58           HB2      ASN  58  62.156  -6.823  -0.965
  500    HB3  ASN  58           HB1      ASN  58  60.744  -5.934  -0.460
  501   HD21  ASN  58          HD21      ASN  58  61.989  -8.564  -2.299
  502   HD22  ASN  58          HD22      ASN  58  60.556  -9.488  -2.406
  503    HA   PRO  59           HA       PRO  59  64.449  -2.763  -1.977
  504    HB2  PRO  59           HB2      PRO  59  63.348  -0.713  -0.341
  505    HB3  PRO  59           HB1      PRO  59  63.738  -0.646  -2.054
  506    HG2  PRO  59           HG2      PRO  59  61.083  -0.570  -1.174
  507    HG3  PRO  59           HG1      PRO  59  61.593  -1.117  -2.674
  508    HD2  PRO  59           HD2      PRO  59  60.903  -2.756  -0.351
  509    HD3  PRO  59           HD1      PRO  59  60.589  -2.992  -2.064
  510    H    TYR  60           HN       TYR  60  66.186  -2.987  -0.936
  511    HA   TYR  60           HA       TYR  60  66.017  -2.955   1.843
  512    HB2  TYR  60           HB2      TYR  60  67.582  -5.349   0.830
  513    HB3  TYR  60           HB1      TYR  60  66.964  -4.885   2.233
  514    HD1  TYR  60           HD2      TYR  60  64.796  -5.238   2.984
  515    HD2  TYR  60           HD1      TYR  60  66.008  -6.449  -0.844
  516    HE1  TYR  60           HE2      TYR  60  62.856  -6.770   2.871
  517    HE2  TYR  60           HE1      TYR  60  64.100  -7.968  -1.010
  518    HH   TYR  60           HH       TYR  60  62.608  -9.220   0.690
  519    H    ALA  61           HN       ALA  61  68.112  -3.084   2.570
  520    HA   ALA  61           HA       ALA  61  69.895  -1.313   1.090
  521    HB1  ALA  61           HB1      ALA  61  70.368  -0.472   3.224
  522    HB2  ALA  61           HB2      ALA  61  69.616  -1.911   3.916
  523    HB3  ALA  61           HB3      ALA  61  68.572  -0.698   3.186
  524    H    VAL  62           HN       VAL  62  72.052  -1.717   2.360
  525    HA   VAL  62           HA       VAL  62  72.576  -4.588   2.465
  526    HB   VAL  62           HB       VAL  62  74.371  -2.251   1.643
  527   HG11  VAL  62          HG11      VAL  62  75.136  -5.087   1.929
  528   HG12  VAL  62          HG12      VAL  62  75.599  -3.673   2.914
  529   HG13  VAL  62          HG13      VAL  62  76.101  -3.762   1.228
  530   HG21  VAL  62          HG21      VAL  62  73.335  -4.558   0.068
  531   HG22  VAL  62          HG22      VAL  62  74.547  -3.405  -0.499
  532   HG23  VAL  62          HG23      VAL  62  72.906  -2.850  -0.169
  533    H    CYS  63           HN       CYS  63  72.619  -5.152   4.523
  534    HA   CYS  63           HA       CYS  63  72.754  -3.344   6.647
  535    HB2  CYS  63           HB2      CYS  63  72.562  -5.196   8.057
  536    HB3  CYS  63           HB1      CYS  63  71.842  -5.691   6.516
  537    H    ASP  64           HN       ASP  64  74.293  -3.724   8.509
  538    HA   ASP  64           HA       ASP  64  76.856  -2.690   8.096
  539    HB2  ASP  64           HB2      ASP  64  75.836  -2.700  10.295
  540    HB3  ASP  64           HB1      ASP  64  75.832  -4.449  10.327
  541    H    LYS  65           HN       LYS  65  75.841  -5.979   8.464
  542    HA   LYS  65           HA       LYS  65  78.376  -7.172   8.591
  543    HB2  LYS  65           HB2      LYS  65  75.763  -8.360   7.674
  544    HB3  LYS  65           HB1      LYS  65  77.186  -9.261   8.190
  545    HG2  LYS  65           HG2      LYS  65  77.018  -8.338  10.411
  546    HG3  LYS  65           HG1      LYS  65  75.666  -7.327   9.913
  547    HD2  LYS  65           HD2      LYS  65  74.356  -9.292   9.471
  548    HD3  LYS  65           HD1      LYS  65  75.710 -10.332   9.945
  549    HE2  LYS  65           HE2      LYS  65  75.696  -9.323  12.160
  550    HE3  LYS  65           HE1      LYS  65  74.341  -8.301  11.697
  551    HZ1  LYS  65           HZ1      LYS  65  73.553 -10.198  12.936
  552    HZ2  LYS  65           HZ2      LYS  65  74.312 -11.269  11.891
  553    HZ3  LYS  65           HZ3      LYS  65  73.020 -10.340  11.342
  554    H    CYS  66           HN       CYS  66  76.078  -6.704   6.006
  555    HA   CYS  66           HA       CYS  66  77.719  -7.818   3.957
  556    HB2  CYS  66           HB2      CYS  66  75.129  -6.306   3.982
  557    HB3  CYS  66           HB1      CYS  66  75.814  -6.938   2.501
  558    H    LEU  67           HN       LEU  67  77.158  -4.557   5.125
  559    HA   LEU  67           HA       LEU  67  78.363  -3.040   3.157
  560    HB2  LEU  67           HB2      LEU  67  78.413  -2.760   6.114
  561    HB3  LEU  67           HB1      LEU  67  79.173  -1.575   5.082
  562    HG   LEU  67           HG       LEU  67  76.243  -2.279   5.206
  563   HD11  LEU  67          HD11      LEU  67  77.059  -0.836   6.916
  564   HD12  LEU  67          HD12      LEU  67  76.086   0.088   5.730
  565   HD13  LEU  67          HD13      LEU  67  77.870   0.116   5.668
  566   HD21  LEU  67          HD21      LEU  67  77.678  -0.458   3.279
  567   HD22  LEU  67          HD22      LEU  67  75.936  -0.528   3.514
  568   HD23  LEU  67          HD23      LEU  67  76.780  -1.923   2.862
  569    H    LYS  68           HN       LYS  68  79.851  -4.776   5.761
  570    HA   LYS  68           HA       LYS  68  82.560  -4.260   5.398
  571    HB2  LYS  68           HB2      LYS  68  81.620  -5.524   7.260
  572    HB3  LYS  68           HB1      LYS  68  81.187  -6.838   6.180
  573    HG2  LYS  68           HG2      LYS  68  83.741  -6.888   5.674
  574    HG3  LYS  68           HG1      LYS  68  83.872  -6.019   7.197
  575    HD2  LYS  68           HD2      LYS  68  82.498  -8.695   6.846
  576    HD3  LYS  68           HD1      LYS  68  84.145  -8.502   7.411
  577    HE2  LYS  68           HE2      LYS  68  82.740  -8.929   9.286
  578    HE3  LYS  68           HE1      LYS  68  83.222  -7.232   9.387
  579    HZ1  LYS  68           HZ1      LYS  68  80.588  -8.301   8.474
  580    HZ2  LYS  68           HZ2      LYS  68  81.004  -6.655   8.549
  581    HZ3  LYS  68           HZ3      LYS  68  80.931  -7.561   9.941
  582    H    PHE  69           HN       PHE  69  80.501  -6.820   3.896
  583    HA   PHE  69           HA       PHE  69  82.538  -8.199   2.611
  584    HB2  PHE  69           HB2      PHE  69  79.642  -8.024   2.237
  585    HB3  PHE  69           HB1      PHE  69  80.593  -9.302   1.567
  586    HD1  PHE  69           HD1      PHE  69  82.235  -9.408   4.367
  587    HD2  PHE  69           HD2      PHE  69  78.169  -9.608   3.166
  588    HE1  PHE  69           HE1      PHE  69  81.704 -10.689   6.382
  589    HE2  PHE  69           HE2      PHE  69  77.603 -10.853   5.131
  590    HZ   PHE  69           HZ       PHE  69  79.414 -11.412   6.812
  591    H    TYR  70           HN       TYR  70  79.927  -6.055   1.508
  592    HA   TYR  70           HA       TYR  70  80.748  -6.566  -1.172
  593    HB2  TYR  70           HB2      TYR  70  78.354  -5.085  -0.135
  594    HB3  TYR  70           HB1      TYR  70  78.661  -5.476  -1.831
  595    HD1  TYR  70           HD2      TYR  70  79.058  -7.949  -2.401
  596    HD2  TYR  70           HD1      TYR  70  77.296  -6.666   1.219
  597    HE1  TYR  70           HE2      TYR  70  78.111 -10.205  -2.069
  598    HE2  TYR  70           HE1      TYR  70  76.370  -8.924   1.600
  599    HH   TYR  70           HH       TYR  70  77.274 -11.619  -0.289
  600    H    SER  71           HN       SER  71  81.089  -3.894   1.017
  601    HA   SER  71           HA       SER  71  81.764  -2.089  -1.090
  602    HB2  SER  71           HB2      SER  71  81.044  -1.353   1.236
  603    HB3  SER  71           HB1      SER  71  82.597  -1.930   1.835
  604    HG   SER  71           HG       SER  71  82.622  -0.169  -0.319
  605    H    LYS  72           HN       LYS  72  83.294  -4.644   0.612
  606    HA   LYS  72           HA       LYS  72  85.979  -4.012  -0.130
  607    HB2  LYS  72           HB2      LYS  72  85.375  -5.425   1.841
  608    HB3  LYS  72           HB1      LYS  72  84.768  -6.641   0.744
  609    HG2  LYS  72           HG2      LYS  72  86.969  -7.267   1.538
  610    HG3  LYS  72           HG1      LYS  72  87.011  -6.943  -0.195
  611    HD2  LYS  72           HD2      LYS  72  87.939  -4.716   0.247
  612    HD3  LYS  72           HD1      LYS  72  87.876  -5.031   1.982
  613    HE2  LYS  72           HE2      LYS  72  89.497  -6.575  -0.044
  614    HE3  LYS  72           HE1      LYS  72  90.125  -5.361   1.070
  615    HZ1  LYS  72           HZ1      LYS  72  89.455  -6.790   2.920
  616    HZ2  LYS  72           HZ2      LYS  72  90.522  -7.572   1.887
  617    HZ3  LYS  72           HZ3      LYS  72  88.900  -7.967   1.838
  618    H    ILE  73           HN       ILE  73  83.414  -6.165  -1.270
  619    HA   ILE  73           HA       ILE  73  84.840  -7.276  -3.419
  620    HB   ILE  73           HB       ILE  73  81.824  -6.858  -3.363
  621   HG12  ILE  73          HG12      ILE  73  83.547  -9.140  -2.318
  622   HG13  ILE  73          HG11      ILE  73  82.357  -8.150  -1.471
  623   HG21  ILE  73          HG21      ILE  73  83.498  -8.730  -5.043
  624   HG22  ILE  73          HG22      ILE  73  82.617  -7.315  -5.615
  625   HG23  ILE  73          HG23      ILE  73  81.734  -8.712  -4.994
  626   HD11  ILE  73          HD11      ILE  73  80.554  -9.208  -2.667
  627   HD12  ILE  73          HD12      ILE  73  81.553 -10.405  -1.845
  628   HD13  ILE  73          HD13      ILE  73  81.709 -10.174  -3.585
  629    H    SER  74           HN       SER  74  82.983  -4.351  -3.221
  630    HA   SER  74           HA       SER  74  83.161  -3.647  -5.957
  631    HB2  SER  74           HB2      SER  74  82.723  -1.893  -3.540
  632    HB3  SER  74           HB1      SER  74  82.346  -1.478  -5.214
  633    HG   SER  74           HG       SER  74  81.071  -3.291  -3.481
  634    H    GLU  75           HN       GLU  75  85.607  -3.859  -3.688
  635    HA   GLU  75           HA       GLU  75  87.229  -1.867  -5.116
  636    HB2  GLU  75           HB2      GLU  75  86.360  -1.428  -2.632
  637    HB3  GLU  75           HB1      GLU  75  87.661  -2.513  -2.212
  638    HG2  GLU  75           HG2      GLU  75  88.099   0.005  -3.812
  639    HG3  GLU  75           HG1      GLU  75  88.123  -0.019  -2.060
  640    H    TYR  76           HN       TYR  76  86.691  -4.879  -5.263
  641    HA   TYR  76           HA       TYR  76  89.092  -5.932  -4.224
  642    HB2  TYR  76           HB2      TYR  76  86.730  -7.122  -5.234
  643    HB3  TYR  76           HB1      TYR  76  88.145  -7.964  -5.880
  644    HD1  TYR  76           HD2      TYR  76  89.999  -7.521  -3.580
  645    HD2  TYR  76           HD1      TYR  76  85.927  -8.720  -3.665
  646    HE1  TYR  76           HE2      TYR  76  90.277  -8.595  -1.395
  647    HE2  TYR  76           HE1      TYR  76  86.186  -9.784  -1.470
  648    HH   TYR  76           HH       TYR  76  88.022 -10.731  -0.142
  649    H    ARG  77           HN       ARG  77  90.908  -5.768  -4.945
  650    HA   ARG  77           HA       ARG  77  91.430  -6.165  -7.757
  651    HB2  ARG  77           HB2      ARG  77  92.954  -4.228  -5.962
  652    HB3  ARG  77           HB1      ARG  77  93.240  -4.514  -7.665
  653    HG2  ARG  77           HG2      ARG  77  90.830  -3.150  -6.464
  654    HG3  ARG  77           HG1      ARG  77  92.166  -2.368  -7.307
  655    HD2  ARG  77           HD2      ARG  77  90.216  -4.338  -8.484
  656    HD3  ARG  77           HD1      ARG  77  90.206  -2.598  -8.747
  657    HE   ARG  77           HE       ARG  77  92.698  -3.463  -9.507
  658   HH11  ARG  77          HH11      ARG  77  89.361  -4.121 -10.498
  659   HH12  ARG  77          HH12      ARG  77  89.765  -4.497 -12.100
  660   HH21  ARG  77          HH21      ARG  77  93.261  -3.984 -11.694
  661   HH22  ARG  77          HH22      ARG  77  92.051  -4.427 -12.802
  662    H    HIS  78           HN       HIS  78  91.653  -8.306  -6.945
  663    HA   HIS  78           HA       HIS  78  93.638  -8.639  -4.924
  664    HB2  HIS  78           HB2      HIS  78  92.953 -11.106  -4.948
  665    HB3  HIS  78           HB1      HIS  78  91.876  -9.829  -4.369
  666    HD1  HIS  78           HD1      HIS  78  92.240 -12.220  -7.326
  667    HD2  HIS  78           HD2      HIS  78  89.597  -9.684  -5.470
  668    HE1  HIS  78           HE1      HIS  78  90.024 -12.681  -8.424
  669    H    TYR  79           HN       TYR  79  95.473  -8.354  -5.614
  670    HA   TYR  79           HA       TYR  79  96.494 -10.012  -7.769
  671    HB2  TYR  79           HB2      TYR  79  96.743  -7.044  -7.372
  672    HB3  TYR  79           HB1      TYR  79  97.909  -7.948  -8.331
  673    HD1  TYR  79           HD1      TYR  79  94.146  -7.466  -8.062
  674    HD2  TYR  79           HD2      TYR  79  97.556  -8.141 -10.552
  675    HE1  TYR  79           HE1      TYR  79  92.745  -7.281 -10.070
  676    HE2  TYR  79           HE2      TYR  79  96.159  -7.991 -12.528
  677    HH   TYR  79           HH       TYR  79  92.913  -6.884 -12.455
  678    H    SER  80           HN       SER  80  98.843 -10.278  -7.553
  679    HA   SER  80           HA       SER  80  99.902  -9.593  -4.947
  680    HB2  SER  80           HB2      SER  80  99.911 -12.385  -6.121
  681    HB3  SER  80           HB1      SER  80 100.684 -11.899  -4.608
  682    HG   SER  80           HG       SER  80  98.266 -11.014  -4.497
  Start of MODEL   12
    1    H1   GLY  -1           HT1      GLY  -1  55.880   0.240  -0.361
    2    H2   GLY  -1           HT2      GLY  -1  54.664   1.335   0.008
    3    H3   GLY  -1           HT3      GLY  -1  54.471  -0.310   0.376
    4    HA2  GLY  -1           HA1      GLY  -1  56.456   1.513   1.599
    5    HA3  GLY  -1           HA2      GLY  -1  54.969   0.963   2.360
    6    H    ALA   0           HN       ALA   0  54.895  -1.056   3.258
    7    HA   ALA   0           HA       ALA   0  57.316  -2.389   3.870
    8    HB1  ALA   0           HB1      ALA   0  54.476  -3.404   4.052
    9    HB2  ALA   0           HB2      ALA   0  55.334  -2.520   5.314
   10    HB3  ALA   0           HB3      ALA   0  55.873  -4.131   4.843
   11    H    MET   1           HN       MET   1  54.791  -2.947   1.497
   12    HA   MET   1           HA       MET   1  56.515  -4.905   0.186
   13    HB2  MET   1           HB2      MET   1  54.523  -5.539  -1.097
   14    HB3  MET   1           HB1      MET   1  54.282  -5.803   0.624
   15    HG2  MET   1           HG2      MET   1  52.627  -4.279   0.748
   16    HG3  MET   1           HG1      MET   1  53.386  -3.195  -0.417
   17    HE1  MET   1           HE1      MET   1  53.217  -3.386  -2.963
   18    HE2  MET   1           HE2      MET   1  52.314  -4.619  -3.838
   19    HE3  MET   1           HE3      MET   1  53.804  -5.044  -3.000
   20    H    PHE   2           HN       PHE   2  57.168  -4.437  -1.916
   21    HA   PHE   2           HA       PHE   2  56.349  -1.821  -2.768
   22    HB2  PHE   2           HB2      PHE   2  59.000  -3.017  -2.761
   23    HB3  PHE   2           HB1      PHE   2  58.561  -2.362  -4.336
   24    HD1  PHE   2           HD1      PHE   2  58.100  -1.311  -0.756
   25    HD2  PHE   2           HD2      PHE   2  59.251  -0.214  -4.707
   26    HE1  PHE   2           HE1      PHE   2  58.487   0.965  -0.030
   27    HE2  PHE   2           HE2      PHE   2  59.652   2.018  -3.989
   28    HZ   PHE   2           HZ       PHE   2  59.261   2.661  -1.640
   29    H    GLN   3           HN       GLN   3  56.112  -1.323  -4.935
   30    HA   GLN   3           HA       GLN   3  54.577  -3.431  -6.132
   31    HB2  GLN   3           HB2      GLN   3  53.689  -1.632  -7.644
   32    HB3  GLN   3           HB1      GLN   3  53.240  -1.542  -5.956
   33    HG2  GLN   3           HG2      GLN   3  53.890   0.615  -7.245
   34    HG3  GLN   3           HG1      GLN   3  54.483   0.362  -5.600
   35   HE21  GLN   3          HE21      GLN   3  55.357  -0.123  -8.954
   36   HE22  GLN   3          HE22      GLN   3  57.059  -0.003  -8.635
   37    H    ASP   4           HN       ASP   4  54.311  -3.348  -8.470
   38    HA   ASP   4           HA       ASP   4  56.872  -4.041  -9.712
   39    HB2  ASP   4           HB2      ASP   4  55.091  -5.750  -9.603
   40    HB3  ASP   4           HB1      ASP   4  53.938  -4.634 -10.287
   41    HA   PRO   5           HA       PRO   5  57.181  -4.544 -12.030
   42    HB2  PRO   5           HB2      PRO   5  58.800  -3.276 -14.009
   43    HB3  PRO   5           HB1      PRO   5  57.386  -4.299 -14.265
   44    HG2  PRO   5           HG2      PRO   5  57.509  -1.580 -14.830
   45    HG3  PRO   5           HG1      PRO   5  56.020  -2.506 -14.619
   46    HD2  PRO   5           HD2      PRO   5  57.450  -0.741 -12.679
   47    HD3  PRO   5           HD1      PRO   5  55.709  -0.951 -12.935
   48    H    GLN   6           HN       GLN   6  59.403  -1.822 -12.599
   49    HA   GLN   6           HA       GLN   6  61.112  -2.859 -10.428
   50    HB2  GLN   6           HB2      GLN   6  62.066  -1.475 -12.961
   51    HB3  GLN   6           HB1      GLN   6  63.078  -2.097 -11.678
   52    HG2  GLN   6           HG2      GLN   6  63.319  -3.610 -13.444
   53    HG3  GLN   6           HG1      GLN   6  62.195  -4.395 -12.334
   54   HE21  GLN   6          HE21      GLN   6  61.411  -5.671 -14.003
   55   HE22  GLN   6          HE22      GLN   6  60.371  -5.047 -15.230
   56    H    GLU   7           HN       GLU   7  58.953  -0.876 -10.638
   57    HA   GLU   7           HA       GLU   7  60.202   1.671 -10.835
   58    HB2  GLU   7           HB2      GLU   7  58.167   1.144 -11.811
   59    HB3  GLU   7           HB1      GLU   7  57.341   0.949 -10.268
   60    HG2  GLU   7           HG2      GLU   7  57.738   3.305  -9.788
   61    HG3  GLU   7           HG1      GLU   7  58.567   3.498 -11.337
   62    H    ARG   8           HN       ARG   8  61.412   0.774  -9.085
   63    HA   ARG   8           HA       ARG   8  60.813   2.302  -6.620
   64    HB2  ARG   8           HB2      ARG   8  62.832   0.040  -6.819
   65    HB3  ARG   8           HB1      ARG   8  62.219   0.792  -5.368
   66    HG2  ARG   8           HG2      ARG   8  61.053  -1.113  -5.191
   67    HG3  ARG   8           HG1      ARG   8  59.998  -0.257  -6.360
   68    HD2  ARG   8           HD2      ARG   8  61.155  -1.277  -8.232
   69    HD3  ARG   8           HD1      ARG   8  62.136  -2.219  -7.107
   70    HE   ARG   8           HE       ARG   8  59.272  -2.485  -6.835
   71   HH11  ARG   8          HH11      ARG   8  62.202  -3.878  -8.320
   72   HH12  ARG   8          HH12      ARG   8  61.506  -5.414  -8.516
   73   HH21  ARG   8          HH21      ARG   8  58.365  -4.583  -7.107
   74   HH22  ARG   8          HH22      ARG   8  59.289  -5.835  -7.782
   75    HA   PRO   9           HA       PRO   9  64.536   4.310  -8.205
   76    HB2  PRO   9           HB2      PRO   9  65.750   5.177  -5.983
   77    HB3  PRO   9           HB1      PRO   9  64.321   5.988  -6.530
   78    HG2  PRO   9           HG2      PRO   9  64.749   4.037  -4.371
   79    HG3  PRO   9           HG1      PRO   9  63.567   5.372  -4.452
   80    HD2  PRO   9           HD2      PRO   9  63.129   2.721  -4.713
   81    HD3  PRO   9           HD1      PRO   9  61.971   3.895  -5.311
   82    H    ARG  10           HN       ARG  10  67.057   4.526  -7.086
   83    HA   ARG  10           HA       ARG  10  67.686   1.960  -5.879
   84    HB2  ARG  10           HB2      ARG  10  68.280   1.921  -8.320
   85    HB3  ARG  10           HB1      ARG  10  69.387   3.253  -8.001
   86    HG2  ARG  10           HG2      ARG  10  70.868   1.983  -6.963
   87    HG3  ARG  10           HG1      ARG  10  69.667   0.888  -6.273
   88    HD2  ARG  10           HD2      ARG  10  69.312  -0.024  -8.462
   89    HD3  ARG  10           HD1      ARG  10  70.641   0.950  -9.117
   90    HE   ARG  10           HE       ARG  10  71.895  -0.281  -7.155
   91   HH11  ARG  10          HH11      ARG  10  69.597  -1.678  -9.458
   92   HH12  ARG  10          HH12      ARG  10  70.232  -3.245  -9.378
   93   HH21  ARG  10          HH21      ARG  10  72.786  -2.484  -7.010
   94   HH22  ARG  10          HH22      ARG  10  72.070  -3.707  -7.933
   95    H    LYS  11           HN       LYS  11  67.357   5.086  -5.406
   96    HA   LYS  11           HA       LYS  11  69.799   5.280  -3.861
   97    HB2  LYS  11           HB2      LYS  11  68.007   7.565  -4.701
   98    HB3  LYS  11           HB1      LYS  11  69.502   7.630  -3.858
   99    HG2  LYS  11           HG2      LYS  11  70.089   8.311  -6.045
  100    HG3  LYS  11           HG1      LYS  11  70.652   6.657  -5.861
  101    HD2  LYS  11           HD2      LYS  11  68.718   5.841  -7.107
  102    HD3  LYS  11           HD1      LYS  11  68.145   7.498  -7.298
  103    HE2  LYS  11           HE2      LYS  11  70.261   8.041  -8.477
  104    HE3  LYS  11           HE1      LYS  11  70.720   6.345  -8.380
  105    HZ1  LYS  11           HZ1      LYS  11  68.376   7.454  -9.836
  106    HZ2  LYS  11           HZ2      LYS  11  68.679   5.829  -9.683
  107    HZ3  LYS  11           HZ3      LYS  11  69.754   6.803 -10.531
  108    H    LEU  12           HN       LEU  12  69.564   5.629  -1.763
  109    HA   LEU  12           HA       LEU  12  67.317   4.766  -0.424
  110    HB2  LEU  12           HB2      LEU  12  69.342   4.569   0.625
  111    HB3  LEU  12           HB1      LEU  12  69.724   6.279   0.481
  112    HG   LEU  12           HG       LEU  12  67.891   6.764   2.056
  113   HD11  LEU  12          HD11      LEU  12  66.946   4.990   3.366
  114   HD12  LEU  12          HD12      LEU  12  67.882   3.795   2.451
  115   HD13  LEU  12          HD13      LEU  12  66.586   4.704   1.646
  116   HD21  LEU  12          HD21      LEU  12  69.854   4.805   3.107
  117   HD22  LEU  12          HD22      LEU  12  69.061   6.098   4.021
  118   HD23  LEU  12          HD23      LEU  12  70.237   6.485   2.752
  119    HA   PRO  13           HA       PRO  13  66.216   9.240   0.919
  120    HB2  PRO  13           HB2      PRO  13  67.070  11.380  -0.535
  121    HB3  PRO  13           HB1      PRO  13  68.110  10.570   0.671
  122    HG2  PRO  13           HG2      PRO  13  68.083  10.115  -2.281
  123    HG3  PRO  13           HG1      PRO  13  69.450  10.547  -1.235
  124    HD2  PRO  13           HD2      PRO  13  68.962   7.999  -1.881
  125    HD3  PRO  13           HD1      PRO  13  69.537   8.419  -0.268
  126    H    GLN  14           HN       GLN  14  66.538   8.685  -2.480
  127    HA   GLN  14           HA       GLN  14  64.111   9.834  -3.327
  128    HB2  GLN  14           HB2      GLN  14  66.082   9.351  -4.722
  129    HB3  GLN  14           HB1      GLN  14  65.731   7.636  -4.582
  130    HG2  GLN  14           HG2      GLN  14  63.578   8.006  -5.681
  131    HG3  GLN  14           HG1      GLN  14  63.998   9.722  -5.784
  132   HE21  GLN  14          HE21      GLN  14  66.832   9.179  -6.384
  133   HE22  GLN  14          HE22      GLN  14  66.821   8.683  -8.025
  134    H    LEU  15           HN       LEU  15  64.999   6.561  -2.144
  135    HA   LEU  15           HA       LEU  15  62.543   5.357  -2.783
  136    HB2  LEU  15           HB2      LEU  15  64.612   4.128  -2.330
  137    HB3  LEU  15           HB1      LEU  15  64.652   4.758  -0.766
  138    HG   LEU  15           HG       LEU  15  62.600   3.665  -0.151
  139   HD11  LEU  15          HD11      LEU  15  62.877   2.320  -2.847
  140   HD12  LEU  15          HD12      LEU  15  61.605   3.473  -2.416
  141   HD13  LEU  15          HD13      LEU  15  61.691   1.911  -1.611
  142   HD21  LEU  15          HD21      LEU  15  63.583   1.456  -0.052
  143   HD22  LEU  15          HD22      LEU  15  64.758   2.784   0.227
  144   HD23  LEU  15          HD23      LEU  15  64.721   1.957  -1.319
  145    H    CYS  16           HN       CYS  16  63.836   6.960  -0.015
  146    HA   CYS  16           HA       CYS  16  61.739   6.498   1.776
  147    HB2  CYS  16           HB2      CYS  16  63.416   9.032   1.534
  148    HB3  CYS  16           HB1      CYS  16  62.503   8.553   2.935
  149    HG   CYS  16           HG       CYS  16  65.121   6.735   1.687
  150    H    THR  17           HN       THR  17  62.104   8.884  -0.739
  151    HA   THR  17           HA       THR  17  59.837  10.447  -0.483
  152    HB   THR  17           HB       THR  17  61.483   9.476  -2.733
  153    HG1  THR  17           HG1      THR  17  62.172  11.682  -2.749
  154   HG21  THR  17          HG21      THR  17  60.407  11.163  -4.237
  155   HG22  THR  17          HG22      THR  17  59.118  11.348  -3.026
  156   HG23  THR  17          HG23      THR  17  59.413   9.780  -3.807
  157    H    GLU  18           HN       GLU  18  60.280   7.334  -2.014
  158    HA   GLU  18           HA       GLU  18  57.746   7.027  -3.142
  159    HB2  GLU  18           HB2      GLU  18  59.992   5.350  -2.407
  160    HB3  GLU  18           HB1      GLU  18  58.532   4.587  -3.061
  161    HG2  GLU  18           HG2      GLU  18  60.091   6.845  -4.297
  162    HG3  GLU  18           HG1      GLU  18  60.304   5.180  -4.779
  163    H    LEU  19           HN       LEU  19  59.196   5.670  -0.182
  164    HA   LEU  19           HA       LEU  19  56.776   4.723   0.862
  165    HB2  LEU  19           HB2      LEU  19  59.418   5.387   1.998
  166    HB3  LEU  19           HB1      LEU  19  58.199   4.806   3.041
  167    HG   LEU  19           HG       LEU  19  58.217   2.785   1.168
  168   HD11  LEU  19          HD11      LEU  19  60.439   2.321   0.522
  169   HD12  LEU  19          HD12      LEU  19  60.999   3.815   1.271
  170   HD13  LEU  19          HD13      LEU  19  59.933   3.881  -0.131
  171   HD21  LEU  19          HD21      LEU  19  58.401   2.460   3.509
  172   HD22  LEU  19          HD22      LEU  19  59.977   3.245   3.490
  173   HD23  LEU  19          HD23      LEU  19  59.778   1.658   2.709
  174    H    GLN  20           HN       GLN  20  57.529   7.845   0.271
  175    HA   GLN  20           HA       GLN  20  56.609   9.820   0.851
  176    HB2  GLN  20           HB2      GLN  20  54.708   7.938   2.118
  177    HB3  GLN  20           HB1      GLN  20  54.344   9.678   2.016
  178    HG2  GLN  20           HG2      GLN  20  54.454   9.417  -0.468
  179    HG3  GLN  20           HG1      GLN  20  54.699   7.689  -0.242
  180   HE21  GLN  20          HE21      GLN  20  52.827   7.649   2.067
  181   HE22  GLN  20          HE22      GLN  20  51.256   7.760   1.367
  182    H    THR  21           HN       THR  21  58.667   8.810   2.467
  183    HA   THR  21           HA       THR  21  58.119  10.174   4.949
  184    HB   THR  21           HB       THR  21  57.469   7.750   5.233
  185    HG1  THR  21           HG1      THR  21  58.450   7.598   7.209
  186   HG21  THR  21          HG21      THR  21  59.155   6.726   3.789
  187   HG22  THR  21          HG22      THR  21  59.278   6.070   5.424
  188   HG23  THR  21          HG23      THR  21  60.434   7.279   4.869
  189    H    THR  22           HN       THR  22  60.479   9.541   6.258
  190    HA   THR  22           HA       THR  22  62.570  10.220   4.292
  191    HB   THR  22           HB       THR  22  62.996  11.043   7.108
  192    HG1  THR  22           HG1      THR  22  60.795  11.781   5.616
  193   HG21  THR  22          HG21      THR  22  64.653  11.553   5.401
  194   HG22  THR  22          HG22      THR  22  63.900  13.065   5.906
  195   HG23  THR  22          HG23      THR  22  63.423  12.295   4.391
  196    H    ILE  23           HN       ILE  23  64.862   9.774   5.476
  197    HA   ILE  23           HA       ILE  23  65.300   7.121   5.594
  198    HB   ILE  23           HB       ILE  23  66.882   9.217   6.988
  199   HG12  ILE  23          HG12      ILE  23  66.590   8.449   4.137
  200   HG13  ILE  23          HG11      ILE  23  66.524  10.009   4.868
  201   HG21  ILE  23          HG21      ILE  23  67.649   6.551   5.725
  202   HG22  ILE  23          HG22      ILE  23  67.621   6.895   7.459
  203   HG23  ILE  23          HG23      ILE  23  68.811   7.688   6.418
  204   HD11  ILE  23          HD11      ILE  23  68.976   9.921   5.265
  205   HD12  ILE  23          HD12      ILE  23  68.552   9.770   3.543
  206   HD13  ILE  23          HD13      ILE  23  68.959   8.331   4.483
  207    H    HIS  24           HN       HIS  24  64.241   9.239   7.986
  208    HA   HIS  24           HA       HIS  24  65.388   8.187  10.315
  209    HB2  HIS  24           HB2      HIS  24  63.064  10.088  10.139
  210    HB3  HIS  24           HB1      HIS  24  64.320  10.068  11.350
  211    HD1  HIS  24           HD1      HIS  24  66.597   9.921   9.038
  212    HD2  HIS  24           HD2      HIS  24  63.581  12.636   9.497
  213    HE1  HIS  24           HE1      HIS  24  67.091  11.667   7.322
  214    H    ASP  25           HN       ASP  25  62.767   7.396   8.377
  215    HA   ASP  25           HA       ASP  25  61.206   6.191  10.565
  216    HB2  ASP  25           HB2      ASP  25  60.252   8.336   9.708
  217    HB3  ASP  25           HB1      ASP  25  60.207   7.607   8.136
  218    H    ILE  26           HN       ILE  26  62.181   6.138   7.182
  219    HA   ILE  26           HA       ILE  26  60.781   3.984   6.165
  220    HB   ILE  26           HB       ILE  26  62.081   5.429   4.727
  221   HG12  ILE  26          HG12      ILE  26  63.358   2.733   4.665
  222   HG13  ILE  26          HG11      ILE  26  61.772   2.866   4.041
  223   HG21  ILE  26          HG21      ILE  26  64.514   4.216   6.018
  224   HG22  ILE  26          HG22      ILE  26  63.916   5.853   6.262
  225   HG23  ILE  26          HG23      ILE  26  64.515   5.362   4.669
  226   HD11  ILE  26          HD11      ILE  26  64.293   4.144   3.015
  227   HD12  ILE  26          HD12      ILE  26  62.692   4.523   2.360
  228   HD13  ILE  26          HD13      ILE  26  63.331   2.866   2.282
  229    H    ILE  27           HN       ILE  27  60.840   1.836   6.325
  230    HA   ILE  27           HA       ILE  27  63.113   0.709   7.675
  231    HB   ILE  27           HB       ILE  27  60.335  -0.359   7.219
  232   HG12  ILE  27          HG12      ILE  27  60.522   1.387   8.941
  233   HG13  ILE  27          HG11      ILE  27  60.036  -0.169   9.586
  234   HG21  ILE  27          HG21      ILE  27  61.933  -2.133   7.072
  235   HG22  ILE  27          HG22      ILE  27  61.021  -2.262   8.586
  236   HG23  ILE  27          HG23      ILE  27  62.672  -1.634   8.594
  237   HD11  ILE  27          HD11      ILE  27  62.349  -0.510  10.397
  238   HD12  ILE  27          HD12      ILE  27  61.607   0.935  11.075
  239   HD13  ILE  27          HD13      ILE  27  62.784   1.084   9.773
  240    H    LEU  28           HN       LEU  28  64.553  -0.067   6.727
  241    HA   LEU  28           HA       LEU  28  64.186  -1.058   4.013
  242    HB2  LEU  28           HB2      LEU  28  65.689   1.015   4.968
  243    HB3  LEU  28           HB1      LEU  28  66.837  -0.305   4.811
  244    HG   LEU  28           HG       LEU  28  66.298  -0.590   2.505
  245   HD11  LEU  28          HD11      LEU  28  64.030  -0.270   2.273
  246   HD12  LEU  28          HD12      LEU  28  64.582   1.339   1.732
  247   HD13  LEU  28          HD13      LEU  28  64.069   1.050   3.416
  248   HD21  LEU  28          HD21      LEU  28  66.467   2.339   3.124
  249   HD22  LEU  28          HD22      LEU  28  67.019   1.531   1.650
  250   HD23  LEU  28          HD23      LEU  28  67.848   1.261   3.184
  251    H    GLU  29           HN       GLU  29  65.221  -3.272   3.758
  252    HA   GLU  29           HA       GLU  29  66.702  -3.777   6.242
  253    HB2  GLU  29           HB2      GLU  29  66.390  -6.084   5.961
  254    HB3  GLU  29           HB1      GLU  29  64.964  -5.205   6.670
  255    HG2  GLU  29           HG2      GLU  29  64.047  -5.445   4.460
  256    HG3  GLU  29           HG1      GLU  29  65.510  -6.414   4.088
  257    H    CYS  30           HN       CYS  30  68.254  -5.868   6.135
  258    HA   CYS  30           HA       CYS  30  69.973  -5.533   4.121
  259    HB2  CYS  30           HB2      CYS  30  69.284  -7.973   5.701
  260    HB3  CYS  30           HB1      CYS  30  70.715  -7.728   4.716
  261    H    VAL  31           HN       VAL  31  70.052  -6.225   2.290
  262    HA   VAL  31           HA       VAL  31  68.108  -7.865   0.943
  263    HB   VAL  31           HB       VAL  31  69.148  -6.055  -0.327
  264   HG11  VAL  31          HG11      VAL  31  70.962  -5.496   0.895
  265   HG12  VAL  31          HG12      VAL  31  71.518  -6.105  -0.705
  266   HG13  VAL  31          HG13      VAL  31  71.656  -7.135   0.720
  267   HG21  VAL  31          HG21      VAL  31  68.918  -7.972  -1.718
  268   HG22  VAL  31          HG22      VAL  31  70.484  -8.588  -1.176
  269   HG23  VAL  31          HG23      VAL  31  70.392  -7.094  -2.117
  270    H    TYR  32           HN       TYR  32  70.944  -8.275   2.698
  271    HA   TYR  32           HA       TYR  32  71.285 -10.910   1.555
  272    HB2  TYR  32           HB2      TYR  32  73.477  -9.412   2.976
  273    HB3  TYR  32           HB1      TYR  32  73.653 -10.937   2.107
  274    HD1  TYR  32           HD2      TYR  32  72.215 -10.592  -0.411
  275    HD2  TYR  32           HD1      TYR  32  74.484  -7.725   1.816
  276    HE1  TYR  32           HE2      TYR  32  72.538  -9.399  -2.368
  277    HE2  TYR  32           HE1      TYR  32  74.803  -6.383  -0.207
  278    HH   TYR  32           HH       TYR  32  74.702  -6.575  -2.557
  279    H    CYS  33           HN       CYS  33  71.489  -9.326   4.806
  280    HA   CYS  33           HA       CYS  33  71.657 -11.877   6.214
  281    HB2  CYS  33           HB2      CYS  33  70.994  -9.193   7.412
  282    HB3  CYS  33           HB1      CYS  33  71.675 -10.588   8.239
  283    H    LYS  34           HN       LYS  34  69.337  -9.815   4.998
  284    HA   LYS  34           HA       LYS  34  67.221  -9.488   5.020
  285    HB2  LYS  34           HB2      LYS  34  67.010 -12.356   5.910
  286    HB3  LYS  34           HB1      LYS  34  65.784 -11.411   5.058
  287    HG2  LYS  34           HG2      LYS  34  68.476 -12.196   4.028
  288    HG3  LYS  34           HG1      LYS  34  66.939 -12.867   3.532
  289    HD2  LYS  34           HD2      LYS  34  67.722  -9.963   3.168
  290    HD3  LYS  34           HD1      LYS  34  67.982 -11.222   1.989
  291    HE2  LYS  34           HE2      LYS  34  66.067  -9.893   1.440
  292    HE3  LYS  34           HE1      LYS  34  65.597 -11.552   1.748
  293    HZ1  LYS  34           HZ1      LYS  34  64.051  -9.888   2.711
  294    HZ2  LYS  34           HZ2      LYS  34  65.221  -9.357   3.797
  295    HZ3  LYS  34           HZ3      LYS  34  64.665 -10.923   3.832
  296    H    GLN  35           HN       GLN  35  68.346  -8.433   7.298
  297    HA   GLN  35           HA       GLN  35  66.069  -8.556   8.964
  298    HB2  GLN  35           HB2      GLN  35  67.638  -7.878  10.658
  299    HB3  GLN  35           HB1      GLN  35  67.528  -9.603  10.300
  300    HG2  GLN  35           HG2      GLN  35  69.635  -8.971   8.836
  301    HG3  GLN  35           HG1      GLN  35  69.686  -7.557   9.905
  302   HE21  GLN  35          HE21      GLN  35  68.658 -10.835  10.620
  303   HE22  GLN  35          HE22      GLN  35  69.741 -11.092  11.872
  304    H    GLN  36           HN       GLN  36  65.660  -6.358   9.875
  305    HA   GLN  36           HA       GLN  36  66.111  -4.336   8.110
  306    HB2  GLN  36           HB2      GLN  36  65.097  -4.491  10.907
  307    HB3  GLN  36           HB1      GLN  36  65.012  -3.069   9.876
  308    HG2  GLN  36           HG2      GLN  36  63.652  -4.104   8.329
  309    HG3  GLN  36           HG1      GLN  36  64.007  -5.694   8.982
  310   HE21  GLN  36          HE21      GLN  36  63.530  -4.619  11.776
  311   HE22  GLN  36          HE22      GLN  36  61.814  -4.451  11.893
  312    H    LEU  37           HN       LEU  37  67.374  -2.737   8.110
  313    HA   LEU  37           HA       LEU  37  69.900  -2.814   9.463
  314    HB2  LEU  37           HB2      LEU  37  68.639  -0.966   7.493
  315    HB3  LEU  37           HB1      LEU  37  69.844  -0.392   8.576
  316    HG   LEU  37           HG       LEU  37  71.371  -2.184   7.815
  317   HD11  LEU  37          HD11      LEU  37  70.880  -3.238   5.643
  318   HD12  LEU  37          HD12      LEU  37  69.210  -2.668   5.800
  319   HD13  LEU  37          HD13      LEU  37  69.876  -3.789   6.977
  320   HD21  LEU  37          HD21      LEU  37  71.920  -1.064   5.690
  321   HD22  LEU  37          HD22      LEU  37  71.616   0.062   7.013
  322   HD23  LEU  37          HD23      LEU  37  70.385  -0.199   5.779
  323    H    LEU  38           HN       LEU  38  70.818  -1.608  10.846
  324    HA   LEU  38           HA       LEU  38  69.339  -0.514  12.977
  325    HB2  LEU  38           HB2      LEU  38  71.906  -1.366  12.271
  326    HB3  LEU  38           HB1      LEU  38  72.033   0.346  12.433
  327    HG   LEU  38           HG       LEU  38  71.023  -1.501  14.569
  328   HD11  LEU  38          HD11      LEU  38  73.210  -1.141  15.626
  329   HD12  LEU  38          HD12      LEU  38  73.694  -0.155  14.238
  330   HD13  LEU  38          HD13      LEU  38  73.351  -1.870  14.018
  331   HD21  LEU  38          HD21      LEU  38  70.146   0.759  14.784
  332   HD22  LEU  38          HD22      LEU  38  71.779   1.417  14.670
  333   HD23  LEU  38          HD23      LEU  38  71.321   0.428  16.055
  334    H    ARG  39           HN       ARG  39  68.630   1.713  12.969
  335    HA   ARG  39           HA       ARG  39  68.541   3.012  10.512
  336    HB2  ARG  39           HB2      ARG  39  66.933   3.445  12.337
  337    HB3  ARG  39           HB1      ARG  39  68.181   4.339  13.191
  338    HG2  ARG  39           HG2      ARG  39  68.293   5.968  11.418
  339    HG3  ARG  39           HG1      ARG  39  67.122   5.066  10.475
  340    HD2  ARG  39           HD2      ARG  39  66.032   6.919  11.630
  341    HD3  ARG  39           HD1      ARG  39  65.438   5.372  12.232
  342    HE   ARG  39           HE       ARG  39  67.546   6.138  13.840
  343   HH11  ARG  39          HH11      ARG  39  64.273   7.303  13.109
  344   HH12  ARG  39          HH12      ARG  39  64.090   8.063  14.628
  345   HH21  ARG  39          HH21      ARG  39  67.275   7.149  15.851
  346   HH22  ARG  39          HH22      ARG  39  65.835   7.985  16.227
  347    H    ARG  40           HN       ARG  40  70.923   3.341  13.063
  348    HA   ARG  40           HA       ARG  40  72.422   5.469  12.266
  349    HB2  ARG  40           HB2      ARG  40  73.207   2.744  13.247
  350    HB3  ARG  40           HB1      ARG  40  74.340   4.060  13.051
  351    HG2  ARG  40           HG2      ARG  40  73.030   5.376  14.673
  352    HG3  ARG  40           HG1      ARG  40  71.977   3.968  14.866
  353    HD2  ARG  40           HD2      ARG  40  73.771   2.645  15.726
  354    HD3  ARG  40           HD1      ARG  40  74.946   3.910  15.363
  355    HE   ARG  40           HE       ARG  40  72.851   4.736  17.114
  356   HH11  ARG  40          HH11      ARG  40  75.950   3.012  17.062
  357   HH12  ARG  40          HH12      ARG  40  76.455   3.571  18.586
  358   HH21  ARG  40          HH21      ARG  40  73.541   5.479  19.243
  359   HH22  ARG  40          HH22      ARG  40  75.041   4.992  19.876
  360    H    GLU  41           HN       GLU  41  72.582   2.133  11.128
  361    HA   GLU  41           HA       GLU  41  74.615   2.549   9.152
  362    HB2  GLU  41           HB2      GLU  41  72.621   0.321   9.471
  363    HB3  GLU  41           HB1      GLU  41  74.029   0.188   8.471
  364    HG2  GLU  41           HG2      GLU  41  73.803   0.203  11.461
  365    HG3  GLU  41           HG1      GLU  41  74.536  -0.964  10.383
  366    H    VAL  42           HN       VAL  42  71.151   2.587   9.177
  367    HA   VAL  42           HA       VAL  42  70.750   2.615   6.356
  368    HB   VAL  42           HB       VAL  42  68.915   4.116   8.276
  369   HG11  VAL  42          HG11      VAL  42  68.338   2.564   5.788
  370   HG12  VAL  42          HG12      VAL  42  68.561   4.323   5.800
  371   HG13  VAL  42          HG13      VAL  42  67.196   3.583   6.659
  372   HG21  VAL  42          HG21      VAL  42  68.780   1.204   7.570
  373   HG22  VAL  42          HG22      VAL  42  67.665   2.084   8.620
  374   HG23  VAL  42          HG23      VAL  42  69.344   1.824   9.114
  375    H    TYR  43           HN       TYR  43  71.342   5.267   8.694
  376    HA   TYR  43           HA       TYR  43  71.254   7.363   6.831
  377    HB2  TYR  43           HB2      TYR  43  72.837   7.061   9.352
  378    HB3  TYR  43           HB1      TYR  43  72.850   8.552   8.389
  379    HD1  TYR  43           HD1      TYR  43  70.182   9.033   7.706
  380    HD2  TYR  43           HD2      TYR  43  71.621   7.234  11.261
  381    HE1  TYR  43           HE1      TYR  43  68.140   9.664   8.824
  382    HE2  TYR  43           HE2      TYR  43  69.566   7.859  12.423
  383    HH   TYR  43           HH       TYR  43  67.738   9.543  12.196
  384    H    ASP  44           HN       ASP  44  73.891   5.151   7.682
  385    HA   ASP  44           HA       ASP  44  76.004   6.378   6.424
  386    HB2  ASP  44           HB2      ASP  44  75.346   3.482   6.790
  387    HB3  ASP  44           HB1      ASP  44  76.768   4.054   6.047
  388    H    PHE  45           HN       PHE  45  73.428   4.562   5.227
  389    HA   PHE  45           HA       PHE  45  74.504   3.690   2.841
  390    HB2  PHE  45           HB2      PHE  45  72.240   3.291   4.180
  391    HB3  PHE  45           HB1      PHE  45  71.721   4.487   3.011
  392    HD1  PHE  45           HD2      PHE  45  73.548   1.291   3.251
  393    HD2  PHE  45           HD1      PHE  45  71.127   3.938   0.998
  394    HE1  PHE  45           HE2      PHE  45  73.228  -0.420   1.488
  395    HE2  PHE  45           HE1      PHE  45  70.852   2.259  -0.724
  396    HZ   PHE  45           HZ       PHE  45  71.846   0.104  -0.493
  397    H    ALA  46           HN       ALA  46  72.528   6.618   3.484
  398    HA   ALA  46           HA       ALA  46  73.029   7.635   0.800
  399    HB1  ALA  46           HB1      ALA  46  71.695   9.616   1.535
  400    HB2  ALA  46           HB2      ALA  46  71.604   8.922   3.149
  401    HB3  ALA  46           HB3      ALA  46  70.828   8.117   1.789
  402    H    ARG  47           HN       ARG  47  74.486   7.731   3.827
  403    HA   ARG  47           HA       ARG  47  75.952  10.193   3.414
  404    HB2  ARG  47           HB2      ARG  47  75.408   8.347   5.557
  405    HB3  ARG  47           HB1      ARG  47  77.049   8.903   5.657
  406    HG2  ARG  47           HG2      ARG  47  75.678  10.274   7.044
  407    HG3  ARG  47           HG1      ARG  47  76.179  11.247   5.671
  408    HD2  ARG  47           HD2      ARG  47  73.500   9.863   5.845
  409    HD3  ARG  47           HD1      ARG  47  73.793  11.491   6.439
  410    HE   ARG  47           HE       ARG  47  74.567  11.229   3.702
  411   HH11  ARG  47          HH11      ARG  47  71.740  11.659   5.781
  412   HH12  ARG  47          HH12      ARG  47  70.800  12.412   4.581
  413   HH21  ARG  47          HH21      ARG  47  73.281  12.268   2.067
  414   HH22  ARG  47          HH22      ARG  47  71.700  12.790   2.447
  415    H    ARG  48           HN       ARG  48  76.265   7.062   2.387
  416    HA   ARG  48           HA       ARG  48  79.087   7.442   1.754
  417    HB2  ARG  48           HB2      ARG  48  77.427   5.025   2.260
  418    HB3  ARG  48           HB1      ARG  48  79.019   4.911   1.546
  419    HG2  ARG  48           HG2      ARG  48  80.027   5.749   3.552
  420    HG3  ARG  48           HG1      ARG  48  78.430   6.068   4.255
  421    HD2  ARG  48           HD2      ARG  48  77.865   3.789   4.147
  422    HD3  ARG  48           HD1      ARG  48  79.329   3.440   3.268
  423    HE   ARG  48           HE       ARG  48  80.342   4.458   5.510
  424   HH11  ARG  48          HH11      ARG  48  77.708   2.076   5.292
  425   HH12  ARG  48          HH12      ARG  48  78.224   1.220   6.684
  426   HH21  ARG  48          HH21      ARG  48  80.961   3.233   7.424
  427   HH22  ARG  48          HH22      ARG  48  80.050   1.864   7.882
  428    H    ASP  49           HN       ASP  49  79.029   5.318  -0.175
  429    HA   ASP  49           HA       ASP  49  77.551   6.794  -2.208
  430    HB2  ASP  49           HB2      ASP  49  79.086   5.907  -3.879
  431    HB3  ASP  49           HB1      ASP  49  79.991   6.643  -2.565
  432    H    LEU  50           HN       LEU  50  77.153   4.099  -0.463
  433    HA   LEU  50           HA       LEU  50  76.639   2.025  -2.234
  434    HB2  LEU  50           HB2      LEU  50  75.404   2.601   0.426
  435    HB3  LEU  50           HB1      LEU  50  75.147   1.143  -0.468
  436    HG   LEU  50           HG       LEU  50  77.538   0.567  -0.282
  437   HD11  LEU  50          HD11      LEU  50  78.979   1.712   1.302
  438   HD12  LEU  50          HD12      LEU  50  77.740   2.944   1.544
  439   HD13  LEU  50          HD13      LEU  50  78.519   2.775  -0.031
  440   HD21  LEU  50          HD21      LEU  50  76.139   1.125   2.301
  441   HD22  LEU  50          HD22      LEU  50  77.477  -0.005   2.079
  442   HD23  LEU  50          HD23      LEU  50  75.929  -0.303   1.283
  443    H    CYS  51           HN       CYS  51  74.837   1.235  -3.114
  444    HA   CYS  51           HA       CYS  51  72.602   3.095  -3.412
  445    HB2  CYS  51           HB2      CYS  51  72.288   2.177  -5.655
  446    HB3  CYS  51           HB1      CYS  51  73.894   2.873  -5.491
  447    HG   CYS  51           HG       CYS  51  75.037   0.831  -6.501
  448    H    ILE  52           HN       ILE  52  70.561   1.906  -3.939
  449    HA   ILE  52           HA       ILE  52  70.321  -0.186  -1.988
  450    HB   ILE  52           HB       ILE  52  68.299   1.397  -3.529
  451   HG12  ILE  52          HG12      ILE  52  69.178   0.997  -0.737
  452   HG13  ILE  52          HG11      ILE  52  69.272   2.483  -1.732
  453   HG21  ILE  52          HG21      ILE  52  67.381  -0.906  -3.433
  454   HG22  ILE  52          HG22      ILE  52  66.497   0.184  -2.365
  455   HG23  ILE  52          HG23      ILE  52  67.674  -0.943  -1.692
  456   HD11  ILE  52          HD11      ILE  52  67.035   1.081  -0.543
  457   HD12  ILE  52          HD12      ILE  52  66.857   2.494  -1.640
  458   HD13  ILE  52          HD13      ILE  52  67.694   2.646  -0.042
  459    H    VAL  53           HN       VAL  53  69.726  -2.041  -2.149
  460    HA   VAL  53           HA       VAL  53  70.018  -3.363  -4.702
  461    HB   VAL  53           HB       VAL  53  70.919  -5.228  -3.079
  462   HG11  VAL  53          HG11      VAL  53  72.249  -4.041  -4.824
  463   HG12  VAL  53          HG12      VAL  53  73.189  -4.311  -3.353
  464   HG13  VAL  53          HG13      VAL  53  72.513  -2.719  -3.688
  465   HG21  VAL  53          HG21      VAL  53  72.084  -4.240  -1.153
  466   HG22  VAL  53          HG22      VAL  53  70.340  -4.034  -1.007
  467   HG23  VAL  53          HG23      VAL  53  71.359  -2.688  -1.504
  468    H    TYR  54           HN       TYR  54  68.334  -4.343  -5.207
  469    HA   TYR  54           HA       TYR  54  66.248  -4.982  -3.316
  470    HB2  TYR  54           HB2      TYR  54  66.365  -5.019  -6.324
  471    HB3  TYR  54           HB1      TYR  54  64.934  -5.362  -5.349
  472    HD1  TYR  54           HD2      TYR  54  67.360  -2.696  -6.240
  473    HD2  TYR  54           HD1      TYR  54  63.654  -3.652  -4.407
  474    HE1  TYR  54           HE2      TYR  54  66.807  -0.277  -6.043
  475    HE2  TYR  54           HE1      TYR  54  63.115  -1.313  -4.266
  476    HH   TYR  54           HH       TYR  54  64.969   1.091  -5.782
  477    H    ARG  55           HN       ARG  55  66.249  -6.720  -2.522
  478    HA   ARG  55           HA       ARG  55  67.769  -8.910  -3.720
  479    HB2  ARG  55           HB2      ARG  55  67.193  -8.513  -1.015
  480    HB3  ARG  55           HB1      ARG  55  66.028  -9.736  -1.459
  481    HG2  ARG  55           HG2      ARG  55  69.036 -10.080  -1.827
  482    HG3  ARG  55           HG1      ARG  55  68.181 -10.606  -0.453
  483    HD2  ARG  55           HD2      ARG  55  67.691 -11.449  -3.311
  484    HD3  ARG  55           HD1      ARG  55  68.526 -12.418  -2.100
  485    HE   ARG  55           HE       ARG  55  66.016 -12.015  -1.070
  486   HH11  ARG  55          HH11      ARG  55  67.202 -13.221  -4.194
  487   HH12  ARG  55          HH12      ARG  55  65.959 -14.362  -4.374
  488   HH21  ARG  55          HH21      ARG  55  64.237 -13.619  -1.379
  489   HH22  ARG  55          HH22      ARG  55  64.277 -14.570  -2.780
  490    H    ASP  56           HN       ASP  56  66.580 -10.282  -5.163
  491    HA   ASP  56           HA       ASP  56  64.930 -10.973  -6.507
  492    HB2  ASP  56           HB2      ASP  56  63.854 -12.082  -4.586
  493    HB3  ASP  56           HB1      ASP  56  63.137 -10.557  -4.078
  494    H    GLY  57           HN       GLY  57  63.108  -8.596  -4.652
  495    HA2  GLY  57           HA2      GLY  57  63.460  -6.524  -6.503
  496    HA3  GLY  57           HA1      GLY  57  61.904  -7.319  -6.800
  497    H    ASN  58           HN       ASN  58  63.545  -6.780  -3.721
  498    HA   ASN  58           HA       ASN  58  61.377  -4.904  -2.928
  499    HB2  ASN  58           HB2      ASN  58  62.735  -6.872  -1.122
  500    HB3  ASN  58           HB1      ASN  58  61.232  -6.064  -0.798
  501   HD21  ASN  58          HD21      ASN  58  62.848  -8.689  -2.306
  502   HD22  ASN  58          HD22      ASN  58  61.487  -9.671  -2.631
  503    HA   PRO  59           HA       PRO  59  64.960  -2.753  -2.044
  504    HB2  PRO  59           HB2      PRO  59  63.626  -0.746  -0.462
  505    HB3  PRO  59           HB1      PRO  59  64.104  -0.654  -2.157
  506    HG2  PRO  59           HG2      PRO  59  61.423  -0.761  -1.404
  507    HG3  PRO  59           HG1      PRO  59  61.987  -1.334  -2.903
  508    HD2  PRO  59           HD2      PRO  59  61.429  -2.906  -0.470
  509    HD3  PRO  59           HD1      PRO  59  61.049  -3.251  -2.161
  510    H    TYR  60           HN       TYR  60  66.603  -2.989  -0.967
  511    HA   TYR  60           HA       TYR  60  66.357  -2.975   1.832
  512    HB2  TYR  60           HB2      TYR  60  68.090  -5.167   0.718
  513    HB3  TYR  60           HB1      TYR  60  67.472  -4.855   2.183
  514    HD1  TYR  60           HD1      TYR  60  65.161  -5.156   2.774
  515    HD2  TYR  60           HD2      TYR  60  66.756  -6.411  -0.841
  516    HE1  TYR  60           HE1      TYR  60  63.267  -6.771   2.519
  517    HE2  TYR  60           HE2      TYR  60  64.914  -8.038  -1.129
  518    HH   TYR  60           HH       TYR  60  63.325  -9.274   0.263
  519    H    ALA  61           HN       ALA  61  68.202  -2.722   2.710
  520    HA   ALA  61           HA       ALA  61  69.979  -0.916   1.348
  521    HB1  ALA  61           HB1      ALA  61  69.638  -1.633   4.149
  522    HB2  ALA  61           HB2      ALA  61  68.541  -0.527   3.376
  523    HB3  ALA  61           HB3      ALA  61  70.300  -0.104   3.520
  524    H    VAL  62           HN       VAL  62  72.145  -1.203   2.666
  525    HA   VAL  62           HA       VAL  62  72.873  -4.025   2.933
  526    HB   VAL  62           HB       VAL  62  74.451  -1.719   1.646
  527   HG11  VAL  62          HG11      VAL  62  75.523  -4.399   2.196
  528   HG12  VAL  62          HG12      VAL  62  75.866  -2.869   3.020
  529   HG13  VAL  62          HG13      VAL  62  76.272  -3.050   1.316
  530   HG21  VAL  62          HG21      VAL  62  72.923  -2.605   0.115
  531   HG22  VAL  62          HG22      VAL  62  73.418  -4.254   0.531
  532   HG23  VAL  62          HG23      VAL  62  74.549  -3.170  -0.302
  533    H    CYS  63           HN       CYS  63  72.895  -4.230   5.060
  534    HA   CYS  63           HA       CYS  63  73.621  -2.106   6.776
  535    HB2  CYS  63           HB2      CYS  63  73.387  -3.629   8.534
  536    HB3  CYS  63           HB1      CYS  63  72.375  -4.239   7.207
  537    H    ASP  64           HN       ASP  64  75.322  -2.841   8.505
  538    HA   ASP  64           HA       ASP  64  77.944  -2.321   7.587
  539    HB2  ASP  64           HB2      ASP  64  77.147  -1.931   9.893
  540    HB3  ASP  64           HB1      ASP  64  76.990  -3.655  10.098
  541    H    LYS  65           HN       LYS  65  76.250  -5.246   8.359
  542    HA   LYS  65           HA       LYS  65  78.549  -6.898   8.032
  543    HB2  LYS  65           HB2      LYS  65  75.681  -7.562   8.515
  544    HB3  LYS  65           HB1      LYS  65  76.985  -8.752   8.397
  545    HG2  LYS  65           HG2      LYS  65  76.646  -6.532  10.383
  546    HG3  LYS  65           HG1      LYS  65  76.482  -8.281  10.593
  547    HD2  LYS  65           HD2      LYS  65  78.822  -8.623  10.213
  548    HD3  LYS  65           HD1      LYS  65  79.052  -6.907   9.856
  549    HE2  LYS  65           HE2      LYS  65  77.955  -7.959  12.372
  550    HE3  LYS  65           HE1      LYS  65  79.688  -7.596  12.161
  551    HZ1  LYS  65           HZ1      LYS  65  77.364  -5.715  12.115
  552    HZ2  LYS  65           HZ2      LYS  65  78.890  -5.267  11.582
  553    HZ3  LYS  65           HZ3      LYS  65  78.663  -5.707  13.196
  554    H    CYS  66           HN       CYS  66  75.727  -6.020   6.164
  555    HA   CYS  66           HA       CYS  66  76.133  -7.873   4.044
  556    HB2  CYS  66           HB2      CYS  66  74.744  -5.186   4.184
  557    HB3  CYS  66           HB1      CYS  66  74.852  -6.086   2.693
  558    H    LEU  67           HN       LEU  67  77.375  -4.688   4.818
  559    HA   LEU  67           HA       LEU  67  78.799  -4.124   2.495
  560    HB2  LEU  67           HB2      LEU  67  78.708  -3.167   5.181
  561    HB3  LEU  67           HB1      LEU  67  80.306  -2.998   4.486
  562    HG   LEU  67           HG       LEU  67  77.783  -2.026   3.159
  563   HD11  LEU  67          HD11      LEU  67  79.870  -0.602   4.715
  564   HD12  LEU  67          HD12      LEU  67  78.200  -0.954   5.224
  565   HD13  LEU  67          HD13      LEU  67  78.496   0.146   3.866
  566   HD21  LEU  67          HD21      LEU  67  79.363  -0.760   1.757
  567   HD22  LEU  67          HD22      LEU  67  79.604  -2.493   1.595
  568   HD23  LEU  67          HD23      LEU  67  80.707  -1.542   2.585
  569    H    LYS  68           HN       LYS  68  79.515  -6.160   5.159
  570    HA   LYS  68           HA       LYS  68  82.240  -6.644   4.518
  571    HB2  LYS  68           HB2      LYS  68  81.804  -7.111   6.759
  572    HB3  LYS  68           HB1      LYS  68  80.217  -7.749   6.420
  573    HG2  LYS  68           HG2      LYS  68  82.696  -9.306   5.729
  574    HG3  LYS  68           HG1      LYS  68  82.018  -9.319   7.361
  575    HD2  LYS  68           HD2      LYS  68  79.848 -10.061   6.414
  576    HD3  LYS  68           HD1      LYS  68  80.587 -10.113   4.825
  577    HE2  LYS  68           HE2      LYS  68  80.440 -12.312   5.803
  578    HE3  LYS  68           HE1      LYS  68  82.134 -11.837   5.590
  579    HZ1  LYS  68           HZ1      LYS  68  80.590 -11.714   8.112
  580    HZ2  LYS  68           HZ2      LYS  68  82.234 -11.368   7.974
  581    HZ3  LYS  68           HZ3      LYS  68  81.652 -12.935   7.708
  582    H    PHE  69           HN       PHE  69  79.169  -7.992   3.535
  583    HA   PHE  69           HA       PHE  69  80.030 -10.323   2.282
  584    HB2  PHE  69           HB2      PHE  69  77.784  -8.504   2.241
  585    HB3  PHE  69           HB1      PHE  69  77.855  -9.666   0.951
  586    HD1  PHE  69           HD2      PHE  69  78.069  -9.382   4.610
  587    HD2  PHE  69           HD1      PHE  69  76.788 -11.621   1.278
  588    HE1  PHE  69           HE2      PHE  69  76.938 -10.902   6.104
  589    HE2  PHE  69           HE1      PHE  69  75.639 -13.149   2.697
  590    HZ   PHE  69           HZ       PHE  69  75.703 -12.775   5.219
  591    H    TYR  70           HN       TYR  70  79.065  -7.084   1.087
  592    HA   TYR  70           HA       TYR  70  80.571  -7.558  -1.330
  593    HB2  TYR  70           HB2      TYR  70  77.781  -6.474  -1.047
  594    HB3  TYR  70           HB1      TYR  70  78.720  -6.457  -2.535
  595    HD1  TYR  70           HD2      TYR  70  79.364  -8.642  -3.571
  596    HD2  TYR  70           HD1      TYR  70  76.666  -8.421  -0.317
  597    HE1  TYR  70           HE2      TYR  70  78.656 -10.921  -4.028
  598    HE2  TYR  70           HE1      TYR  70  75.943 -10.716  -0.720
  599    HH   TYR  70           HH       TYR  70  77.581 -12.810  -2.857
  600    H    SER  71           HN       SER  71  82.171  -6.092  -0.885
  601    HA   SER  71           HA       SER  71  81.499  -3.485   0.211
  602    HB2  SER  71           HB2      SER  71  84.186  -4.632  -0.522
  603    HB3  SER  71           HB1      SER  71  83.878  -3.231   0.511
  604    HG   SER  71           HG       SER  71  82.530  -4.950   1.720
  605    H    LYS  72           HN       LYS  72  82.764  -4.970  -2.710
  606    HA   LYS  72           HA       LYS  72  83.039  -2.399  -4.041
  607    HB2  LYS  72           HB2      LYS  72  84.811  -4.096  -4.348
  608    HB3  LYS  72           HB1      LYS  72  83.627  -5.188  -5.025
  609    HG2  LYS  72           HG2      LYS  72  84.945  -4.150  -6.795
  610    HG3  LYS  72           HG1      LYS  72  83.249  -3.691  -6.902
  611    HD2  LYS  72           HD2      LYS  72  83.738  -1.546  -5.838
  612    HD3  LYS  72           HD1      LYS  72  85.436  -1.996  -5.682
  613    HE2  LYS  72           HE2      LYS  72  83.928  -1.709  -8.282
  614    HE3  LYS  72           HE1      LYS  72  85.012  -0.501  -7.599
  615    HZ1  LYS  72           HZ1      LYS  72  86.123  -1.811  -9.266
  616    HZ2  LYS  72           HZ2      LYS  72  85.778  -3.242  -8.451
  617    HZ3  LYS  72           HZ3      LYS  72  86.819  -2.106  -7.756
  618    H    ILE  73           HN       ILE  73  81.320  -5.432  -4.349
  619    HA   ILE  73           HA       ILE  73  79.881  -4.685  -6.690
  620    HB   ILE  73           HB       ILE  73  79.236  -6.834  -4.700
  621   HG12  ILE  73          HG12      ILE  73  80.887  -6.997  -7.244
  622   HG13  ILE  73          HG11      ILE  73  81.525  -7.103  -5.612
  623   HG21  ILE  73          HG21      ILE  73  78.027  -7.906  -6.578
  624   HG22  ILE  73          HG22      ILE  73  78.380  -6.499  -7.581
  625   HG23  ILE  73          HG23      ILE  73  77.357  -6.330  -6.156
  626   HD11  ILE  73          HD11      ILE  73  79.651  -9.079  -6.898
  627   HD12  ILE  73          HD12      ILE  73  80.350  -9.219  -5.283
  628   HD13  ILE  73          HD13      ILE  73  81.388  -9.281  -6.706
  629    H    SER  74           HN       SER  74  78.398  -3.141  -6.637
  630    HA   SER  74           HA       SER  74  76.565  -3.243  -4.426
  631    HB2  SER  74           HB2      SER  74  76.075  -0.781  -5.065
  632    HB3  SER  74           HB1      SER  74  77.640  -1.129  -4.324
  633    HG   SER  74           HG       SER  74  77.920   0.179  -6.126
  634    H    GLU  75           HN       GLU  75  76.946  -3.899  -7.622
  635    HA   GLU  75           HA       GLU  75  74.070  -4.147  -8.070
  636    HB2  GLU  75           HB2      GLU  75  75.324  -2.260  -9.417
  637    HB3  GLU  75           HB1      GLU  75  76.078  -3.585 -10.273
  638    HG2  GLU  75           HG2      GLU  75  73.124  -2.971 -10.196
  639    HG3  GLU  75           HG1      GLU  75  74.217  -2.622 -11.520
  640    H    TYR  76           HN       TYR  76  74.015  -6.292  -7.660
  641    HA   TYR  76           HA       TYR  76  76.331  -7.899  -8.178
  642    HB2  TYR  76           HB2      TYR  76  74.886  -8.122  -6.147
  643    HB3  TYR  76           HB1      TYR  76  73.648  -8.849  -7.167
  644    HD1  TYR  76           HD1      TYR  76  77.075  -9.672  -8.058
  645    HD2  TYR  76           HD2      TYR  76  73.819 -10.774  -5.545
  646    HE1  TYR  76           HE1      TYR  76  78.133 -11.814  -7.659
  647    HE2  TYR  76           HE2      TYR  76  74.878 -12.954  -5.148
  648    HH   TYR  76           HH       TYR  76  76.442 -14.391  -6.168
  649    H    ARG  77           HN       ARG  77  76.747  -8.538 -10.118
  650    HA   ARG  77           HA       ARG  77  74.541  -9.072 -11.870
  651    HB2  ARG  77           HB2      ARG  77  75.860  -7.048 -12.440
  652    HB3  ARG  77           HB1      ARG  77  77.304  -8.038 -12.527
  653    HG2  ARG  77           HG2      ARG  77  76.409  -7.508 -14.727
  654    HG3  ARG  77           HG1      ARG  77  76.413  -9.243 -14.383
  655    HD2  ARG  77           HD2      ARG  77  74.311  -8.441 -15.493
  656    HD3  ARG  77           HD1      ARG  77  74.060  -9.244 -13.954
  657    HE   ARG  77           HE       ARG  77  74.193  -6.640 -13.245
  658   HH11  ARG  77          HH11      ARG  77  72.272  -8.268 -15.768
  659   HH12  ARG  77          HH12      ARG  77  70.942  -7.234 -15.578
  660   HH21  ARG  77          HH21      ARG  77  72.381  -5.360 -12.943
  661   HH22  ARG  77          HH22      ARG  77  70.967  -5.533 -13.901
  662    H    HIS  78           HN       HIS  78  74.631 -11.060 -10.869
  663    HA   HIS  78           HA       HIS  78  76.906 -12.654 -11.544
  664    HB2  HIS  78           HB2      HIS  78  75.900 -14.415 -10.018
  665    HB3  HIS  78           HB1      HIS  78  76.129 -12.831  -9.277
  666    HD1  HIS  78           HD1      HIS  78  73.656 -15.500  -9.724
  667    HD2  HIS  78           HD2      HIS  78  73.784 -11.460  -9.046
  668    HE1  HIS  78           HE1      HIS  78  71.351 -14.923  -8.895
  669    H    TYR  79           HN       TYR  79  73.517 -13.769 -11.580
  670    HA   TYR  79           HA       TYR  79  72.160 -14.525 -13.177
  671    HB2  TYR  79           HB2      TYR  79  73.725 -12.514 -14.803
  672    HB3  TYR  79           HB1      TYR  79  72.269 -13.316 -15.395
  673    HD1  TYR  79           HD1      TYR  79  73.540 -11.032 -12.694
  674    HD2  TYR  79           HD2      TYR  79  70.138 -12.570 -14.770
  675    HE1  TYR  79           HE1      TYR  79  72.128  -9.398 -11.592
  676    HE2  TYR  79           HE2      TYR  79  68.718 -10.924 -13.654
  677    HH   TYR  79           HH       TYR  79  70.017  -8.298 -11.847
  678    H    SER  80           HN       SER  80  72.633 -15.010 -16.002
  679    HA   SER  80           HA       SER  80  74.760 -16.983 -15.886
  680    HB2  SER  80           HB2      SER  80  71.990 -17.387 -17.052
  681    HB3  SER  80           HB1      SER  80  73.308 -18.562 -17.097
  682    HG   SER  80           HG       SER  80  72.845 -17.601 -14.613
  Start of MODEL   13
    1    H1   GLY  -1           HT1      GLY  -1  52.949  -6.493   2.031
    2    H2   GLY  -1           HT2      GLY  -1  52.808  -5.299   3.209
    3    H3   GLY  -1           HT3      GLY  -1  52.275  -6.890   3.528
    4    HA2  GLY  -1           HA1      GLY  -1  54.384  -6.408   4.596
    5    HA3  GLY  -1           HA2      GLY  -1  54.516  -7.686   3.385
    6    H    ALA   0           HN       ALA   0  56.840  -6.723   3.777
    7    HA   ALA   0           HA       ALA   0  57.314  -4.303   2.318
    8    HB1  ALA   0           HB1      ALA   0  59.679  -4.665   2.796
    9    HB2  ALA   0           HB2      ALA   0  59.313  -6.281   3.403
   10    HB3  ALA   0           HB3      ALA   0  58.712  -4.861   4.259
   11    H    MET   1           HN       MET   1  56.284  -5.012   0.480
   12    HA   MET   1           HA       MET   1  58.073  -6.279  -1.457
   13    HB2  MET   1           HB2      MET   1  56.112  -7.748  -0.532
   14    HB3  MET   1           HB1      MET   1  55.070  -6.668  -1.426
   15    HG2  MET   1           HG2      MET   1  57.242  -8.342  -2.683
   16    HG3  MET   1           HG1      MET   1  55.596  -8.898  -2.483
   17    HE1  MET   1           HE1      MET   1  58.152  -6.942  -4.530
   18    HE2  MET   1           HE2      MET   1  57.290  -5.474  -3.981
   19    HE3  MET   1           HE3      MET   1  57.188  -5.982  -5.653
   20    H    PHE   2           HN       PHE   2  58.578  -4.411  -2.498
   21    HA   PHE   2           HA       PHE   2  56.707  -2.346  -2.403
   22    HB2  PHE   2           HB2      PHE   2  59.270  -2.198  -2.013
   23    HB3  PHE   2           HB1      PHE   2  59.353  -2.170  -3.754
   24    HD1  PHE   2           HD1      PHE   2  56.709  -0.544  -1.808
   25    HD2  PHE   2           HD2      PHE   2  60.284  -0.109  -3.968
   26    HE1  PHE   2           HE1      PHE   2  56.385   1.898  -1.796
   27    HE2  PHE   2           HE2      PHE   2  60.047   2.286  -4.004
   28    HZ   PHE   2           HZ       PHE   2  58.042   3.347  -2.889
   29    H    GLN   3           HN       GLN   3  55.554  -1.517  -3.888
   30    HA   GLN   3           HA       GLN   3  54.572  -3.133  -5.846
   31    HB2  GLN   3           HB2      GLN   3  53.209  -1.139  -6.537
   32    HB3  GLN   3           HB1      GLN   3  53.108  -1.637  -4.863
   33    HG2  GLN   3           HG2      GLN   3  53.192   0.768  -4.970
   34    HG3  GLN   3           HG1      GLN   3  54.674   0.165  -4.247
   35   HE21  GLN   3          HE21      GLN   3  53.898   0.095  -7.632
   36   HE22  GLN   3          HE22      GLN   3  55.178   1.060  -8.155
   37    H    ASP   4           HN       ASP   4  53.930  -2.625  -8.040
   38    HA   ASP   4           HA       ASP   4  56.315  -2.772  -9.630
   39    HB2  ASP   4           HB2      ASP   4  54.817  -3.803 -11.277
   40    HB3  ASP   4           HB1      ASP   4  54.493  -4.483  -9.695
   41    HA   PRO   5           HA       PRO   5  56.282  -2.995 -12.111
   42    HB2  PRO   5           HB2      PRO   5  57.940  -1.263 -13.758
   43    HB3  PRO   5           HB1      PRO   5  56.649  -2.352 -14.274
   44    HG2  PRO   5           HG2      PRO   5  56.435   0.355 -14.433
   45    HG3  PRO   5           HG1      PRO   5  55.046  -0.718 -14.180
   46    HD2  PRO   5           HD2      PRO   5  56.593   0.872 -12.167
   47    HD3  PRO   5           HD1      PRO   5  54.835   0.698 -12.331
   48    H    GLN   6           HN       GLN   6  58.537  -0.289 -12.195
   49    HA   GLN   6           HA       GLN   6  59.919  -1.491  -9.975
   50    HB2  GLN   6           HB2      GLN   6  61.327  -0.610 -12.517
   51    HB3  GLN   6           HB1      GLN   6  62.136  -0.977 -11.006
   52    HG2  GLN   6           HG2      GLN   6  61.276  -3.290 -11.146
   53    HG3  GLN   6           HG1      GLN   6  60.561  -2.901 -12.706
   54   HE21  GLN   6          HE21      GLN   6  63.693  -1.679 -11.660
   55   HE22  GLN   6          HE22      GLN   6  64.606  -2.613 -12.782
   56    H    GLU   7           HN       GLU   7  58.406   0.289  -9.214
   57    HA   GLU   7           HA       GLU   7  59.263   2.929  -9.622
   58    HB2  GLU   7           HB2      GLU   7  57.288   1.508  -7.927
   59    HB3  GLU   7           HB1      GLU   7  57.586   3.229  -7.787
   60    HG2  GLU   7           HG2      GLU   7  56.576   1.728 -10.190
   61    HG3  GLU   7           HG1      GLU   7  55.747   2.938  -9.206
   62    H    ARG   8           HN       ARG   8  61.169   1.047  -8.600
   63    HA   ARG   8           HA       ARG   8  61.644   2.068  -5.921
   64    HB2  ARG   8           HB2      ARG   8  62.872  -0.392  -7.143
   65    HB3  ARG   8           HB1      ARG   8  62.918   0.122  -5.474
   66    HG2  ARG   8           HG2      ARG   8  61.311  -1.347  -5.102
   67    HG3  ARG   8           HG1      ARG   8  60.244  -0.236  -5.965
   68    HD2  ARG   8           HD2      ARG   8  60.833  -1.257  -8.120
   69    HD3  ARG   8           HD1      ARG   8  61.871  -2.406  -7.288
   70    HE   ARG   8           HE       ARG   8  59.108  -2.470  -6.458
   71   HH11  ARG   8          HH11      ARG   8  61.545  -3.854  -8.684
   72   HH12  ARG   8          HH12      ARG   8  60.580  -5.209  -9.046
   73   HH21  ARG   8          HH21      ARG   8  57.864  -4.319  -6.979
   74   HH22  ARG   8          HH22      ARG   8  58.413  -5.473  -8.096
   75    HA   PRO   9           HA       PRO   9  65.008   4.059  -8.184
   76    HB2  PRO   9           HB2      PRO   9  66.150   5.134  -6.047
   77    HB3  PRO   9           HB1      PRO   9  64.724   5.875  -6.672
   78    HG2  PRO   9           HG2      PRO   9  65.153   4.066  -4.390
   79    HG3  PRO   9           HG1      PRO   9  64.010   5.423  -4.540
   80    HD2  PRO   9           HD2      PRO   9  63.386   2.821  -4.646
   81    HD3  PRO   9           HD1      PRO   9  62.398   4.036  -5.471
   82    H    ARG  10           HN       ARG  10  67.442   4.511  -7.244
   83    HA   ARG  10           HA       ARG  10  68.391   2.047  -6.029
   84    HB2  ARG  10           HB2      ARG  10  69.630   3.823  -8.077
   85    HB3  ARG  10           HB1      ARG  10  70.559   2.675  -7.128
   86    HG2  ARG  10           HG2      ARG  10  68.278   2.015  -8.996
   87    HG3  ARG  10           HG1      ARG  10  70.006   1.784  -9.284
   88    HD2  ARG  10           HD2      ARG  10  70.122   0.222  -7.398
   89    HD3  ARG  10           HD1      ARG  10  68.393   0.427  -7.132
   90    HE   ARG  10           HE       ARG  10  68.488  -0.340  -9.682
   91   HH11  ARG  10          HH11      ARG  10  69.799  -1.740  -6.693
   92   HH12  ARG  10          HH12      ARG  10  69.861  -3.324  -7.300
   93   HH21  ARG  10          HH21      ARG  10  68.596  -2.528 -10.512
   94   HH22  ARG  10          HH22      ARG  10  69.181  -3.787  -9.530
   95    H    LYS  11           HN       LYS  11  67.851   5.357  -5.503
   96    HA   LYS  11           HA       LYS  11  70.134   5.430  -3.696
   97    HB2  LYS  11           HB2      LYS  11  68.421   7.768  -4.449
   98    HB3  LYS  11           HB1      LYS  11  69.994   7.724  -3.706
   99    HG2  LYS  11           HG2      LYS  11  70.899   6.683  -5.830
  100    HG3  LYS  11           HG1      LYS  11  69.328   7.104  -6.542
  101    HD2  LYS  11           HD2      LYS  11  69.657   9.408  -5.941
  102    HD3  LYS  11           HD1      LYS  11  71.221   8.955  -5.237
  103    HE2  LYS  11           HE2      LYS  11  70.472   8.599  -8.147
  104    HE3  LYS  11           HE1      LYS  11  71.438   9.936  -7.535
  105    HZ1  LYS  11           HZ1      LYS  11  73.130   8.363  -6.841
  106    HZ2  LYS  11           HZ2      LYS  11  72.791   8.180  -8.476
  107    HZ3  LYS  11           HZ3      LYS  11  72.202   7.056  -7.380
  108    H    LEU  12           HN       LEU  12  69.782   5.831  -1.534
  109    HA   LEU  12           HA       LEU  12  67.440   4.915  -0.371
  110    HB2  LEU  12           HB2      LEU  12  69.401   4.679   0.810
  111    HB3  LEU  12           HB1      LEU  12  69.793   6.392   0.733
  112    HG   LEU  12           HG       LEU  12  67.891   6.844   2.221
  113   HD11  LEU  12          HD11      LEU  12  66.554   4.843   1.672
  114   HD12  LEU  12          HD12      LEU  12  66.870   5.024   3.417
  115   HD13  LEU  12          HD13      LEU  12  67.805   3.859   2.461
  116   HD21  LEU  12          HD21      LEU  12  70.179   6.467   3.065
  117   HD22  LEU  12          HD22      LEU  12  69.701   4.780   3.336
  118   HD23  LEU  12          HD23      LEU  12  68.894   6.074   4.205
  119    HA   PRO  13           HA       PRO  13  66.253   9.425   0.904
  120    HB2  PRO  13           HB2      PRO  13  67.150  11.504  -0.637
  121    HB3  PRO  13           HB1      PRO  13  68.071  10.843   0.736
  122    HG2  PRO  13           HG2      PRO  13  68.394  10.195  -2.167
  123    HG3  PRO  13           HG1      PRO  13  69.628  10.698  -0.994
  124    HD2  PRO  13           HD2      PRO  13  69.257   8.128  -1.589
  125    HD3  PRO  13           HD1      PRO  13  69.627   8.623   0.068
  126    H    GLN  14           HN       GLN  14  66.830   8.740  -2.390
  127    HA   GLN  14           HA       GLN  14  64.578   9.882  -3.642
  128    HB2  GLN  14           HB2      GLN  14  66.791   9.149  -4.595
  129    HB3  GLN  14           HB1      GLN  14  66.238   7.498  -4.418
  130    HG2  GLN  14           HG2      GLN  14  64.403   8.025  -6.002
  131    HG3  GLN  14           HG1      GLN  14  65.149   9.621  -6.204
  132   HE21  GLN  14          HE21      GLN  14  65.668   9.250  -8.367
  133   HE22  GLN  14          HE22      GLN  14  66.902   8.147  -8.850
  134    H    LEU  15           HN       LEU  15  65.235   6.628  -2.267
  135    HA   LEU  15           HA       LEU  15  62.780   5.463  -2.955
  136    HB2  LEU  15           HB2      LEU  15  64.811   4.240  -2.364
  137    HB3  LEU  15           HB1      LEU  15  64.757   4.924  -0.800
  138    HG   LEU  15           HG       LEU  15  62.728   3.810  -0.244
  139   HD11  LEU  15          HD11      LEU  15  61.752   2.123  -1.703
  140   HD12  LEU  15          HD12      LEU  15  63.007   2.361  -2.891
  141   HD13  LEU  15          HD13      LEU  15  61.806   3.644  -2.599
  142   HD21  LEU  15          HD21      LEU  15  64.862   2.099  -1.389
  143   HD22  LEU  15          HD22      LEU  15  63.681   1.574  -0.168
  144   HD23  LEU  15          HD23      LEU  15  64.855   2.878   0.182
  145    H    CYS  16           HN       CYS  16  63.971   7.132  -0.155
  146    HA   CYS  16           HA       CYS  16  61.769   6.701   1.508
  147    HB2  CYS  16           HB2      CYS  16  63.578   9.141   1.407
  148    HB3  CYS  16           HB1      CYS  16  62.491   8.728   2.720
  149    HG   CYS  16           HG       CYS  16  65.202   6.917   1.708
  150    H    THR  17           HN       THR  17  62.358   9.108  -0.974
  151    HA   THR  17           HA       THR  17  60.111  10.710  -0.779
  152    HB   THR  17           HB       THR  17  61.826   9.737  -2.981
  153    HG1  THR  17           HG1      THR  17  61.888  11.756  -1.248
  154   HG21  THR  17          HG21      THR  17  59.523  11.677  -3.352
  155   HG22  THR  17          HG22      THR  17  59.777  10.096  -4.127
  156   HG23  THR  17          HG23      THR  17  60.836  11.439  -4.520
  157    H    GLU  18           HN       GLU  18  60.589   7.646  -2.414
  158    HA   GLU  18           HA       GLU  18  58.124   7.383  -3.615
  159    HB2  GLU  18           HB2      GLU  18  60.292   5.625  -2.814
  160    HB3  GLU  18           HB1      GLU  18  58.873   4.947  -3.636
  161    HG2  GLU  18           HG2      GLU  18  60.709   7.144  -4.570
  162    HG3  GLU  18           HG1      GLU  18  60.676   5.535  -5.244
  163    H    LEU  19           HN       LEU  19  59.358   5.780  -0.652
  164    HA   LEU  19           HA       LEU  19  56.885   4.900   0.249
  165    HB2  LEU  19           HB2      LEU  19  59.514   5.399   1.505
  166    HB3  LEU  19           HB1      LEU  19  58.211   4.885   2.486
  167    HG   LEU  19           HG       LEU  19  58.007   2.934   0.754
  168   HD11  LEU  19          HD11      LEU  19  60.796   3.786   0.285
  169   HD12  LEU  19          HD12      LEU  19  59.466   3.749  -0.878
  170   HD13  LEU  19          HD13      LEU  19  60.091   2.244  -0.199
  171   HD21  LEU  19          HD21      LEU  19  58.601   2.627   3.078
  172   HD22  LEU  19          HD22      LEU  19  60.256   3.122   2.687
  173   HD23  LEU  19          HD23      LEU  19  59.613   1.612   2.030
  174    H    GLN  20           HN       GLN  20  57.847   8.061  -0.048
  175    HA   GLN  20           HA       GLN  20  56.903  10.012   0.621
  176    HB2  GLN  20           HB2      GLN  20  54.842   8.060   1.562
  177    HB3  GLN  20           HB1      GLN  20  54.566   9.811   1.540
  178    HG2  GLN  20           HG2      GLN  20  54.622   9.868  -0.796
  179    HG3  GLN  20           HG1      GLN  20  55.370   8.273  -0.914
  180   HE21  GLN  20          HE21      GLN  20  54.112   6.494  -0.682
  181   HE22  GLN  20          HE22      GLN  20  52.401   6.488  -0.765
  182    H    THR  21           HN       THR  21  58.768   8.696   2.312
  183    HA   THR  21           HA       THR  21  58.073   9.885   4.865
  184    HB   THR  21           HB       THR  21  57.407   7.429   4.892
  185    HG1  THR  21           HG1      THR  21  58.307   7.078   6.931
  186   HG21  THR  21          HG21      THR  21  59.209   6.513   3.503
  187   HG22  THR  21          HG22      THR  21  59.191   5.743   5.097
  188   HG23  THR  21          HG23      THR  21  60.390   6.980   4.734
  189    H    THR  22           HN       THR  22  60.400   9.030   6.209
  190    HA   THR  22           HA       THR  22  62.536   9.913   4.406
  191    HB   THR  22           HB       THR  22  62.806  10.698   7.256
  192    HG1  THR  22           HG1      THR  22  60.747  11.495   7.072
  193   HG21  THR  22          HG21      THR  22  63.238  12.077   4.594
  194   HG22  THR  22          HG22      THR  22  64.474  11.283   5.562
  195   HG23  THR  22          HG23      THR  22  63.695  12.746   6.159
  196    H    ILE  23           HN       ILE  23  64.739   9.495   5.604
  197    HA   ILE  23           HA       ILE  23  65.293   6.869   5.701
  198    HB   ILE  23           HB       ILE  23  66.734   8.993   7.211
  199   HG12  ILE  23          HG12      ILE  23  66.580   8.298   4.331
  200   HG13  ILE  23          HG11      ILE  23  66.402   9.833   5.101
  201   HG21  ILE  23          HG21      ILE  23  67.567   6.706   7.646
  202   HG22  ILE  23          HG22      ILE  23  68.741   7.570   6.637
  203   HG23  ILE  23          HG23      ILE  23  67.630   6.400   5.910
  204   HD11  ILE  23          HD11      ILE  23  68.835   9.856   5.587
  205   HD12  ILE  23          HD12      ILE  23  68.471   9.737   3.848
  206   HD13  ILE  23          HD13      ILE  23  68.924   8.293   4.754
  207    H    HIS  24           HN       HIS  24  64.146   8.925   8.094
  208    HA   HIS  24           HA       HIS  24  65.180   7.844  10.451
  209    HB2  HIS  24           HB2      HIS  24  62.830   9.709  10.195
  210    HB3  HIS  24           HB1      HIS  24  64.026   9.692  11.466
  211    HD1  HIS  24           HD1      HIS  24  66.386   9.593   9.234
  212    HD2  HIS  24           HD2      HIS  24  63.360  12.305   9.654
  213    HE1  HIS  24           HE1      HIS  24  66.986  11.414   7.626
  214    H    ASP  25           HN       ASP  25  62.587   7.104   8.399
  215    HA   ASP  25           HA       ASP  25  60.987   5.774  10.503
  216    HB2  ASP  25           HB2      ASP  25  60.019   7.933   9.662
  217    HB3  ASP  25           HB1      ASP  25  60.033   7.235   8.077
  218    H    ILE  26           HN       ILE  26  62.262   5.761   7.248
  219    HA   ILE  26           HA       ILE  26  60.764   3.708   6.097
  220    HB   ILE  26           HB       ILE  26  62.082   5.210   4.723
  221   HG12  ILE  26          HG12      ILE  26  63.300   2.500   4.495
  222   HG13  ILE  26          HG11      ILE  26  61.687   2.680   3.962
  223   HG21  ILE  26          HG21      ILE  26  64.503   3.866   5.914
  224   HG22  ILE  26          HG22      ILE  26  63.955   5.498   6.265
  225   HG23  ILE  26          HG23      ILE  26  64.518   5.087   4.636
  226   HD11  ILE  26          HD11      ILE  26  63.169   2.746   2.129
  227   HD12  ILE  26          HD12      ILE  26  64.165   3.996   2.874
  228   HD13  ILE  26          HD13      ILE  26  62.532   4.387   2.300
  229    H    ILE  27           HN       ILE  27  60.836   1.584   6.027
  230    HA   ILE  27           HA       ILE  27  62.886   0.251   7.544
  231    HB   ILE  27           HB       ILE  27  60.237  -0.674   6.453
  232   HG12  ILE  27          HG12      ILE  27  60.106   0.728   8.477
  233   HG13  ILE  27          HG11      ILE  27  59.548  -0.916   8.738
  234   HG21  ILE  27          HG21      ILE  27  60.703  -2.827   7.565
  235   HG22  ILE  27          HG22      ILE  27  62.337  -2.236   7.930
  236   HG23  ILE  27          HG23      ILE  27  61.835  -2.451   6.259
  237   HD11  ILE  27          HD11      ILE  27  62.222   0.215   9.579
  238   HD12  ILE  27          HD12      ILE  27  61.694  -1.452   9.807
  239   HD13  ILE  27          HD13      ILE  27  60.853  -0.141  10.638
  240    H    LEU  28           HN       LEU  28  64.516  -0.095   6.667
  241    HA   LEU  28           HA       LEU  28  64.365  -1.082   3.961
  242    HB2  LEU  28           HB2      LEU  28  65.650   1.147   4.838
  243    HB3  LEU  28           HB1      LEU  28  66.934  -0.054   4.748
  244    HG   LEU  28           HG       LEU  28  66.401  -0.548   2.471
  245   HD11  LEU  28          HD11      LEU  28  64.565   1.244   1.615
  246   HD12  LEU  28          HD12      LEU  28  64.004   0.876   3.294
  247   HD13  LEU  28          HD13      LEU  28  64.191  -0.406   2.124
  248   HD21  LEU  28          HD21      LEU  28  66.963   1.553   1.465
  249   HD22  LEU  28          HD22      LEU  28  67.825   1.449   3.016
  250   HD23  LEU  28          HD23      LEU  28  66.366   2.417   2.873
  251    H    GLU  29           HN       GLU  29  65.347  -3.202   3.805
  252    HA   GLU  29           HA       GLU  29  66.908  -3.688   6.257
  253    HB2  GLU  29           HB2      GLU  29  66.396  -6.041   5.988
  254    HB3  GLU  29           HB1      GLU  29  65.180  -4.998   6.821
  255    HG2  GLU  29           HG2      GLU  29  64.126  -4.974   4.616
  256    HG3  GLU  29           HG1      GLU  29  65.269  -6.306   4.258
  257    H    CYS  30           HN       CYS  30  68.383  -5.813   6.142
  258    HA   CYS  30           HA       CYS  30  69.924  -5.624   3.944
  259    HB2  CYS  30           HB2      CYS  30  69.470  -7.945   5.764
  260    HB3  CYS  30           HB1      CYS  30  70.757  -7.675   4.581
  261    H    VAL  31           HN       VAL  31  69.701  -6.311   2.232
  262    HA   VAL  31           HA       VAL  31  67.622  -7.879   1.085
  263    HB   VAL  31           HB       VAL  31  68.585  -6.377  -0.463
  264   HG11  VAL  31          HG11      VAL  31  70.349  -5.497   0.767
  265   HG12  VAL  31          HG12      VAL  31  70.973  -6.189  -0.755
  266   HG13  VAL  31          HG13      VAL  31  71.188  -7.073   0.755
  267   HG21  VAL  31          HG21      VAL  31  70.129  -7.438  -1.995
  268   HG22  VAL  31          HG22      VAL  31  68.649  -8.309  -1.691
  269   HG23  VAL  31          HG23      VAL  31  70.166  -8.855  -0.931
  270    H    TYR  32           HN       TYR  32  70.680  -8.435   2.345
  271    HA   TYR  32           HA       TYR  32  70.872 -11.162   1.439
  272    HB2  TYR  32           HB2      TYR  32  72.965  -9.571   2.889
  273    HB3  TYR  32           HB1      TYR  32  73.200 -11.081   2.008
  274    HD1  TYR  32           HD2      TYR  32  71.827 -10.773  -0.538
  275    HD2  TYR  32           HD1      TYR  32  73.923  -7.800   1.755
  276    HE1  TYR  32           HE2      TYR  32  72.182  -9.592  -2.474
  277    HE2  TYR  32           HE1      TYR  32  74.278  -6.471  -0.261
  278    HH   TYR  32           HH       TYR  32  74.362  -6.823  -2.666
  279    H    CYS  33           HN       CYS  33  71.036  -9.372   4.619
  280    HA   CYS  33           HA       CYS  33  71.397 -11.811   6.192
  281    HB2  CYS  33           HB2      CYS  33  70.954  -8.984   7.176
  282    HB3  CYS  33           HB1      CYS  33  71.498 -10.346   8.143
  283    H    LYS  34           HN       LYS  34  68.856 -10.124   4.882
  284    HA   LYS  34           HA       LYS  34  66.770  -9.865   5.070
  285    HB2  LYS  34           HB2      LYS  34  66.733 -12.249   6.883
  286    HB3  LYS  34           HB1      LYS  34  65.461 -11.696   5.808
  287    HG2  LYS  34           HG2      LYS  34  68.132 -12.793   4.990
  288    HG3  LYS  34           HG1      LYS  34  66.594 -13.619   4.884
  289    HD2  LYS  34           HD2      LYS  34  65.860 -11.752   3.335
  290    HD3  LYS  34           HD1      LYS  34  67.530 -11.224   3.357
  291    HE2  LYS  34           HE2      LYS  34  68.305 -13.366   2.551
  292    HE3  LYS  34           HE1      LYS  34  66.656 -13.982   2.538
  293    HZ1  LYS  34           HZ1      LYS  34  66.110 -12.312   0.871
  294    HZ2  LYS  34           HZ2      LYS  34  67.368 -13.337   0.366
  295    HZ3  LYS  34           HZ3      LYS  34  67.726 -11.775   0.902
  296    H    GLN  35           HN       GLN  35  68.502  -8.697   7.436
  297    HA   GLN  35           HA       GLN  35  66.352  -8.385   9.290
  298    HB2  GLN  35           HB2      GLN  35  68.114  -7.724  10.758
  299    HB3  GLN  35           HB1      GLN  35  67.952  -9.442  10.296
  300    HG2  GLN  35           HG2      GLN  35  69.850  -9.119   8.812
  301    HG3  GLN  35           HG1      GLN  35  69.945  -7.427   9.360
  302   HE21  GLN  35          HE21      GLN  35  69.005  -9.913  11.545
  303   HE22  GLN  35          HE22      GLN  35  70.380  -9.897  12.495
  304    H    GLN  36           HN       GLN  36  65.878  -6.304   9.915
  305    HA   GLN  36           HA       GLN  36  66.351  -4.265   8.139
  306    HB2  GLN  36           HB2      GLN  36  65.008  -4.636  10.760
  307    HB3  GLN  36           HB1      GLN  36  65.162  -3.050  10.030
  308    HG2  GLN  36           HG2      GLN  36  63.897  -3.646   8.160
  309    HG3  GLN  36           HG1      GLN  36  64.119  -5.358   8.469
  310   HE21  GLN  36          HE21      GLN  36  61.980  -5.667   8.239
  311   HE22  GLN  36          HE22      GLN  36  60.798  -5.254   9.436
  312    H    LEU  37           HN       LEU  37  67.684  -2.752   8.088
  313    HA   LEU  37           HA       LEU  37  70.104  -2.886   9.440
  314    HB2  LEU  37           HB2      LEU  37  68.846  -0.912   7.609
  315    HB3  LEU  37           HB1      LEU  37  70.130  -0.415   8.644
  316    HG   LEU  37           HG       LEU  37  71.557  -2.216   7.725
  317   HD11  LEU  37          HD11      LEU  37  69.272  -2.581   5.822
  318   HD12  LEU  37          HD12      LEU  37  69.936  -3.766   6.947
  319   HD13  LEU  37          HD13      LEU  37  70.899  -3.212   5.578
  320   HD21  LEU  37          HD21      LEU  37  71.753   0.059   6.951
  321   HD22  LEU  37          HD22      LEU  37  70.463  -0.203   5.781
  322   HD23  LEU  37          HD23      LEU  37  71.994  -1.064   5.611
  323    H    LEU  38           HN       LEU  38  71.091  -1.754  10.920
  324    HA   LEU  38           HA       LEU  38  69.819  -0.628  13.115
  325    HB2  LEU  38           HB2      LEU  38  72.284  -1.459  12.287
  326    HB3  LEU  38           HB1      LEU  38  72.454   0.262  12.164
  327    HG   LEU  38           HG       LEU  38  71.730  -1.281  14.603
  328   HD11  LEU  38          HD11      LEU  38  74.301   0.072  13.793
  329   HD12  LEU  38          HD12      LEU  38  73.976  -1.655  13.796
  330   HD13  LEU  38          HD13      LEU  38  74.028  -0.771  15.331
  331   HD21  LEU  38          HD21      LEU  38  72.064   0.792  15.848
  332   HD22  LEU  38          HD22      LEU  38  70.828   1.035  14.609
  333   HD23  LEU  38          HD23      LEU  38  72.463   1.645  14.370
  334    H    ARG  39           HN       ARG  39  69.034   1.599  13.197
  335    HA   ARG  39           HA       ARG  39  68.681   2.907  10.769
  336    HB2  ARG  39           HB2      ARG  39  67.257   3.300  12.790
  337    HB3  ARG  39           HB1      ARG  39  68.560   4.259  13.481
  338    HG2  ARG  39           HG2      ARG  39  68.368   5.906  11.786
  339    HG3  ARG  39           HG1      ARG  39  67.309   4.886  10.827
  340    HD2  ARG  39           HD2      ARG  39  65.993   6.598  11.907
  341    HD3  ARG  39           HD1      ARG  39  65.600   5.024  12.583
  342    HE   ARG  39           HE       ARG  39  67.495   6.055  14.256
  343   HH11  ARG  39          HH11      ARG  39  64.244   7.069  13.182
  344   HH12  ARG  39          HH12      ARG  39  63.926   7.962  14.595
  345   HH21  ARG  39          HH21      ARG  39  67.018   7.287  16.179
  346   HH22  ARG  39          HH22      ARG  39  65.526   8.105  16.325
  347    H    ARG  40           HN       ARG  40  71.320   3.085  12.975
  348    HA   ARG  40           HA       ARG  40  72.827   5.208  12.237
  349    HB2  ARG  40           HB2      ARG  40  73.350   3.683  14.001
  350    HB3  ARG  40           HB1      ARG  40  73.329   2.362  12.855
  351    HG2  ARG  40           HG2      ARG  40  75.518   2.814  13.674
  352    HG3  ARG  40           HG1      ARG  40  75.377   3.060  11.926
  353    HD2  ARG  40           HD2      ARG  40  74.886   5.374  13.600
  354    HD3  ARG  40           HD1      ARG  40  76.558   4.799  13.638
  355    HE   ARG  40           HE       ARG  40  75.972   4.878  10.984
  356   HH11  ARG  40          HH11      ARG  40  75.455   7.332  13.461
  357   HH12  ARG  40          HH12      ARG  40  76.026   8.617  12.495
  358   HH21  ARG  40          HH21      ARG  40  76.783   6.580   9.697
  359   HH22  ARG  40          HH22      ARG  40  76.797   8.183  10.273
  360    H    GLU  41           HN       GLU  41  72.758   1.926  10.822
  361    HA   GLU  41           HA       GLU  41  74.621   2.421   8.740
  362    HB2  GLU  41           HB2      GLU  41  72.679   0.234   9.344
  363    HB3  GLU  41           HB1      GLU  41  73.702   0.110   7.947
  364    HG2  GLU  41           HG2      GLU  41  74.518   0.261  10.829
  365    HG3  GLU  41           HG1      GLU  41  74.583  -1.144   9.766
  366    H    VAL  42           HN       VAL  42  71.202   2.526   9.080
  367    HA   VAL  42           HA       VAL  42  70.567   2.744   6.314
  368    HB   VAL  42           HB       VAL  42  68.879   4.099   8.450
  369   HG11  VAL  42          HG11      VAL  42  68.139   2.588   5.985
  370   HG12  VAL  42          HG12      VAL  42  68.326   4.353   6.020
  371   HG13  VAL  42          HG13      VAL  42  67.047   3.565   6.966
  372   HG21  VAL  42          HG21      VAL  42  68.772   1.192   7.701
  373   HG22  VAL  42          HG22      VAL  42  67.695   2.021   8.831
  374   HG23  VAL  42          HG23      VAL  42  69.405   1.810   9.220
  375    H    TYR  43           HN       TYR  43  71.230   5.238   8.840
  376    HA   TYR  43           HA       TYR  43  71.066   7.427   7.078
  377    HB2  TYR  43           HB2      TYR  43  72.752   7.107   9.547
  378    HB3  TYR  43           HB1      TYR  43  72.643   8.612   8.632
  379    HD1  TYR  43           HD1      TYR  43  69.989   8.981   7.976
  380    HD2  TYR  43           HD2      TYR  43  71.529   7.181  11.485
  381    HE1  TYR  43           HE1      TYR  43  67.926   9.478   9.097
  382    HE2  TYR  43           HE2      TYR  43  69.466   7.664  12.658
  383    HH   TYR  43           HH       TYR  43  67.571   9.252  12.440
  384    H    ASP  44           HN       ASP  44  73.765   5.346   7.935
  385    HA   ASP  44           HA       ASP  44  75.805   6.600   6.646
  386    HB2  ASP  44           HB2      ASP  44  75.255   3.666   6.893
  387    HB3  ASP  44           HB1      ASP  44  76.672   4.389   6.274
  388    H    PHE  45           HN       PHE  45  73.336   4.572   5.402
  389    HA   PHE  45           HA       PHE  45  74.433   3.911   2.981
  390    HB2  PHE  45           HB2      PHE  45  72.144   3.338   4.271
  391    HB3  PHE  45           HB1      PHE  45  71.594   4.527   3.112
  392    HD1  PHE  45           HD1      PHE  45  73.423   1.319   3.382
  393    HD2  PHE  45           HD2      PHE  45  71.216   4.044   0.961
  394    HE1  PHE  45           HE1      PHE  45  73.199  -0.360   1.602
  395    HE2  PHE  45           HE2      PHE  45  71.040   2.386  -0.781
  396    HZ   PHE  45           HZ       PHE  45  71.979   0.204  -0.497
  397    H    ALA  46           HN       ALA  46  72.344   6.704   3.801
  398    HA   ALA  46           HA       ALA  46  72.760   7.883   1.173
  399    HB1  ALA  46           HB1      ALA  46  70.526   8.113   2.156
  400    HB2  ALA  46           HB2      ALA  46  71.270   9.687   1.929
  401    HB3  ALA  46           HB3      ALA  46  71.255   8.940   3.534
  402    H    ARG  47           HN       ARG  47  74.041   8.182   4.332
  403    HA   ARG  47           HA       ARG  47  75.240  10.725   3.969
  404    HB2  ARG  47           HB2      ARG  47  75.309   8.560   5.927
  405    HB3  ARG  47           HB1      ARG  47  76.796   9.453   5.917
  406    HG2  ARG  47           HG2      ARG  47  75.285  10.297   7.603
  407    HG3  ARG  47           HG1      ARG  47  75.491  11.521   6.360
  408    HD2  ARG  47           HD2      ARG  47  73.338  11.064   5.456
  409    HD3  ARG  47           HD1      ARG  47  73.173   9.600   6.426
  410    HE   ARG  47           HE       ARG  47  73.480  11.506   8.279
  411   HH11  ARG  47          HH11      ARG  47  71.281  11.417   5.447
  412   HH12  ARG  47          HH12      ARG  47  70.005  12.151   6.258
  413   HH21  ARG  47          HH21      ARG  47  71.656  12.533   9.374
  414   HH22  ARG  47          HH22      ARG  47  70.210  12.814   8.534
  415    H    ARG  48           HN       ARG  48  76.088   7.486   3.189
  416    HA   ARG  48           HA       ARG  48  78.605   8.332   1.974
  417    HB2  ARG  48           HB2      ARG  48  77.295   5.677   2.334
  418    HB3  ARG  48           HB1      ARG  48  78.887   5.883   1.635
  419    HG2  ARG  48           HG2      ARG  48  79.714   6.666   3.760
  420    HG3  ARG  48           HG1      ARG  48  78.089   6.573   4.439
  421    HD2  ARG  48           HD2      ARG  48  79.632   4.178   3.334
  422    HD3  ARG  48           HD1      ARG  48  79.533   4.654   5.016
  423    HE   ARG  48           HE       ARG  48  76.999   4.147   3.796
  424   HH11  ARG  48          HH11      ARG  48  79.694   2.851   5.727
  425   HH12  ARG  48          HH12      ARG  48  78.813   1.578   6.412
  426   HH21  ARG  48          HH21      ARG  48  75.738   2.240   4.814
  427   HH22  ARG  48          HH22      ARG  48  76.559   1.247   5.908
  428    H    ASP  49           HN       ASP  49  78.432   6.317  -0.147
  429    HA   ASP  49           HA       ASP  49  75.848   6.835  -1.319
  430    HB2  ASP  49           HB2      ASP  49  77.282   8.514  -2.397
  431    HB3  ASP  49           HB1      ASP  49  78.329   7.223  -2.992
  432    H    LEU  50           HN       LEU  50  75.338   4.856  -0.711
  433    HA   LEU  50           HA       LEU  50  76.496   2.674  -2.219
  434    HB2  LEU  50           HB2      LEU  50  74.619   2.644   0.170
  435    HB3  LEU  50           HB1      LEU  50  75.300   1.228  -0.596
  436    HG   LEU  50           HG       LEU  50  77.568   2.105   0.080
  437   HD11  LEU  50          HD11      LEU  50  77.044   4.323   0.413
  438   HD12  LEU  50          HD12      LEU  50  77.667   3.629   1.922
  439   HD13  LEU  50          HD13      LEU  50  75.935   3.941   1.726
  440   HD21  LEU  50          HD21      LEU  50  75.642   1.447   2.282
  441   HD22  LEU  50          HD22      LEU  50  77.374   1.539   2.454
  442   HD23  LEU  50          HD23      LEU  50  76.654   0.296   1.380
  443    H    CYS  51           HN       CYS  51  74.931   1.217  -3.223
  444    HA   CYS  51           HA       CYS  51  72.551   2.678  -4.055
  445    HB2  CYS  51           HB2      CYS  51  72.564   1.109  -5.993
  446    HB3  CYS  51           HB1      CYS  51  73.998   2.127  -5.881
  447    HG   CYS  51           HG       CYS  51  75.517   0.201  -6.297
  448    H    ILE  52           HN       ILE  52  70.598   1.666  -4.054
  449    HA   ILE  52           HA       ILE  52  70.358  -0.278  -1.992
  450    HB   ILE  52           HB       ILE  52  68.332   1.256  -3.580
  451   HG12  ILE  52          HG12      ILE  52  69.260   1.006  -0.798
  452   HG13  ILE  52          HG11      ILE  52  69.500   2.393  -1.905
  453   HG21  ILE  52          HG21      ILE  52  66.558   0.204  -2.225
  454   HG22  ILE  52          HG22      ILE  52  67.737  -0.889  -1.502
  455   HG23  ILE  52          HG23      ILE  52  67.357  -1.016  -3.217
  456   HD11  ILE  52          HD11      ILE  52  67.115   2.666  -1.851
  457   HD12  ILE  52          HD12      ILE  52  67.948   2.807  -0.233
  458   HD13  ILE  52          HD13      ILE  52  67.110   1.296  -0.699
  459    H    VAL  53           HN       VAL  53  69.632  -2.171  -2.108
  460    HA   VAL  53           HA       VAL  53  69.821  -3.489  -4.672
  461    HB   VAL  53           HB       VAL  53  70.717  -5.411  -3.070
  462   HG11  VAL  53          HG11      VAL  53  71.975  -4.330  -4.942
  463   HG12  VAL  53          HG12      VAL  53  73.004  -4.607  -3.537
  464   HG13  VAL  53          HG13      VAL  53  72.377  -2.991  -3.866
  465   HG21  VAL  53          HG21      VAL  53  71.406  -2.856  -1.618
  466   HG22  VAL  53          HG22      VAL  53  72.057  -4.428  -1.238
  467   HG23  VAL  53          HG23      VAL  53  70.330  -4.107  -1.016
  468    H    TYR  54           HN       TYR  54  68.121  -4.400  -5.163
  469    HA   TYR  54           HA       TYR  54  66.013  -5.014  -3.281
  470    HB2  TYR  54           HB2      TYR  54  66.136  -5.005  -6.292
  471    HB3  TYR  54           HB1      TYR  54  64.689  -5.262  -5.307
  472    HD1  TYR  54           HD1      TYR  54  67.220  -2.776  -6.307
  473    HD2  TYR  54           HD2      TYR  54  63.609  -3.490  -4.178
  474    HE1  TYR  54           HE1      TYR  54  66.904  -0.352  -5.966
  475    HE2  TYR  54           HE2      TYR  54  63.307  -1.180  -3.893
  476    HH   TYR  54           HH       TYR  54  65.259   1.152  -5.472
  477    H    ARG  55           HN       ARG  55  65.983  -6.711  -2.491
  478    HA   ARG  55           HA       ARG  55  67.308  -8.942  -3.783
  479    HB2  ARG  55           HB2      ARG  55  66.912  -8.539  -1.038
  480    HB3  ARG  55           HB1      ARG  55  65.657  -9.677  -1.461
  481    HG2  ARG  55           HG2      ARG  55  68.642 -10.257  -2.011
  482    HG3  ARG  55           HG1      ARG  55  67.784 -10.740  -0.627
  483    HD2  ARG  55           HD2      ARG  55  66.296 -12.151  -1.821
  484    HD3  ARG  55           HD1      ARG  55  66.681 -11.401  -3.367
  485    HE   ARG  55           HE       ARG  55  69.031 -12.439  -2.608
  486   HH11  ARG  55          HH11      ARG  55  65.804 -13.926  -2.727
  487   HH12  ARG  55          HH12      ARG  55  66.366 -15.440  -3.248
  488   HH21  ARG  55          HH21      ARG  55  69.782 -14.522  -3.299
  489   HH22  ARG  55          HH22      ARG  55  68.682 -15.796  -3.591
  490    H    ASP  56           HN       ASP  56  65.964 -10.109  -5.209
  491    HA   ASP  56           HA       ASP  56  64.132 -11.015  -6.228
  492    HB2  ASP  56           HB2      ASP  56  63.363 -11.942  -4.102
  493    HB3  ASP  56           HB1      ASP  56  62.757 -10.348  -3.642
  494    H    GLY  57           HN       GLY  57  62.826  -8.310  -4.395
  495    HA2  GLY  57           HA2      GLY  57  62.907  -6.498  -6.434
  496    HA3  GLY  57           HA1      GLY  57  61.296  -7.239  -6.535
  497    H    ASN  58           HN       ASN  58  63.253  -6.620  -3.648
  498    HA   ASN  58           HA       ASN  58  61.232  -4.691  -2.759
  499    HB2  ASN  58           HB2      ASN  58  62.507  -6.743  -0.985
  500    HB3  ASN  58           HB1      ASN  58  61.067  -5.831  -0.641
  501   HD21  ASN  58          HD21      ASN  58  62.462  -8.558  -2.165
  502   HD22  ASN  58          HD22      ASN  58  61.040  -9.414  -2.562
  503    HA   PRO  59           HA       PRO  59  64.888  -2.656  -1.962
  504    HB2  PRO  59           HB2      PRO  59  63.604  -0.668  -0.270
  505    HB3  PRO  59           HB1      PRO  59  64.075  -0.524  -1.966
  506    HG2  PRO  59           HG2      PRO  59  61.404  -0.627  -1.282
  507    HG3  PRO  59           HG1      PRO  59  61.973  -1.305  -2.739
  508    HD2  PRO  59           HD2      PRO  59  61.515  -2.724  -0.181
  509    HD3  PRO  59           HD1      PRO  59  60.966  -3.142  -1.808
  510    H    TYR  60           HN       TYR  60  66.581  -2.948  -0.933
  511    HA   TYR  60           HA       TYR  60  66.395  -2.953   1.859
  512    HB2  TYR  60           HB2      TYR  60  67.975  -5.264   0.721
  513    HB3  TYR  60           HB1      TYR  60  67.430  -4.874   2.178
  514    HD1  TYR  60           HD1      TYR  60  65.174  -5.051   2.910
  515    HD2  TYR  60           HD2      TYR  60  66.419  -6.416  -0.812
  516    HE1  TYR  60           HE1      TYR  60  63.193  -6.525   2.821
  517    HE2  TYR  60           HE2      TYR  60  64.446  -7.905  -0.968
  518    HH   TYR  60           HH       TYR  60  61.845  -7.688   1.283
  519    H    ALA  61           HN       ALA  61  68.083  -2.455   2.727
  520    HA   ALA  61           HA       ALA  61  69.957  -0.827   1.328
  521    HB1  ALA  61           HB1      ALA  61  70.435  -0.110   3.538
  522    HB2  ALA  61           HB2      ALA  61  69.616  -1.566   4.119
  523    HB3  ALA  61           HB3      ALA  61  68.645  -0.296   3.385
  524    H    VAL  62           HN       VAL  62  72.120  -1.175   2.868
  525    HA   VAL  62           HA       VAL  62  72.812  -3.994   2.953
  526    HB   VAL  62           HB       VAL  62  74.352  -1.734   1.546
  527   HG11  VAL  62          HG11      VAL  62  75.488  -4.355   2.179
  528   HG12  VAL  62          HG12      VAL  62  75.826  -2.772   2.904
  529   HG13  VAL  62          HG13      VAL  62  76.179  -3.039   1.198
  530   HG21  VAL  62          HG21      VAL  62  74.404  -3.254  -0.321
  531   HG22  VAL  62          HG22      VAL  62  72.818  -2.664   0.149
  532   HG23  VAL  62          HG23      VAL  62  73.296  -4.326   0.574
  533    H    CYS  63           HN       CYS  63  73.017  -4.213   5.089
  534    HA   CYS  63           HA       CYS  63  73.866  -2.175   6.834
  535    HB2  CYS  63           HB2      CYS  63  73.774  -3.808   8.521
  536    HB3  CYS  63           HB1      CYS  63  72.631  -4.309   7.248
  537    H    ASP  64           HN       ASP  64  75.684  -2.974   8.426
  538    HA   ASP  64           HA       ASP  64  78.231  -2.469   7.290
  539    HB2  ASP  64           HB2      ASP  64  77.594  -1.955   9.612
  540    HB3  ASP  64           HB1      ASP  64  77.526  -3.669   9.957
  541    H    LYS  65           HN       LYS  65  76.594  -5.357   8.336
  542    HA   LYS  65           HA       LYS  65  78.715  -7.244   8.099
  543    HB2  LYS  65           HB2      LYS  65  75.753  -7.657   7.750
  544    HB3  LYS  65           HB1      LYS  65  76.917  -8.914   8.048
  545    HG2  LYS  65           HG2      LYS  65  77.219  -8.220  10.289
  546    HG3  LYS  65           HG1      LYS  65  76.360  -6.703   9.993
  547    HD2  LYS  65           HD2      LYS  65  74.854  -8.269  11.110
  548    HD3  LYS  65           HD1      LYS  65  74.344  -7.945   9.447
  549    HE2  LYS  65           HE2      LYS  65  75.524 -10.087   8.792
  550    HE3  LYS  65           HE1      LYS  65  75.667 -10.424  10.518
  551    HZ1  LYS  65           HZ1      LYS  65  73.749 -11.497   9.647
  552    HZ2  LYS  65           HZ2      LYS  65  73.210 -10.092   8.928
  553    HZ3  LYS  65           HZ3      LYS  65  73.192 -10.225  10.622
  554    H    CYS  66           HN       CYS  66  76.038  -6.215   6.028
  555    HA   CYS  66           HA       CYS  66  76.597  -7.895   3.845
  556    HB2  CYS  66           HB2      CYS  66  75.111  -5.248   4.003
  557    HB3  CYS  66           HB1      CYS  66  75.298  -6.179   2.521
  558    H    LEU  67           HN       LEU  67  77.578  -4.618   4.645
  559    HA   LEU  67           HA       LEU  67  79.017  -3.957   2.399
  560    HB2  LEU  67           HB2      LEU  67  79.211  -3.130   5.195
  561    HB3  LEU  67           HB1      LEU  67  80.450  -2.628   4.056
  562    HG   LEU  67           HG       LEU  67  77.500  -2.133   3.724
  563   HD11  LEU  67          HD11      LEU  67  78.508  -0.933   5.529
  564   HD12  LEU  67          HD12      LEU  67  78.114   0.136   4.157
  565   HD13  LEU  67          HD13      LEU  67  79.790  -0.414   4.428
  566   HD21  LEU  67          HD21      LEU  67  79.913  -1.320   2.109
  567   HD22  LEU  67          HD22      LEU  67  78.335  -0.582   1.956
  568   HD23  LEU  67          HD23      LEU  67  78.536  -2.280   1.547
  569    H    LYS  68           HN       LYS  68  80.173  -5.753   5.220
  570    HA   LYS  68           HA       LYS  68  82.756  -5.832   4.017
  571    HB2  LYS  68           HB2      LYS  68  83.453  -7.312   5.897
  572    HB3  LYS  68           HB1      LYS  68  82.852  -5.734   6.379
  573    HG2  LYS  68           HG2      LYS  68  81.985  -7.194   7.969
  574    HG3  LYS  68           HG1      LYS  68  80.647  -6.981   6.845
  575    HD2  LYS  68           HD2      LYS  68  81.203  -9.094   5.767
  576    HD3  LYS  68           HD1      LYS  68  82.580  -9.297   6.849
  577    HE2  LYS  68           HE2      LYS  68  79.685  -9.155   7.671
  578    HE3  LYS  68           HE1      LYS  68  80.659 -10.618   7.585
  579    HZ1  LYS  68           HZ1      LYS  68  81.088  -8.319   9.420
  580    HZ2  LYS  68           HZ2      LYS  68  82.118  -9.639   9.292
  581    HZ3  LYS  68           HZ3      LYS  68  80.545  -9.858   9.841
  582    H    PHE  69           HN       PHE  69  79.986  -7.777   3.735
  583    HA   PHE  69           HA       PHE  69  81.208 -10.073   2.691
  584    HB2  PHE  69           HB2      PHE  69  78.641  -8.715   2.393
  585    HB3  PHE  69           HB1      PHE  69  78.914 -10.207   1.576
  586    HD1  PHE  69           HD2      PHE  69  80.430 -11.019   4.460
  587    HD2  PHE  69           HD1      PHE  69  76.611  -9.757   3.105
  588    HE1  PHE  69           HE2      PHE  69  79.381 -12.073   6.410
  589    HE2  PHE  69           HE1      PHE  69  75.550 -10.780   5.003
  590    HZ   PHE  69           HZ       PHE  69  76.912 -11.949   6.697
  591    H    TYR  70           HN       TYR  70  79.651  -7.168   1.398
  592    HA   TYR  70           HA       TYR  70  80.482  -7.818  -1.327
  593    HB2  TYR  70           HB2      TYR  70  78.106  -6.330  -0.257
  594    HB3  TYR  70           HB1      TYR  70  78.499  -6.492  -1.961
  595    HD1  TYR  70           HD2      TYR  70  78.544  -8.750  -2.968
  596    HD2  TYR  70           HD1      TYR  70  77.009  -8.042   0.913
  597    HE1  TYR  70           HE2      TYR  70  77.405 -10.909  -3.042
  598    HE2  TYR  70           HE1      TYR  70  75.853 -10.193   0.885
  599    HH   TYR  70           HH       TYR  70  76.544 -12.567  -1.379
  600    H    SER  71           HN       SER  71  82.435  -6.346   0.085
  601    HA   SER  71           HA       SER  71  82.097  -3.531  -0.106
  602    HB2  SER  71           HB2      SER  71  84.680  -5.116  -0.223
  603    HB3  SER  71           HB1      SER  71  84.524  -3.412   0.200
  604    HG   SER  71           HG       SER  71  82.889  -4.685   1.811
  605    H    LYS  72           HN       LYS  72  82.657  -5.947  -2.317
  606    HA   LYS  72           HA       LYS  72  83.904  -5.017  -4.553
  607    HB2  LYS  72           HB2      LYS  72  83.084  -7.272  -4.103
  608    HB3  LYS  72           HB1      LYS  72  81.453  -6.716  -4.210
  609    HG2  LYS  72           HG2      LYS  72  81.932  -7.962  -6.184
  610    HG3  LYS  72           HG1      LYS  72  81.774  -6.276  -6.634
  611    HD2  LYS  72           HD2      LYS  72  84.477  -7.470  -6.115
  612    HD3  LYS  72           HD1      LYS  72  83.667  -7.746  -7.651
  613    HE2  LYS  72           HE2      LYS  72  83.502  -5.282  -7.938
  614    HE3  LYS  72           HE1      LYS  72  84.429  -5.079  -6.455
  615    HZ1  LYS  72           HZ1      LYS  72  85.835  -4.926  -8.396
  616    HZ2  LYS  72           HZ2      LYS  72  85.364  -6.451  -8.909
  617    HZ3  LYS  72           HZ3      LYS  72  86.259  -6.293  -7.504
  618    H    ILE  73           HN       ILE  73  80.602  -4.484  -3.443
  619    HA   ILE  73           HA       ILE  73  79.511  -3.652  -5.866
  620    HB   ILE  73           HB       ILE  73  78.412  -2.952  -3.130
  621   HG12  ILE  73          HG12      ILE  73  77.703  -5.159  -5.086
  622   HG13  ILE  73          HG11      ILE  73  78.621  -5.402  -3.611
  623   HG21  ILE  73          HG21      ILE  73  77.532  -1.466  -4.919
  624   HG22  ILE  73          HG22      ILE  73  76.284  -2.559  -4.324
  625   HG23  ILE  73          HG23      ILE  73  77.081  -2.884  -5.861
  626   HD11  ILE  73          HD11      ILE  73  75.755  -4.483  -3.806
  627   HD12  ILE  73          HD12      ILE  73  76.657  -4.704  -2.304
  628   HD13  ILE  73          HD13      ILE  73  76.311  -6.091  -3.336
  629    H    SER  74           HN       SER  74  80.092  -1.338  -3.203
  630    HA   SER  74           HA       SER  74  80.296   0.872  -3.175
  631    HB2  SER  74           HB2      SER  74  81.999   1.879  -4.768
  632    HB3  SER  74           HB1      SER  74  82.570   0.495  -3.843
  633    HG   SER  74           HG       SER  74  81.704  -0.640  -5.907
  634    H    GLU  75           HN       GLU  75  80.339   0.814  -6.596
  635    HA   GLU  75           HA       GLU  75  78.080   2.643  -6.670
  636    HB2  GLU  75           HB2      GLU  75  78.647   2.794  -9.138
  637    HB3  GLU  75           HB1      GLU  75  79.877   3.381  -8.035
  638    HG2  GLU  75           HG2      GLU  75  80.968   1.102  -8.271
  639    HG3  GLU  75           HG1      GLU  75  79.833   0.828  -9.591
  640    H    TYR  76           HN       TYR  76  79.005  -0.393  -8.318
  641    HA   TYR  76           HA       TYR  76  76.987  -1.935  -7.588
  642    HB2  TYR  76           HB2      TYR  76  75.478  -0.424  -8.890
  643    HB3  TYR  76           HB1      TYR  76  76.379  -0.898 -10.345
  644    HD1  TYR  76           HD2      TYR  76  74.884  -2.469  -7.424
  645    HD2  TYR  76           HD1      TYR  76  75.440  -2.605 -11.582
  646    HE1  TYR  76           HE2      TYR  76  73.526  -4.544  -7.494
  647    HE2  TYR  76           HE1      TYR  76  74.095  -4.687 -11.728
  648    HH   TYR  76           HH       TYR  76  73.505  -6.559 -10.163
  649    H    ARG  77           HN       ARG  77  78.354  -3.480  -7.553
  650    HA   ARG  77           HA       ARG  77  79.364  -4.750  -9.898
  651    HB2  ARG  77           HB2      ARG  77  81.225  -3.558  -7.803
  652    HB3  ARG  77           HB1      ARG  77  81.702  -4.754  -8.983
  653    HG2  ARG  77           HG2      ARG  77  80.753  -1.979  -9.671
  654    HG3  ARG  77           HG1      ARG  77  82.447  -2.432  -9.485
  655    HD2  ARG  77           HD2      ARG  77  82.176  -4.083 -11.285
  656    HD3  ARG  77           HD1      ARG  77  80.499  -3.579 -11.481
  657    HE   ARG  77           HE       ARG  77  81.431  -1.332 -11.999
  658   HH11  ARG  77          HH11      ARG  77  83.326  -4.262 -12.652
  659   HH12  ARG  77          HH12      ARG  77  84.234  -3.564 -13.908
  660   HH21  ARG  77          HH21      ARG  77  82.724  -0.361 -13.713
  661   HH22  ARG  77          HH22      ARG  77  83.896  -1.316 -14.512
  662    H    HIS  78           HN       HIS  78  78.494  -6.717  -9.164
  663    HA   HIS  78           HA       HIS  78  79.212  -7.415  -6.408
  664    HB2  HIS  78           HB2      HIS  78  77.117  -8.731  -6.281
  665    HB3  HIS  78           HB1      HIS  78  76.841  -6.980  -6.426
  666    HD1  HIS  78           HD1      HIS  78  76.083 -10.274  -7.921
  667    HD2  HIS  78           HD2      HIS  78  75.930  -6.294  -8.812
  668    HE1  HIS  78           HE1      HIS  78  74.513 -10.126  -9.897
  669    H    TYR  79           HN       TYR  79  80.208  -7.991  -9.188
  670    HA   TYR  79           HA       TYR  79  79.547 -10.743  -9.563
  671    HB2  TYR  79           HB2      TYR  79  81.178  -8.866 -11.271
  672    HB3  TYR  79           HB1      TYR  79  80.623 -10.468 -11.711
  673    HD1  TYR  79           HD2      TYR  79  79.255  -7.107 -10.628
  674    HD2  TYR  79           HD1      TYR  79  78.600 -10.775 -12.681
  675    HE1  TYR  79           HE2      TYR  79  77.240  -6.208 -11.481
  676    HE2  TYR  79           HE1      TYR  79  76.479  -9.891 -13.547
  677    HH   TYR  79           HH       TYR  79  74.856  -8.159 -12.960
  678    H    SER  80           HN       SER  80  80.976 -12.311  -9.058
  679    HA   SER  80           HA       SER  80  83.801 -11.752  -8.835
  680    HB2  SER  80           HB2      SER  80  82.228 -12.881  -6.493
  681    HB3  SER  80           HB1      SER  80  83.979 -12.655  -6.551
  682    HG   SER  80           HG       SER  80  82.846 -10.392  -7.244
  Start of MODEL   14
    1    H1   GLY  -1           HT1      GLY  -1  55.161   1.395   5.819
    2    H2   GLY  -1           HT2      GLY  -1  56.739   1.312   6.444
    3    H3   GLY  -1           HT3      GLY  -1  55.812  -0.093   6.229
    4    HA2  GLY  -1           HA1      GLY  -1  56.689   1.646   4.032
    5    HA3  GLY  -1           HA2      GLY  -1  57.446   0.126   4.499
    6    H    ALA   0           HN       ALA   0  56.931  -0.674   2.362
    7    HA   ALA   0           HA       ALA   0  54.556  -2.163   2.240
    8    HB1  ALA   0           HB1      ALA   0  53.541  -0.015   1.614
    9    HB2  ALA   0           HB2      ALA   0  53.576  -1.107   0.230
   10    HB3  ALA   0           HB3      ALA   0  54.754   0.202   0.355
   11    H    MET   1           HN       MET   1  54.565  -3.418   0.180
   12    HA   MET   1           HA       MET   1  57.265  -3.647  -0.747
   13    HB2  MET   1           HB2      MET   1  56.519  -5.670  -1.950
   14    HB3  MET   1           HB1      MET   1  56.324  -5.757  -0.218
   15    HG2  MET   1           HG2      MET   1  54.579  -6.833  -1.286
   16    HG3  MET   1           HG1      MET   1  53.907  -5.402  -0.524
   17    HE1  MET   1           HE1      MET   1  55.282  -6.862  -3.902
   18    HE2  MET   1           HE2      MET   1  55.840  -5.170  -4.032
   19    HE3  MET   1           HE3      MET   1  54.583  -5.765  -5.091
   20    H    PHE   2           HN       PHE   2  57.889  -3.404  -2.818
   21    HA   PHE   2           HA       PHE   2  56.063  -1.738  -4.340
   22    HB2  PHE   2           HB2      PHE   2  59.015  -1.753  -4.124
   23    HB3  PHE   2           HB1      PHE   2  58.300  -0.936  -5.477
   24    HD1  PHE   2           HD1      PHE   2  55.912   0.262  -4.098
   25    HD2  PHE   2           HD2      PHE   2  59.975  -0.079  -2.927
   26    HE1  PHE   2           HE1      PHE   2  55.690   2.258  -2.714
   27    HE2  PHE   2           HE2      PHE   2  59.827   1.795  -1.635
   28    HZ   PHE   2           HZ       PHE   2  57.639   3.069  -1.432
   29    H    GLN   3           HN       GLN   3  55.557  -2.122  -6.354
   30    HA   GLN   3           HA       GLN   3  56.210  -4.748  -7.236
   31    HB2  GLN   3           HB2      GLN   3  53.917  -3.099  -7.492
   32    HB3  GLN   3           HB1      GLN   3  54.443  -3.546  -9.102
   33    HG2  GLN   3           HG2      GLN   3  53.813  -5.502  -6.867
   34    HG3  GLN   3           HG1      GLN   3  52.726  -5.067  -8.169
   35   HE21  GLN   3          HE21      GLN   3  56.234  -5.870  -8.328
   36   HE22  GLN   3          HE22      GLN   3  56.080  -7.070  -9.508
   37    H    ASP   4           HN       ASP   4  56.228  -4.952  -9.843
   38    HA   ASP   4           HA       ASP   4  58.633  -3.699 -10.524
   39    HB2  ASP   4           HB2      ASP   4  58.741  -5.330 -12.336
   40    HB3  ASP   4           HB1      ASP   4  58.273  -6.131 -10.852
   41    HA   PRO   5           HA       PRO   5  59.558  -3.623 -12.830
   42    HB2  PRO   5           HB2      PRO   5  60.127  -1.297 -14.453
   43    HB3  PRO   5           HB1      PRO   5  60.019  -2.980 -14.967
   44    HG2  PRO   5           HG2      PRO   5  58.218  -1.061 -15.720
   45    HG3  PRO   5           HG1      PRO   5  57.822  -2.784 -15.595
   46    HD2  PRO   5           HD2      PRO   5  57.299  -0.577 -13.630
   47    HD3  PRO   5           HD1      PRO   5  56.222  -1.891 -14.147
   48    H    GLN   6           HN       GLN   6  59.213  -0.047 -12.880
   49    HA   GLN   6           HA       GLN   6  61.029  -0.024 -10.599
   50    HB2  GLN   6           HB2      GLN   6  60.933   1.959 -12.875
   51    HB3  GLN   6           HB1      GLN   6  61.906   2.132 -11.428
   52    HG2  GLN   6           HG2      GLN   6  63.169   0.141 -12.025
   53    HG3  GLN   6           HG1      GLN   6  62.169  -0.064 -13.466
   54   HE21  GLN   6          HE21      GLN   6  64.634   1.853 -11.951
   55   HE22  GLN   6          HE22      GLN   6  65.118   2.684 -13.372
   56    H    GLU   7           HN       GLU   7  58.734  -0.196  -9.672
   57    HA   GLU   7           HA       GLU   7  57.380   2.327  -9.447
   58    HB2  GLU   7           HB2      GLU   7  56.180   0.166  -9.203
   59    HB3  GLU   7           HB1      GLU   7  57.163  -0.217  -7.807
   60    HG2  GLU   7           HG2      GLU   7  56.160   1.638  -6.593
   61    HG3  GLU   7           HG1      GLU   7  55.171   2.028  -8.001
   62    H    ARG   8           HN       ARG   8  59.893   0.810  -8.192
   63    HA   ARG   8           HA       ARG   8  60.301   2.780  -6.108
   64    HB2  ARG   8           HB2      ARG   8  61.378   1.181  -4.690
   65    HB3  ARG   8           HB1      ARG   8  59.781   0.615  -5.107
   66    HG2  ARG   8           HG2      ARG   8  62.360  -0.324  -6.254
   67    HG3  ARG   8           HG1      ARG   8  61.409  -1.054  -4.928
   68    HD2  ARG   8           HD2      ARG   8  59.781  -1.886  -6.393
   69    HD3  ARG   8           HD1      ARG   8  60.154  -0.727  -7.666
   70    HE   ARG   8           HE       ARG   8  62.301  -2.048  -7.849
   71   HH11  ARG   8          HH11      ARG   8  59.269  -3.686  -6.829
   72   HH12  ARG   8          HH12      ARG   8  59.671  -5.123  -7.632
   73   HH21  ARG   8          HH21      ARG   8  62.742  -4.116  -8.967
   74   HH22  ARG   8          HH22      ARG   8  61.628  -5.374  -8.846
   75    HA   PRO   9           HA       PRO   9  63.959   3.932  -8.262
   76    HB2  PRO   9           HB2      PRO   9  65.395   4.941  -6.186
   77    HB3  PRO   9           HB1      PRO   9  64.057   5.821  -6.829
   78    HG2  PRO   9           HG2      PRO   9  64.351   4.288  -4.391
   79    HG3  PRO   9           HG1      PRO   9  63.256   5.629  -4.772
   80    HD2  PRO   9           HD2      PRO   9  62.619   2.973  -4.521
   81    HD3  PRO   9           HD1      PRO   9  61.564   4.145  -5.240
   82    H    ARG  10           HN       ARG  10  66.544   4.210  -7.322
   83    HA   ARG  10           HA       ARG  10  67.405   1.681  -6.169
   84    HB2  ARG  10           HB2      ARG  10  68.547   3.283  -8.409
   85    HB3  ARG  10           HB1      ARG  10  69.421   2.007  -7.572
   86    HG2  ARG  10           HG2      ARG  10  66.790   1.600  -8.983
   87    HG3  ARG  10           HG1      ARG  10  68.380   1.414  -9.722
   88    HD2  ARG  10           HD2      ARG  10  67.552  -0.118  -7.275
   89    HD3  ARG  10           HD1      ARG  10  67.279  -0.721  -8.906
   90    HE   ARG  10           HE       ARG  10  69.866  -0.262  -7.613
   91   HH11  ARG  10          HH11      ARG  10  67.945  -1.781 -10.194
   92   HH12  ARG  10          HH12      ARG  10  69.269  -2.579 -10.896
   93   HH21  ARG  10          HH21      ARG  10  71.716  -1.383  -8.642
   94   HH22  ARG  10          HH22      ARG  10  71.413  -2.354 -10.003
   95    H    LYS  11           HN       LYS  11  67.005   4.902  -5.551
   96    HA   LYS  11           HA       LYS  11  69.557   5.081  -4.117
   97    HB2  LYS  11           HB2      LYS  11  67.654   7.324  -4.681
   98    HB3  LYS  11           HB1      LYS  11  69.240   7.373  -3.996
   99    HG2  LYS  11           HG2      LYS  11  70.165   6.532  -6.156
  100    HG3  LYS  11           HG1      LYS  11  68.562   6.816  -6.855
  101    HD2  LYS  11           HD2      LYS  11  68.653   9.118  -5.996
  102    HD3  LYS  11           HD1      LYS  11  70.302   8.778  -5.453
  103    HE2  LYS  11           HE2      LYS  11  70.355  10.002  -7.573
  104    HE3  LYS  11           HE1      LYS  11  70.962   8.366  -7.799
  105    HZ1  LYS  11           HZ1      LYS  11  68.167   9.178  -8.412
  106    HZ2  LYS  11           HZ2      LYS  11  68.938   7.744  -8.900
  107    HZ3  LYS  11           HZ3      LYS  11  69.408   9.209  -9.515
  108    H    LEU  12           HN       LEU  12  69.451   5.521  -1.932
  109    HA   LEU  12           HA       LEU  12  67.266   4.640  -0.458
  110    HB2  LEU  12           HB2      LEU  12  69.359   4.442   0.515
  111    HB3  LEU  12           HB1      LEU  12  69.742   6.137   0.283
  112    HG   LEU  12           HG       LEU  12  68.050   6.732   1.958
  113   HD11  LEU  12          HD11      LEU  12  67.080   5.059   3.360
  114   HD12  LEU  12          HD12      LEU  12  67.919   3.785   2.462
  115   HD13  LEU  12          HD13      LEU  12  66.632   4.720   1.668
  116   HD21  LEU  12          HD21      LEU  12  70.418   6.337   2.511
  117   HD22  LEU  12          HD22      LEU  12  69.937   4.688   2.978
  118   HD23  LEU  12          HD23      LEU  12  69.292   6.075   3.850
  119    HA   PRO  13           HA       PRO  13  66.207   9.081   0.923
  120    HB2  PRO  13           HB2      PRO  13  67.093  11.254  -0.454
  121    HB3  PRO  13           HB1      PRO  13  68.136  10.392   0.710
  122    HG2  PRO  13           HG2      PRO  13  68.057  10.054  -2.259
  123    HG3  PRO  13           HG1      PRO  13  69.451  10.402  -1.216
  124    HD2  PRO  13           HD2      PRO  13  68.860   7.909  -1.995
  125    HD3  PRO  13           HD1      PRO  13  69.521   8.218  -0.387
  126    H    GLN  14           HN       GLN  14  66.522   8.560  -2.422
  127    HA   GLN  14           HA       GLN  14  64.152   9.849  -3.371
  128    HB2  GLN  14           HB2      GLN  14  66.406   8.988  -4.477
  129    HB3  GLN  14           HB1      GLN  14  65.457   7.531  -4.711
  130    HG2  GLN  14           HG2      GLN  14  63.828   8.831  -5.950
  131    HG3  GLN  14           HG1      GLN  14  64.831  10.273  -5.756
  132   HE21  GLN  14          HE21      GLN  14  64.459   7.309  -7.357
  133   HE22  GLN  14          HE22      GLN  14  65.753   7.443  -8.483
  134    H    LEU  15           HN       LEU  15  64.999   6.466  -2.429
  135    HA   LEU  15           HA       LEU  15  62.582   5.246  -2.928
  136    HB2  LEU  15           HB2      LEU  15  64.719   4.108  -2.325
  137    HB3  LEU  15           HB1      LEU  15  64.580   4.823  -0.783
  138    HG   LEU  15           HG       LEU  15  62.648   3.589  -0.213
  139   HD11  LEU  15          HD11      LEU  15  61.812   1.799  -1.641
  140   HD12  LEU  15          HD12      LEU  15  62.985   2.203  -2.872
  141   HD13  LEU  15          HD13      LEU  15  61.659   3.342  -2.492
  142   HD21  LEU  15          HD21      LEU  15  64.848   1.986  -1.368
  143   HD22  LEU  15          HD22      LEU  15  63.719   1.424  -0.112
  144   HD23  LEU  15          HD23      LEU  15  64.833   2.790   0.189
  145    H    CYS  16           HN       CYS  16  63.768   6.896  -0.108
  146    HA   CYS  16           HA       CYS  16  61.691   6.368   1.675
  147    HB2  CYS  16           HB2      CYS  16  63.340   8.872   1.328
  148    HB3  CYS  16           HB1      CYS  16  62.400   8.502   2.766
  149    HG   CYS  16           HG       CYS  16  65.068   6.691   1.605
  150    H    THR  17           HN       THR  17  61.883   8.789  -0.884
  151    HA   THR  17           HA       THR  17  59.563  10.211  -0.407
  152    HB   THR  17           HB       THR  17  60.954   9.414  -2.907
  153    HG1  THR  17           HG1      THR  17  61.389  11.253  -0.956
  154   HG21  THR  17          HG21      THR  17  58.833  11.547  -2.541
  155   HG22  THR  17          HG22      THR  17  58.732  10.060  -3.513
  156   HG23  THR  17          HG23      THR  17  59.848  11.345  -3.984
  157    H    GLU  18           HN       GLU  18  60.033   7.236  -2.438
  158    HA   GLU  18           HA       GLU  18  57.521   6.760  -3.178
  159    HB2  GLU  18           HB2      GLU  18  59.951   5.265  -2.675
  160    HB3  GLU  18           HB1      GLU  18  58.474   4.335  -2.918
  161    HG2  GLU  18           HG2      GLU  18  59.572   4.593  -4.979
  162    HG3  GLU  18           HG1      GLU  18  58.075   5.575  -4.875
  163    H    LEU  19           HN       LEU  19  59.114   5.627  -0.204
  164    HA   LEU  19           HA       LEU  19  56.747   4.436   0.803
  165    HB2  LEU  19           HB2      LEU  19  59.404   5.083   1.895
  166    HB3  LEU  19           HB1      LEU  19  58.285   4.293   2.889
  167    HG   LEU  19           HG       LEU  19  58.350   2.516   0.717
  168   HD11  LEU  19          HD11      LEU  19  60.902   3.935   0.758
  169   HD12  LEU  19          HD12      LEU  19  59.747   3.756  -0.574
  170   HD13  LEU  19          HD13      LEU  19  60.610   2.349   0.068
  171   HD21  LEU  19          HD21      LEU  19  60.334   2.734   2.911
  172   HD22  LEU  19          HD22      LEU  19  59.942   1.266   1.993
  173   HD23  LEU  19          HD23      LEU  19  58.744   1.986   3.093
  174    H    GLN  20           HN       GLN  20  57.373   7.584   0.415
  175    HA   GLN  20           HA       GLN  20  56.441   9.492   1.211
  176    HB2  GLN  20           HB2      GLN  20  54.658   7.450   2.419
  177    HB3  GLN  20           HB1      GLN  20  54.273   9.181   2.490
  178    HG2  GLN  20           HG2      GLN  20  54.246   9.186   0.007
  179    HG3  GLN  20           HG1      GLN  20  54.554   7.452   0.027
  180   HE21  GLN  20          HE21      GLN  20  52.664   6.993  -1.017
  181   HE22  GLN  20          HE22      GLN  20  51.116   7.113  -0.289
  182    H    THR  21           HN       THR  21  58.599   8.462   2.601
  183    HA   THR  21           HA       THR  21  58.184   9.664   5.186
  184    HB   THR  21           HB       THR  21  57.637   7.209   5.413
  185    HG1  THR  21           HG1      THR  21  58.758   7.048   7.338
  186   HG21  THR  21          HG21      THR  21  59.502   5.605   5.439
  187   HG22  THR  21          HG22      THR  21  60.574   6.858   4.817
  188   HG23  THR  21          HG23      THR  21  59.226   6.268   3.823
  189    H    THR  22           HN       THR  22  60.653   9.080   6.290
  190    HA   THR  22           HA       THR  22  62.551   9.903   4.190
  191    HB   THR  22           HB       THR  22  63.069  10.829   6.963
  192    HG1  THR  22           HG1      THR  22  60.908  11.720   5.287
  193   HG21  THR  22          HG21      THR  22  64.584  11.377   5.115
  194   HG22  THR  22          HG22      THR  22  63.822  12.847   5.713
  195   HG23  THR  22          HG23      THR  22  63.252  12.099   4.217
  196    H    ILE  23           HN       ILE  23  64.932   9.610   5.232
  197    HA   ILE  23           HA       ILE  23  65.527   6.993   5.476
  198    HB   ILE  23           HB       ILE  23  67.035   9.217   6.751
  199   HG12  ILE  23          HG12      ILE  23  66.784   8.327   3.919
  200   HG13  ILE  23          HG11      ILE  23  66.576   9.906   4.595
  201   HG21  ILE  23          HG21      ILE  23  67.883   6.957   7.281
  202   HG22  ILE  23          HG22      ILE  23  69.010   7.756   6.171
  203   HG23  ILE  23          HG23      ILE  23  67.871   6.547   5.564
  204   HD11  ILE  23          HD11      ILE  23  69.141   8.414   4.358
  205   HD12  ILE  23          HD12      ILE  23  68.995  10.042   5.032
  206   HD13  ILE  23          HD13      ILE  23  68.660   9.748   3.305
  207    H    HIS  24           HN       HIS  24  64.541   9.256   7.750
  208    HA   HIS  24           HA       HIS  24  65.671   8.394  10.166
  209    HB2  HIS  24           HB2      HIS  24  63.311  10.213   9.777
  210    HB3  HIS  24           HB1      HIS  24  64.515  10.310  11.037
  211    HD1  HIS  24           HD1      HIS  24  66.837  10.026   8.772
  212    HD2  HIS  24           HD2      HIS  24  63.823  12.769   9.034
  213    HE1  HIS  24           HE1      HIS  24  67.369  11.679   6.959
  214    H    ASP  25           HN       ASP  25  63.156   7.250   8.335
  215    HA   ASP  25           HA       ASP  25  61.731   6.081  10.639
  216    HB2  ASP  25           HB2      ASP  25  60.541   8.139   9.760
  217    HB3  ASP  25           HB1      ASP  25  60.453   7.322   8.247
  218    H    ILE  26           HN       ILE  26  62.395   6.047   7.177
  219    HA   ILE  26           HA       ILE  26  60.995   3.942   6.210
  220    HB   ILE  26           HB       ILE  26  62.292   5.341   4.743
  221   HG12  ILE  26          HG12      ILE  26  63.452   2.612   4.576
  222   HG13  ILE  26          HG11      ILE  26  61.806   2.805   4.125
  223   HG21  ILE  26          HG21      ILE  26  64.723   5.153   4.575
  224   HG22  ILE  26          HG22      ILE  26  64.724   3.978   5.887
  225   HG23  ILE  26          HG23      ILE  26  64.240   5.643   6.205
  226   HD11  ILE  26          HD11      ILE  26  63.174   2.767   2.205
  227   HD12  ILE  26          HD12      ILE  26  64.247   4.014   2.841
  228   HD13  ILE  26          HD13      ILE  26  62.590   4.429   2.355
  229    H    ILE  27           HN       ILE  27  60.850   1.852   6.325
  230    HA   ILE  27           HA       ILE  27  62.931   0.408   7.679
  231    HB   ILE  27           HB       ILE  27  60.140  -0.385   6.849
  232   HG12  ILE  27          HG12      ILE  27  60.163   1.159   8.732
  233   HG13  ILE  27          HG11      ILE  27  59.644  -0.448   9.223
  234   HG21  ILE  27          HG21      ILE  27  61.617  -2.273   6.719
  235   HG22  ILE  27          HG22      ILE  27  60.509  -2.460   8.086
  236   HG23  ILE  27          HG23      ILE  27  62.193  -1.978   8.361
  237   HD11  ILE  27          HD11      ILE  27  61.876  -0.850  10.175
  238   HD12  ILE  27          HD12      ILE  27  61.090   0.552  10.897
  239   HD13  ILE  27          HD13      ILE  27  62.362   0.779   9.700
  240    H    LEU  28           HN       LEU  28  64.453  -0.094   6.712
  241    HA   LEU  28           HA       LEU  28  64.194  -1.116   4.006
  242    HB2  LEU  28           HB2      LEU  28  65.599   1.035   4.952
  243    HB3  LEU  28           HB1      LEU  28  66.797  -0.245   4.816
  244    HG   LEU  28           HG       LEU  28  66.277  -0.598   2.526
  245   HD11  LEU  28          HD11      LEU  28  63.941   0.898   3.406
  246   HD12  LEU  28          HD12      LEU  28  64.040  -0.375   2.170
  247   HD13  LEU  28          HD13      LEU  28  64.483   1.300   1.773
  248   HD21  LEU  28          HD21      LEU  28  66.322   2.354   3.070
  249   HD22  LEU  28          HD22      LEU  28  66.895   1.539   1.609
  250   HD23  LEU  28          HD23      LEU  28  67.744   1.328   3.144
  251    H    GLU  29           HN       GLU  29  65.188  -3.278   3.822
  252    HA   GLU  29           HA       GLU  29  66.747  -3.741   6.258
  253    HB2  GLU  29           HB2      GLU  29  66.362  -6.076   6.045
  254    HB3  GLU  29           HB1      GLU  29  65.034  -5.127   6.814
  255    HG2  GLU  29           HG2      GLU  29  63.998  -5.305   4.620
  256    HG3  GLU  29           HG1      GLU  29  65.314  -6.464   4.246
  257    H    CYS  30           HN       CYS  30  68.306  -5.858   6.094
  258    HA   CYS  30           HA       CYS  30  69.881  -5.524   3.967
  259    HB2  CYS  30           HB2      CYS  30  69.336  -8.024   5.489
  260    HB3  CYS  30           HB1      CYS  30  70.695  -7.635   4.452
  261    H    VAL  31           HN       VAL  31  69.783  -6.161   2.171
  262    HA   VAL  31           HA       VAL  31  67.796  -7.721   0.876
  263    HB   VAL  31           HB       VAL  31  68.918  -5.993  -0.401
  264   HG11  VAL  31          HG11      VAL  31  71.416  -7.120   0.666
  265   HG12  VAL  31          HG12      VAL  31  70.747  -5.445   0.804
  266   HG13  VAL  31          HG13      VAL  31  71.276  -6.113  -0.759
  267   HG21  VAL  31          HG21      VAL  31  70.151  -8.582  -1.210
  268   HG22  VAL  31          HG22      VAL  31  70.247  -7.067  -2.109
  269   HG23  VAL  31          HG23      VAL  31  68.681  -7.821  -1.852
  270    H    TYR  32           HN       TYR  32  70.914  -8.221   2.261
  271    HA   TYR  32           HA       TYR  32  71.085 -10.918   1.256
  272    HB2  TYR  32           HB2      TYR  32  73.249  -9.411   2.720
  273    HB3  TYR  32           HB1      TYR  32  73.438 -10.909   1.805
  274    HD1  TYR  32           HD2      TYR  32  71.914 -10.461  -0.667
  275    HD2  TYR  32           HD1      TYR  32  74.330  -7.710   1.555
  276    HE1  TYR  32           HE2      TYR  32  72.181  -9.198  -2.595
  277    HE2  TYR  32           HE1      TYR  32  74.591  -6.309  -0.449
  278    HH   TYR  32           HH       TYR  32  74.370  -6.458  -2.844
  279    H    CYS  33           HN       CYS  33  71.230  -9.309   4.512
  280    HA   CYS  33           HA       CYS  33  71.281 -11.894   5.885
  281    HB2  CYS  33           HB2      CYS  33  70.810  -9.253   7.302
  282    HB3  CYS  33           HB1      CYS  33  71.474 -10.729   7.923
  283    H    LYS  34           HN       LYS  34  68.986  -9.793   4.606
  284    HA   LYS  34           HA       LYS  34  66.979  -9.215   4.845
  285    HB2  LYS  34           HB2      LYS  34  66.622 -12.052   5.798
  286    HB3  LYS  34           HB1      LYS  34  65.287 -10.996   5.380
  287    HG2  LYS  34           HG2      LYS  34  65.660 -12.362   3.495
  288    HG3  LYS  34           HG1      LYS  34  66.338 -10.792   3.072
  289    HD2  LYS  34           HD2      LYS  34  68.518 -11.560   3.454
  290    HD3  LYS  34           HD1      LYS  34  67.936 -13.024   4.226
  291    HE2  LYS  34           HE2      LYS  34  66.977 -13.702   2.004
  292    HE3  LYS  34           HE1      LYS  34  67.718 -12.263   1.300
  293    HZ1  LYS  34           HZ1      LYS  34  69.132 -14.514   2.605
  294    HZ2  LYS  34           HZ2      LYS  34  69.900 -13.152   2.063
  295    HZ3  LYS  34           HZ3      LYS  34  69.135 -14.200   0.960
  296    H    GLN  35           HN       GLN  35  68.448  -8.233   7.016
  297    HA   GLN  35           HA       GLN  35  66.639  -8.428   9.209
  298    HB2  GLN  35           HB2      GLN  35  68.441  -9.472   9.909
  299    HB3  GLN  35           HB1      GLN  35  69.589  -8.612   8.873
  300    HG2  GLN  35           HG2      GLN  35  70.070  -7.930  11.023
  301    HG3  GLN  35           HG1      GLN  35  69.056  -6.711  10.207
  302   HE21  GLN  35          HE21      GLN  35  67.555  -9.588  11.348
  303   HE22  GLN  35          HE22      GLN  35  66.720  -8.892  12.679
  304    H    GLN  36           HN       GLN  36  65.943  -6.437   9.874
  305    HA   GLN  36           HA       GLN  36  66.163  -4.256   8.219
  306    HB2  GLN  36           HB2      GLN  36  65.068  -4.844  10.894
  307    HB3  GLN  36           HB1      GLN  36  65.124  -3.199  10.299
  308    HG2  GLN  36           HG2      GLN  36  63.785  -3.751   8.437
  309    HG3  GLN  36           HG1      GLN  36  63.941  -5.466   8.775
  310   HE21  GLN  36          HE21      GLN  36  63.331  -3.033  11.260
  311   HE22  GLN  36          HE22      GLN  36  61.710  -3.501  11.567
  312    H    LEU  37           HN       LEU  37  67.463  -2.703   8.114
  313    HA   LEU  37           HA       LEU  37  69.897  -2.664   9.553
  314    HB2  LEU  37           HB2      LEU  37  68.658  -0.852   7.522
  315    HB3  LEU  37           HB1      LEU  37  69.926  -0.316   8.554
  316    HG   LEU  37           HG       LEU  37  71.329  -2.222   7.767
  317   HD11  LEU  37          HD11      LEU  37  70.725  -3.260   5.628
  318   HD12  LEU  37          HD12      LEU  37  69.111  -2.561   5.785
  319   HD13  LEU  37          HD13      LEU  37  69.686  -3.728   6.969
  320   HD21  LEU  37          HD21      LEU  37  71.678   0.011   6.944
  321   HD22  LEU  37          HD22      LEU  37  70.405  -0.199   5.748
  322   HD23  LEU  37          HD23      LEU  37  71.888  -1.147   5.630
  323    H    LEU  38           HN       LEU  38  70.727  -1.467  11.023
  324    HA   LEU  38           HA       LEU  38  69.153  -0.234  12.973
  325    HB2  LEU  38           HB2      LEU  38  71.709  -1.197  12.594
  326    HB3  LEU  38           HB1      LEU  38  71.917   0.521  12.537
  327    HG   LEU  38           HG       LEU  38  70.625  -0.954  14.769
  328   HD11  LEU  38          HD11      LEU  38  72.769  -0.573  15.971
  329   HD12  LEU  38          HD12      LEU  38  73.419   0.130  14.474
  330   HD13  LEU  38          HD13      LEU  38  72.927  -1.563  14.511
  331   HD21  LEU  38          HD21      LEU  38  69.923   1.381  14.637
  332   HD22  LEU  38          HD22      LEU  38  71.612   1.889  14.596
  333   HD23  LEU  38          HD23      LEU  38  70.954   1.135  16.048
  334    H    ARG  39           HN       ARG  39  68.544   1.955  12.921
  335    HA   ARG  39           HA       ARG  39  68.382   3.363  10.562
  336    HB2  ARG  39           HB2      ARG  39  67.109   3.856  12.624
  337    HB3  ARG  39           HB1      ARG  39  68.558   4.568  13.309
  338    HG2  ARG  39           HG2      ARG  39  68.568   6.282  11.596
  339    HG3  ARG  39           HG1      ARG  39  67.151   5.558  10.846
  340    HD2  ARG  39           HD2      ARG  39  67.278   6.658  13.642
  341    HD3  ARG  39           HD1      ARG  39  66.522   7.455  12.256
  342    HE   ARG  39           HE       ARG  39  65.363   5.011  12.367
  343   HH11  ARG  39          HH11      ARG  39  65.649   7.667  14.662
  344   HH12  ARG  39          HH12      ARG  39  64.171   7.337  15.443
  345   HH21  ARG  39          HH21      ARG  39  63.369   4.520  13.446
  346   HH22  ARG  39          HH22      ARG  39  62.853   5.496  14.736
  347    H    ARG  40           HN       ARG  40  71.032   3.355  12.851
  348    HA   ARG  40           HA       ARG  40  72.545   5.494  11.970
  349    HB2  ARG  40           HB2      ARG  40  73.403   2.806  13.029
  350    HB3  ARG  40           HB1      ARG  40  74.382   4.259  12.952
  351    HG2  ARG  40           HG2      ARG  40  71.884   3.927  14.585
  352    HG3  ARG  40           HG1      ARG  40  73.534   3.834  15.202
  353    HD2  ARG  40           HD2      ARG  40  72.181   6.207  13.945
  354    HD3  ARG  40           HD1      ARG  40  72.581   6.003  15.649
  355    HE   ARG  40           HE       ARG  40  74.894   5.776  14.035
  356   HH11  ARG  40          HH11      ARG  40  72.704   8.098  15.486
  357   HH12  ARG  40          HH12      ARG  40  73.762   9.418  15.368
  358   HH21  ARG  40          HH21      ARG  40  76.391   7.562  13.882
  359   HH22  ARG  40          HH22      ARG  40  75.944   9.092  14.467
  360    H    GLU  41           HN       GLU  41  72.573   2.054  10.976
  361    HA   GLU  41           HA       GLU  41  74.589   2.274   8.972
  362    HB2  GLU  41           HB2      GLU  41  72.348   0.257   9.133
  363    HB3  GLU  41           HB1      GLU  41  73.841  -0.014   8.304
  364    HG2  GLU  41           HG2      GLU  41  73.190  -0.287  11.203
  365    HG3  GLU  41           HG1      GLU  41  74.122  -1.270  10.123
  366    H    VAL  42           HN       VAL  42  71.134   2.617   9.041
  367    HA   VAL  42           HA       VAL  42  70.726   2.674   6.228
  368    HB   VAL  42           HB       VAL  42  68.959   4.248   8.134
  369   HG11  VAL  42          HG11      VAL  42  68.557   4.372   5.666
  370   HG12  VAL  42          HG12      VAL  42  67.212   3.672   6.583
  371   HG13  VAL  42          HG13      VAL  42  68.317   2.611   5.715
  372   HG21  VAL  42          HG21      VAL  42  67.648   2.233   8.535
  373   HG22  VAL  42          HG22      VAL  42  69.299   2.018   9.121
  374   HG23  VAL  42          HG23      VAL  42  68.800   1.295   7.594
  375    H    TYR  43           HN       TYR  43  71.386   5.311   8.601
  376    HA   TYR  43           HA       TYR  43  71.388   7.391   6.728
  377    HB2  TYR  43           HB2      TYR  43  72.933   7.095   9.287
  378    HB3  TYR  43           HB1      TYR  43  73.014   8.550   8.287
  379    HD1  TYR  43           HD2      TYR  43  70.452   9.125   7.466
  380    HD2  TYR  43           HD1      TYR  43  71.621   7.362  11.132
  381    HE1  TYR  43           HE2      TYR  43  68.385   9.870   8.460
  382    HE2  TYR  43           HE1      TYR  43  69.535   8.098  12.155
  383    HH   TYR  43           HH       TYR  43  67.808   9.929  11.732
  384    H    ASP  44           HN       ASP  44  73.979   5.134   7.626
  385    HA   ASP  44           HA       ASP  44  76.136   6.310   6.439
  386    HB2  ASP  44           HB2      ASP  44  75.380   3.403   6.542
  387    HB3  ASP  44           HB1      ASP  44  76.922   4.008   6.086
  388    H    PHE  45           HN       PHE  45  73.635   4.424   5.112
  389    HA   PHE  45           HA       PHE  45  74.648   3.812   2.629
  390    HB2  PHE  45           HB2      PHE  45  72.371   3.314   3.983
  391    HB3  PHE  45           HB1      PHE  45  71.852   4.556   2.867
  392    HD1  PHE  45           HD1      PHE  45  73.403   1.247   3.095
  393    HD2  PHE  45           HD2      PHE  45  71.489   4.169   0.676
  394    HE1  PHE  45           HE1      PHE  45  73.060  -0.421   1.281
  395    HE2  PHE  45           HE2      PHE  45  71.187   2.539  -1.098
  396    HZ   PHE  45           HZ       PHE  45  71.931   0.259  -0.807
  397    H    ALA  46           HN       ALA  46  72.736   6.671   3.625
  398    HA   ALA  46           HA       ALA  46  73.074   7.910   1.019
  399    HB1  ALA  46           HB1      ALA  46  70.890   8.217   2.150
  400    HB2  ALA  46           HB2      ALA  46  71.680   9.747   1.876
  401    HB3  ALA  46           HB3      ALA  46  71.732   9.013   3.480
  402    H    ARG  47           HN       ARG  47  74.487   8.105   4.167
  403    HA   ARG  47           HA       ARG  47  75.785  10.624   3.769
  404    HB2  ARG  47           HB2      ARG  47  75.809   8.495   5.824
  405    HB3  ARG  47           HB1      ARG  47  77.217   9.516   5.830
  406    HG2  ARG  47           HG2      ARG  47  75.497  10.254   7.433
  407    HG3  ARG  47           HG1      ARG  47  75.801  11.482   6.210
  408    HD2  ARG  47           HD2      ARG  47  73.782  10.875   5.038
  409    HD3  ARG  47           HD1      ARG  47  73.514   9.513   6.115
  410    HE   ARG  47           HE       ARG  47  73.518  11.513   7.838
  411   HH11  ARG  47          HH11      ARG  47  71.929  11.441   4.649
  412   HH12  ARG  47          HH12      ARG  47  70.522  12.217   5.183
  413   HH21  ARG  47          HH21      ARG  47  71.570  12.642   8.538
  414   HH22  ARG  47          HH22      ARG  47  70.324  12.967   7.440
  415    H    ARG  48           HN       ARG  48  76.452   7.434   2.853
  416    HA   ARG  48           HA       ARG  48  79.099   8.183   1.855
  417    HB2  ARG  48           HB2      ARG  48  77.727   5.555   2.170
  418    HB3  ARG  48           HB1      ARG  48  79.377   5.763   1.616
  419    HG2  ARG  48           HG2      ARG  48  80.060   6.532   3.779
  420    HG3  ARG  48           HG1      ARG  48  78.385   6.595   4.336
  421    HD2  ARG  48           HD2      ARG  48  78.198   4.181   3.974
  422    HD3  ARG  48           HD1      ARG  48  79.882   4.157   3.471
  423    HE   ARG  48           HE       ARG  48  79.687   5.330   5.998
  424   HH11  ARG  48          HH11      ARG  48  79.513   2.089   4.546
  425   HH12  ARG  48          HH12      ARG  48  79.731   1.280   6.026
  426   HH21  ARG  48          HH21      ARG  48  80.029   4.163   8.002
  427   HH22  ARG  48          HH22      ARG  48  80.035   2.458   8.006
  428    H    ASP  49           HN       ASP  49  78.899   6.054  -0.233
  429    HA   ASP  49           HA       ASP  49  76.644   7.105  -1.748
  430    HB2  ASP  49           HB2      ASP  49  78.651   8.268  -2.583
  431    HB3  ASP  49           HB1      ASP  49  79.409   6.717  -2.927
  432    H    LEU  50           HN       LEU  50  75.782   5.098  -0.823
  433    HA   LEU  50           HA       LEU  50  76.474   2.845  -2.473
  434    HB2  LEU  50           HB2      LEU  50  74.849   3.021   0.050
  435    HB3  LEU  50           HB1      LEU  50  75.088   1.555  -0.872
  436    HG   LEU  50           HG       LEU  50  77.569   1.957  -0.489
  437   HD11  LEU  50          HD11      LEU  50  76.520   3.716   1.674
  438   HD12  LEU  50          HD12      LEU  50  77.463   4.168   0.251
  439   HD13  LEU  50          HD13      LEU  50  78.193   3.151   1.501
  440   HD21  LEU  50          HD21      LEU  50  75.766   1.258   1.774
  441   HD22  LEU  50          HD22      LEU  50  77.500   0.918   1.709
  442   HD23  LEU  50          HD23      LEU  50  76.398   0.143   0.548
  443    H    CYS  51           HN       CYS  51  74.766   1.668  -3.445
  444    HA   CYS  51           HA       CYS  51  72.339   3.225  -3.910
  445    HB2  CYS  51           HB2      CYS  51  72.288   1.987  -6.114
  446    HB3  CYS  51           HB1      CYS  51  73.625   3.126  -5.916
  447    HG   CYS  51           HG       CYS  51  73.777   0.096  -6.859
  448    H    ILE  52           HN       ILE  52  70.418   1.933  -4.228
  449    HA   ILE  52           HA       ILE  52  70.398  -0.107  -2.209
  450    HB   ILE  52           HB       ILE  52  68.233   1.437  -3.577
  451   HG12  ILE  52          HG12      ILE  52  69.221   0.962  -0.845
  452   HG13  ILE  52          HG11      ILE  52  69.398   2.462  -1.813
  453   HG21  ILE  52          HG21      ILE  52  67.346  -0.885  -3.410
  454   HG22  ILE  52          HG22      ILE  52  66.548   0.205  -2.274
  455   HG23  ILE  52          HG23      ILE  52  67.786  -0.912  -1.701
  456   HD11  ILE  52          HD11      ILE  52  67.108   1.151  -0.631
  457   HD12  ILE  52          HD12      ILE  52  66.989   2.506  -1.800
  458   HD13  ILE  52          HD13      ILE  52  67.791   2.731  -0.174
  459    H    VAL  53           HN       VAL  53  69.574  -1.928  -2.269
  460    HA   VAL  53           HA       VAL  53  69.937  -3.397  -4.722
  461    HB   VAL  53           HB       VAL  53  70.730  -5.171  -2.978
  462   HG11  VAL  53          HG11      VAL  53  72.338  -2.659  -3.522
  463   HG12  VAL  53          HG12      VAL  53  72.188  -4.022  -4.629
  464   HG13  VAL  53          HG13      VAL  53  73.003  -4.232  -3.073
  465   HG21  VAL  53          HG21      VAL  53  69.985  -3.890  -1.008
  466   HG22  VAL  53          HG22      VAL  53  71.107  -2.598  -1.445
  467   HG23  VAL  53          HG23      VAL  53  71.724  -4.169  -0.992
  468    H    TYR  54           HN       TYR  54  68.029  -4.069  -5.265
  469    HA   TYR  54           HA       TYR  54  66.036  -4.803  -3.333
  470    HB2  TYR  54           HB2      TYR  54  66.045  -4.637  -6.334
  471    HB3  TYR  54           HB1      TYR  54  64.645  -5.032  -5.343
  472    HD1  TYR  54           HD1      TYR  54  67.087  -2.328  -6.062
  473    HD2  TYR  54           HD2      TYR  54  63.434  -3.414  -4.237
  474    HE1  TYR  54           HE1      TYR  54  66.566   0.051  -5.616
  475    HE2  TYR  54           HE2      TYR  54  62.927  -1.094  -3.842
  476    HH   TYR  54           HH       TYR  54  64.205   0.985  -3.472
  477    H    ARG  55           HN       ARG  55  66.064  -6.516  -2.598
  478    HA   ARG  55           HA       ARG  55  67.489  -8.712  -3.857
  479    HB2  ARG  55           HB2      ARG  55  67.017  -8.275  -1.147
  480    HB3  ARG  55           HB1      ARG  55  65.770  -9.413  -1.563
  481    HG2  ARG  55           HG2      ARG  55  68.722 -10.042  -2.067
  482    HG3  ARG  55           HG1      ARG  55  67.893 -10.409  -0.615
  483    HD2  ARG  55           HD2      ARG  55  67.035 -11.342  -3.355
  484    HD3  ARG  55           HD1      ARG  55  67.873 -12.334  -2.156
  485    HE   ARG  55           HE       ARG  55  65.679 -11.434  -0.854
  486   HH11  ARG  55          HH11      ARG  55  66.056 -13.136  -3.947
  487   HH12  ARG  55          HH12      ARG  55  64.605 -14.004  -3.779
  488   HH21  ARG  55          HH21      ARG  55  63.712 -12.547  -0.678
  489   HH22  ARG  55          HH22      ARG  55  63.215 -13.660  -1.863
  490    H    ASP  56           HN       ASP  56  66.237  -9.945  -5.347
  491    HA   ASP  56           HA       ASP  56  64.545 -10.840  -6.492
  492    HB2  ASP  56           HB2      ASP  56  63.761 -11.880  -4.393
  493    HB3  ASP  56           HB1      ASP  56  62.894 -10.395  -4.001
  494    H    GLY  57           HN       GLY  57  63.016  -8.335  -4.581
  495    HA2  GLY  57           HA2      GLY  57  63.030  -6.383  -6.502
  496    HA3  GLY  57           HA1      GLY  57  61.499  -7.242  -6.709
  497    H    ASN  58           HN       ASN  58  63.302  -6.586  -3.717
  498    HA   ASN  58           HA       ASN  58  61.164  -4.746  -2.812
  499    HB2  ASN  58           HB2      ASN  58  62.555  -6.753  -1.069
  500    HB3  ASN  58           HB1      ASN  58  61.105  -5.878  -0.686
  501   HD21  ASN  58          HD21      ASN  58  62.533  -8.534  -2.301
  502   HD22  ASN  58          HD22      ASN  58  61.140  -9.488  -2.550
  503    HA   PRO  59           HA       PRO  59  64.715  -2.573  -1.961
  504    HB2  PRO  59           HB2      PRO  59  63.353  -0.735  -0.179
  505    HB3  PRO  59           HB1      PRO  59  63.780  -0.497  -1.876
  506    HG2  PRO  59           HG2      PRO  59  61.139  -0.751  -1.121
  507    HG3  PRO  59           HG1      PRO  59  61.677  -1.323  -2.627
  508    HD2  PRO  59           HD2      PRO  59  61.354  -2.872  -0.152
  509    HD3  PRO  59           HD1      PRO  59  60.791  -3.248  -1.790
  510    H    TYR  60           HN       TYR  60  66.440  -2.921  -0.930
  511    HA   TYR  60           HA       TYR  60  66.255  -2.905   1.866
  512    HB2  TYR  60           HB2      TYR  60  67.908  -5.193   0.787
  513    HB3  TYR  60           HB1      TYR  60  67.269  -4.813   2.220
  514    HD1  TYR  60           HD1      TYR  60  65.100  -5.205   2.924
  515    HD2  TYR  60           HD2      TYR  60  66.417  -6.234  -0.882
  516    HE1  TYR  60           HE1      TYR  60  63.198  -6.796   2.720
  517    HE2  TYR  60           HE2      TYR  60  64.559  -7.811  -1.147
  518    HH   TYR  60           HH       TYR  60  61.978  -7.949   1.145
  519    H    ALA  61           HN       ALA  61  68.120  -2.654   2.709
  520    HA   ALA  61           HA       ALA  61  69.926  -0.910   1.289
  521    HB1  ALA  61           HB1      ALA  61  69.610  -1.564   4.115
  522    HB2  ALA  61           HB2      ALA  61  68.529  -0.449   3.332
  523    HB3  ALA  61           HB3      ALA  61  70.299  -0.066   3.441
  524    H    VAL  62           HN       VAL  62  72.110  -1.189   2.594
  525    HA   VAL  62           HA       VAL  62  72.806  -4.020   2.810
  526    HB   VAL  62           HB       VAL  62  74.372  -1.706   1.535
  527   HG11  VAL  62          HG11      VAL  62  75.398  -4.428   2.033
  528   HG12  VAL  62          HG12      VAL  62  75.764  -2.922   2.901
  529   HG13  VAL  62          HG13      VAL  62  76.195  -3.072   1.197
  530   HG21  VAL  62          HG21      VAL  62  74.451  -3.156  -0.433
  531   HG22  VAL  62          HG22      VAL  62  72.852  -2.580  -0.015
  532   HG23  VAL  62          HG23      VAL  62  73.333  -4.249   0.402
  533    H    CYS  63           HN       CYS  63  72.920  -4.300   4.920
  534    HA   CYS  63           HA       CYS  63  73.603  -2.224   6.713
  535    HB2  CYS  63           HB2      CYS  63  73.378  -3.818   8.425
  536    HB3  CYS  63           HB1      CYS  63  72.366  -4.375   7.075
  537    H    ASP  64           HN       ASP  64  75.291  -2.869   8.412
  538    HA   ASP  64           HA       ASP  64  77.925  -2.355   7.507
  539    HB2  ASP  64           HB2      ASP  64  76.965  -1.937   9.831
  540    HB3  ASP  64           HB1      ASP  64  77.015  -3.652  10.046
  541    H    LYS  65           HN       LYS  65  76.183  -5.262   8.247
  542    HA   LYS  65           HA       LYS  65  78.507  -6.917   8.099
  543    HB2  LYS  65           HB2      LYS  65  75.627  -7.593   8.467
  544    HB3  LYS  65           HB1      LYS  65  76.961  -8.756   8.488
  545    HG2  LYS  65           HG2      LYS  65  76.505  -6.426  10.304
  546    HG3  LYS  65           HG1      LYS  65  76.299  -8.154  10.627
  547    HD2  LYS  65           HD2      LYS  65  78.641  -8.545  10.467
  548    HD3  LYS  65           HD1      LYS  65  78.936  -6.883   9.945
  549    HE2  LYS  65           HE2      LYS  65  77.608  -7.580  12.473
  550    HE3  LYS  65           HE1      LYS  65  79.374  -7.383  12.386
  551    HZ1  LYS  65           HZ1      LYS  65  78.362  -5.331  13.126
  552    HZ2  LYS  65           HZ2      LYS  65  77.257  -5.325  11.864
  553    HZ3  LYS  65           HZ3      LYS  65  78.887  -5.061  11.557
  554    H    CYS  66           HN       CYS  66  75.748  -6.130   6.087
  555    HA   CYS  66           HA       CYS  66  76.290  -8.020   4.030
  556    HB2  CYS  66           HB2      CYS  66  74.962  -5.285   3.971
  557    HB3  CYS  66           HB1      CYS  66  75.151  -6.272   2.542
  558    H    LEU  67           HN       LEU  67  77.431  -4.818   4.798
  559    HA   LEU  67           HA       LEU  67  79.076  -4.300   2.641
  560    HB2  LEU  67           HB2      LEU  67  79.011  -3.382   5.418
  561    HB3  LEU  67           HB1      LEU  67  80.333  -2.874   4.396
  562    HG   LEU  67           HG       LEU  67  77.403  -2.449   3.830
  563   HD11  LEU  67          HD11      LEU  67  79.605  -0.669   4.606
  564   HD12  LEU  67          HD12      LEU  67  78.223  -1.156   5.619
  565   HD13  LEU  67          HD13      LEU  67  77.971  -0.132   4.175
  566   HD21  LEU  67          HD21      LEU  67  78.628  -2.687   1.728
  567   HD22  LEU  67          HD22      LEU  67  79.856  -1.569   2.311
  568   HD23  LEU  67          HD23      LEU  67  78.222  -0.999   2.014
  569    H    LYS  68           HN       LYS  68  79.719  -6.326   5.447
  570    HA   LYS  68           HA       LYS  68  82.542  -6.485   4.817
  571    HB2  LYS  68           HB2      LYS  68  82.802  -8.028   6.644
  572    HB3  LYS  68           HB1      LYS  68  81.653  -6.823   7.198
  573    HG2  LYS  68           HG2      LYS  68  79.819  -8.328   6.784
  574    HG3  LYS  68           HG1      LYS  68  80.912  -9.509   6.080
  575    HD2  LYS  68           HD2      LYS  68  82.025  -9.705   8.287
  576    HD3  LYS  68           HD1      LYS  68  80.816  -8.604   8.950
  577    HE2  LYS  68           HE2      LYS  68  79.027 -10.115   8.381
  578    HE3  LYS  68           HE1      LYS  68  80.137 -11.181   7.538
  579    HZ1  LYS  68           HZ1      LYS  68  80.126 -10.632  10.450
  580    HZ2  LYS  68           HZ2      LYS  68  81.225 -11.629   9.651
  581    HZ3  LYS  68           HZ3      LYS  68  79.583 -12.031   9.687
  582    H    PHE  69           HN       PHE  69  79.611  -8.144   3.947
  583    HA   PHE  69           HA       PHE  69  80.518 -10.625   3.086
  584    HB2  PHE  69           HB2      PHE  69  78.348  -8.780   2.624
  585    HB3  PHE  69           HB1      PHE  69  78.514 -10.007   1.408
  586    HD1  PHE  69           HD1      PHE  69  78.835 -10.071   5.119
  587    HD2  PHE  69           HD2      PHE  69  76.757 -11.373   1.671
  588    HE1  PHE  69           HE1      PHE  69  77.375 -11.423   6.523
  589    HE2  PHE  69           HE2      PHE  69  75.306 -12.725   2.997
  590    HZ   PHE  69           HZ       PHE  69  75.587 -12.751   5.502
  591    H    TYR  70           HN       TYR  70  79.764  -7.600   1.406
  592    HA   TYR  70           HA       TYR  70  81.610  -8.231  -0.716
  593    HB2  TYR  70           HB2      TYR  70  78.730  -7.401  -0.946
  594    HB3  TYR  70           HB1      TYR  70  79.877  -7.456  -2.275
  595    HD1  TYR  70           HD2      TYR  70  81.012  -9.754  -2.675
  596    HD2  TYR  70           HD1      TYR  70  77.424  -9.253  -0.454
  597    HE1  TYR  70           HE2      TYR  70  80.514 -12.111  -2.981
  598    HE2  TYR  70           HE1      TYR  70  76.900 -11.630  -0.721
  599    HH   TYR  70           HH       TYR  70  77.547 -13.443  -2.492
  600    H    SER  71           HN       SER  71  82.971  -6.494  -0.303
  601    HA   SER  71           HA       SER  71  81.796  -3.955   0.425
  602    HB2  SER  71           HB2      SER  71  84.708  -4.642  -0.011
  603    HB3  SER  71           HB1      SER  71  84.055  -3.230   0.822
  604    HG   SER  71           HG       SER  71  82.942  -5.088   2.120
  605    H    LYS  72           HN       LYS  72  83.426  -5.460  -2.290
  606    HA   LYS  72           HA       LYS  72  83.178  -3.037  -3.866
  607    HB2  LYS  72           HB2      LYS  72  85.228  -4.469  -4.048
  608    HB3  LYS  72           HB1      LYS  72  84.228  -5.744  -4.718
  609    HG2  LYS  72           HG2      LYS  72  85.392  -4.556  -6.491
  610    HG3  LYS  72           HG1      LYS  72  83.648  -4.304  -6.615
  611    HD2  LYS  72           HD2      LYS  72  83.879  -2.136  -5.499
  612    HD3  LYS  72           HD1      LYS  72  85.618  -2.397  -5.363
  613    HE2  LYS  72           HE2      LYS  72  85.796  -2.403  -7.797
  614    HE3  LYS  72           HE1      LYS  72  84.051  -2.181  -7.928
  615    HZ1  LYS  72           HZ1      LYS  72  85.937  -0.262  -6.660
  616    HZ2  LYS  72           HZ2      LYS  72  84.254  -0.078  -6.797
  617    HZ3  LYS  72           HZ3      LYS  72  85.196  -0.087  -8.173
  618    H    ILE  73           HN       ILE  73  81.994  -6.317  -3.750
  619    HA   ILE  73           HA       ILE  73  80.173  -5.930  -6.008
  620    HB   ILE  73           HB       ILE  73  80.324  -8.333  -4.191
  621   HG12  ILE  73          HG12      ILE  73  82.116  -7.772  -6.579
  622   HG13  ILE  73          HG11      ILE  73  82.621  -7.800  -4.894
  623   HG21  ILE  73          HG21      ILE  73  78.501  -8.303  -5.859
  624   HG22  ILE  73          HG22      ILE  73  79.667  -9.562  -6.268
  625   HG23  ILE  73          HG23      ILE  73  79.672  -8.035  -7.152
  626   HD11  ILE  73          HD11      ILE  73  82.096 -10.174  -4.774
  627   HD12  ILE  73          HD12      ILE  73  83.264  -9.830  -6.053
  628   HD13  ILE  73          HD13      ILE  73  81.571 -10.135  -6.458
  629    H    SER  74           HN       SER  74  79.662  -4.249  -3.760
  630    HA   SER  74           HA       SER  74  77.964  -5.368  -1.877
  631    HB2  SER  74           HB2      SER  74  78.064  -2.462  -2.733
  632    HB3  SER  74           HB1      SER  74  77.378  -3.071  -1.230
  633    HG   SER  74           HG       SER  74  79.554  -3.992  -0.888
  634    H    GLU  75           HN       GLU  75  77.352  -3.876  -4.907
  635    HA   GLU  75           HA       GLU  75  74.494  -4.168  -4.544
  636    HB2  GLU  75           HB2      GLU  75  75.245  -2.093  -5.597
  637    HB3  GLU  75           HB1      GLU  75  76.005  -2.995  -6.894
  638    HG2  GLU  75           HG2      GLU  75  73.718  -3.904  -7.442
  639    HG3  GLU  75           HG1      GLU  75  73.074  -2.717  -6.312
  640    H    TYR  76           HN       TYR  76  76.221  -4.754  -7.542
  641    HA   TYR  76           HA       TYR  76  75.661  -6.064  -9.204
  642    HB2  TYR  76           HB2      TYR  76  77.526  -7.178  -8.062
  643    HB3  TYR  76           HB1      TYR  76  76.383  -8.250  -7.244
  644    HD1  TYR  76           HD1      TYR  76  75.891  -7.173 -10.724
  645    HD2  TYR  76           HD2      TYR  76  77.391 -10.267  -8.218
  646    HE1  TYR  76           HE1      TYR  76  76.050  -8.610 -12.642
  647    HE2  TYR  76           HE2      TYR  76  77.542 -11.758 -10.176
  648    HH   TYR  76           HH       TYR  76  76.578 -11.978 -12.399
  649    H    ARG  77           HN       ARG  77  73.646  -5.733  -9.619
  650    HA   ARG  77           HA       ARG  77  71.706  -7.640  -8.639
  651    HB2  ARG  77           HB2      ARG  77  71.276  -4.639  -8.616
  652    HB3  ARG  77           HB1      ARG  77  70.036  -5.835  -8.291
  653    HG2  ARG  77           HG2      ARG  77  72.444  -6.020  -6.612
  654    HG3  ARG  77           HG1      ARG  77  71.477  -4.563  -6.418
  655    HD2  ARG  77           HD2      ARG  77  70.893  -6.393  -4.836
  656    HD3  ARG  77           HD1      ARG  77  69.549  -5.834  -5.816
  657    HE   ARG  77           HE       ARG  77  69.550  -7.848  -6.952
  658   HH11  ARG  77          HH11      ARG  77  72.196  -7.884  -4.550
  659   HH12  ARG  77          HH12      ARG  77  72.124  -9.572  -4.365
  660   HH21  ARG  77          HH21      ARG  77  69.449 -10.111  -6.591
  661   HH22  ARG  77          HH22      ARG  77  70.547 -10.878  -5.533
  662    H    HIS  78           HN       HIS  78  72.089  -8.413 -10.725
  663    HA   HIS  78           HA       HIS  78  70.898  -6.810 -12.797
  664    HB2  HIS  78           HB2      HIS  78  71.752  -8.618 -14.398
  665    HB3  HIS  78           HB1      HIS  78  73.008  -7.858 -13.415
  666    HD1  HIS  78           HD1      HIS  78  71.921 -11.101 -14.620
  667    HD2  HIS  78           HD2      HIS  78  73.617  -9.522 -11.239
  668    HE1  HIS  78           HE1      HIS  78  72.923 -13.074 -13.428
  669    H    TYR  79           HN       TYR  79  70.547 -10.259 -12.848
  670    HA   TYR  79           HA       TYR  79  68.963 -11.688 -12.462
  671    HB2  TYR  79           HB2      TYR  79  68.118  -9.748 -10.360
  672    HB3  TYR  79           HB1      TYR  79  67.526 -11.401 -10.479
  673    HD1  TYR  79           HD2      TYR  79  70.492  -9.329  -9.663
  674    HD2  TYR  79           HD1      TYR  79  68.946 -13.293  -9.950
  675    HE1  TYR  79           HE2      TYR  79  72.440 -10.170  -8.459
  676    HE2  TYR  79           HE1      TYR  79  70.912 -14.139  -8.748
  677    HH   TYR  79           HH       TYR  79  73.118 -12.088  -7.132
  678    H    SER  80           HN       SER  80  67.758 -12.073 -13.933
  679    HA   SER  80           HA       SER  80  65.161 -10.888 -14.068
  680    HB2  SER  80           HB2      SER  80  65.377 -10.870 -16.652
  681    HB3  SER  80           HB1      SER  80  66.157  -9.555 -15.775
  682    HG   SER  80           HG       SER  80  67.265 -11.774 -17.077
  Start of MODEL   15
    1    H1   GLY  -1           HT1      GLY  -1  56.471   1.246   5.241
    2    H2   GLY  -1           HT2      GLY  -1  56.492  -0.348   5.738
    3    H3   GLY  -1           HT3      GLY  -1  56.073   0.020   4.156
    4    HA2  GLY  -1           HA1      GLY  -1  58.335   0.895   3.794
    5    HA3  GLY  -1           HA2      GLY  -1  58.720   0.391   5.437
    6    H    ALA   0           HN       ALA   0  59.502  -0.380   2.560
    7    HA   ALA   0           HA       ALA   0  60.361  -2.134   1.486
    8    HB1  ALA   0           HB1      ALA   0  61.469  -2.545   3.651
    9    HB2  ALA   0           HB2      ALA   0  61.202  -4.031   2.736
   10    HB3  ALA   0           HB3      ALA   0  60.153  -3.634   4.096
   11    H    MET   1           HN       MET   1  57.245  -2.057   2.058
   12    HA   MET   1           HA       MET   1  56.570  -4.821   1.377
   13    HB2  MET   1           HB2      MET   1  54.331  -4.248   2.007
   14    HB3  MET   1           HB1      MET   1  55.385  -3.540   3.223
   15    HG2  MET   1           HG2      MET   1  54.112  -2.073   0.917
   16    HG3  MET   1           HG1      MET   1  53.585  -2.022   2.597
   17    HE1  MET   1           HE1      MET   1  53.669   0.632   1.754
   18    HE2  MET   1           HE2      MET   1  54.666   0.278   0.325
   19    HE3  MET   1           HE3      MET   1  55.199   1.485   1.490
   20    H    PHE   2           HN       PHE   2  57.763  -2.823  -0.386
   21    HA   PHE   2           HA       PHE   2  55.918  -1.666  -2.157
   22    HB2  PHE   2           HB2      PHE   2  58.833  -2.193  -2.320
   23    HB3  PHE   2           HB1      PHE   2  57.987  -1.677  -3.768
   24    HD1  PHE   2           HD2      PHE   2  56.538  -0.326  -0.802
   25    HD2  PHE   2           HD1      PHE   2  59.714   0.146  -3.579
   26    HE1  PHE   2           HE2      PHE   2  56.751   2.031  -0.161
   27    HE2  PHE   2           HE1      PHE   2  59.951   2.441  -2.965
   28    HZ   PHE   2           HZ       PHE   2  58.448   3.433  -1.234
   29    H    GLN   3           HN       GLN   3  55.229  -2.235  -4.173
   30    HA   GLN   3           HA       GLN   3  55.679  -4.999  -4.984
   31    HB2  GLN   3           HB2      GLN   3  53.450  -4.866  -6.148
   32    HB3  GLN   3           HB1      GLN   3  53.329  -4.660  -4.417
   33    HG2  GLN   3           HG2      GLN   3  51.904  -3.021  -5.088
   34    HG3  GLN   3           HG1      GLN   3  53.400  -2.097  -5.069
   35   HE21  GLN   3          HE21      GLN   3  54.096  -3.754  -7.456
   36   HE22  GLN   3          HE22      GLN   3  53.540  -2.936  -8.784
   37    H    ASP   4           HN       ASP   4  55.342  -5.316  -7.390
   38    HA   ASP   4           HA       ASP   4  57.603  -4.437  -8.801
   39    HB2  ASP   4           HB2      ASP   4  56.728  -5.763 -10.600
   40    HB3  ASP   4           HB1      ASP   4  56.117  -6.502  -9.137
   41    HA   PRO   5           HA       PRO   5  58.183  -4.646 -10.717
   42    HB2  PRO   5           HB2      PRO   5  59.311  -3.265 -12.893
   43    HB3  PRO   5           HB1      PRO   5  58.045  -4.489 -12.986
   44    HG2  PRO   5           HG2      PRO   5  57.730  -1.775 -13.649
   45    HG3  PRO   5           HG1      PRO   5  56.427  -2.931 -13.356
   46    HD2  PRO   5           HD2      PRO   5  57.626  -0.924 -11.476
   47    HD3  PRO   5           HD1      PRO   5  55.923  -1.407 -11.671
   48    H    GLN   6           HN       GLN   6  59.656  -1.778 -11.827
   49    HA   GLN   6           HA       GLN   6  61.700  -1.891  -9.718
   50    HB2  GLN   6           HB2      GLN   6  62.130  -1.840 -12.703
   51    HB3  GLN   6           HB1      GLN   6  63.380  -1.360 -11.564
   52    HG2  GLN   6           HG2      GLN   6  63.358  -3.561 -10.564
   53    HG3  GLN   6           HG1      GLN   6  62.036  -4.045 -11.616
   54   HE21  GLN   6          HE21      GLN   6  64.659  -2.078 -12.814
   55   HE22  GLN   6          HE22      GLN   6  65.371  -3.319 -13.778
   56    H    GLU   7           HN       GLU   7  59.425  -0.204 -10.090
   57    HA   GLU   7           HA       GLU   7  60.209   2.349 -11.073
   58    HB2  GLU   7           HB2      GLU   7  57.854   1.684 -10.932
   59    HB3  GLU   7           HB1      GLU   7  57.985   1.530  -9.193
   60    HG2  GLU   7           HG2      GLU   7  58.267   3.902  -8.962
   61    HG3  GLU   7           HG1      GLU   7  58.270   4.115 -10.712
   62    H    ARG   8           HN       ARG   8  60.935   0.664  -8.456
   63    HA   ARG   8           HA       ARG   8  61.382   2.630  -6.497
   64    HB2  ARG   8           HB2      ARG   8  62.297  -0.255  -6.808
   65    HB3  ARG   8           HB1      ARG   8  62.587   0.693  -5.369
   66    HG2  ARG   8           HG2      ARG   8  60.788  -0.647  -4.896
   67    HG3  ARG   8           HG1      ARG   8  60.177   1.003  -5.180
   68    HD2  ARG   8           HD2      ARG   8  59.688   0.205  -7.583
   69    HD3  ARG   8           HD1      ARG   8  59.844  -1.430  -6.942
   70    HE   ARG   8           HE       ARG   8  57.809  -1.195  -6.054
   71   HH11  ARG   8          HH11      ARG   8  59.048   2.093  -6.767
   72   HH12  ARG   8          HH12      ARG   8  57.617   2.896  -6.450
   73   HH21  ARG   8          HH21      ARG   8  55.758  -0.069  -5.663
   74   HH22  ARG   8          HH22      ARG   8  55.678   1.617  -5.839
   75    HA   PRO   9           HA       PRO   9  65.229   4.044  -8.204
   76    HB2  PRO   9           HB2      PRO   9  66.385   5.038  -6.011
   77    HB3  PRO   9           HB1      PRO   9  65.061   5.888  -6.724
   78    HG2  PRO   9           HG2      PRO   9  65.244   4.228  -4.354
   79    HG3  PRO   9           HG1      PRO   9  64.104   5.554  -4.703
   80    HD2  PRO   9           HD2      PRO   9  63.651   2.806  -4.710
   81    HD3  PRO   9           HD1      PRO   9  62.492   3.924  -5.365
   82    H    ARG  10           HN       ARG  10  67.720   4.251  -7.134
   83    HA   ARG  10           HA       ARG  10  68.299   1.622  -6.040
   84    HB2  ARG  10           HB2      ARG  10  69.881   3.336  -7.901
   85    HB3  ARG  10           HB1      ARG  10  70.451   1.864  -7.135
   86    HG2  ARG  10           HG2      ARG  10  68.190   2.098  -9.114
   87    HG3  ARG  10           HG1      ARG  10  69.827   1.490  -9.373
   88    HD2  ARG  10           HD2      ARG  10  69.451  -0.395  -7.960
   89    HD3  ARG  10           HD1      ARG  10  67.879   0.235  -7.457
   90    HE   ARG  10           HE       ARG  10  67.946   0.021 -10.232
   91   HH11  ARG  10          HH11      ARG  10  67.855  -2.151  -7.435
   92   HH12  ARG  10          HH12      ARG  10  66.932  -3.330  -8.264
   93   HH21  ARG  10          HH21      ARG  10  66.672  -1.622 -11.283
   94   HH22  ARG  10          HH22      ARG  10  66.266  -3.039 -10.422
   95    H    LYS  11           HN       LYS  11  67.884   4.752  -5.276
   96    HA   LYS  11           HA       LYS  11  70.215   4.659  -3.558
   97    HB2  LYS  11           HB2      LYS  11  68.917   7.124  -4.653
   98    HB3  LYS  11           HB1      LYS  11  70.380   6.999  -3.720
   99    HG2  LYS  11           HG2      LYS  11  70.034   5.790  -6.425
  100    HG3  LYS  11           HG1      LYS  11  70.724   7.378  -6.225
  101    HD2  LYS  11           HD2      LYS  11  71.683   4.881  -4.927
  102    HD3  LYS  11           HD1      LYS  11  72.350   5.438  -6.469
  103    HE2  LYS  11           HE2      LYS  11  72.482   6.919  -3.814
  104    HE3  LYS  11           HE1      LYS  11  73.795   5.959  -4.483
  105    HZ1  LYS  11           HZ1      LYS  11  74.299   8.121  -5.003
  106    HZ2  LYS  11           HZ2      LYS  11  72.746   8.563  -5.435
  107    HZ3  LYS  11           HZ3      LYS  11  73.658   7.563  -6.457
  108    H    LEU  12           HN       LEU  12  69.899   5.149  -1.544
  109    HA   LEU  12           HA       LEU  12  67.544   4.555  -0.310
  110    HB2  LEU  12           HB2      LEU  12  69.581   4.234   0.757
  111    HB3  LEU  12           HB1      LEU  12  70.024   5.924   0.633
  112    HG   LEU  12           HG       LEU  12  68.289   6.482   2.223
  113   HD11  LEU  12          HD11      LEU  12  67.174   4.738   3.462
  114   HD12  LEU  12          HD12      LEU  12  68.000   3.507   2.483
  115   HD13  LEU  12          HD13      LEU  12  66.781   4.560   1.735
  116   HD21  LEU  12          HD21      LEU  12  70.581   5.925   2.913
  117   HD22  LEU  12          HD22      LEU  12  70.004   4.281   3.232
  118   HD23  LEU  12          HD23      LEU  12  69.357   5.636   4.146
  119    HA   PRO  13           HA       PRO  13  66.696   9.206   0.760
  120    HB2  PRO  13           HB2      PRO  13  67.703  11.143  -0.876
  121    HB3  PRO  13           HB1      PRO  13  68.609  10.450   0.492
  122    HG2  PRO  13           HG2      PRO  13  68.790   9.673  -2.388
  123    HG3  PRO  13           HG1      PRO  13  70.098  10.144  -1.279
  124    HD2  PRO  13           HD2      PRO  13  69.540   7.578  -1.740
  125    HD3  PRO  13           HD1      PRO  13  69.988   8.122  -0.122
  126    H    GLN  14           HN       GLN  14  67.054   8.405  -2.600
  127    HA   GLN  14           HA       GLN  14  64.655   9.668  -3.471
  128    HB2  GLN  14           HB2      GLN  14  66.390   7.562  -4.718
  129    HB3  GLN  14           HB1      GLN  14  64.949   8.190  -5.490
  130    HG2  GLN  14           HG2      GLN  14  65.931  10.427  -5.516
  131    HG3  GLN  14           HG1      GLN  14  67.361   9.792  -4.694
  132   HE21  GLN  14          HE21      GLN  14  68.802   8.596  -5.807
  133   HE22  GLN  14          HE22      GLN  14  68.762   8.365  -7.506
  134    H    LEU  15           HN       LEU  15  65.431   6.388  -2.275
  135    HA   LEU  15           HA       LEU  15  62.973   5.253  -2.919
  136    HB2  LEU  15           HB2      LEU  15  64.982   4.012  -2.295
  137    HB3  LEU  15           HB1      LEU  15  64.920   4.723  -0.740
  138    HG   LEU  15           HG       LEU  15  62.868   3.670  -0.191
  139   HD11  LEU  15          HD11      LEU  15  61.922   1.914  -1.651
  140   HD12  LEU  15          HD12      LEU  15  63.135   2.262  -2.874
  141   HD13  LEU  15          HD13      LEU  15  61.903   3.467  -2.484
  142   HD21  LEU  15          HD21      LEU  15  64.927   2.672   0.305
  143   HD22  LEU  15          HD22      LEU  15  64.983   1.923  -1.285
  144   HD23  LEU  15          HD23      LEU  15  63.752   1.395  -0.103
  145    H    CYS  16           HN       CYS  16  64.185   7.003  -0.213
  146    HA   CYS  16           HA       CYS  16  62.085   6.651   1.553
  147    HB2  CYS  16           HB2      CYS  16  63.831   9.119   1.187
  148    HB3  CYS  16           HB1      CYS  16  62.823   8.827   2.570
  149    HG   CYS  16           HG       CYS  16  65.418   6.812   1.615
  150    H    THR  17           HN       THR  17  62.411   8.788  -1.137
  151    HA   THR  17           HA       THR  17  60.172  10.438  -0.983
  152    HB   THR  17           HB       THR  17  61.775   9.249  -3.155
  153    HG1  THR  17           HG1      THR  17  61.954  11.321  -1.576
  154   HG21  THR  17          HG21      THR  17  59.471  11.177  -3.581
  155   HG22  THR  17          HG22      THR  17  59.696   9.545  -4.256
  156   HG23  THR  17          HG23      THR  17  60.742  10.858  -4.776
  157    H    GLU  18           HN       GLU  18  60.541   7.192  -2.228
  158    HA   GLU  18           HA       GLU  18  57.983   6.887  -3.311
  159    HB2  GLU  18           HB2      GLU  18  60.214   5.209  -2.510
  160    HB3  GLU  18           HB1      GLU  18  58.725   4.447  -3.074
  161    HG2  GLU  18           HG2      GLU  18  60.297   6.565  -4.516
  162    HG3  GLU  18           HG1      GLU  18  60.470   4.866  -4.872
  163    H    LEU  19           HN       LEU  19  59.467   5.737  -0.293
  164    HA   LEU  19           HA       LEU  19  57.077   4.882   0.904
  165    HB2  LEU  19           HB2      LEU  19  59.763   5.649   1.879
  166    HB3  LEU  19           HB1      LEU  19  58.555   5.168   3.014
  167    HG   LEU  19           HG       LEU  19  58.512   3.029   1.404
  168   HD11  LEU  19          HD11      LEU  19  60.166   3.908  -0.144
  169   HD12  LEU  19          HD12      LEU  19  60.742   2.462   0.683
  170   HD13  LEU  19          HD13      LEU  19  61.315   4.054   1.184
  171   HD21  LEU  19          HD21      LEU  19  60.481   3.663   3.504
  172   HD22  LEU  19          HD22      LEU  19  60.127   2.021   2.918
  173   HD23  LEU  19          HD23      LEU  19  58.872   2.975   3.744
  174    H    GLN  20           HN       GLN  20  58.090   7.960   0.187
  175    HA   GLN  20           HA       GLN  20  57.308  10.017   0.643
  176    HB2  GLN  20           HB2      GLN  20  55.129   8.321   1.737
  177    HB3  GLN  20           HB1      GLN  20  54.932  10.089   1.633
  178    HG2  GLN  20           HG2      GLN  20  55.538   8.284  -0.712
  179    HG3  GLN  20           HG1      GLN  20  53.892   8.643  -0.209
  180   HE21  GLN  20          HE21      GLN  20  56.409  11.131  -0.132
  181   HE22  GLN  20          HE22      GLN  20  55.797  12.025  -1.455
  182    H    THR  21           HN       THR  21  59.094   8.822   2.418
  183    HA   THR  21           HA       THR  21  58.563  10.273   4.878
  184    HB   THR  21           HB       THR  21  57.824   7.836   5.148
  185    HG1  THR  21           HG1      THR  21  58.963   7.571   7.140
  186   HG21  THR  21          HG21      THR  21  60.796   7.301   4.929
  187   HG22  THR  21          HG22      THR  21  59.584   6.809   3.759
  188   HG23  THR  21          HG23      THR  21  59.575   6.111   5.383
  189    H    THR  22           HN       THR  22  60.938   9.500   6.191
  190    HA   THR  22           HA       THR  22  62.968  10.154   4.161
  191    HB   THR  22           HB       THR  22  63.544  10.927   6.940
  192    HG1  THR  22           HG1      THR  22  61.481  12.114   5.322
  193   HG21  THR  22          HG21      THR  22  63.733  12.296   4.244
  194   HG22  THR  22          HG22      THR  22  65.037  11.448   5.065
  195   HG23  THR  22          HG23      THR  22  64.394  12.943   5.746
  196    H    ILE  23           HN       ILE  23  65.299   9.669   5.242
  197    HA   ILE  23           HA       ILE  23  65.678   7.003   5.414
  198    HB   ILE  23           HB       ILE  23  67.383   9.067   6.712
  199   HG12  ILE  23          HG12      ILE  23  67.027   8.258   3.868
  200   HG13  ILE  23          HG11      ILE  23  66.972   9.833   4.581
  201   HG21  ILE  23          HG21      ILE  23  67.962   6.355   5.480
  202   HG22  ILE  23          HG22      ILE  23  68.028   6.742   7.202
  203   HG23  ILE  23          HG23      ILE  23  69.216   7.445   6.092
  204   HD11  ILE  23          HD11      ILE  23  69.383   8.110   4.305
  205   HD12  ILE  23          HD12      ILE  23  69.398   9.733   5.001
  206   HD13  ILE  23          HD13      ILE  23  69.032   9.495   3.267
  207    H    HIS  24           HN       HIS  24  64.848   9.298   7.702
  208    HA   HIS  24           HA       HIS  24  65.953   8.318  10.071
  209    HB2  HIS  24           HB2      HIS  24  63.711  10.301   9.768
  210    HB3  HIS  24           HB1      HIS  24  64.938  10.293  11.005
  211    HD1  HIS  24           HD1      HIS  24  67.270   9.921   8.771
  212    HD2  HIS  24           HD2      HIS  24  64.385  12.807   9.004
  213    HE1  HIS  24           HE1      HIS  24  67.866  11.537   6.935
  214    H    ASP  25           HN       ASP  25  63.324   7.442   8.219
  215    HA   ASP  25           HA       ASP  25  61.859   6.256  10.493
  216    HB2  ASP  25           HB2      ASP  25  60.748   8.318   9.606
  217    HB3  ASP  25           HB1      ASP  25  60.657   7.522   8.070
  218    H    ILE  26           HN       ILE  26  62.678   6.115   7.070
  219    HA   ILE  26           HA       ILE  26  61.229   4.052   6.056
  220    HB   ILE  26           HB       ILE  26  62.673   5.368   4.657
  221   HG12  ILE  26          HG12      ILE  26  63.742   2.586   4.632
  222   HG13  ILE  26          HG11      ILE  26  62.172   2.854   3.988
  223   HG21  ILE  26          HG21      ILE  26  65.091   5.116   4.668
  224   HG22  ILE  26          HG22      ILE  26  64.967   3.965   6.001
  225   HG23  ILE  26          HG23      ILE  26  64.499   5.648   6.249
  226   HD11  ILE  26          HD11      ILE  26  63.746   2.732   2.244
  227   HD12  ILE  26          HD12      ILE  26  64.800   3.929   2.996
  228   HD13  ILE  26          HD13      ILE  26  63.234   4.422   2.321
  229    H    ILE  27           HN       ILE  27  61.025   1.932   6.217
  230    HA   ILE  27           HA       ILE  27  63.074   0.463   7.611
  231    HB   ILE  27           HB       ILE  27  60.295  -0.338   6.758
  232   HG12  ILE  27          HG12      ILE  27  60.251   1.254   8.594
  233   HG13  ILE  27          HG11      ILE  27  59.750  -0.349   9.117
  234   HG21  ILE  27          HG21      ILE  27  62.341  -1.861   8.354
  235   HG22  ILE  27          HG22      ILE  27  61.811  -2.200   6.708
  236   HG23  ILE  27          HG23      ILE  27  60.672  -2.381   8.054
  237   HD11  ILE  27          HD11      ILE  27  61.147   0.743  10.787
  238   HD12  ILE  27          HD12      ILE  27  62.441   0.927   9.609
  239   HD13  ILE  27          HD13      ILE  27  61.957  -0.685  10.144
  240    H    LEU  28           HN       LEU  28  64.538  -0.287   6.721
  241    HA   LEU  28           HA       LEU  28  64.230  -1.244   4.003
  242    HB2  LEU  28           HB2      LEU  28  65.693   0.885   4.866
  243    HB3  LEU  28           HB1      LEU  28  66.863  -0.425   4.813
  244    HG   LEU  28           HG       LEU  28  66.355  -0.881   2.529
  245   HD11  LEU  28          HD11      LEU  28  64.110  -0.569   2.202
  246   HD12  LEU  28          HD12      LEU  28  64.648   1.031   1.625
  247   HD13  LEU  28          HD13      LEU  28  64.107   0.779   3.311
  248   HD21  LEU  28          HD21      LEU  28  66.524   2.085   2.929
  249   HD22  LEU  28          HD22      LEU  28  67.118   1.160   1.538
  250   HD23  LEU  28          HD23      LEU  28  67.893   1.003   3.118
  251    H    GLU  29           HN       GLU  29  65.033  -3.441   3.875
  252    HA   GLU  29           HA       GLU  29  66.601  -3.960   6.327
  253    HB2  GLU  29           HB2      GLU  29  66.126  -6.264   6.116
  254    HB3  GLU  29           HB1      GLU  29  64.837  -5.252   6.887
  255    HG2  GLU  29           HG2      GLU  29  63.734  -5.396   4.758
  256    HG3  GLU  29           HG1      GLU  29  65.042  -6.521   4.273
  257    H    CYS  30           HN       CYS  30  67.971  -6.229   6.182
  258    HA   CYS  30           HA       CYS  30  69.504  -5.797   3.917
  259    HB2  CYS  30           HB2      CYS  30  70.280  -7.027   6.103
  260    HB3  CYS  30           HB1      CYS  30  69.474  -8.385   5.393
  261    H    VAL  31           HN       VAL  31  69.217  -6.381   2.170
  262    HA   VAL  31           HA       VAL  31  67.196  -7.887   0.993
  263    HB   VAL  31           HB       VAL  31  68.444  -6.328  -0.377
  264   HG11  VAL  31          HG11      VAL  31  70.356  -6.014   0.831
  265   HG12  VAL  31          HG12      VAL  31  70.779  -6.667  -0.782
  266   HG13  VAL  31          HG13      VAL  31  70.818  -7.724   0.628
  267   HG21  VAL  31          HG21      VAL  31  69.388  -9.056  -1.137
  268   HG22  VAL  31          HG22      VAL  31  69.559  -7.598  -2.106
  269   HG23  VAL  31          HG23      VAL  31  67.953  -8.208  -1.737
  270    H    TYR  32           HN       TYR  32  70.329  -8.741   2.196
  271    HA   TYR  32           HA       TYR  32  70.185 -11.388   1.066
  272    HB2  TYR  32           HB2      TYR  32  72.479 -10.155   2.580
  273    HB3  TYR  32           HB1      TYR  32  72.522 -11.604   1.576
  274    HD1  TYR  32           HD1      TYR  32  71.124 -10.930  -0.821
  275    HD2  TYR  32           HD2      TYR  32  73.684  -8.449   1.546
  276    HE1  TYR  32           HE1      TYR  32  71.508  -9.651  -2.706
  277    HE2  TYR  32           HE2      TYR  32  74.143  -7.025  -0.399
  278    HH   TYR  32           HH       TYR  32  72.334  -7.279  -3.305
  279    H    CYS  33           HN       CYS  33  70.238  -9.800   4.260
  280    HA   CYS  33           HA       CYS  33  70.362 -12.453   5.545
  281    HB2  CYS  33           HB2      CYS  33  70.871  -9.799   6.871
  282    HB3  CYS  33           HB1      CYS  33  71.181 -11.404   7.497
  283    H    LYS  34           HN       LYS  34  68.111  -9.944   4.873
  284    HA   LYS  34           HA       LYS  34  66.227  -9.314   5.653
  285    HB2  LYS  34           HB2      LYS  34  66.359 -12.169   6.353
  286    HB3  LYS  34           HB1      LYS  34  65.080 -11.244   7.132
  287    HG2  LYS  34           HG2      LYS  34  64.546 -12.383   4.967
  288    HG3  LYS  34           HG1      LYS  34  64.113 -10.656   5.108
  289    HD2  LYS  34           HD2      LYS  34  66.230 -10.206   3.820
  290    HD3  LYS  34           HD1      LYS  34  66.340 -11.949   3.552
  291    HE2  LYS  34           HE2      LYS  34  65.222 -10.648   1.717
  292    HE3  LYS  34           HE1      LYS  34  64.272 -11.981   2.378
  293    HZ1  LYS  34           HZ1      LYS  34  63.031  -9.755   2.089
  294    HZ2  LYS  34           HZ2      LYS  34  63.884  -9.241   3.494
  295    HZ3  LYS  34           HZ3      LYS  34  62.907 -10.547   3.542
  296    H    GLN  35           HN       GLN  35  68.613  -8.767   7.207
  297    HA   GLN  35           HA       GLN  35  67.571  -8.492   9.830
  298    HB2  GLN  35           HB2      GLN  35  69.520  -9.234  10.124
  299    HB3  GLN  35           HB1      GLN  35  70.164  -8.866   8.520
  300    HG2  GLN  35           HG2      GLN  35  71.526  -7.669   9.962
  301    HG3  GLN  35           HG1      GLN  35  70.282  -6.544   9.398
  302   HE21  GLN  35          HE21      GLN  35  69.529  -8.931  11.805
  303   HE22  GLN  35          HE22      GLN  35  69.376  -7.865  13.129
  304    H    GLN  36           HN       GLN  36  66.394  -6.793   9.954
  305    HA   GLN  36           HA       GLN  36  66.252  -4.616   8.303
  306    HB2  GLN  36           HB2      GLN  36  64.749  -5.550  10.223
  307    HB3  GLN  36           HB1      GLN  36  65.685  -4.430  11.210
  308    HG2  GLN  36           HG2      GLN  36  65.107  -2.669   9.509
  309    HG3  GLN  36           HG1      GLN  36  64.080  -3.980   8.865
  310   HE21  GLN  36          HE21      GLN  36  62.164  -4.465   9.869
  311   HE22  GLN  36          HE22      GLN  36  61.553  -3.570  11.211
  312    H    LEU  37           HN       LEU  37  67.610  -2.937   8.084
  313    HA   LEU  37           HA       LEU  37  70.009  -2.918   9.453
  314    HB2  LEU  37           HB2      LEU  37  68.738  -1.073   7.522
  315    HB3  LEU  37           HB1      LEU  37  70.053  -0.536   8.509
  316    HG   LEU  37           HG       LEU  37  71.380  -2.473   7.716
  317   HD11  LEU  37          HD11      LEU  37  70.665  -3.523   5.582
  318   HD12  LEU  37          HD12      LEU  37  69.061  -2.815   5.847
  319   HD13  LEU  37          HD13      LEU  37  69.719  -3.967   6.996
  320   HD21  LEU  37          HD21      LEU  37  71.919  -1.448   5.549
  321   HD22  LEU  37          HD22      LEU  37  71.748  -0.261   6.844
  322   HD23  LEU  37          HD23      LEU  37  70.451  -0.477   5.669
  323    H    LEU  38           HN       LEU  38  70.902  -1.937  10.980
  324    HA   LEU  38           HA       LEU  38  69.567  -0.670  13.058
  325    HB2  LEU  38           HB2      LEU  38  72.076  -1.671  12.397
  326    HB3  LEU  38           HB1      LEU  38  72.283   0.051  12.449
  327    HG   LEU  38           HG       LEU  38  71.208  -1.581  14.700
  328   HD11  LEU  38          HD11      LEU  38  73.949  -0.425  14.231
  329   HD12  LEU  38          HD12      LEU  38  73.490  -2.121  14.136
  330   HD13  LEU  38          HD13      LEU  38  73.440  -1.283  15.697
  331   HD21  LEU  38          HD21      LEU  38  72.155   1.285  14.597
  332   HD22  LEU  38          HD22      LEU  38  71.607   0.431  16.045
  333   HD23  LEU  38          HD23      LEU  38  70.479   0.758  14.731
  334    H    ARG  39           HN       ARG  39  69.072   1.557  13.161
  335    HA   ARG  39           HA       ARG  39  68.655   3.050  10.907
  336    HB2  ARG  39           HB2      ARG  39  67.791   3.423  13.238
  337    HB3  ARG  39           HB1      ARG  39  69.313   4.216  13.595
  338    HG2  ARG  39           HG2      ARG  39  68.861   5.856  11.858
  339    HG3  ARG  39           HG1      ARG  39  67.300   5.100  11.543
  340    HD2  ARG  39           HD2      ARG  39  66.902   5.367  14.098
  341    HD3  ARG  39           HD1      ARG  39  68.203   6.546  14.016
  342    HE   ARG  39           HE       ARG  39  65.955   6.827  12.211
  343   HH11  ARG  39          HH11      ARG  39  67.756   8.114  14.957
  344   HH12  ARG  39          HH12      ARG  39  66.733   9.453  15.220
  345   HH21  ARG  39          HH21      ARG  39  64.504   8.664  12.575
  346   HH22  ARG  39          HH22      ARG  39  64.852   9.769  13.829
  347    H    ARG  40           HN       ARG  40  71.551   3.166  13.001
  348    HA   ARG  40           HA       ARG  40  72.927   5.204  11.795
  349    HB2  ARG  40           HB2      ARG  40  73.365   3.955  13.932
  350    HB3  ARG  40           HB1      ARG  40  74.073   2.707  12.915
  351    HG2  ARG  40           HG2      ARG  40  75.665   4.287  12.069
  352    HG3  ARG  40           HG1      ARG  40  74.919   5.536  13.089
  353    HD2  ARG  40           HD2      ARG  40  75.430   4.202  15.082
  354    HD3  ARG  40           HD1      ARG  40  76.211   3.006  14.056
  355    HE   ARG  40           HE       ARG  40  77.282   5.610  13.741
  356   HH11  ARG  40          HH11      ARG  40  77.443   2.642  15.642
  357   HH12  ARG  40          HH12      ARG  40  78.968   2.944  16.318
  358   HH21  ARG  40          HH21      ARG  40  79.433   6.050  14.639
  359   HH22  ARG  40          HH22      ARG  40  80.136   4.918  15.707
  360    H    GLU  41           HN       GLU  41  72.920   1.693  11.013
  361    HA   GLU  41           HA       GLU  41  74.846   1.812   8.889
  362    HB2  GLU  41           HB2      GLU  41  72.608  -0.178   9.299
  363    HB3  GLU  41           HB1      GLU  41  74.025  -0.468   8.338
  364    HG2  GLU  41           HG2      GLU  41  73.796  -0.299  11.328
  365    HG3  GLU  41           HG1      GLU  41  74.195  -1.701  10.351
  366    H    VAL  42           HN       VAL  42  71.371   2.225   9.126
  367    HA   VAL  42           HA       VAL  42  70.784   2.162   6.346
  368    HB   VAL  42           HB       VAL  42  69.308   3.966   8.303
  369   HG11  VAL  42          HG11      VAL  42  68.753   4.156   5.898
  370   HG12  VAL  42          HG12      VAL  42  67.403   3.554   6.869
  371   HG13  VAL  42          HG13      VAL  42  68.361   2.427   5.912
  372   HG21  VAL  42          HG21      VAL  42  67.808   2.125   8.818
  373   HG22  VAL  42          HG22      VAL  42  69.459   1.722   9.301
  374   HG23  VAL  42          HG23      VAL  42  68.776   1.046   7.819
  375    H    TYR  43           HN       TYR  43  71.593   4.847   8.552
  376    HA   TYR  43           HA       TYR  43  71.629   6.870   6.636
  377    HB2  TYR  43           HB2      TYR  43  73.097   6.540   9.213
  378    HB3  TYR  43           HB1      TYR  43  73.341   7.989   8.204
  379    HD1  TYR  43           HD2      TYR  43  70.848   8.748   7.333
  380    HD2  TYR  43           HD1      TYR  43  71.800   6.827  10.958
  381    HE1  TYR  43           HE2      TYR  43  68.781   9.604   8.303
  382    HE2  TYR  43           HE1      TYR  43  69.720   7.674  11.964
  383    HH   TYR  43           HH       TYR  43  68.167   9.548  11.569
  384    H    ASP  44           HN       ASP  44  74.156   4.510   7.421
  385    HA   ASP  44           HA       ASP  44  76.330   5.659   6.168
  386    HB2  ASP  44           HB2      ASP  44  75.517   2.769   6.373
  387    HB3  ASP  44           HB1      ASP  44  77.010   3.300   5.732
  388    H    PHE  45           HN       PHE  45  73.761   3.818   4.917
  389    HA   PHE  45           HA       PHE  45  74.668   3.237   2.407
  390    HB2  PHE  45           HB2      PHE  45  72.443   2.780   3.875
  391    HB3  PHE  45           HB1      PHE  45  71.889   4.004   2.758
  392    HD1  PHE  45           HD2      PHE  45  73.421   0.672   2.990
  393    HD2  PHE  45           HD1      PHE  45  71.473   3.605   0.607
  394    HE1  PHE  45           HE2      PHE  45  73.024  -0.998   1.206
  395    HE2  PHE  45           HE1      PHE  45  71.125   1.960  -1.154
  396    HZ   PHE  45           HZ       PHE  45  71.857  -0.318  -0.865
  397    H    ALA  46           HN       ALA  46  72.771   6.087   3.482
  398    HA   ALA  46           HA       ALA  46  73.022   7.333   0.870
  399    HB1  ALA  46           HB1      ALA  46  70.898   7.603   2.057
  400    HB2  ALA  46           HB2      ALA  46  71.656   9.154   1.783
  401    HB3  ALA  46           HB3      ALA  46  71.757   8.395   3.376
  402    H    ARG  47           HN       ARG  47  74.576   7.507   3.963
  403    HA   ARG  47           HA       ARG  47  75.810  10.025   3.523
  404    HB2  ARG  47           HB2      ARG  47  75.880   7.881   5.520
  405    HB3  ARG  47           HB1      ARG  47  77.396   8.713   5.429
  406    HG2  ARG  47           HG2      ARG  47  76.106   9.670   7.182
  407    HG3  ARG  47           HG1      ARG  47  76.174  10.854   5.893
  408    HD2  ARG  47           HD2      ARG  47  73.827   9.000   6.336
  409    HD3  ARG  47           HD1      ARG  47  73.948  10.585   7.088
  410    HE   ARG  47           HE       ARG  47  74.191  10.608   4.220
  411   HH11  ARG  47          HH11      ARG  47  71.938  10.946   6.972
  412   HH12  ARG  47          HH12      ARG  47  70.706  11.613   6.000
  413   HH21  ARG  47          HH21      ARG  47  72.464  11.524   2.965
  414   HH22  ARG  47          HH22      ARG  47  70.999  11.952   3.717
  415    H    ARG  48           HN       ARG  48  76.449   6.800   2.564
  416    HA   ARG  48           HA       ARG  48  78.949   7.595   1.258
  417    HB2  ARG  48           HB2      ARG  48  77.678   4.944   1.796
  418    HB3  ARG  48           HB1      ARG  48  79.196   5.145   0.937
  419    HG2  ARG  48           HG2      ARG  48  80.285   5.922   2.910
  420    HG3  ARG  48           HG1      ARG  48  78.749   6.002   3.787
  421    HD2  ARG  48           HD2      ARG  48  78.475   3.638   3.590
  422    HD3  ARG  48           HD1      ARG  48  79.910   3.533   2.594
  423    HE   ARG  48           HE       ARG  48  80.968   4.587   4.758
  424   HH11  ARG  48          HH11      ARG  48  78.555   1.966   4.720
  425   HH12  ARG  48          HH12      ARG  48  79.228   1.163   6.065
  426   HH21  ARG  48          HH21      ARG  48  81.864   3.436   6.609
  427   HH22  ARG  48          HH22      ARG  48  81.132   2.015   7.153
  428    H    ASP  49           HN       ASP  49  78.543   5.415  -0.761
  429    HA   ASP  49           HA       ASP  49  76.116   6.356  -2.057
  430    HB2  ASP  49           HB2      ASP  49  78.035   7.776  -2.885
  431    HB3  ASP  49           HB1      ASP  49  78.732   6.319  -3.580
  432    H    LEU  50           HN       LEU  50  75.534   4.229  -1.273
  433    HA   LEU  50           HA       LEU  50  76.460   2.095  -2.974
  434    HB2  LEU  50           HB2      LEU  50  74.792   2.053  -0.472
  435    HB3  LEU  50           HB1      LEU  50  75.216   0.634  -1.403
  436    HG   LEU  50           HG       LEU  50  77.630   1.296  -0.961
  437   HD11  LEU  50          HD11      LEU  50  77.286   3.493  -0.231
  438   HD12  LEU  50          HD12      LEU  50  78.071   2.558   1.054
  439   HD13  LEU  50          HD13      LEU  50  76.347   2.959   1.164
  440   HD21  LEU  50          HD21      LEU  50  77.646   0.183   1.188
  441   HD22  LEU  50          HD22      LEU  50  76.522  -0.616   0.067
  442   HD23  LEU  50          HD23      LEU  50  75.917   0.471   1.332
  443    H    CYS  51           HN       CYS  51  74.720   0.596  -3.775
  444    HA   CYS  51           HA       CYS  51  72.324   2.122  -4.539
  445    HB2  CYS  51           HB2      CYS  51  72.111   0.662  -6.404
  446    HB3  CYS  51           HB1      CYS  51  73.822   1.085  -6.342
  447    HG   CYS  51           HG       CYS  51  73.118  -1.594  -4.571
  448    H    ILE  52           HN       ILE  52  70.383   1.214  -4.293
  449    HA   ILE  52           HA       ILE  52  70.173  -0.674  -2.163
  450    HB   ILE  52           HB       ILE  52  68.143   0.966  -3.640
  451   HG12  ILE  52          HG12      ILE  52  69.239   0.656  -0.940
  452   HG13  ILE  52          HG11      ILE  52  69.442   2.048  -2.045
  453   HG21  ILE  52          HG21      ILE  52  67.545  -1.137  -1.529
  454   HG22  ILE  52          HG22      ILE  52  67.068  -1.249  -3.221
  455   HG23  ILE  52          HG23      ILE  52  66.389   0.017  -2.197
  456   HD11  ILE  52          HD11      ILE  52  67.123   1.042  -0.618
  457   HD12  ILE  52          HD12      ILE  52  67.085   2.379  -1.831
  458   HD13  ILE  52          HD13      ILE  52  68.013   2.545  -0.276
  459    H    VAL  53           HN       VAL  53  69.428  -2.459  -2.142
  460    HA   VAL  53           HA       VAL  53  69.516  -3.928  -4.602
  461    HB   VAL  53           HB       VAL  53  70.267  -5.774  -2.880
  462   HG11  VAL  53          HG11      VAL  53  72.045  -3.446  -3.692
  463   HG12  VAL  53          HG12      VAL  53  71.639  -4.810  -4.732
  464   HG13  VAL  53          HG13      VAL  53  72.600  -5.069  -3.274
  465   HG21  VAL  53          HG21      VAL  53  69.838  -4.359  -0.892
  466   HG22  VAL  53          HG22      VAL  53  71.024  -3.191  -1.484
  467   HG23  VAL  53          HG23      VAL  53  71.534  -4.798  -1.029
  468    H    TYR  54           HN       TYR  54  67.745  -4.604  -5.104
  469    HA   TYR  54           HA       TYR  54  65.608  -5.097  -3.218
  470    HB2  TYR  54           HB2      TYR  54  65.703  -5.020  -6.225
  471    HB3  TYR  54           HB1      TYR  54  64.253  -5.293  -5.263
  472    HD1  TYR  54           HD1      TYR  54  66.880  -2.781  -6.002
  473    HD2  TYR  54           HD2      TYR  54  63.117  -3.554  -4.251
  474    HE1  TYR  54           HE1      TYR  54  66.519  -0.342  -5.651
  475    HE2  TYR  54           HE2      TYR  54  62.752  -1.233  -3.958
  476    HH   TYR  54           HH       TYR  54  64.223   0.788  -3.598
  477    H    ARG  55           HN       ARG  55  65.454  -6.824  -2.461
  478    HA   ARG  55           HA       ARG  55  66.754  -9.093  -3.717
  479    HB2  ARG  55           HB2      ARG  55  66.269  -8.689  -1.003
  480    HB3  ARG  55           HB1      ARG  55  65.009  -9.807  -1.448
  481    HG2  ARG  55           HG2      ARG  55  67.945 -10.428  -2.013
  482    HG3  ARG  55           HG1      ARG  55  67.168 -10.816  -0.523
  483    HD2  ARG  55           HD2      ARG  55  65.479 -12.161  -1.744
  484    HD3  ARG  55           HD1      ARG  55  66.298 -11.802  -3.258
  485    HE   ARG  55           HE       ARG  55  67.675 -13.162  -1.040
  486   HH11  ARG  55          HH11      ARG  55  66.726 -13.129  -4.453
  487   HH12  ARG  55          HH12      ARG  55  67.552 -14.566  -4.820
  488   HH21  ARG  55          HH21      ARG  55  68.853 -15.067  -1.574
  489   HH22  ARG  55          HH22      ARG  55  68.829 -15.683  -3.163
  490    H    ASP  56           HN       ASP  56  65.570 -10.028  -5.268
  491    HA   ASP  56           HA       ASP  56  63.962 -10.883  -6.556
  492    HB2  ASP  56           HB2      ASP  56  63.201 -12.133  -4.530
  493    HB3  ASP  56           HB1      ASP  56  62.126 -10.782  -4.162
  494    H    GLY  57           HN       GLY  57  62.300  -8.572  -4.449
  495    HA2  GLY  57           HA2      GLY  57  62.176  -6.614  -6.394
  496    HA3  GLY  57           HA1      GLY  57  60.635  -7.481  -6.436
  497    H    ASN  58           HN       ASN  58  62.694  -6.701  -3.606
  498    HA   ASN  58           HA       ASN  58  60.708  -4.672  -2.686
  499    HB2  ASN  58           HB2      ASN  58  62.018  -6.711  -0.919
  500    HB3  ASN  58           HB1      ASN  58  60.642  -5.731  -0.518
  501   HD21  ASN  58          HD21      ASN  58  61.850  -8.555  -2.057
  502   HD22  ASN  58          HD22      ASN  58  60.383  -9.407  -2.251
  503    HA   PRO  59           HA       PRO  59  64.518  -2.762  -1.937
  504    HB2  PRO  59           HB2      PRO  59  63.418  -0.732  -0.236
  505    HB3  PRO  59           HB1      PRO  59  63.833  -0.611  -1.944
  506    HG2  PRO  59           HG2      PRO  59  61.214  -0.542  -1.008
  507    HG3  PRO  59           HG1      PRO  59  61.638  -0.993  -2.604
  508    HD2  PRO  59           HD2      PRO  59  60.992  -2.772  -0.303
  509    HD3  PRO  59           HD1      PRO  59  60.621  -2.946  -2.027
  510    H    TYR  60           HN       TYR  60  66.218  -3.081  -0.872
  511    HA   TYR  60           HA       TYR  60  66.014  -3.061   1.918
  512    HB2  TYR  60           HB2      TYR  60  67.505  -5.420   0.787
  513    HB3  TYR  60           HB1      TYR  60  66.956  -5.033   2.272
  514    HD1  TYR  60           HD1      TYR  60  64.684  -5.235   2.982
  515    HD2  TYR  60           HD2      TYR  60  65.968  -6.505  -0.779
  516    HE1  TYR  60           HE1      TYR  60  62.698  -6.731   2.817
  517    HE2  TYR  60           HE2      TYR  60  63.994  -7.992  -0.980
  518    HH   TYR  60           HH       TYR  60  61.393  -7.873   1.136
  519    H    ALA  61           HN       ALA  61  67.860  -2.844   2.738
  520    HA   ALA  61           HA       ALA  61  69.784  -1.328   1.260
  521    HB1  ALA  61           HB1      ALA  61  69.580  -2.045   4.080
  522    HB2  ALA  61           HB2      ALA  61  68.574  -0.800   3.389
  523    HB3  ALA  61           HB3      ALA  61  70.377  -0.602   3.403
  524    H    VAL  62           HN       VAL  62  71.984  -1.888   2.485
  525    HA   VAL  62           HA       VAL  62  72.435  -4.774   2.459
  526    HB   VAL  62           HB       VAL  62  74.165  -2.389   1.649
  527   HG11  VAL  62          HG11      VAL  62  75.969  -3.829   1.221
  528   HG12  VAL  62          HG12      VAL  62  75.091  -5.154   2.030
  529   HG13  VAL  62          HG13      VAL  62  75.527  -3.670   2.915
  530   HG21  VAL  62          HG21      VAL  62  74.409  -3.545  -0.466
  531   HG22  VAL  62          HG22      VAL  62  72.748  -3.106  -0.110
  532   HG23  VAL  62          HG23      VAL  62  73.296  -4.785   0.115
  533    H    CYS  63           HN       CYS  63  72.523  -5.469   4.513
  534    HA   CYS  63           HA       CYS  63  72.578  -3.787   6.746
  535    HB2  CYS  63           HB2      CYS  63  72.442  -5.718   8.052
  536    HB3  CYS  63           HB1      CYS  63  71.791  -6.129   6.457
  537    H    ASP  64           HN       ASP  64  74.062  -4.224   8.609
  538    HA   ASP  64           HA       ASP  64  76.545  -3.054   8.465
  539    HB2  ASP  64           HB2      ASP  64  75.504  -3.424  10.582
  540    HB3  ASP  64           HB1      ASP  64  75.477  -5.152  10.337
  541    H    LYS  65           HN       LYS  65  75.859  -6.473   8.394
  542    HA   LYS  65           HA       LYS  65  78.541  -7.339   8.273
  543    HB2  LYS  65           HB2      LYS  65  76.010  -8.770   7.507
  544    HB3  LYS  65           HB1      LYS  65  77.579  -9.530   7.758
  545    HG2  LYS  65           HG2      LYS  65  77.587  -8.859  10.066
  546    HG3  LYS  65           HG1      LYS  65  76.085  -7.966   9.836
  547    HD2  LYS  65           HD2      LYS  65  74.942 -10.026   9.295
  548    HD3  LYS  65           HD1      LYS  65  76.440 -10.941   9.537
  549    HE2  LYS  65           HE2      LYS  65  76.536 -10.114  11.833
  550    HE3  LYS  65           HE1      LYS  65  75.010  -9.270  11.595
  551    HZ1  LYS  65           HZ1      LYS  65  75.419 -12.210  11.472
  552    HZ2  LYS  65           HZ2      LYS  65  73.956 -11.440  11.174
  553    HZ3  LYS  65           HZ3      LYS  65  74.646 -11.373  12.709
  554    H    CYS  66           HN       CYS  66  76.023  -6.915   5.868
  555    HA   CYS  66           HA       CYS  66  77.673  -7.779   3.737
  556    HB2  CYS  66           HB2      CYS  66  74.984  -6.436   3.804
  557    HB3  CYS  66           HB1      CYS  66  75.726  -6.996   2.312
  558    H    LEU  67           HN       LEU  67  76.937  -4.720   5.158
  559    HA   LEU  67           HA       LEU  67  77.928  -2.920   3.318
  560    HB2  LEU  67           HB2      LEU  67  77.846  -2.921   6.262
  561    HB3  LEU  67           HB1      LEU  67  78.609  -1.602   5.406
  562    HG   LEU  67           HG       LEU  67  75.726  -2.456   5.177
  563   HD11  LEU  67          HD11      LEU  67  77.112  -0.073   6.194
  564   HD12  LEU  67          HD12      LEU  67  76.352  -1.332   7.197
  565   HD13  LEU  67          HD13      LEU  67  75.350  -0.276   6.153
  566   HD21  LEU  67          HD21      LEU  67  76.498  -1.633   3.015
  567   HD22  LEU  67          HD22      LEU  67  77.233  -0.241   3.803
  568   HD23  LEU  67          HD23      LEU  67  75.484  -0.429   3.809
  569    H    LYS  68           HN       LYS  68  79.662  -4.800   5.733
  570    HA   LYS  68           HA       LYS  68  82.079  -3.577   4.850
  571    HB2  LYS  68           HB2      LYS  68  83.256  -5.073   6.445
  572    HB3  LYS  68           HB1      LYS  68  82.105  -3.950   7.160
  573    HG2  LYS  68           HG2      LYS  68  81.869  -5.935   8.365
  574    HG3  LYS  68           HG1      LYS  68  80.524  -5.981   7.228
  575    HD2  LYS  68           HD2      LYS  68  81.753  -7.497   5.798
  576    HD3  LYS  68           HD1      LYS  68  83.171  -7.355   6.842
  577    HE2  LYS  68           HE2      LYS  68  80.496  -8.503   7.663
  578    HE3  LYS  68           HE1      LYS  68  81.924  -9.447   7.250
  579    HZ1  LYS  68           HZ1      LYS  68  83.071  -8.390   9.147
  580    HZ2  LYS  68           HZ2      LYS  68  81.692  -9.225   9.637
  581    HZ3  LYS  68           HZ3      LYS  68  81.660  -7.569   9.532
  582    H    PHE  69           HN       PHE  69  80.333  -6.267   3.806
  583    HA   PHE  69           HA       PHE  69  82.438  -7.635   2.577
  584    HB2  PHE  69           HB2      PHE  69  79.559  -7.405   2.089
  585    HB3  PHE  69           HB1      PHE  69  80.574  -8.472   1.168
  586    HD1  PHE  69           HD1      PHE  69  82.054  -9.127   4.048
  587    HD2  PHE  69           HD2      PHE  69  78.128  -9.296   2.445
  588    HE1  PHE  69           HE1      PHE  69  81.469 -10.897   5.645
  589    HE2  PHE  69           HE2      PHE  69  77.519 -11.025   4.009
  590    HZ   PHE  69           HZ       PHE  69  79.197 -11.858   5.648
  591    H    TYR  70           HN       TYR  70  79.938  -5.305   1.553
  592    HA   TYR  70           HA       TYR  70  81.056  -5.266  -1.142
  593    HB2  TYR  70           HB2      TYR  70  78.288  -4.643  -0.158
  594    HB3  TYR  70           HB1      TYR  70  78.819  -4.610  -1.838
  595    HD1  TYR  70           HD1      TYR  70  80.018  -6.816  -2.603
  596    HD2  TYR  70           HD2      TYR  70  77.260  -6.585   0.605
  597    HE1  TYR  70           HE1      TYR  70  79.582  -9.224  -2.822
  598    HE2  TYR  70           HE2      TYR  70  76.818  -8.997   0.423
  599    HH   TYR  70           HH       TYR  70  76.973 -10.728  -1.419
  600    H    SER  71           HN       SER  71  81.838  -3.395   1.205
  601    HA   SER  71           HA       SER  71  80.815  -0.870   0.620
  602    HB2  SER  71           HB2      SER  71  83.076  -0.199   1.818
  603    HB3  SER  71           HB1      SER  71  81.751  -0.948   2.710
  604    HG   SER  71           HG       SER  71  83.054  -2.404   3.187
  605    H    LYS  72           HN       LYS  72  83.529  -2.605  -0.756
  606    HA   LYS  72           HA       LYS  72  84.594  -0.317  -2.125
  607    HB2  LYS  72           HB2      LYS  72  85.975  -2.287  -1.475
  608    HB3  LYS  72           HB1      LYS  72  85.089  -3.254  -2.625
  609    HG2  LYS  72           HG2      LYS  72  87.232  -2.630  -3.551
  610    HG3  LYS  72           HG1      LYS  72  85.925  -1.887  -4.471
  611    HD2  LYS  72           HD2      LYS  72  86.299   0.232  -3.334
  612    HD3  LYS  72           HD1      LYS  72  87.543  -0.506  -2.325
  613    HE2  LYS  72           HE2      LYS  72  88.855  -0.995  -4.357
  614    HE3  LYS  72           HE1      LYS  72  87.620  -0.192  -5.323
  615    HZ1  LYS  72           HZ1      LYS  72  88.120   1.881  -4.202
  616    HZ2  LYS  72           HZ2      LYS  72  89.531   1.236  -4.824
  617    HZ3  LYS  72           HZ3      LYS  72  89.213   1.114  -3.184
  618    H    ILE  73           HN       ILE  73  82.607  -3.059  -2.957
  619    HA   ILE  73           HA       ILE  73  82.382  -2.497  -5.736
  620    HB   ILE  73           HB       ILE  73  80.433  -4.046  -4.006
  621   HG12  ILE  73          HG12      ILE  73  82.823  -4.923  -5.643
  622   HG13  ILE  73          HG11      ILE  73  82.593  -5.071  -3.905
  623   HG21  ILE  73          HG21      ILE  73  79.681  -5.095  -6.122
  624   HG22  ILE  73          HG22      ILE  73  80.737  -4.003  -7.018
  625   HG23  ILE  73          HG23      ILE  73  79.378  -3.359  -6.093
  626   HD11  ILE  73          HD11      ILE  73  82.356  -7.221  -4.955
  627   HD12  ILE  73          HD12      ILE  73  81.126  -6.587  -6.042
  628   HD13  ILE  73          HD13      ILE  73  80.788  -6.710  -4.323
  629    H    SER  74           HN       SER  74  80.230  -1.767  -3.037
  630    HA   SER  74           HA       SER  74  78.762  -0.202  -2.641
  631    HB2  SER  74           HB2      SER  74  79.744   1.224  -5.119
  632    HB3  SER  74           HB1      SER  74  78.787   1.950  -3.822
  633    HG   SER  74           HG       SER  74  80.928   0.719  -2.775
  634    H    GLU  75           HN       GLU  75  78.638  -0.897  -6.046
  635    HA   GLU  75           HA       GLU  75  75.764  -1.284  -5.658
  636    HB2  GLU  75           HB2      GLU  75  75.308  -0.833  -8.030
  637    HB3  GLU  75           HB1      GLU  75  76.095   0.541  -7.284
  638    HG2  GLU  75           HG2      GLU  75  78.120   0.100  -8.426
  639    HG3  GLU  75           HG1      GLU  75  77.560  -1.497  -8.920
  640    H    TYR  76           HN       TYR  76  75.475  -3.337  -5.273
  641    HA   TYR  76           HA       TYR  76  77.092  -5.271  -6.739
  642    HB2  TYR  76           HB2      TYR  76  76.663  -5.443  -4.213
  643    HB3  TYR  76           HB1      TYR  76  75.028  -5.946  -4.647
  644    HD1  TYR  76           HD1      TYR  76  78.568  -6.696  -5.347
  645    HD2  TYR  76           HD2      TYR  76  74.625  -8.221  -5.104
  646    HE1  TYR  76           HE1      TYR  76  79.436  -8.914  -5.754
  647    HE2  TYR  76           HE2      TYR  76  75.483 -10.500  -5.497
  648    HH   TYR  76           HH       TYR  76  77.556 -11.436  -6.687
  649    H    ARG  77           HN       ARG  77  76.260  -6.622  -8.261
  650    HA   ARG  77           HA       ARG  77  73.539  -5.996  -9.043
  651    HB2  ARG  77           HB2      ARG  77  75.754  -6.597 -11.012
  652    HB3  ARG  77           HB1      ARG  77  74.137  -6.020 -11.362
  653    HG2  ARG  77           HG2      ARG  77  76.406  -4.475 -10.127
  654    HG3  ARG  77           HG1      ARG  77  75.680  -4.237 -11.711
  655    HD2  ARG  77           HD2      ARG  77  74.336  -3.784  -9.049
  656    HD3  ARG  77           HD1      ARG  77  74.980  -2.533 -10.099
  657    HE   ARG  77           HE       ARG  77  72.752  -4.285 -10.923
  658   HH11  ARG  77          HH11      ARG  77  74.240  -1.060 -10.728
  659   HH12  ARG  77          HH12      ARG  77  72.829  -0.266 -11.258
  660   HH21  ARG  77          HH21      ARG  77  70.810  -3.139 -11.619
  661   HH22  ARG  77          HH22      ARG  77  70.869  -1.450 -11.790
  662    H    HIS  78           HN       HIS  78  72.933  -7.713  -7.974
  663    HA   HIS  78           HA       HIS  78  73.956 -10.259  -8.783
  664    HB2  HIS  78           HB2      HIS  78  72.533 -11.130  -6.833
  665    HB3  HIS  78           HB1      HIS  78  73.769  -9.899  -6.499
  666    HD1  HIS  78           HD1      HIS  78  70.067 -10.524  -6.197
  667    HD2  HIS  78           HD2      HIS  78  72.874  -7.562  -5.770
  668    HE1  HIS  78           HE1      HIS  78  68.881  -8.686  -4.956
  669    H    TYR  79           HN       TYR  79  70.622  -9.473  -8.053
  670    HA   TYR  79           HA       TYR  79  68.692  -9.655  -9.140
  671    HB2  TYR  79           HB2      TYR  79  70.308  -8.076 -11.038
  672    HB3  TYR  79           HB1      TYR  79  68.550  -8.117 -11.024
  673    HD1  TYR  79           HD1      TYR  79  71.548  -6.850  -9.217
  674    HD2  TYR  79           HD2      TYR  79  67.300  -7.116  -9.258
  675    HE1  TYR  79           HE1      TYR  79  71.417  -5.079  -7.520
  676    HE2  TYR  79           HE2      TYR  79  67.173  -5.358  -7.557
  677    HH   TYR  79           HH       TYR  79  69.858  -3.458  -6.637
  678    H    SER  80           HN       SER  80  68.165 -11.539  -9.674
  679    HA   SER  80           HA       SER  80  68.990 -12.854 -12.098
  680    HB2  SER  80           HB2      SER  80  66.688 -13.511 -10.228
  681    HB3  SER  80           HB1      SER  80  67.354 -14.572 -11.470
  682    HG   SER  80           HG       SER  80  68.059 -14.793  -9.171
  Start of MODEL   16
    1    H1   GLY  -1           HT1      GLY  -1  56.429   2.402   8.682
    2    H2   GLY  -1           HT2      GLY  -1  54.926   1.983   7.973
    3    H3   GLY  -1           HT3      GLY  -1  55.780   3.306   7.413
    4    HA2  GLY  -1           HA1      GLY  -1  57.490   1.979   6.540
    5    HA3  GLY  -1           HA2      GLY  -1  56.712   0.539   7.206
    6    H    ALA   0           HN       ALA   0  57.080   0.407   4.578
    7    HA   ALA   0           HA       ALA   0  54.433   0.306   3.567
    8    HB1  ALA   0           HB1      ALA   0  54.838   2.702   3.200
    9    HB2  ALA   0           HB2      ALA   0  54.737   1.827   1.672
   10    HB3  ALA   0           HB3      ALA   0  56.309   2.318   2.305
   11    H    MET   1           HN       MET   1  54.434  -1.467   2.332
   12    HA   MET   1           HA       MET   1  56.943  -2.246   1.129
   13    HB2  MET   1           HB2      MET   1  55.876  -4.083   2.310
   14    HB3  MET   1           HB1      MET   1  54.362  -3.815   1.459
   15    HG2  MET   1           HG2      MET   1  55.593  -5.760   0.604
   16    HG3  MET   1           HG1      MET   1  55.352  -4.510  -0.620
   17    HE1  MET   1           HE1      MET   1  57.129  -5.864  -2.061
   18    HE2  MET   1           HE2      MET   1  58.672  -4.996  -2.157
   19    HE3  MET   1           HE3      MET   1  57.148  -4.095  -2.220
   20    H    PHE   2           HN       PHE   2  57.155  -2.666  -0.980
   21    HA   PHE   2           HA       PHE   2  55.774  -0.805  -2.524
   22    HB2  PHE   2           HB2      PHE   2  58.268  -2.260  -2.921
   23    HB3  PHE   2           HB1      PHE   2  57.496  -1.551  -4.330
   24    HD1  PHE   2           HD2      PHE   2  59.050  -0.843  -1.104
   25    HD2  PHE   2           HD1      PHE   2  57.225   0.759  -4.559
   26    HE1  PHE   2           HE2      PHE   2  59.826   1.319  -0.493
   27    HE2  PHE   2           HE1      PHE   2  57.994   2.982  -3.951
   28    HZ   PHE   2           HZ       PHE   2  59.294   3.295  -1.910
   29    H    GLN   3           HN       GLN   3  54.052  -1.088  -3.451
   30    HA   GLN   3           HA       GLN   3  53.634  -3.431  -5.111
   31    HB2  GLN   3           HB2      GLN   3  51.975  -3.621  -3.402
   32    HB3  GLN   3           HB1      GLN   3  51.743  -1.887  -3.314
   33    HG2  GLN   3           HG2      GLN   3  49.830  -3.131  -4.286
   34    HG3  GLN   3           HG1      GLN   3  50.506  -1.879  -5.331
   35   HE21  GLN   3          HE21      GLN   3  50.012  -2.600  -7.207
   36   HE22  GLN   3          HE22      GLN   3  50.633  -3.994  -7.976
   37    H    ASP   4           HN       ASP   4  52.764  -2.980  -7.178
   38    HA   ASP   4           HA       ASP   4  53.655  -0.851  -8.553
   39    HB2  ASP   4           HB2      ASP   4  52.815  -2.935  -9.582
   40    HB3  ASP   4           HB1      ASP   4  51.170  -2.436  -9.215
   41    HA   PRO   5           HA       PRO   5  53.155   0.692 -10.271
   42    HB2  PRO   5           HB2      PRO   5  52.936   3.139 -10.980
   43    HB3  PRO   5           HB1      PRO   5  51.546   1.992 -10.848
   44    HG2  PRO   5           HG2      PRO   5  52.307   4.058  -8.813
   45    HG3  PRO   5           HG1      PRO   5  50.765   3.949  -9.691
   46    HD2  PRO   5           HD2      PRO   5  51.295   2.713  -7.269
   47    HD3  PRO   5           HD1      PRO   5  50.042   2.181  -8.406
   48    H    GLN   6           HN       GLN   6  53.599   1.163  -7.529
   49    HA   GLN   6           HA       GLN   6  55.929   2.885  -7.439
   50    HB2  GLN   6           HB2      GLN   6  54.877   1.160  -5.172
   51    HB3  GLN   6           HB1      GLN   6  56.211   2.304  -5.058
   52    HG2  GLN   6           HG2      GLN   6  54.687   4.133  -5.600
   53    HG3  GLN   6           HG1      GLN   6  53.351   2.988  -5.647
   54   HE21  GLN   6          HE21      GLN   6  53.840   5.309  -3.946
   55   HE22  GLN   6          HE22      GLN   6  53.756   4.741  -2.321
   56    H    GLU   7           HN       GLU   7  56.658   1.802  -9.030
   57    HA   GLU   7           HA       GLU   7  57.798  -0.783  -9.244
   58    HB2  GLU   7           HB2      GLU   7  57.283   0.928 -11.028
   59    HB3  GLU   7           HB1      GLU   7  58.861   1.604 -10.650
   60    HG2  GLU   7           HG2      GLU   7  58.777   0.093 -12.514
   61    HG3  GLU   7           HG1      GLU   7  59.962  -0.418 -11.288
   62    H    ARG   8           HN       ARG   8  58.740   1.564  -7.304
   63    HA   ARG   8           HA       ARG   8  60.380   1.908  -5.783
   64    HB2  ARG   8           HB2      ARG   8  61.736  -0.688  -6.594
   65    HB3  ARG   8           HB1      ARG   8  61.873   0.153  -5.078
   66    HG2  ARG   8           HG2      ARG   8  60.502  -1.442  -4.324
   67    HG3  ARG   8           HG1      ARG   8  59.310  -0.365  -4.968
   68    HD2  ARG   8           HD2      ARG   8  58.979  -2.757  -5.657
   69    HD3  ARG   8           HD1      ARG   8  59.032  -1.592  -6.982
   70    HE   ARG   8           HE       ARG   8  61.571  -2.381  -6.846
   71   HH11  ARG   8          HH11      ARG   8  58.624  -4.354  -6.901
   72   HH12  ARG   8          HH12      ARG   8  59.303  -5.596  -7.813
   73   HH21  ARG   8          HH21      ARG   8  62.501  -4.083  -8.109
   74   HH22  ARG   8          HH22      ARG   8  61.586  -5.444  -8.545
   75    HA   PRO   9           HA       PRO   9  63.799   3.788  -8.141
   76    HB2  PRO   9           HB2      PRO   9  65.070   4.702  -5.912
   77    HB3  PRO   9           HB1      PRO   9  63.926   5.693  -6.723
   78    HG2  PRO   9           HG2      PRO   9  63.814   4.254  -4.252
   79    HG3  PRO   9           HG1      PRO   9  62.663   5.495  -4.838
   80    HD2  PRO   9           HD2      PRO   9  62.374   2.800  -4.455
   81    HD3  PRO   9           HD1      PRO   9  61.180   3.791  -5.290
   82    H    ARG  10           HN       ARG  10  66.348   3.991  -7.536
   83    HA   ARG  10           HA       ARG  10  67.141   1.521  -6.194
   84    HB2  ARG  10           HB2      ARG  10  68.481   3.022  -8.402
   85    HB3  ARG  10           HB1      ARG  10  69.140   1.633  -7.560
   86    HG2  ARG  10           HG2      ARG  10  66.684   1.705  -9.315
   87    HG3  ARG  10           HG1      ARG  10  68.254   0.951  -9.624
   88    HD2  ARG  10           HD2      ARG  10  66.412   0.117  -7.392
   89    HD3  ARG  10           HD1      ARG  10  66.455  -0.649  -8.965
   90    HE   ARG  10           HE       ARG  10  68.954  -0.526  -7.455
   91   HH11  ARG  10          HH11      ARG  10  66.177  -2.463  -8.482
   92   HH12  ARG  10          HH12      ARG  10  66.975  -3.952  -8.262
   93   HH21  ARG  10          HH21      ARG  10  69.999  -2.581  -7.101
   94   HH22  ARG  10          HH22      ARG  10  69.159  -4.023  -7.473
   95    H    LYS  11           HN       LYS  11  66.980   4.803  -5.654
   96    HA   LYS  11           HA       LYS  11  69.500   4.684  -4.178
   97    HB2  LYS  11           HB2      LYS  11  67.925   7.143  -4.874
   98    HB3  LYS  11           HB1      LYS  11  69.447   7.020  -4.058
   99    HG2  LYS  11           HG2      LYS  11  70.428   5.965  -6.086
  100    HG3  LYS  11           HG1      LYS  11  68.933   6.392  -6.932
  101    HD2  LYS  11           HD2      LYS  11  69.265   8.724  -6.288
  102    HD3  LYS  11           HD1      LYS  11  70.767   8.228  -5.490
  103    HE2  LYS  11           HE2      LYS  11  70.182   7.955  -8.437
  104    HE3  LYS  11           HE1      LYS  11  71.189   9.215  -7.726
  105    HZ1  LYS  11           HZ1      LYS  11  71.736   6.295  -7.625
  106    HZ2  LYS  11           HZ2      LYS  11  72.713   7.492  -6.944
  107    HZ3  LYS  11           HZ3      LYS  11  72.511   7.416  -8.618
  108    H    LEU  12           HN       LEU  12  69.465   5.116  -2.034
  109    HA   LEU  12           HA       LEU  12  67.246   4.489  -0.522
  110    HB2  LEU  12           HB2      LEU  12  69.348   4.168   0.414
  111    HB3  LEU  12           HB1      LEU  12  69.826   5.837   0.157
  112    HG   LEU  12           HG       LEU  12  68.194   6.541   1.848
  113   HD11  LEU  12          HD11      LEU  12  66.659   4.615   1.595
  114   HD12  LEU  12          HD12      LEU  12  67.163   4.922   3.276
  115   HD13  LEU  12          HD13      LEU  12  67.909   3.602   2.351
  116   HD21  LEU  12          HD21      LEU  12  70.547   5.996   2.386
  117   HD22  LEU  12          HD22      LEU  12  69.956   4.395   2.878
  118   HD23  LEU  12          HD23      LEU  12  69.414   5.835   3.731
  119    HA   PRO  13           HA       PRO  13  66.516   9.046   0.671
  120    HB2  PRO  13           HB2      PRO  13  67.536  11.086  -0.828
  121    HB3  PRO  13           HB1      PRO  13  68.506  10.213   0.390
  122    HG2  PRO  13           HG2      PRO  13  68.431   9.721  -2.552
  123    HG3  PRO  13           HG1      PRO  13  69.834  10.043  -1.512
  124    HD2  PRO  13           HD2      PRO  13  69.108   7.551  -2.151
  125    HD3  PRO  13           HD1      PRO  13  69.753   7.928  -0.550
  126    H    GLN  14           HN       GLN  14  66.763   8.429  -2.742
  127    HA   GLN  14           HA       GLN  14  64.412   9.713  -3.587
  128    HB2  GLN  14           HB2      GLN  14  66.275   8.980  -5.060
  129    HB3  GLN  14           HB1      GLN  14  65.796   7.314  -4.770
  130    HG2  GLN  14           HG2      GLN  14  63.609   7.795  -5.767
  131    HG3  GLN  14           HG1      GLN  14  64.193   9.443  -6.052
  132   HE21  GLN  14          HE21      GLN  14  66.856   8.695  -6.822
  133   HE22  GLN  14          HE22      GLN  14  66.755   7.967  -8.375
  134    H    LEU  15           HN       LEU  15  65.080   6.396  -2.403
  135    HA   LEU  15           HA       LEU  15  62.559   5.341  -2.839
  136    HB2  LEU  15           HB2      LEU  15  64.605   4.048  -2.341
  137    HB3  LEU  15           HB1      LEU  15  64.645   4.767  -0.813
  138    HG   LEU  15           HG       LEU  15  62.618   3.749  -0.116
  139   HD11  LEU  15          HD11      LEU  15  62.783   2.268  -2.725
  140   HD12  LEU  15          HD12      LEU  15  61.601   3.563  -2.392
  141   HD13  LEU  15          HD13      LEU  15  61.548   2.058  -1.486
  142   HD21  LEU  15          HD21      LEU  15  64.631   1.932  -1.311
  143   HD22  LEU  15          HD22      LEU  15  63.493   1.493  -0.018
  144   HD23  LEU  15          HD23      LEU  15  64.736   2.755   0.235
  145    H    CYS  16           HN       CYS  16  63.976   6.957  -0.110
  146    HA   CYS  16           HA       CYS  16  61.870   6.673   1.693
  147    HB2  CYS  16           HB2      CYS  16  63.754   9.027   1.347
  148    HB3  CYS  16           HB1      CYS  16  62.807   8.723   2.790
  149    HG   CYS  16           HG       CYS  16  65.324   6.764   1.560
  150    H    THR  17           HN       THR  17  62.350   9.021  -0.859
  151    HA   THR  17           HA       THR  17  60.203  10.752  -0.587
  152    HB   THR  17           HB       THR  17  61.695   9.610  -2.876
  153    HG1  THR  17           HG1      THR  17  62.869  11.364  -2.834
  154   HG21  THR  17          HG21      THR  17  59.565  11.744  -3.102
  155   HG22  THR  17          HG22      THR  17  59.631  10.155  -3.889
  156   HG23  THR  17          HG23      THR  17  60.774  11.408  -4.353
  157    H    GLU  18           HN       GLU  18  60.420   7.580  -1.933
  158    HA   GLU  18           HA       GLU  18  57.911   7.421  -3.191
  159    HB2  GLU  18           HB2      GLU  18  60.013   5.590  -2.398
  160    HB3  GLU  18           HB1      GLU  18  58.597   5.017  -3.281
  161    HG2  GLU  18           HG2      GLU  18  60.569   7.177  -4.091
  162    HG3  GLU  18           HG1      GLU  18  60.523   5.565  -4.768
  163    H    LEU  19           HN       LEU  19  59.268   5.910  -0.277
  164    HA   LEU  19           HA       LEU  19  56.849   4.955   0.784
  165    HB2  LEU  19           HB2      LEU  19  59.469   5.697   1.923
  166    HB3  LEU  19           HB1      LEU  19  58.261   5.107   2.971
  167    HG   LEU  19           HG       LEU  19  58.389   3.030   1.181
  168   HD11  LEU  19          HD11      LEU  19  60.694   2.697   0.634
  169   HD12  LEU  19          HD12      LEU  19  61.056   4.317   1.224
  170   HD13  LEU  19          HD13      LEU  19  60.013   4.106  -0.177
  171   HD21  LEU  19          HD21      LEU  19  59.875   1.993   2.747
  172   HD22  LEU  19          HD22      LEU  19  58.629   2.942   3.592
  173   HD23  LEU  19          HD23      LEU  19  60.271   3.582   3.403
  174    H    GLN  20           HN       GLN  20  57.805   8.124   0.359
  175    HA   GLN  20           HA       GLN  20  56.881  10.101   0.951
  176    HB2  GLN  20           HB2      GLN  20  54.844   8.218   2.022
  177    HB3  GLN  20           HB1      GLN  20  54.564   9.975   2.038
  178    HG2  GLN  20           HG2      GLN  20  54.746   9.959  -0.415
  179    HG3  GLN  20           HG1      GLN  20  55.047   8.224  -0.382
  180   HE21  GLN  20          HE21      GLN  20  52.689  10.722  -0.020
  181   HE22  GLN  20          HE22      GLN  20  51.313   9.687  -0.063
  182    H    THR  21           HN       THR  21  58.806   8.897   2.552
  183    HA   THR  21           HA       THR  21  58.340  10.237   5.066
  184    HB   THR  21           HB       THR  21  57.595   7.837   5.339
  185    HG1  THR  21           HG1      THR  21  58.275   7.969   7.304
  186   HG21  THR  21          HG21      THR  21  59.205   6.772   3.824
  187   HG22  THR  21          HG22      THR  21  59.301   6.061   5.437
  188   HG23  THR  21          HG23      THR  21  60.526   7.216   4.905
  189    H    THR  22           HN       THR  22  60.757   9.350   6.267
  190    HA   THR  22           HA       THR  22  62.734  10.121   4.221
  191    HB   THR  22           HB       THR  22  63.280  10.850   7.049
  192    HG1  THR  22           HG1      THR  22  61.058  11.582   5.670
  193   HG21  THR  22          HG21      THR  22  63.639  12.213   4.363
  194   HG22  THR  22          HG22      THR  22  64.896  11.385   5.269
  195   HG23  THR  22          HG23      THR  22  64.191  12.875   5.895
  196    H    ILE  23           HN       ILE  23  65.077   9.610   5.299
  197    HA   ILE  23           HA       ILE  23  65.478   6.949   5.428
  198    HB   ILE  23           HB       ILE  23  67.135   8.998   6.814
  199   HG12  ILE  23          HG12      ILE  23  66.873   8.263   3.935
  200   HG13  ILE  23          HG11      ILE  23  66.719   9.822   4.673
  201   HG21  ILE  23          HG21      ILE  23  67.817   6.646   7.208
  202   HG22  ILE  23          HG22      ILE  23  69.005   7.423   6.148
  203   HG23  ILE  23          HG23      ILE  23  67.783   6.344   5.468
  204   HD11  ILE  23          HD11      ILE  23  68.797   9.661   3.423
  205   HD12  ILE  23          HD12      ILE  23  69.193   8.213   4.359
  206   HD13  ILE  23          HD13      ILE  23  69.151   9.786   5.168
  207    H    HIS  24           HN       HIS  24  64.461   9.145   7.745
  208    HA   HIS  24           HA       HIS  24  65.543   8.126  10.121
  209    HB2  HIS  24           HB2      HIS  24  63.385  10.180   9.735
  210    HB3  HIS  24           HB1      HIS  24  64.494  10.077  11.078
  211    HD1  HIS  24           HD1      HIS  24  66.960   9.646   9.033
  212    HD2  HIS  24           HD2      HIS  24  64.232  12.678   9.129
  213    HE1  HIS  24           HE1      HIS  24  67.778  11.260   7.269
  214    H    ASP  25           HN       ASP  25  63.099   7.117   8.227
  215    HA   ASP  25           HA       ASP  25  61.557   5.979  10.462
  216    HB2  ASP  25           HB2      ASP  25  60.506   8.118   9.587
  217    HB3  ASP  25           HB1      ASP  25  60.225   7.247   8.109
  218    H    ILE  26           HN       ILE  26  62.398   5.889   7.079
  219    HA   ILE  26           HA       ILE  26  60.983   3.747   6.088
  220    HB   ILE  26           HB       ILE  26  62.305   5.150   4.650
  221   HG12  ILE  26          HG12      ILE  26  63.567   2.449   4.640
  222   HG13  ILE  26          HG11      ILE  26  62.005   2.586   3.975
  223   HG21  ILE  26          HG21      ILE  26  64.133   5.622   6.177
  224   HG22  ILE  26          HG22      ILE  26  64.748   5.058   4.619
  225   HG23  ILE  26          HG23      ILE  26  64.723   3.970   6.005
  226   HD11  ILE  26          HD11      ILE  26  62.964   4.251   2.328
  227   HD12  ILE  26          HD12      ILE  26  63.604   2.593   2.259
  228   HD13  ILE  26          HD13      ILE  26  64.548   3.865   3.023
  229    H    ILE  27           HN       ILE  27  61.037   1.566   6.161
  230    HA   ILE  27           HA       ILE  27  63.173   0.373   7.669
  231    HB   ILE  27           HB       ILE  27  60.433  -0.667   6.948
  232   HG12  ILE  27          HG12      ILE  27  60.487   1.041   8.742
  233   HG13  ILE  27          HG11      ILE  27  59.918  -0.533   9.268
  234   HG21  ILE  27          HG21      ILE  27  62.607  -1.986   8.540
  235   HG22  ILE  27          HG22      ILE  27  62.088  -2.416   6.911
  236   HG23  ILE  27          HG23      ILE  27  60.976  -2.624   8.271
  237   HD11  ILE  27          HD11      ILE  27  62.656   0.645   9.759
  238   HD12  ILE  27          HD12      ILE  27  62.142  -0.978  10.217
  239   HD13  ILE  27          HD13      ILE  27  61.368   0.426  10.957
  240    H    LEU  28           HN       LEU  28  64.729   0.094   6.617
  241    HA   LEU  28           HA       LEU  28  64.531  -1.307   4.048
  242    HB2  LEU  28           HB2      LEU  28  65.858   1.020   4.799
  243    HB3  LEU  28           HB1      LEU  28  67.075  -0.243   4.670
  244    HG   LEU  28           HG       LEU  28  66.441  -0.752   2.446
  245   HD11  LEU  28          HD11      LEU  28  64.542   0.926   1.590
  246   HD12  LEU  28          HD12      LEU  28  64.068   0.724   3.332
  247   HD13  LEU  28          HD13      LEU  28  64.191  -0.659   2.276
  248   HD21  LEU  28          HD21      LEU  28  66.413   2.222   2.819
  249   HD22  LEU  28          HD22      LEU  28  66.891   1.352   1.359
  250   HD23  LEU  28          HD23      LEU  28  67.873   1.245   2.825
  251    H    GLU  29           HN       GLU  29  65.352  -3.181   3.926
  252    HA   GLU  29           HA       GLU  29  66.773  -3.915   6.409
  253    HB2  GLU  29           HB2      GLU  29  65.958  -6.194   5.517
  254    HB3  GLU  29           HB1      GLU  29  65.083  -5.321   6.776
  255    HG2  GLU  29           HG2      GLU  29  63.962  -4.158   4.784
  256    HG3  GLU  29           HG1      GLU  29  64.517  -5.534   3.865
  257    H    CYS  30           HN       CYS  30  67.823  -6.277   5.864
  258    HA   CYS  30           HA       CYS  30  69.716  -5.613   3.831
  259    HB2  CYS  30           HB2      CYS  30  70.395  -6.674   6.083
  260    HB3  CYS  30           HB1      CYS  30  69.666  -8.122   5.450
  261    H    VAL  31           HN       VAL  31  69.591  -6.225   2.061
  262    HA   VAL  31           HA       VAL  31  67.647  -7.764   0.842
  263    HB   VAL  31           HB       VAL  31  68.825  -6.185  -0.503
  264   HG11  VAL  31          HG11      VAL  31  71.139  -6.311  -0.900
  265   HG12  VAL  31          HG12      VAL  31  71.309  -7.414   0.487
  266   HG13  VAL  31          HG13      VAL  31  70.693  -5.738   0.710
  267   HG21  VAL  31          HG21      VAL  31  70.009  -7.351  -2.254
  268   HG22  VAL  31          HG22      VAL  31  68.461  -8.069  -1.859
  269   HG23  VAL  31          HG23      VAL  31  69.969  -8.828  -1.286
  270    H    TYR  32           HN       TYR  32  70.711  -8.558   2.044
  271    HA   TYR  32           HA       TYR  32  70.691 -11.235   1.024
  272    HB2  TYR  32           HB2      TYR  32  72.826  -9.887   2.667
  273    HB3  TYR  32           HB1      TYR  32  72.993 -11.365   1.720
  274    HD1  TYR  32           HD2      TYR  32  71.684 -10.764  -0.783
  275    HD2  TYR  32           HD1      TYR  32  74.103  -8.206   1.640
  276    HE1  TYR  32           HE2      TYR  32  72.149  -9.499  -2.689
  277    HE2  TYR  32           HE1      TYR  32  74.613  -6.811  -0.316
  278    HH   TYR  32           HH       TYR  32  72.908  -7.165  -3.287
  279    H    CYS  33           HN       CYS  33  70.570  -9.613   4.244
  280    HA   CYS  33           HA       CYS  33  70.603 -12.246   5.580
  281    HB2  CYS  33           HB2      CYS  33  70.722  -9.538   6.890
  282    HB3  CYS  33           HB1      CYS  33  70.986 -11.095   7.620
  283    H    LYS  34           HN       LYS  34  68.423  -9.728   4.731
  284    HA   LYS  34           HA       LYS  34  66.415  -9.238   5.095
  285    HB2  LYS  34           HB2      LYS  34  66.286 -12.028   6.160
  286    HB3  LYS  34           HB1      LYS  34  64.871 -10.989   6.141
  287    HG2  LYS  34           HG2      LYS  34  64.966 -12.485   4.287
  288    HG3  LYS  34           HG1      LYS  34  65.006 -10.811   3.714
  289    HD2  LYS  34           HD2      LYS  34  67.413 -11.117   3.310
  290    HD3  LYS  34           HD1      LYS  34  67.309 -12.759   3.946
  291    HE2  LYS  34           HE2      LYS  34  67.282 -12.726   1.488
  292    HE3  LYS  34           HE1      LYS  34  65.790 -13.378   2.164
  293    HZ1  LYS  34           HZ1      LYS  34  66.159 -10.611   1.166
  294    HZ2  LYS  34           HZ2      LYS  34  64.703 -11.276   1.759
  295    HZ3  LYS  34           HZ3      LYS  34  65.371 -11.864   0.348
  296    H    GLN  35           HN       GLN  35  68.537  -9.011   7.308
  297    HA   GLN  35           HA       GLN  35  66.819  -8.481   9.539
  298    HB2  GLN  35           HB2      GLN  35  69.724  -8.172   9.028
  299    HB3  GLN  35           HB1      GLN  35  68.946  -7.495  10.433
  300    HG2  GLN  35           HG2      GLN  35  68.873 -10.350   9.662
  301    HG3  GLN  35           HG1      GLN  35  69.977  -9.653  10.895
  302   HE21  GLN  35          HE21      GLN  35  66.830 -10.732  10.128
  303   HE22  GLN  35          HE22      GLN  35  66.136 -10.551  11.708
  304    H    GLN  36           HN       GLN  36  66.372  -6.561  10.186
  305    HA   GLN  36           HA       GLN  36  66.280  -4.608   8.163
  306    HB2  GLN  36           HB2      GLN  36  65.102  -4.971  10.849
  307    HB3  GLN  36           HB1      GLN  36  64.989  -3.460   9.975
  308    HG2  GLN  36           HG2      GLN  36  63.857  -4.443   8.190
  309    HG3  GLN  36           HG1      GLN  36  64.254  -6.064   8.745
  310   HE21  GLN  36          HE21      GLN  36  61.762  -4.941   8.026
  311   HE22  GLN  36          HE22      GLN  36  60.680  -5.007   9.359
  312    H    LEU  37           HN       LEU  37  67.584  -3.129   7.934
  313    HA   LEU  37           HA       LEU  37  69.855  -2.817   9.487
  314    HB2  LEU  37           HB2      LEU  37  68.629  -1.121   7.349
  315    HB3  LEU  37           HB1      LEU  37  69.832  -0.511   8.417
  316    HG   LEU  37           HG       LEU  37  71.307  -2.413   7.780
  317   HD11  LEU  37          HD11      LEU  37  70.851  -3.505   5.636
  318   HD12  LEU  37          HD12      LEU  37  69.230  -2.812   5.667
  319   HD13  LEU  37          HD13      LEU  37  69.726  -3.948   6.918
  320   HD21  LEU  37          HD21      LEU  37  71.992  -1.385   5.660
  321   HD22  LEU  37          HD22      LEU  37  71.684  -0.201   6.929
  322   HD23  LEU  37          HD23      LEU  37  70.494  -0.451   5.654
  323    H    LEU  38           HN       LEU  38  70.463  -1.772  11.032
  324    HA   LEU  38           HA       LEU  38  68.836  -0.445  12.887
  325    HB2  LEU  38           HB2      LEU  38  71.444  -1.435  12.574
  326    HB3  LEU  38           HB1      LEU  38  71.614   0.288  12.679
  327    HG   LEU  38           HG       LEU  38  70.165  -1.302  14.741
  328   HD11  LEU  38          HD11      LEU  38  72.250  -1.185  16.051
  329   HD12  LEU  38          HD12      LEU  38  73.045  -0.408  14.672
  330   HD13  LEU  38          HD13      LEU  38  72.464  -2.067  14.534
  331   HD21  LEU  38          HD21      LEU  38  71.416   1.440  14.804
  332   HD22  LEU  38          HD22      LEU  38  70.561   0.659  16.136
  333   HD23  LEU  38          HD23      LEU  38  69.694   1.103  14.665
  334    H    ARG  39           HN       ARG  39  68.292   1.780  12.753
  335    HA   ARG  39           HA       ARG  39  68.319   3.111  10.345
  336    HB2  ARG  39           HB2      ARG  39  66.905   3.700  12.264
  337    HB3  ARG  39           HB1      ARG  39  68.303   4.408  13.058
  338    HG2  ARG  39           HG2      ARG  39  68.501   6.057  11.306
  339    HG3  ARG  39           HG1      ARG  39  67.155   5.329  10.440
  340    HD2  ARG  39           HD2      ARG  39  67.031   6.521  13.199
  341    HD3  ARG  39           HD1      ARG  39  66.404   7.265  11.732
  342    HE   ARG  39           HE       ARG  39  65.165   4.898  11.755
  343   HH11  ARG  39          HH11      ARG  39  65.438   7.508  14.103
  344   HH12  ARG  39          HH12      ARG  39  64.020   7.103  14.955
  345   HH21  ARG  39          HH21      ARG  39  63.167   4.326  12.933
  346   HH22  ARG  39          HH22      ARG  39  62.712   5.293  14.259
  347    H    ARG  40           HN       ARG  40  70.785   3.171  12.813
  348    HA   ARG  40           HA       ARG  40  72.490   5.159  12.005
  349    HB2  ARG  40           HB2      ARG  40  73.071   2.390  13.032
  350    HB3  ARG  40           HB1      ARG  40  74.214   3.720  12.987
  351    HG2  ARG  40           HG2      ARG  40  71.653   3.681  14.559
  352    HG3  ARG  40           HG1      ARG  40  73.260   3.356  15.213
  353    HD2  ARG  40           HD2      ARG  40  72.304   5.919  13.953
  354    HD3  ARG  40           HD1      ARG  40  72.617   5.640  15.666
  355    HE   ARG  40           HE       ARG  40  74.920   5.034  14.172
  356   HH11  ARG  40          HH11      ARG  40  73.073   7.769  15.381
  357   HH12  ARG  40          HH12      ARG  40  74.350   8.880  15.288
  358   HH21  ARG  40          HH21      ARG  40  76.701   6.517  14.016
  359   HH22  ARG  40          HH22      ARG  40  76.495   8.138  14.503
  360    H    GLU  41           HN       GLU  41  72.283   1.788  10.898
  361    HA   GLU  41           HA       GLU  41  74.440   1.891   9.004
  362    HB2  GLU  41           HB2      GLU  41  72.132  -0.049   9.104
  363    HB3  GLU  41           HB1      GLU  41  73.699  -0.391   8.437
  364    HG2  GLU  41           HG2      GLU  41  72.847  -0.224  11.299
  365    HG3  GLU  41           HG1      GLU  41  73.587  -1.557  10.437
  366    H    VAL  42           HN       VAL  42  70.989   2.411   8.962
  367    HA   VAL  42           HA       VAL  42  70.686   2.339   6.135
  368    HB   VAL  42           HB       VAL  42  68.900   4.018   7.933
  369   HG11  VAL  42          HG11      VAL  42  68.316   2.328   5.542
  370   HG12  VAL  42          HG12      VAL  42  68.594   4.079   5.460
  371   HG13  VAL  42          HG13      VAL  42  67.184   3.430   6.322
  372   HG21  VAL  42          HG21      VAL  42  67.528   2.067   8.368
  373   HG22  VAL  42          HG22      VAL  42  69.165   1.795   8.984
  374   HG23  VAL  42          HG23      VAL  42  68.653   1.058   7.467
  375    H    TYR  43           HN       TYR  43  71.396   4.961   8.459
  376    HA   TYR  43           HA       TYR  43  71.500   7.034   6.583
  377    HB2  TYR  43           HB2      TYR  43  73.042   6.662   9.131
  378    HB3  TYR  43           HB1      TYR  43  73.132   8.146   8.165
  379    HD1  TYR  43           HD1      TYR  43  70.429   8.586   7.397
  380    HD2  TYR  43           HD2      TYR  43  71.899   7.070  11.067
  381    HE1  TYR  43           HE1      TYR  43  68.402   9.310   8.491
  382    HE2  TYR  43           HE2      TYR  43  69.846   7.808  12.187
  383    HH   TYR  43           HH       TYR  43  68.057   9.548  11.769
  384    H    ASP  44           HN       ASP  44  73.962   4.662   7.507
  385    HA   ASP  44           HA       ASP  44  76.199   5.717   6.320
  386    HB2  ASP  44           HB2      ASP  44  75.321   2.849   6.501
  387    HB3  ASP  44           HB1      ASP  44  76.903   3.386   6.100
  388    H    PHE  45           HN       PHE  45  73.569   4.019   5.020
  389    HA   PHE  45           HA       PHE  45  74.607   3.195   2.598
  390    HB2  PHE  45           HB2      PHE  45  72.315   2.842   3.953
  391    HB3  PHE  45           HB1      PHE  45  71.853   4.078   2.812
  392    HD1  PHE  45           HD2      PHE  45  73.386   0.735   3.029
  393    HD2  PHE  45           HD1      PHE  45  71.328   3.649   0.719
  394    HE1  PHE  45           HE2      PHE  45  72.933  -0.939   1.248
  395    HE2  PHE  45           HE1      PHE  45  70.917   2.010  -1.022
  396    HZ   PHE  45           HZ       PHE  45  71.659  -0.249  -0.778
  397    H    ALA  46           HN       ALA  46  72.799   6.172   3.428
  398    HA   ALA  46           HA       ALA  46  73.198   7.279   0.765
  399    HB1  ALA  46           HB1      ALA  46  71.047   7.796   1.877
  400    HB2  ALA  46           HB2      ALA  46  71.956   9.260   1.601
  401    HB3  ALA  46           HB3      ALA  46  71.942   8.531   3.208
  402    H    ARG  47           HN       ARG  47  74.684   7.393   3.868
  403    HA   ARG  47           HA       ARG  47  76.076   9.857   3.457
  404    HB2  ARG  47           HB2      ARG  47  75.875   7.820   5.572
  405    HB3  ARG  47           HB1      ARG  47  77.380   8.694   5.598
  406    HG2  ARG  47           HG2      ARG  47  75.678   9.668   7.089
  407    HG3  ARG  47           HG1      ARG  47  76.136  10.805   5.824
  408    HD2  ARG  47           HD2      ARG  47  74.140  10.214   4.555
  409    HD3  ARG  47           HD1      ARG  47  73.690   9.044   5.785
  410    HE   ARG  47           HE       ARG  47  73.633  11.054   7.299
  411   HH11  ARG  47          HH11      ARG  47  72.908  11.331   3.793
  412   HH12  ARG  47          HH12      ARG  47  71.706  12.501   4.042
  413   HH21  ARG  47          HH21      ARG  47  71.925  12.698   7.520
  414   HH22  ARG  47          HH22      ARG  47  71.169  13.304   6.105
  415    H    ARG  48           HN       ARG  48  76.564   6.668   2.506
  416    HA   ARG  48           HA       ARG  48  79.311   7.241   1.700
  417    HB2  ARG  48           HB2      ARG  48  77.779   4.746   2.206
  418    HB3  ARG  48           HB1      ARG  48  79.355   4.717   1.452
  419    HG2  ARG  48           HG2      ARG  48  80.367   5.571   3.448
  420    HG3  ARG  48           HG1      ARG  48  78.774   5.809   4.191
  421    HD2  ARG  48           HD2      ARG  48  78.321   3.500   4.108
  422    HD3  ARG  48           HD1      ARG  48  79.748   3.180   3.169
  423    HE   ARG  48           HE       ARG  48  80.935   4.171   5.263
  424   HH11  ARG  48          HH11      ARG  48  78.167   1.942   5.408
  425   HH12  ARG  48          HH12      ARG  48  78.597   1.278   6.914
  426   HH21  ARG  48          HH21      ARG  48  81.532   3.195   7.296
  427   HH22  ARG  48          HH22      ARG  48  80.536   2.016   8.009
  428    H    ASP  49           HN       ASP  49  79.237   5.089  -0.268
  429    HA   ASP  49           HA       ASP  49  77.383   6.300  -2.157
  430    HB2  ASP  49           HB2      ASP  49  80.223   5.438  -2.603
  431    HB3  ASP  49           HB1      ASP  49  79.090   5.557  -3.938
  432    H    LEU  50           HN       LEU  50  75.967   4.581  -1.352
  433    HA   LEU  50           HA       LEU  50  76.499   2.145  -2.788
  434    HB2  LEU  50           HB2      LEU  50  74.721   2.608  -0.427
  435    HB3  LEU  50           HB1      LEU  50  74.867   1.093  -1.291
  436    HG   LEU  50           HG       LEU  50  77.346   1.318  -0.747
  437   HD11  LEU  50          HD11      LEU  50  76.220   3.082   1.378
  438   HD12  LEU  50          HD12      LEU  50  77.306   3.495   0.044
  439   HD13  LEU  50          HD13      LEU  50  77.872   2.418   1.329
  440   HD21  LEU  50          HD21      LEU  50  75.978  -0.416   0.072
  441   HD22  LEU  50          HD22      LEU  50  75.300   0.704   1.273
  442   HD23  LEU  50          HD23      LEU  50  77.002   0.223   1.379
  443    H    CYS  51           HN       CYS  51  74.368   1.035  -3.382
  444    HA   CYS  51           HA       CYS  51  72.206   2.876  -3.953
  445    HB2  CYS  51           HB2      CYS  51  71.898   1.811  -6.141
  446    HB3  CYS  51           HB1      CYS  51  73.495   2.542  -6.033
  447    HG   CYS  51           HG       CYS  51  74.104  -0.376  -5.039
  448    H    ILE  52           HN       ILE  52  70.208   1.636  -4.191
  449    HA   ILE  52           HA       ILE  52  70.182  -0.391  -2.143
  450    HB   ILE  52           HB       ILE  52  68.062   1.137  -3.599
  451   HG12  ILE  52          HG12      ILE  52  69.016   0.788  -0.838
  452   HG13  ILE  52          HG11      ILE  52  69.204   2.236  -1.879
  453   HG21  ILE  52          HG21      ILE  52  66.348  -0.026  -2.283
  454   HG22  ILE  52          HG22      ILE  52  67.566  -1.127  -1.640
  455   HG23  ILE  52          HG23      ILE  52  67.163  -1.164  -3.356
  456   HD11  ILE  52          HD11      ILE  52  66.893   0.982  -0.694
  457   HD12  ILE  52          HD12      ILE  52  66.809   2.344  -1.865
  458   HD13  ILE  52          HD13      ILE  52  67.608   2.543  -0.232
  459    H    VAL  53           HN       VAL  53  69.498  -2.259  -2.236
  460    HA   VAL  53           HA       VAL  53  69.501  -3.547  -4.802
  461    HB   VAL  53           HB       VAL  53  70.530  -5.483  -3.307
  462   HG11  VAL  53          HG11      VAL  53  71.637  -4.327  -5.219
  463   HG12  VAL  53          HG12      VAL  53  72.773  -4.664  -3.911
  464   HG13  VAL  53          HG13      VAL  53  72.126  -3.033  -4.128
  465   HG21  VAL  53          HG21      VAL  53  71.994  -4.538  -1.534
  466   HG22  VAL  53          HG22      VAL  53  70.295  -4.254  -1.179
  467   HG23  VAL  53          HG23      VAL  53  71.291  -2.960  -1.808
  468    H    TYR  54           HN       TYR  54  67.650  -4.321  -5.140
  469    HA   TYR  54           HA       TYR  54  65.819  -4.992  -3.025
  470    HB2  TYR  54           HB2      TYR  54  65.599  -4.856  -6.025
  471    HB3  TYR  54           HB1      TYR  54  64.292  -5.355  -4.954
  472    HD1  TYR  54           HD2      TYR  54  66.585  -2.526  -5.668
  473    HD2  TYR  54           HD1      TYR  54  62.913  -3.784  -3.955
  474    HE1  TYR  54           HE2      TYR  54  65.892  -0.157  -5.276
  475    HE2  TYR  54           HE1      TYR  54  62.272  -1.542  -3.623
  476    HH   TYR  54           HH       TYR  54  64.016   1.050  -4.988
  477    H    ARG  55           HN       ARG  55  65.702  -6.806  -2.362
  478    HA   ARG  55           HA       ARG  55  67.099  -8.868  -3.822
  479    HB2  ARG  55           HB2      ARG  55  66.771  -8.656  -1.081
  480    HB3  ARG  55           HB1      ARG  55  65.576  -9.860  -1.496
  481    HG2  ARG  55           HG2      ARG  55  68.576 -10.083  -2.065
  482    HG3  ARG  55           HG1      ARG  55  67.757 -10.930  -0.815
  483    HD2  ARG  55           HD2      ARG  55  67.839 -12.547  -2.520
  484    HD3  ARG  55           HD1      ARG  55  66.310 -11.783  -2.952
  485    HE   ARG  55           HE       ARG  55  68.670 -10.593  -4.109
  486   HH11  ARG  55          HH11      ARG  55  65.911 -12.766  -4.724
  487   HH12  ARG  55          HH12      ARG  55  66.248 -12.890  -6.386
  488   HH21  ARG  55          HH21      ARG  55  69.067 -10.748  -6.345
  489   HH22  ARG  55          HH22      ARG  55  68.057 -11.698  -7.344
  490    H    ASP  56           HN       ASP  56  65.752  -9.751  -5.423
  491    HA   ASP  56           HA       ASP  56  64.027 -10.584  -6.534
  492    HB2  ASP  56           HB2      ASP  56  62.728 -10.728  -3.836
  493    HB3  ASP  56           HB1      ASP  56  61.845 -11.179  -5.292
  494    H    GLY  57           HN       GLY  57  62.150  -8.702  -4.200
  495    HA2  GLY  57           HA2      GLY  57  62.121  -6.508  -5.991
  496    HA3  GLY  57           HA1      GLY  57  60.557  -7.324  -5.938
  497    H    ASN  58           HN       ASN  58  62.755  -6.987  -3.222
  498    HA   ASN  58           HA       ASN  58  60.822  -5.127  -1.967
  499    HB2  ASN  58           HB2      ASN  58  62.602  -7.062  -0.484
  500    HB3  ASN  58           HB1      ASN  58  61.225  -6.200   0.139
  501   HD21  ASN  58          HD21      ASN  58  62.310  -8.842  -1.824
  502   HD22  ASN  58          HD22      ASN  58  60.869  -9.759  -1.783
  503    HA   PRO  59           HA       PRO  59  64.472  -2.819  -1.762
  504    HB2  PRO  59           HB2      PRO  59  63.362  -0.894   0.064
  505    HB3  PRO  59           HB1      PRO  59  63.569  -0.741  -1.677
  506    HG2  PRO  59           HG2      PRO  59  61.072  -0.912  -0.516
  507    HG3  PRO  59           HG1      PRO  59  61.387  -1.426  -2.115
  508    HD2  PRO  59           HD2      PRO  59  61.260  -3.101   0.357
  509    HD3  PRO  59           HD1      PRO  59  60.600  -3.415  -1.262
  510    H    TYR  60           HN       TYR  60  66.294  -3.132  -0.814
  511    HA   TYR  60           HA       TYR  60  66.226  -3.107   2.014
  512    HB2  TYR  60           HB2      TYR  60  67.732  -5.159   0.449
  513    HB3  TYR  60           HB1      TYR  60  67.670  -4.937   2.123
  514    HD1  TYR  60           HD2      TYR  60  65.889  -6.000  -0.804
  515    HD2  TYR  60           HD1      TYR  60  66.121  -5.916   3.284
  516    HE1  TYR  60           HE2      TYR  60  64.318  -7.900  -0.777
  517    HE2  TYR  60           HE1      TYR  60  64.533  -7.896   3.456
  518    HH   TYR  60           HH       TYR  60  62.780  -8.902   2.008
  519    H    ALA  61           HN       ALA  61  68.067  -2.675   2.759
  520    HA   ALA  61           HA       ALA  61  69.888  -1.132   1.197
  521    HB1  ALA  61           HB1      ALA  61  70.594  -0.424   3.351
  522    HB2  ALA  61           HB2      ALA  61  69.696  -1.788   4.021
  523    HB3  ALA  61           HB3      ALA  61  68.785  -0.438   3.339
  524    H    VAL  62           HN       VAL  62  72.048  -1.696   2.828
  525    HA   VAL  62           HA       VAL  62  72.490  -4.564   2.670
  526    HB   VAL  62           HB       VAL  62  74.239  -2.252   1.712
  527   HG11  VAL  62          HG11      VAL  62  75.083  -5.070   2.061
  528   HG12  VAL  62          HG12      VAL  62  75.594  -3.606   2.949
  529   HG13  VAL  62          HG13      VAL  62  75.975  -3.765   1.237
  530   HG21  VAL  62          HG21      VAL  62  73.159  -4.630   0.278
  531   HG22  VAL  62          HG22      VAL  62  74.318  -3.481  -0.391
  532   HG23  VAL  62          HG23      VAL  62  72.700  -2.942   0.015
  533    H    CYS  63           HN       CYS  63  72.588  -5.183   4.737
  534    HA   CYS  63           HA       CYS  63  72.893  -3.410   6.877
  535    HB2  CYS  63           HB2      CYS  63  72.637  -5.234   8.274
  536    HB3  CYS  63           HB1      CYS  63  71.926  -5.744   6.739
  537    H    ASP  64           HN       ASP  64  74.495  -3.876   8.715
  538    HA   ASP  64           HA       ASP  64  77.000  -2.762   8.146
  539    HB2  ASP  64           HB2      ASP  64  76.141  -2.750  10.382
  540    HB3  ASP  64           HB1      ASP  64  76.187  -4.498  10.453
  541    H    LYS  65           HN       LYS  65  76.161  -6.080   8.614
  542    HA   LYS  65           HA       LYS  65  78.737  -7.162   8.497
  543    HB2  LYS  65           HB2      LYS  65  76.080  -8.353   7.892
  544    HB3  LYS  65           HB1      LYS  65  77.583  -9.298   8.007
  545    HG2  LYS  65           HG2      LYS  65  76.301  -7.604  10.125
  546    HG3  LYS  65           HG1      LYS  65  76.292  -9.360   9.950
  547    HD2  LYS  65           HD2      LYS  65  78.563  -9.565  10.441
  548    HD3  LYS  65           HD1      LYS  65  78.870  -7.842  10.229
  549    HE2  LYS  65           HE2      LYS  65  78.820  -8.308  12.565
  550    HE3  LYS  65           HE1      LYS  65  77.401  -7.382  12.048
  551    HZ1  LYS  65           HZ1      LYS  65  76.052  -9.361  12.146
  552    HZ2  LYS  65           HZ2      LYS  65  76.793  -9.109  13.606
  553    HZ3  LYS  65           HZ3      LYS  65  77.371 -10.309  12.588
  554    H    CYS  66           HN       CYS  66  76.262  -6.685   6.104
  555    HA   CYS  66           HA       CYS  66  77.811  -7.723   4.012
  556    HB2  CYS  66           HB2      CYS  66  75.204  -6.268   4.152
  557    HB3  CYS  66           HB1      CYS  66  75.810  -6.895   2.637
  558    H    LEU  67           HN       LEU  67  77.293  -4.525   5.280
  559    HA   LEU  67           HA       LEU  67  78.526  -2.996   3.281
  560    HB2  LEU  67           HB2      LEU  67  78.390  -2.621   6.227
  561    HB3  LEU  67           HB1      LEU  67  79.067  -1.429   5.127
  562    HG   LEU  67           HG       LEU  67  76.233  -2.454   5.041
  563   HD11  LEU  67          HD11      LEU  67  77.467   0.087   5.814
  564   HD12  LEU  67          HD12      LEU  67  76.697  -1.089   6.918
  565   HD13  LEU  67          HD13      LEU  67  75.719  -0.192   5.718
  566   HD21  LEU  67          HD21      LEU  67  77.020  -1.858   2.832
  567   HD22  LEU  67          HD22      LEU  67  77.649  -0.337   3.462
  568   HD23  LEU  67          HD23      LEU  67  75.917  -0.633   3.449
  569    H    LYS  68           HN       LYS  68  79.775  -5.042   5.686
  570    HA   LYS  68           HA       LYS  68  82.489  -4.214   5.392
  571    HB2  LYS  68           HB2      LYS  68  81.900  -4.939   7.553
  572    HB3  LYS  68           HB1      LYS  68  81.061  -6.346   6.948
  573    HG2  LYS  68           HG2      LYS  68  83.979  -6.212   6.517
  574    HG3  LYS  68           HG1      LYS  68  83.406  -6.488   8.172
  575    HD2  LYS  68           HD2      LYS  68  82.044  -8.366   7.332
  576    HD3  LYS  68           HD1      LYS  68  82.694  -8.083   5.722
  577    HE2  LYS  68           HE2      LYS  68  84.305  -8.828   8.154
  578    HE3  LYS  68           HE1      LYS  68  83.767  -9.924   6.881
  579    HZ1  LYS  68           HZ1      LYS  68  86.036  -9.236   6.543
  580    HZ2  LYS  68           HZ2      LYS  68  85.613  -7.614   6.479
  581    HZ3  LYS  68           HZ3      LYS  68  85.078  -8.684   5.289
  582    H    PHE  69           HN       PHE  69  80.414  -6.796   4.076
  583    HA   PHE  69           HA       PHE  69  82.464  -8.192   2.786
  584    HB2  PHE  69           HB2      PHE  69  79.572  -7.989   2.309
  585    HB3  PHE  69           HB1      PHE  69  80.599  -9.214   1.630
  586    HD1  PHE  69           HD2      PHE  69  82.114  -9.598   4.373
  587    HD2  PHE  69           HD1      PHE  69  78.039  -9.533   3.214
  588    HE1  PHE  69           HE2      PHE  69  81.547 -10.974   6.313
  589    HE2  PHE  69           HE1      PHE  69  77.447 -10.890   5.124
  590    HZ   PHE  69           HZ       PHE  69  79.214 -11.624   6.712
  591    H    TYR  70           HN       TYR  70  79.968  -5.868   1.783
  592    HA   TYR  70           HA       TYR  70  80.951  -5.933  -0.935
  593    HB2  TYR  70           HB2      TYR  70  78.309  -4.982   0.162
  594    HB3  TYR  70           HB1      TYR  70  78.749  -5.098  -1.540
  595    HD1  TYR  70           HD1      TYR  70  79.249  -7.334  -2.498
  596    HD2  TYR  70           HD2      TYR  70  77.544  -6.881   1.350
  597    HE1  TYR  70           HE1      TYR  70  78.589  -9.657  -2.540
  598    HE2  TYR  70           HE2      TYR  70  76.854  -9.236   1.348
  599    HH   TYR  70           HH       TYR  70  76.455 -11.024  -0.149
  600    H    SER  71           HN       SER  71  82.648  -4.375  -0.566
  601    HA   SER  71           HA       SER  71  81.596  -1.650  -0.441
  602    HB2  SER  71           HB2      SER  71  84.059  -1.080   0.248
  603    HB3  SER  71           HB1      SER  71  82.950  -1.745   1.448
  604    HG   SER  71           HG       SER  71  84.493  -3.071   1.704
  605    H    LYS  72           HN       LYS  72  83.733  -3.836  -2.080
  606    HA   LYS  72           HA       LYS  72  84.356  -1.929  -4.167
  607    HB2  LYS  72           HB2      LYS  72  86.017  -3.614  -3.439
  608    HB3  LYS  72           HB1      LYS  72  84.929  -4.889  -3.923
  609    HG2  LYS  72           HG2      LYS  72  86.698  -4.575  -5.577
  610    HG3  LYS  72           HG1      LYS  72  85.105  -4.227  -6.245
  611    HD2  LYS  72           HD2      LYS  72  85.500  -1.845  -6.040
  612    HD3  LYS  72           HD1      LYS  72  87.049  -2.152  -5.253
  613    HE2  LYS  72           HE2      LYS  72  87.359  -1.566  -7.616
  614    HE3  LYS  72           HE1      LYS  72  87.881  -3.212  -7.273
  615    HZ1  LYS  72           HZ1      LYS  72  86.624  -3.063  -9.336
  616    HZ2  LYS  72           HZ2      LYS  72  85.281  -2.472  -8.514
  617    HZ3  LYS  72           HZ3      LYS  72  85.831  -4.038  -8.227
  618    H    ILE  73           HN       ILE  73  82.459  -4.823  -3.646
  619    HA   ILE  73           HA       ILE  73  81.306  -4.964  -6.245
  620    HB   ILE  73           HB       ILE  73  80.073  -5.986  -3.658
  621   HG12  ILE  73          HG12      ILE  73  81.944  -7.383  -5.603
  622   HG13  ILE  73          HG11      ILE  73  82.291  -6.889  -3.948
  623   HG21  ILE  73          HG21      ILE  73  79.583  -6.838  -6.528
  624   HG22  ILE  73          HG22      ILE  73  78.460  -5.931  -5.517
  625   HG23  ILE  73          HG23      ILE  73  78.866  -7.599  -5.107
  626   HD11  ILE  73          HD11      ILE  73  81.906  -9.290  -4.139
  627   HD12  ILE  73          HD12      ILE  73  80.271  -8.977  -4.720
  628   HD13  ILE  73          HD13      ILE  73  80.737  -8.511  -3.085
  629    H    SER  74           HN       SER  74  80.665  -3.018  -3.497
  630    HA   SER  74           HA       SER  74  78.083  -2.153  -4.350
  631    HB2  SER  74           HB2      SER  74  78.872  -2.063  -1.952
  632    HB3  SER  74           HB1      SER  74  79.987  -0.786  -2.430
  633    HG   SER  74           HG       SER  74  78.240   0.206  -1.690
  634    H    GLU  75           HN       GLU  75  77.818  -1.021  -6.104
  635    HA   GLU  75           HA       GLU  75  78.142   0.161  -7.886
  636    HB2  GLU  75           HB2      GLU  75  79.941   1.739  -6.097
  637    HB3  GLU  75           HB1      GLU  75  79.863   2.105  -7.817
  638    HG2  GLU  75           HG2      GLU  75  77.555   2.120  -5.883
  639    HG3  GLU  75           HG1      GLU  75  78.335   3.534  -6.608
  640    H    TYR  76           HN       TYR  76  78.945  -2.068  -8.102
  641    HA   TYR  76           HA       TYR  76  81.564  -2.133  -9.367
  642    HB2  TYR  76           HB2      TYR  76  80.810  -4.058  -8.051
  643    HB3  TYR  76           HB1      TYR  76  79.356  -4.199  -9.029
  644    HD1  TYR  76           HD1      TYR  76  82.475  -3.380 -10.677
  645    HD2  TYR  76           HD2      TYR  76  79.960  -6.562  -9.435
  646    HE1  TYR  76           HE1      TYR  76  83.641  -4.812 -12.148
  647    HE2  TYR  76           HE2      TYR  76  81.145  -8.084 -10.943
  648    HH   TYR  76           HH       TYR  76  82.457  -7.918 -12.979
  649    H    ARG  77           HN       ARG  77  81.642  -1.095 -11.189
  650    HA   ARG  77           HA       ARG  77  79.390  -1.394 -13.067
  651    HB2  ARG  77           HB2      ARG  77  81.036   1.085 -12.586
  652    HB3  ARG  77           HB1      ARG  77  79.772   0.913 -13.788
  653    HG2  ARG  77           HG2      ARG  77  79.363   0.753 -10.804
  654    HG3  ARG  77           HG1      ARG  77  79.066   2.174 -11.805
  655    HD2  ARG  77           HD2      ARG  77  77.361   0.975 -13.038
  656    HD3  ARG  77           HD1      ARG  77  77.687  -0.488 -12.107
  657    HE   ARG  77           HE       ARG  77  77.122   1.482 -10.264
  658   HH11  ARG  77          HH11      ARG  77  75.356   0.108 -12.997
  659   HH12  ARG  77          HH12      ARG  77  73.836   0.221 -12.247
  660   HH21  ARG  77          HH21      ARG  77  75.113   1.553  -9.211
  661   HH22  ARG  77          HH22      ARG  77  73.689   1.036 -10.014
  662    H    HIS  78           HN       HIS  78  82.631  -2.098 -12.621
  663    HA   HIS  78           HA       HIS  78  83.365  -1.202 -15.184
  664    HB2  HIS  78           HB2      HIS  78  85.667  -2.113 -14.829
  665    HB3  HIS  78           HB1      HIS  78  85.012  -1.063 -13.581
  666    HD1  HIS  78           HD1      HIS  78  86.296  -4.528 -14.122
  667    HD2  HIS  78           HD2      HIS  78  84.724  -2.066 -11.262
  668    HE1  HIS  78           HE1      HIS  78  86.796  -5.693 -11.950
  669    H    TYR  79           HN       TYR  79  83.769  -4.566 -14.044
  670    HA   TYR  79           HA       TYR  79  83.186  -6.530 -14.910
  671    HB2  TYR  79           HB2      TYR  79  81.435  -4.919 -16.759
  672    HB3  TYR  79           HB1      TYR  79  81.433  -6.676 -16.701
  673    HD1  TYR  79           HD2      TYR  79  81.034  -3.712 -14.517
  674    HD2  TYR  79           HD1      TYR  79  79.942  -7.735 -15.293
  675    HE1  TYR  79           HE2      TYR  79  79.393  -3.593 -12.746
  676    HE2  TYR  79           HE1      TYR  79  78.290  -7.643 -13.500
  677    HH   TYR  79           HH       TYR  79  77.346  -4.671 -12.148
  678    H    SER  80           HN       SER  80  83.054  -7.692 -17.257
  679    HA   SER  80           HA       SER  80  85.388  -6.879 -18.715
  680    HB2  SER  80           HB2      SER  80  84.856  -9.074 -19.938
  681    HB3  SER  80           HB1      SER  80  85.289  -9.214 -18.233
  682    HG   SER  80           HG       SER  80  82.677  -9.073 -19.268
  Start of MODEL   17
    1    H1   GLY  -1           HT1      GLY  -1  54.441  -0.289   5.847
    2    H2   GLY  -1           HT2      GLY  -1  55.911  -0.952   6.364
    3    H3   GLY  -1           HT3      GLY  -1  54.729  -1.945   5.708
    4    HA2  GLY  -1           HA1      GLY  -1  54.945  -0.880   3.601
    5    HA3  GLY  -1           HA2      GLY  -1  56.195   0.167   4.273
    6    H    ALA   0           HN       ALA   0  57.930  -0.505   3.137
    7    HA   ALA   0           HA       ALA   0  59.821  -1.611   2.765
    8    HB1  ALA   0           HB1      ALA   0  59.752  -2.344   5.120
    9    HB2  ALA   0           HB2      ALA   0  60.516  -3.534   4.065
   10    HB3  ALA   0           HB3      ALA   0  58.861  -3.784   4.626
   11    H    MET   1           HN       MET   1  56.849  -3.277   2.233
   12    HA   MET   1           HA       MET   1  58.179  -4.942   0.218
   13    HB2  MET   1           HB2      MET   1  56.459  -6.015   1.716
   14    HB3  MET   1           HB1      MET   1  55.251  -4.984   0.952
   15    HG2  MET   1           HG2      MET   1  56.409  -6.055  -1.237
   16    HG3  MET   1           HG1      MET   1  56.624  -7.375  -0.097
   17    HE1  MET   1           HE1      MET   1  52.616  -5.651  -1.603
   18    HE2  MET   1           HE2      MET   1  54.232  -5.174  -2.158
   19    HE3  MET   1           HE3      MET   1  53.684  -4.720  -0.560
   20    H    PHE   2           HN       PHE   2  58.459  -3.883  -1.600
   21    HA   PHE   2           HA       PHE   2  56.220  -2.333  -2.633
   22    HB2  PHE   2           HB2      PHE   2  59.155  -2.204  -3.094
   23    HB3  PHE   2           HB1      PHE   2  58.126  -1.764  -4.432
   24    HD1  PHE   2           HD2      PHE   2  56.085  -0.551  -1.980
   25    HD2  PHE   2           HD1      PHE   2  60.042   0.066  -3.433
   26    HE1  PHE   2           HE2      PHE   2  56.006   1.733  -1.237
   27    HE2  PHE   2           HE1      PHE   2  59.975   2.316  -2.716
   28    HZ   PHE   2           HZ       PHE   2  57.927   3.221  -1.588
   29    H    GLN   3           HN       GLN   3  56.092  -2.469  -5.103
   30    HA   GLN   3           HA       GLN   3  56.019  -5.297  -5.729
   31    HB2  GLN   3           HB2      GLN   3  54.161  -4.663  -7.348
   32    HB3  GLN   3           HB1      GLN   3  53.774  -4.695  -5.643
   33    HG2  GLN   3           HG2      GLN   3  52.896  -2.757  -7.134
   34    HG3  GLN   3           HG1      GLN   3  53.533  -2.409  -5.524
   35   HE21  GLN   3          HE21      GLN   3  54.471  -2.563  -8.907
   36   HE22  GLN   3          HE22      GLN   3  55.696  -1.370  -8.720
   37    H    ASP   4           HN       ASP   4  55.838  -5.769  -8.112
   38    HA   ASP   4           HA       ASP   4  58.202  -4.636  -9.302
   39    HB2  ASP   4           HB2      ASP   4  58.132  -6.651 -10.709
   40    HB3  ASP   4           HB1      ASP   4  57.896  -7.110  -9.041
   41    HA   PRO   5           HA       PRO   5  58.686  -5.330 -11.870
   42    HB2  PRO   5           HB2      PRO   5  59.219  -3.207 -13.758
   43    HB3  PRO   5           HB1      PRO   5  58.875  -4.905 -14.079
   44    HG2  PRO   5           HG2      PRO   5  57.153  -2.907 -14.738
   45    HG3  PRO   5           HG1      PRO   5  56.615  -4.539 -14.309
   46    HD2  PRO   5           HD2      PRO   5  56.736  -2.083 -12.584
   47    HD3  PRO   5           HD1      PRO   5  55.421  -3.251 -12.741
   48    H    GLN   6           HN       GLN   6  58.998  -1.829 -12.368
   49    HA   GLN   6           HA       GLN   6  60.856  -1.721 -10.146
   50    HB2  GLN   6           HB2      GLN   6  61.778  -1.028 -12.946
   51    HB3  GLN   6           HB1      GLN   6  62.672  -0.650 -11.484
   52    HG2  GLN   6           HG2      GLN   6  62.823  -3.087 -11.013
   53    HG3  GLN   6           HG1      GLN   6  62.038  -3.394 -12.558
   54   HE21  GLN   6          HE21      GLN   6  63.506  -1.153 -13.861
   55   HE22  GLN   6          HE22      GLN   6  65.103  -1.765 -14.083
   56    H    GLU   7           HN       GLU   7  58.975  -0.454  -9.480
   57    HA   GLU   7           HA       GLU   7  58.895   2.216 -10.596
   58    HB2  GLU   7           HB2      GLU   7  56.802   1.161  -9.817
   59    HB3  GLU   7           HB1      GLU   7  57.463   1.027  -8.199
   60    HG2  GLU   7           HG2      GLU   7  57.585   3.486  -8.085
   61    HG3  GLU   7           HG1      GLU   7  56.822   3.578  -9.671
   62    H    ARG   8           HN       ARG   8  60.371   0.507  -8.330
   63    HA   ARG   8           HA       ARG   8  61.061   2.506  -6.371
   64    HB2  ARG   8           HB2      ARG   8  62.486  -0.159  -6.650
   65    HB3  ARG   8           HB1      ARG   8  62.280   0.798  -5.214
   66    HG2  ARG   8           HG2      ARG   8  60.901  -0.961  -4.821
   67    HG3  ARG   8           HG1      ARG   8  59.774   0.230  -5.465
   68    HD2  ARG   8           HD2      ARG   8  59.213  -1.794  -6.524
   69    HD3  ARG   8           HD1      ARG   8  60.122  -0.938  -7.748
   70    HE   ARG   8           HE       ARG   8  60.823  -3.337  -6.340
   71   HH11  ARG   8          HH11      ARG   8  62.356  -0.719  -8.316
   72   HH12  ARG   8          HH12      ARG   8  63.498  -1.787  -8.973
   73   HH21  ARG   8          HH21      ARG   8  62.404  -4.690  -7.370
   74   HH22  ARG   8          HH22      ARG   8  63.535  -4.046  -8.464
   75    HA   PRO   9           HA       PRO   9  64.819   3.887  -8.467
   76    HB2  PRO   9           HB2      PRO   9  66.083   4.982  -6.394
   77    HB3  PRO   9           HB1      PRO   9  64.642   5.764  -6.954
   78    HG2  PRO   9           HG2      PRO   9  65.152   4.048  -4.629
   79    HG3  PRO   9           HG1      PRO   9  63.985   5.374  -4.798
   80    HD2  PRO   9           HD2      PRO   9  63.450   2.664  -4.857
   81    HD3  PRO   9           HD1      PRO   9  62.344   3.913  -5.439
   82    H    ARG  10           HN       ARG  10  67.321   4.112  -7.496
   83    HA   ARG  10           HA       ARG  10  68.039   1.617  -6.165
   84    HB2  ARG  10           HB2      ARG  10  69.392   3.130  -8.349
   85    HB3  ARG  10           HB1      ARG  10  70.283   2.072  -7.277
   86    HG2  ARG  10           HG2      ARG  10  67.947   1.206  -8.979
   87    HG3  ARG  10           HG1      ARG  10  69.649   1.070  -9.415
   88    HD2  ARG  10           HD2      ARG  10  70.025  -0.348  -7.422
   89    HD3  ARG  10           HD1      ARG  10  68.298  -0.283  -7.083
   90    HE   ARG  10           HE       ARG  10  68.386  -1.141  -9.621
   91   HH11  ARG  10          HH11      ARG  10  69.875  -2.376  -6.641
   92   HH12  ARG  10          HH12      ARG  10  70.014  -3.983  -7.210
   93   HH21  ARG  10          HH21      ARG  10  68.573  -3.381 -10.382
   94   HH22  ARG  10          HH22      ARG  10  69.261  -4.561  -9.384
   95    H    LYS  11           HN       LYS  11  67.681   4.911  -5.814
   96    HA   LYS  11           HA       LYS  11  69.990   5.026  -4.064
   97    HB2  LYS  11           HB2      LYS  11  68.342   7.324  -5.035
   98    HB3  LYS  11           HB1      LYS  11  69.759   7.346  -4.068
   99    HG2  LYS  11           HG2      LYS  11  71.160   6.397  -5.738
  100    HG3  LYS  11           HG1      LYS  11  69.794   6.230  -6.846
  101    HD2  LYS  11           HD2      LYS  11  69.501   8.603  -6.864
  102    HD3  LYS  11           HD1      LYS  11  70.776   8.725  -5.634
  103    HE2  LYS  11           HE2      LYS  11  71.551   9.291  -7.998
  104    HE3  LYS  11           HE1      LYS  11  72.470   8.041  -7.170
  105    HZ1  LYS  11           HZ1      LYS  11  71.369   6.369  -8.442
  106    HZ2  LYS  11           HZ2      LYS  11  71.932   7.520  -9.524
  107    HZ3  LYS  11           HZ3      LYS  11  70.300   7.480  -9.126
  108    H    LEU  12           HN       LEU  12  69.731   5.384  -2.016
  109    HA   LEU  12           HA       LEU  12  67.438   4.572  -0.695
  110    HB2  LEU  12           HB2      LEU  12  69.489   4.259   0.343
  111    HB3  LEU  12           HB1      LEU  12  69.918   5.957   0.227
  112    HG   LEU  12           HG       LEU  12  68.181   6.491   1.857
  113   HD11  LEU  12          HD11      LEU  12  66.717   4.542   1.404
  114   HD12  LEU  12          HD12      LEU  12  67.130   4.760   3.121
  115   HD13  LEU  12          HD13      LEU  12  67.957   3.517   2.163
  116   HD21  LEU  12          HD21      LEU  12  69.967   4.340   2.820
  117   HD22  LEU  12          HD22      LEU  12  69.340   5.711   3.760
  118   HD23  LEU  12          HD23      LEU  12  70.513   5.969   2.454
  119    HA   PRO  13           HA       PRO  13  66.566   9.105   0.717
  120    HB2  PRO  13           HB2      PRO  13  67.456  11.189  -0.791
  121    HB3  PRO  13           HB1      PRO  13  68.472  10.366   0.424
  122    HG2  PRO  13           HG2      PRO  13  68.419   9.882  -2.526
  123    HG3  PRO  13           HG1      PRO  13  69.808  10.258  -1.486
  124    HD2  PRO  13           HD2      PRO  13  69.202   7.725  -2.128
  125    HD3  PRO  13           HD1      PRO  13  69.814   8.120  -0.533
  126    H    GLN  14           HN       GLN  14  66.737   8.549  -2.707
  127    HA   GLN  14           HA       GLN  14  64.312   9.902  -3.299
  128    HB2  GLN  14           HB2      GLN  14  65.789   7.864  -4.971
  129    HB3  GLN  14           HB1      GLN  14  64.544   8.974  -5.528
  130    HG2  GLN  14           HG2      GLN  14  66.045  10.866  -4.851
  131    HG3  GLN  14           HG1      GLN  14  67.298   9.673  -4.543
  132   HE21  GLN  14          HE21      GLN  14  66.413   8.043  -6.906
  133   HE22  GLN  14          HE22      GLN  14  66.982   8.919  -8.263
  134    H    LEU  15           HN       LEU  15  65.169   6.507  -2.544
  135    HA   LEU  15           HA       LEU  15  62.705   5.374  -3.060
  136    HB2  LEU  15           HB2      LEU  15  64.773   4.128  -2.587
  137    HB3  LEU  15           HB1      LEU  15  64.789   4.793  -1.015
  138    HG   LEU  15           HG       LEU  15  62.779   3.684  -0.389
  139   HD11  LEU  15          HD11      LEU  15  61.786   1.979  -1.822
  140   HD12  LEU  15          HD12      LEU  15  62.917   2.357  -3.105
  141   HD13  LEU  15          HD13      LEU  15  61.698   3.555  -2.612
  142   HD21  LEU  15          HD21      LEU  15  63.722   1.447  -0.363
  143   HD22  LEU  15          HD22      LEU  15  64.917   2.744  -0.059
  144   HD23  LEU  15          HD23      LEU  15  64.848   1.969  -1.632
  145    H    CYS  16           HN       CYS  16  64.055   6.884  -0.210
  146    HA   CYS  16           HA       CYS  16  61.990   6.422   1.622
  147    HB2  CYS  16           HB2      CYS  16  63.769   8.859   1.329
  148    HB3  CYS  16           HB1      CYS  16  62.844   8.496   2.765
  149    HG   CYS  16           HG       CYS  16  65.405   6.615   1.497
  150    H    THR  17           HN       THR  17  62.254   8.869  -0.870
  151    HA   THR  17           HA       THR  17  60.015  10.424  -0.264
  152    HB   THR  17           HB       THR  17  61.208   9.772  -2.922
  153    HG1  THR  17           HG1      THR  17  62.157  11.127  -0.750
  154   HG21  THR  17          HG21      THR  17  59.669  12.193  -1.973
  155   HG22  THR  17          HG22      THR  17  59.098  10.937  -3.075
  156   HG23  THR  17          HG23      THR  17  60.407  12.016  -3.573
  157    H    GLU  18           HN       GLU  18  60.411   7.473  -2.097
  158    HA   GLU  18           HA       GLU  18  57.828   7.251  -3.094
  159    HB2  GLU  18           HB2      GLU  18  60.068   5.456  -2.642
  160    HB3  GLU  18           HB1      GLU  18  58.525   4.757  -3.154
  161    HG2  GLU  18           HG2      GLU  18  58.581   6.527  -4.960
  162    HG3  GLU  18           HG1      GLU  18  60.259   6.801  -4.479
  163    H    LEU  19           HN       LEU  19  59.332   5.742  -0.294
  164    HA   LEU  19           HA       LEU  19  56.936   4.738   0.759
  165    HB2  LEU  19           HB2      LEU  19  59.630   5.278   1.841
  166    HB3  LEU  19           HB1      LEU  19  58.476   4.581   2.869
  167    HG   LEU  19           HG       LEU  19  58.363   2.743   0.825
  168   HD11  LEU  19          HD11      LEU  19  61.071   3.910   0.659
  169   HD12  LEU  19          HD12      LEU  19  59.822   3.953  -0.584
  170   HD13  LEU  19          HD13      LEU  19  60.522   2.412  -0.083
  171   HD21  LEU  19          HD21      LEU  19  60.034   1.461   2.029
  172   HD22  LEU  19          HD22      LEU  19  58.890   2.249   3.132
  173   HD23  LEU  19          HD23      LEU  19  60.502   2.942   2.877
  174    H    GLN  20           HN       GLN  20  57.724   7.884   0.396
  175    HA   GLN  20           HA       GLN  20  56.788   9.822   1.156
  176    HB2  GLN  20           HB2      GLN  20  54.954   7.815   2.382
  177    HB3  GLN  20           HB1      GLN  20  54.627   9.556   2.466
  178    HG2  GLN  20           HG2      GLN  20  54.490   9.617   0.037
  179    HG3  GLN  20           HG1      GLN  20  54.905   7.906  -0.043
  180   HE21  GLN  20          HE21      GLN  20  53.019   7.393  -1.075
  181   HE22  GLN  20          HE22      GLN  20  51.486   7.393  -0.288
  182    H    THR  21           HN       THR  21  58.915   8.576   2.631
  183    HA   THR  21           HA       THR  21  58.493   9.836   5.203
  184    HB   THR  21           HB       THR  21  57.864   7.397   5.359
  185    HG1  THR  21           HG1      THR  21  58.843   7.196   7.296
  186   HG21  THR  21          HG21      THR  21  60.800   6.957   4.832
  187   HG22  THR  21          HG22      THR  21  59.465   6.445   3.784
  188   HG23  THR  21          HG23      THR  21  59.667   5.727   5.390
  189    H    THR  22           HN       THR  22  60.932   9.165   6.327
  190    HA   THR  22           HA       THR  22  62.860   9.909   4.232
  191    HB   THR  22           HB       THR  22  63.412  10.835   6.989
  192    HG1  THR  22           HG1      THR  22  61.431  11.779   6.979
  193   HG21  THR  22          HG21      THR  22  63.655  12.078   4.232
  194   HG22  THR  22          HG22      THR  22  64.960  11.335   5.154
  195   HG23  THR  22          HG23      THR  22  64.222  12.831   5.716
  196    H    ILE  23           HN       ILE  23  65.224   9.565   5.317
  197    HA   ILE  23           HA       ILE  23  65.679   6.914   5.531
  198    HB   ILE  23           HB       ILE  23  67.328   9.078   6.727
  199   HG12  ILE  23          HG12      ILE  23  66.890   8.156   3.948
  200   HG13  ILE  23          HG11      ILE  23  66.858   9.755   4.593
  201   HG21  ILE  23          HG21      ILE  23  68.090   6.766   7.268
  202   HG22  ILE  23          HG22      ILE  23  69.222   7.511   6.127
  203   HG23  ILE  23          HG23      ILE  23  68.021   6.350   5.552
  204   HD11  ILE  23          HD11      ILE  23  69.283   8.055   4.228
  205   HD12  ILE  23          HD12      ILE  23  69.308   9.711   4.856
  206   HD13  ILE  23          HD13      ILE  23  68.831   9.390   3.171
  207    H    HIS  24           HN       HIS  24  64.734   9.163   7.833
  208    HA   HIS  24           HA       HIS  24  65.910   8.220  10.198
  209    HB2  HIS  24           HB2      HIS  24  63.616  10.152   9.909
  210    HB3  HIS  24           HB1      HIS  24  64.852  10.185  11.135
  211    HD1  HIS  24           HD1      HIS  24  67.179   9.861   8.989
  212    HD2  HIS  24           HD2      HIS  24  64.181  12.611   9.044
  213    HE1  HIS  24           HE1      HIS  24  67.735  11.407   7.053
  214    H    ASP  25           HN       ASP  25  63.294   7.316   8.335
  215    HA   ASP  25           HA       ASP  25  61.856   6.074  10.596
  216    HB2  ASP  25           HB2      ASP  25  60.761   8.192   9.745
  217    HB3  ASP  25           HB1      ASP  25  60.608   7.376   8.235
  218    H    ILE  26           HN       ILE  26  62.572   6.081   7.142
  219    HA   ILE  26           HA       ILE  26  61.113   4.064   6.050
  220    HB   ILE  26           HB       ILE  26  62.590   5.408   4.687
  221   HG12  ILE  26          HG12      ILE  26  63.608   2.620   4.557
  222   HG13  ILE  26          HG11      ILE  26  62.015   2.883   4.000
  223   HG21  ILE  26          HG21      ILE  26  65.010   5.087   4.683
  224   HG22  ILE  26          HG22      ILE  26  64.855   3.882   5.960
  225   HG23  ILE  26          HG23      ILE  26  64.447   5.563   6.292
  226   HD11  ILE  26          HD11      ILE  26  63.517   2.787   2.180
  227   HD12  ILE  26          HD12      ILE  26  64.584   4.000   2.890
  228   HD13  ILE  26          HD13      ILE  26  62.979   4.467   2.285
  229    H    ILE  27           HN       ILE  27  60.923   1.918   6.038
  230    HA   ILE  27           HA       ILE  27  62.898   0.437   7.498
  231    HB   ILE  27           HB       ILE  27  60.127  -0.308   6.577
  232   HG12  ILE  27          HG12      ILE  27  60.034   1.282   8.395
  233   HG13  ILE  27          HG11      ILE  27  59.560  -0.312   8.955
  234   HG21  ILE  27          HG21      ILE  27  62.099  -1.861   8.233
  235   HG22  ILE  27          HG22      ILE  27  61.602  -2.209   6.577
  236   HG23  ILE  27          HG23      ILE  27  60.429  -2.347   7.896
  237   HD11  ILE  27          HD11      ILE  27  62.226   1.021   9.419
  238   HD12  ILE  27          HD12      ILE  27  61.793  -0.598   9.962
  239   HD13  ILE  27          HD13      ILE  27  60.946   0.804  10.612
  240    H    LEU  28           HN       LEU  28  64.428  -0.172   6.606
  241    HA   LEU  28           HA       LEU  28  64.159  -1.193   3.916
  242    HB2  LEU  28           HB2      LEU  28  65.620   0.945   4.792
  243    HB3  LEU  28           HB1      LEU  28  66.786  -0.369   4.699
  244    HG   LEU  28           HG       LEU  28  66.225  -0.798   2.421
  245   HD11  LEU  28          HD11      LEU  28  63.982  -0.471   2.142
  246   HD12  LEU  28          HD12      LEU  28  64.519   1.121   1.537
  247   HD13  LEU  28          HD13      LEU  28  64.004   0.883   3.235
  248   HD21  LEU  28          HD21      LEU  28  66.949   1.264   1.431
  249   HD22  LEU  28          HD22      LEU  28  67.812   1.037   2.964
  250   HD23  LEU  28          HD23      LEU  28  66.456   2.155   2.866
  251    H    GLU  29           HN       GLU  29  64.997  -3.385   3.847
  252    HA   GLU  29           HA       GLU  29  66.461  -3.820   6.335
  253    HB2  GLU  29           HB2      GLU  29  65.992  -6.248   6.044
  254    HB3  GLU  29           HB1      GLU  29  64.789  -5.215   6.903
  255    HG2  GLU  29           HG2      GLU  29  63.712  -5.160   4.723
  256    HG3  GLU  29           HG1      GLU  29  64.852  -6.475   4.301
  257    H    CYS  30           HN       CYS  30  67.938  -6.104   6.224
  258    HA   CYS  30           HA       CYS  30  69.569  -5.565   4.046
  259    HB2  CYS  30           HB2      CYS  30  70.317  -6.703   6.275
  260    HB3  CYS  30           HB1      CYS  30  69.579  -8.128   5.601
  261    H    VAL  31           HN       VAL  31  69.421  -6.222   2.242
  262    HA   VAL  31           HA       VAL  31  67.448  -7.813   1.027
  263    HB   VAL  31           HB       VAL  31  68.700  -6.211  -0.317
  264   HG11  VAL  31          HG11      VAL  31  71.020  -6.495  -0.691
  265   HG12  VAL  31          HG12      VAL  31  71.091  -7.571   0.725
  266   HG13  VAL  31          HG13      VAL  31  70.581  -5.856   0.897
  267   HG21  VAL  31          HG21      VAL  31  69.843  -7.484  -2.048
  268   HG22  VAL  31          HG22      VAL  31  68.253  -8.106  -1.679
  269   HG23  VAL  31          HG23      VAL  31  69.693  -8.938  -1.060
  270    H    TYR  32           HN       TYR  32  70.500  -8.520   2.421
  271    HA   TYR  32           HA       TYR  32  70.509 -11.215   1.359
  272    HB2  TYR  32           HB2      TYR  32  72.722  -9.833   2.851
  273    HB3  TYR  32           HB1      TYR  32  72.826 -11.344   1.944
  274    HD1  TYR  32           HD1      TYR  32  71.384 -10.807  -0.521
  275    HD2  TYR  32           HD2      TYR  32  73.976  -8.227   1.709
  276    HE1  TYR  32           HE1      TYR  32  71.793  -9.639  -2.467
  277    HE2  TYR  32           HE2      TYR  32  74.447  -6.926  -0.312
  278    HH   TYR  32           HH       TYR  32  72.626  -7.328  -3.195
  279    H    CYS  33           HN       CYS  33  70.499  -9.524   4.492
  280    HA   CYS  33           HA       CYS  33  70.516 -12.122   5.852
  281    HB2  CYS  33           HB2      CYS  33  70.666  -9.381   7.110
  282    HB3  CYS  33           HB1      CYS  33  70.887 -10.928   7.899
  283    H    LYS  34           HN       LYS  34  68.348  -9.733   4.832
  284    HA   LYS  34           HA       LYS  34  66.306  -9.299   5.061
  285    HB2  LYS  34           HB2      LYS  34  66.177 -12.105   6.117
  286    HB3  LYS  34           HB1      LYS  34  64.738 -11.136   5.828
  287    HG2  LYS  34           HG2      LYS  34  65.068 -12.528   3.961
  288    HG3  LYS  34           HG1      LYS  34  65.487 -10.891   3.446
  289    HD2  LYS  34           HD2      LYS  34  67.823 -11.454   3.684
  290    HD3  LYS  34           HD1      LYS  34  67.396 -13.050   4.268
  291    HE2  LYS  34           HE2      LYS  34  66.898 -11.895   1.509
  292    HE3  LYS  34           HE1      LYS  34  68.064 -13.140   1.919
  293    HZ1  LYS  34           HZ1      LYS  34  66.133 -14.146   0.934
  294    HZ2  LYS  34           HZ2      LYS  34  65.112 -13.374   2.003
  295    HZ3  LYS  34           HZ3      LYS  34  66.162 -14.565   2.562
  296    H    GLN  35           HN       GLN  35  68.155  -8.611   7.211
  297    HA   GLN  35           HA       GLN  35  66.519  -8.550   9.530
  298    HB2  GLN  35           HB2      GLN  35  68.358  -9.616   9.912
  299    HB3  GLN  35           HB1      GLN  35  69.412  -8.696   8.821
  300    HG2  GLN  35           HG2      GLN  35  70.098  -8.060  10.876
  301    HG3  GLN  35           HG1      GLN  35  68.873  -6.872  10.363
  302   HE21  GLN  35          HE21      GLN  35  67.948 -10.038  11.468
  303   HE22  GLN  35          HE22      GLN  35  67.239  -9.556  12.958
  304    H    GLN  36           HN       GLN  36  65.646  -6.717   9.754
  305    HA   GLN  36           HA       GLN  36  65.814  -4.407   8.266
  306    HB2  GLN  36           HB2      GLN  36  64.280  -5.317  10.280
  307    HB3  GLN  36           HB1      GLN  36  65.236  -4.105  11.111
  308    HG2  GLN  36           HG2      GLN  36  64.590  -2.478   9.372
  309    HG3  GLN  36           HG1      GLN  36  63.636  -3.797   8.691
  310   HE21  GLN  36          HE21      GLN  36  63.867  -1.716  11.499
  311   HE22  GLN  36          HE22      GLN  36  62.260  -1.980  12.044
  312    H    LEU  37           HN       LEU  37  67.355  -2.948   8.035
  313    HA   LEU  37           HA       LEU  37  69.723  -2.949   9.535
  314    HB2  LEU  37           HB2      LEU  37  68.582  -1.133   7.451
  315    HB3  LEU  37           HB1      LEU  37  69.817  -0.603   8.525
  316    HG   LEU  37           HG       LEU  37  71.227  -2.519   7.844
  317   HD11  LEU  37          HD11      LEU  37  69.094  -2.909   5.784
  318   HD12  LEU  37          HD12      LEU  37  69.607  -4.046   7.029
  319   HD13  LEU  37          HD13      LEU  37  70.701  -3.616   5.713
  320   HD21  LEU  37          HD21      LEU  37  70.394  -0.581   5.708
  321   HD22  LEU  37          HD22      LEU  37  71.884  -1.523   5.702
  322   HD23  LEU  37          HD23      LEU  37  71.607  -0.315   6.957
  323    H    LEU  38           HN       LEU  38  70.498  -1.948  10.979
  324    HA   LEU  38           HA       LEU  38  69.069  -0.553  12.929
  325    HB2  LEU  38           HB2      LEU  38  71.666  -1.587  12.381
  326    HB3  LEU  38           HB1      LEU  38  71.818   0.074  12.685
  327    HG   LEU  38           HG       LEU  38  70.331  -1.640  14.662
  328   HD11  LEU  38          HD11      LEU  38  72.401  -1.815  15.928
  329   HD12  LEU  38          HD12      LEU  38  73.262  -0.978  14.636
  330   HD13  LEU  38          HD13      LEU  38  72.563  -2.566  14.338
  331   HD21  LEU  38          HD21      LEU  38  70.906   0.157  16.199
  332   HD22  LEU  38          HD22      LEU  38  70.047   0.799  14.793
  333   HD23  LEU  38          HD23      LEU  38  71.795   0.982  14.921
  334    H    ARG  39           HN       ARG  39  68.684   1.655  12.957
  335    HA   ARG  39           HA       ARG  39  68.479   3.097  10.634
  336    HB2  ARG  39           HB2      ARG  39  67.318   3.612  12.754
  337    HB3  ARG  39           HB1      ARG  39  68.818   4.268  13.387
  338    HG2  ARG  39           HG2      ARG  39  68.803   5.925  11.536
  339    HG3  ARG  39           HG1      ARG  39  67.209   5.334  11.079
  340    HD2  ARG  39           HD2      ARG  39  66.957   7.295  12.476
  341    HD3  ARG  39           HD1      ARG  39  66.389   5.867  13.350
  342    HE   ARG  39           HE       ARG  39  69.072   6.242  13.952
  343   HH11  ARG  39          HH11      ARG  39  66.012   7.899  14.576
  344   HH12  ARG  39          HH12      ARG  39  66.524   8.638  16.017
  345   HH21  ARG  39          HH21      ARG  39  69.783   7.206  15.944
  346   HH22  ARG  39          HH22      ARG  39  68.737   8.211  16.824
  347    H    ARG  40           HN       ARG  40  71.420   2.725  12.531
  348    HA   ARG  40           HA       ARG  40  72.685   5.144  11.774
  349    HB2  ARG  40           HB2      ARG  40  73.919   2.525  12.554
  350    HB3  ARG  40           HB1      ARG  40  74.604   4.130  12.682
  351    HG2  ARG  40           HG2      ARG  40  73.071   4.700  14.440
  352    HG3  ARG  40           HG1      ARG  40  72.267   3.133  14.276
  353    HD2  ARG  40           HD2      ARG  40  75.118   3.627  15.047
  354    HD3  ARG  40           HD1      ARG  40  73.826   3.091  16.126
  355    HE   ARG  40           HE       ARG  40  74.298   1.378  13.842
  356   HH11  ARG  40          HH11      ARG  40  75.055   1.947  17.266
  357   HH12  ARG  40          HH12      ARG  40  75.724   0.406  17.507
  358   HH21  ARG  40          HH21      ARG  40  75.221  -0.664  14.167
  359   HH22  ARG  40          HH22      ARG  40  75.841  -1.119  15.690
  360    H    GLU  41           HN       GLU  41  72.786   1.746  10.881
  361    HA   GLU  41           HA       GLU  41  74.622   1.745   8.779
  362    HB2  GLU  41           HB2      GLU  41  72.229   0.050   9.488
  363    HB3  GLU  41           HB1      GLU  41  73.387  -0.368   8.246
  364    HG2  GLU  41           HG2      GLU  41  73.433  -1.310  10.698
  365    HG3  GLU  41           HG1      GLU  41  74.922  -1.099   9.734
  366    H    VAL  42           HN       VAL  42  71.215   2.274   8.976
  367    HA   VAL  42           HA       VAL  42  70.678   2.342   6.176
  368    HB   VAL  42           HB       VAL  42  69.055   4.006   8.135
  369   HG11  VAL  42          HG11      VAL  42  68.559   4.128   5.684
  370   HG12  VAL  42          HG12      VAL  42  67.225   3.491   6.658
  371   HG13  VAL  42          HG13      VAL  42  68.251   2.380   5.754
  372   HG21  VAL  42          HG21      VAL  42  67.674   2.062   8.608
  373   HG22  VAL  42          HG22      VAL  42  69.339   1.769   9.127
  374   HG23  VAL  42          HG23      VAL  42  68.737   1.058   7.630
  375    H    TYR  43           HN       TYR  43  71.501   4.982   8.510
  376    HA   TYR  43           HA       TYR  43  71.518   7.045   6.618
  377    HB2  TYR  43           HB2      TYR  43  73.098   6.709   9.152
  378    HB3  TYR  43           HB1      TYR  43  73.222   8.161   8.148
  379    HD1  TYR  43           HD2      TYR  43  70.664   8.841   7.393
  380    HD2  TYR  43           HD1      TYR  43  71.863   7.012  11.008
  381    HE1  TYR  43           HE2      TYR  43  68.659   9.665   8.455
  382    HE2  TYR  43           HE1      TYR  43  69.844   7.837  12.102
  383    HH   TYR  43           HH       TYR  43  68.229   9.717  11.756
  384    H    ASP  44           HN       ASP  44  74.050   4.699   7.450
  385    HA   ASP  44           HA       ASP  44  76.228   5.776   6.185
  386    HB2  ASP  44           HB2      ASP  44  75.326   2.922   6.473
  387    HB3  ASP  44           HB1      ASP  44  76.792   3.375   5.727
  388    H    PHE  45           HN       PHE  45  73.632   3.984   4.966
  389    HA   PHE  45           HA       PHE  45  74.618   3.217   2.531
  390    HB2  PHE  45           HB2      PHE  45  72.328   2.869   3.911
  391    HB3  PHE  45           HB1      PHE  45  71.858   4.063   2.727
  392    HD1  PHE  45           HD2      PHE  45  73.374   0.719   3.095
  393    HD2  PHE  45           HD1      PHE  45  71.447   3.584   0.605
  394    HE1  PHE  45           HE2      PHE  45  72.998  -0.994   1.355
  395    HE2  PHE  45           HE1      PHE  45  71.124   1.889  -1.103
  396    HZ   PHE  45           HZ       PHE  45  71.845  -0.365  -0.746
  397    H    ALA  46           HN       ALA  46  72.706   6.142   3.307
  398    HA   ALA  46           HA       ALA  46  73.170   7.226   0.646
  399    HB1  ALA  46           HB1      ALA  46  71.803   9.149   1.388
  400    HB2  ALA  46           HB2      ALA  46  71.704   8.432   2.992
  401    HB3  ALA  46           HB3      ALA  46  70.968   7.624   1.602
  402    H    ARG  47           HN       ARG  47  74.570   7.521   3.826
  403    HA   ARG  47           HA       ARG  47  75.791  10.057   3.309
  404    HB2  ARG  47           HB2      ARG  47  75.707   8.130   5.508
  405    HB3  ARG  47           HB1      ARG  47  77.210   9.002   5.419
  406    HG2  ARG  47           HG2      ARG  47  75.716  10.105   6.974
  407    HG3  ARG  47           HG1      ARG  47  75.923  11.135   5.570
  408    HD2  ARG  47           HD2      ARG  47  73.539   9.310   5.944
  409    HD3  ARG  47           HD1      ARG  47  73.579  10.962   6.541
  410    HE   ARG  47           HE       ARG  47  74.196  10.795   3.760
  411   HH11  ARG  47          HH11      ARG  47  71.485  11.038   6.053
  412   HH12  ARG  47          HH12      ARG  47  70.374  11.555   4.879
  413   HH21  ARG  47          HH21      ARG  47  72.633  11.531   2.170
  414   HH22  ARG  47          HH22      ARG  47  71.018  11.808   2.642
  415    H    ARG  48           HN       ARG  48  76.497   6.890   2.454
  416    HA   ARG  48           HA       ARG  48  79.200   7.636   1.654
  417    HB2  ARG  48           HB2      ARG  48  77.769   5.022   1.787
  418    HB3  ARG  48           HB1      ARG  48  79.460   5.207   1.339
  419    HG2  ARG  48           HG2      ARG  48  80.031   5.918   3.548
  420    HG3  ARG  48           HG1      ARG  48  78.329   6.011   4.014
  421    HD2  ARG  48           HD2      ARG  48  78.114   3.623   3.600
  422    HD3  ARG  48           HD1      ARG  48  79.816   3.534   3.204
  423    HE   ARG  48           HE       ARG  48  78.750   4.317   5.843
  424   HH11  ARG  48          HH11      ARG  48  81.350   2.708   4.034
  425   HH12  ARG  48          HH12      ARG  48  81.928   1.867   5.400
  426   HH21  ARG  48          HH21      ARG  48  79.501   3.181   7.614
  427   HH22  ARG  48          HH22      ARG  48  80.854   2.134   7.515
  428    H    ASP  49           HN       ASP  49  78.789   5.347  -0.446
  429    HA   ASP  49           HA       ASP  49  77.155   6.964  -2.234
  430    HB2  ASP  49           HB2      ASP  49  78.696   6.405  -4.079
  431    HB3  ASP  49           HB1      ASP  49  79.466   7.368  -2.828
  432    H    LEU  50           HN       LEU  50  76.567   4.475  -0.671
  433    HA   LEU  50           HA       LEU  50  76.554   2.323  -2.504
  434    HB2  LEU  50           HB2      LEU  50  75.107   2.637   0.116
  435    HB3  LEU  50           HB1      LEU  50  75.035   1.195  -0.863
  436    HG   LEU  50           HG       LEU  50  77.563   1.079  -0.625
  437   HD11  LEU  50          HD11      LEU  50  78.541   2.146   1.295
  438   HD12  LEU  50          HD12      LEU  50  77.031   3.013   1.574
  439   HD13  LEU  50          HD13      LEU  50  77.961   3.313   0.101
  440   HD21  LEU  50          HD21      LEU  50  77.458   0.048   1.540
  441   HD22  LEU  50          HD22      LEU  50  76.061  -0.419   0.552
  442   HD23  LEU  50          HD23      LEU  50  75.889   0.791   1.837
  443    H    CYS  51           HN       CYS  51  74.838   1.218  -3.353
  444    HA   CYS  51           HA       CYS  51  72.448   2.795  -3.907
  445    HB2  CYS  51           HB2      CYS  51  72.410   1.459  -6.071
  446    HB3  CYS  51           HB1      CYS  51  73.706   2.651  -5.926
  447    HG   CYS  51           HG       CYS  51  75.686   0.872  -5.397
  448    H    ILE  52           HN       ILE  52  70.540   1.514  -4.211
  449    HA   ILE  52           HA       ILE  52  70.386  -0.489  -2.149
  450    HB   ILE  52           HB       ILE  52  68.351   1.088  -3.666
  451   HG12  ILE  52          HG12      ILE  52  69.211   0.685  -0.876
  452   HG13  ILE  52          HG11      ILE  52  69.428   2.147  -1.895
  453   HG21  ILE  52          HG21      ILE  52  67.340  -1.173  -3.504
  454   HG22  ILE  52          HG22      ILE  52  66.534  -0.021  -2.440
  455   HG23  ILE  52          HG23      ILE  52  67.675  -1.187  -1.772
  456   HD11  ILE  52          HD11      ILE  52  67.809   2.507  -0.306
  457   HD12  ILE  52          HD12      ILE  52  67.145   0.900  -0.679
  458   HD13  ILE  52          HD13      ILE  52  67.001   2.226  -1.904
  459    H    VAL  53           HN       VAL  53  69.443  -2.316  -2.200
  460    HA   VAL  53           HA       VAL  53  69.716  -3.820  -4.641
  461    HB   VAL  53           HB       VAL  53  70.457  -5.629  -2.897
  462   HG11  VAL  53          HG11      VAL  53  72.793  -4.877  -3.189
  463   HG12  VAL  53          HG12      VAL  53  72.216  -3.261  -3.614
  464   HG13  VAL  53          HG13      VAL  53  71.877  -4.625  -4.680
  465   HG21  VAL  53          HG21      VAL  53  71.641  -4.604  -0.991
  466   HG22  VAL  53          HG22      VAL  53  69.913  -4.284  -0.916
  467   HG23  VAL  53          HG23      VAL  53  71.022  -3.029  -1.457
  468    H    TYR  54           HN       TYR  54  67.880  -4.558  -5.110
  469    HA   TYR  54           HA       TYR  54  65.788  -5.081  -3.180
  470    HB2  TYR  54           HB2      TYR  54  65.860  -5.100  -6.191
  471    HB3  TYR  54           HB1      TYR  54  64.429  -5.360  -5.195
  472    HD1  TYR  54           HD2      TYR  54  66.986  -2.870  -6.132
  473    HD2  TYR  54           HD1      TYR  54  63.289  -3.592  -4.205
  474    HE1  TYR  54           HE2      TYR  54  66.605  -0.446  -5.923
  475    HE2  TYR  54           HE1      TYR  54  62.893  -1.225  -4.015
  476    HH   TYR  54           HH       TYR  54  64.886   1.051  -5.602
  477    H    ARG  55           HN       ARG  55  65.693  -6.799  -2.398
  478    HA   ARG  55           HA       ARG  55  67.042  -9.066  -3.627
  479    HB2  ARG  55           HB2      ARG  55  66.599  -8.576  -0.921
  480    HB3  ARG  55           HB1      ARG  55  65.305  -9.674  -1.326
  481    HG2  ARG  55           HG2      ARG  55  68.223 -10.375  -1.864
  482    HG3  ARG  55           HG1      ARG  55  67.423 -10.729  -0.388
  483    HD2  ARG  55           HD2      ARG  55  66.565 -11.688  -3.137
  484    HD3  ARG  55           HD1      ARG  55  67.299 -12.674  -1.874
  485    HE   ARG  55           HE       ARG  55  65.040 -11.619  -0.761
  486   HH11  ARG  55          HH11      ARG  55  65.785 -13.716  -3.499
  487   HH12  ARG  55          HH12      ARG  55  64.285 -14.480  -3.570
  488   HH21  ARG  55          HH21      ARG  55  62.912 -12.624  -0.816
  489   HH22  ARG  55          HH22      ARG  55  62.568 -13.844  -1.942
  490    H    ASP  56           HN       ASP  56  65.679 -10.424  -4.955
  491    HA   ASP  56           HA       ASP  56  63.863 -11.093  -6.113
  492    HB2  ASP  56           HB2      ASP  56  62.798 -11.905  -4.061
  493    HB3  ASP  56           HB1      ASP  56  62.357 -10.266  -3.603
  494    H    GLY  57           HN       GLY  57  62.287  -8.400  -4.462
  495    HA2  GLY  57           HA2      GLY  57  63.005  -6.541  -6.435
  496    HA3  GLY  57           HA1      GLY  57  61.337  -7.062  -6.705
  497    H    ASN  58           HN       ASN  58  62.808  -6.861  -3.577
  498    HA   ASN  58           HA       ASN  58  60.919  -4.689  -2.781
  499    HB2  ASN  58           HB2      ASN  58  62.206  -6.721  -0.988
  500    HB3  ASN  58           HB1      ASN  58  60.779  -5.797  -0.627
  501   HD21  ASN  58          HD21      ASN  58  62.140  -8.542  -2.186
  502   HD22  ASN  58          HD22      ASN  58  60.713  -9.431  -2.464
  503    HA   PRO  59           HA       PRO  59  64.662  -2.759  -1.920
  504    HB2  PRO  59           HB2      PRO  59  63.519  -0.717  -0.271
  505    HB3  PRO  59           HB1      PRO  59  63.899  -0.630  -1.991
  506    HG2  PRO  59           HG2      PRO  59  61.290  -0.604  -1.036
  507    HG3  PRO  59           HG1      PRO  59  61.734  -1.164  -2.615
  508    HD2  PRO  59           HD2      PRO  59  61.266  -2.791  -0.156
  509    HD3  PRO  59           HD1      PRO  59  60.711  -3.076  -1.818
  510    H    TYR  60           HN       TYR  60  66.304  -3.099  -0.857
  511    HA   TYR  60           HA       TYR  60  66.082  -3.033   1.928
  512    HB2  TYR  60           HB2      TYR  60  67.576  -5.420   0.810
  513    HB3  TYR  60           HB1      TYR  60  67.065  -5.009   2.310
  514    HD1  TYR  60           HD1      TYR  60  64.776  -5.150   3.003
  515    HD2  TYR  60           HD2      TYR  60  66.100  -6.517  -0.690
  516    HE1  TYR  60           HE1      TYR  60  62.764  -6.591   2.843
  517    HE2  TYR  60           HE2      TYR  60  64.146  -7.966  -0.913
  518    HH   TYR  60           HH       TYR  60  61.464  -7.688   1.262
  519    H    ALA  61           HN       ALA  61  67.947  -2.868   2.770
  520    HA   ALA  61           HA       ALA  61  69.831  -1.301   1.299
  521    HB1  ALA  61           HB1      ALA  61  70.325  -0.454   3.427
  522    HB2  ALA  61           HB2      ALA  61  69.617  -1.912   4.120
  523    HB3  ALA  61           HB3      ALA  61  68.532  -0.715   3.419
  524    H    VAL  62           HN       VAL  62  72.001  -1.753   2.715
  525    HA   VAL  62           HA       VAL  62  72.506  -4.630   2.747
  526    HB   VAL  62           HB       VAL  62  74.244  -2.317   1.741
  527   HG11  VAL  62          HG11      VAL  62  75.093  -5.098   2.204
  528   HG12  VAL  62          HG12      VAL  62  75.586  -3.586   3.019
  529   HG13  VAL  62          HG13      VAL  62  75.974  -3.827   1.319
  530   HG21  VAL  62          HG21      VAL  62  72.742  -3.051   0.063
  531   HG22  VAL  62          HG22      VAL  62  73.217  -4.738   0.363
  532   HG23  VAL  62          HG23      VAL  62  74.378  -3.598  -0.318
  533    H    CYS  63           HN       CYS  63  72.612  -5.189   4.814
  534    HA   CYS  63           HA       CYS  63  72.887  -3.394   6.925
  535    HB2  CYS  63           HB2      CYS  63  72.780  -5.250   8.352
  536    HB3  CYS  63           HB1      CYS  63  71.991  -5.750   6.847
  537    H    ASP  64           HN       ASP  64  74.572  -3.858   8.719
  538    HA   ASP  64           HA       ASP  64  76.998  -2.618   8.109
  539    HB2  ASP  64           HB2      ASP  64  76.156  -2.764  10.391
  540    HB3  ASP  64           HB1      ASP  64  76.406  -4.500  10.395
  541    H    LYS  65           HN       LYS  65  76.351  -6.009   8.557
  542    HA   LYS  65           HA       LYS  65  79.008  -6.955   8.296
  543    HB2  LYS  65           HB2      LYS  65  76.402  -8.384   7.808
  544    HB3  LYS  65           HB1      LYS  65  77.960  -9.156   8.042
  545    HG2  LYS  65           HG2      LYS  65  78.072  -8.321  10.312
  546    HG3  LYS  65           HG1      LYS  65  76.574  -7.431  10.064
  547    HD2  LYS  65           HD2      LYS  65  76.097  -9.461  11.268
  548    HD3  LYS  65           HD1      LYS  65  75.422  -9.530   9.639
  549    HE2  LYS  65           HE2      LYS  65  77.281 -10.928   8.908
  550    HE3  LYS  65           HE1      LYS  65  77.998 -10.834  10.518
  551    HZ1  LYS  65           HZ1      LYS  65  75.375 -12.047   9.844
  552    HZ2  LYS  65           HZ2      LYS  65  76.046 -11.968  11.395
  553    HZ3  LYS  65           HZ3      LYS  65  76.786 -12.887  10.203
  554    H    CYS  66           HN       CYS  66  76.305  -6.703   6.075
  555    HA   CYS  66           HA       CYS  66  77.730  -7.838   3.929
  556    HB2  CYS  66           HB2      CYS  66  75.117  -6.401   4.136
  557    HB3  CYS  66           HB1      CYS  66  75.663  -7.053   2.607
  558    H    LEU  67           HN       LEU  67  77.093  -4.532   4.991
  559    HA   LEU  67           HA       LEU  67  77.996  -3.075   2.858
  560    HB2  LEU  67           HB2      LEU  67  77.030  -2.538   5.247
  561    HB3  LEU  67           HB1      LEU  67  78.726  -2.310   5.618
  562    HG   LEU  67           HG       LEU  67  77.405  -1.001   3.324
  563   HD11  LEU  67          HD11      LEU  67  76.183  -0.459   5.239
  564   HD12  LEU  67          HD12      LEU  67  77.121   0.974   4.765
  565   HD13  LEU  67          HD13      LEU  67  77.633  -0.023   6.152
  566   HD21  LEU  67          HD21      LEU  67  79.217   0.674   3.578
  567   HD22  LEU  67          HD22      LEU  67  79.838  -0.950   3.279
  568   HD23  LEU  67          HD23      LEU  67  79.879  -0.280   4.907
  569    H    LYS  68           HN       LYS  68  79.677  -4.538   5.541
  570    HA   LYS  68           HA       LYS  68  82.271  -3.739   4.857
  571    HB2  LYS  68           HB2      LYS  68  81.718  -4.339   7.120
  572    HB3  LYS  68           HB1      LYS  68  81.208  -5.938   6.630
  573    HG2  LYS  68           HG2      LYS  68  83.996  -5.177   6.081
  574    HG3  LYS  68           HG1      LYS  68  83.570  -5.441   7.783
  575    HD2  LYS  68           HD2      LYS  68  83.157  -7.403   5.511
  576    HD3  LYS  68           HD1      LYS  68  84.498  -7.452   6.656
  577    HE2  LYS  68           HE2      LYS  68  81.560  -7.748   7.359
  578    HE3  LYS  68           HE1      LYS  68  82.736  -9.047   7.257
  579    HZ1  LYS  68           HZ1      LYS  68  83.981  -7.981   9.075
  580    HZ2  LYS  68           HZ2      LYS  68  82.442  -8.417   9.525
  581    HZ3  LYS  68           HZ3      LYS  68  82.773  -6.810   9.219
  582    H    PHE  69           HN       PHE  69  80.392  -6.656   3.971
  583    HA   PHE  69           HA       PHE  69  82.460  -8.015   2.696
  584    HB2  PHE  69           HB2      PHE  69  79.557  -7.921   2.275
  585    HB3  PHE  69           HB1      PHE  69  80.599  -9.096   1.534
  586    HD1  PHE  69           HD2      PHE  69  82.171  -9.336   4.366
  587    HD2  PHE  69           HD1      PHE  69  78.139  -9.654   3.060
  588    HE1  PHE  69           HE2      PHE  69  81.664 -10.795   6.269
  589    HE2  PHE  69           HE1      PHE  69  77.612 -11.094   4.927
  590    HZ   PHE  69           HZ       PHE  69  79.363 -11.684   6.563
  591    H    TYR  70           HN       TYR  70  79.841  -5.936   1.563
  592    HA   TYR  70           HA       TYR  70  80.736  -6.136  -1.183
  593    HB2  TYR  70           HB2      TYR  70  78.172  -5.135   0.040
  594    HB3  TYR  70           HB1      TYR  70  78.501  -5.181  -1.691
  595    HD1  TYR  70           HD1      TYR  70  78.841  -7.363  -2.812
  596    HD2  TYR  70           HD2      TYR  70  77.586  -7.115   1.225
  597    HE1  TYR  70           HE1      TYR  70  78.173  -9.699  -2.894
  598    HE2  TYR  70           HE2      TYR  70  76.903  -9.447   1.185
  599    HH   TYR  70           HH       TYR  70  76.335 -11.163  -0.318
  600    H    SER  71           HN       SER  71  82.209  -4.443   0.681
  601    HA   SER  71           HA       SER  71  81.608  -1.706   0.345
  602    HB2  SER  71           HB2      SER  71  84.333  -2.971   0.689
  603    HB3  SER  71           HB1      SER  71  83.861  -1.334   1.140
  604    HG   SER  71           HG       SER  71  82.167  -2.792   2.407
  605    H    LYS  72           HN       LYS  72  83.309  -4.077  -1.533
  606    HA   LYS  72           HA       LYS  72  84.716  -2.607  -3.394
  607    HB2  LYS  72           HB2      LYS  72  84.741  -5.101  -3.079
  608    HB3  LYS  72           HB1      LYS  72  83.205  -5.166  -3.902
  609    HG2  LYS  72           HG2      LYS  72  84.970  -5.755  -5.442
  610    HG3  LYS  72           HG1      LYS  72  84.215  -4.221  -5.899
  611    HD2  LYS  72           HD2      LYS  72  86.673  -4.118  -6.126
  612    HD3  LYS  72           HD1      LYS  72  86.082  -2.985  -4.918
  613    HE2  LYS  72           HE2      LYS  72  86.700  -4.589  -3.138
  614    HE3  LYS  72           HE1      LYS  72  87.304  -5.698  -4.364
  615    HZ1  LYS  72           HZ1      LYS  72  89.083  -4.457  -3.357
  616    HZ2  LYS  72           HZ2      LYS  72  88.369  -2.997  -3.756
  617    HZ3  LYS  72           HZ3      LYS  72  88.952  -3.998  -4.968
  618    H    ILE  73           HN       ILE  73  81.356  -3.530  -3.326
  619    HA   ILE  73           HA       ILE  73  80.776  -2.535  -5.929
  620    HB   ILE  73           HB       ILE  73  78.760  -3.102  -3.728
  621   HG12  ILE  73          HG12      ILE  73  79.802  -4.920  -5.916
  622   HG13  ILE  73          HG11      ILE  73  80.146  -5.080  -4.199
  623   HG21  ILE  73          HG21      ILE  73  77.170  -3.358  -5.595
  624   HG22  ILE  73          HG22      ILE  73  78.456  -2.954  -6.734
  625   HG23  ILE  73          HG23      ILE  73  77.886  -1.741  -5.586
  626   HD11  ILE  73          HD11      ILE  73  77.777  -5.516  -3.767
  627   HD12  ILE  73          HD12      ILE  73  78.453  -6.675  -4.910
  628   HD13  ILE  73          HD13      ILE  73  77.438  -5.354  -5.489
  629    H    SER  74           HN       SER  74  79.096  -1.402  -2.989
  630    HA   SER  74           HA       SER  74  78.267   0.565  -2.423
  631    HB2  SER  74           HB2      SER  74  80.884   1.600  -3.537
  632    HB3  SER  74           HB1      SER  74  79.777   2.550  -2.540
  633    HG   SER  74           HG       SER  74  81.354   0.311  -1.849
  634    H    GLU  75           HN       GLU  75  79.831   1.878  -5.184
  635    HA   GLU  75           HA       GLU  75  77.301   2.089  -6.628
  636    HB2  GLU  75           HB2      GLU  75  78.026   4.267  -5.347
  637    HB3  GLU  75           HB1      GLU  75  79.322   4.353  -6.520
  638    HG2  GLU  75           HG2      GLU  75  76.437   4.278  -7.338
  639    HG3  GLU  75           HG1      GLU  75  77.244   5.775  -6.902
  640    H    TYR  76           HN       TYR  76  77.915   0.527  -8.018
  641    HA   TYR  76           HA       TYR  76  80.638   0.649  -9.089
  642    HB2  TYR  76           HB2      TYR  76  79.632  -1.314  -7.594
  643    HB3  TYR  76           HB1      TYR  76  79.049  -1.861  -9.158
  644    HD1  TYR  76           HD1      TYR  76  81.908  -0.365 -10.184
  645    HD2  TYR  76           HD2      TYR  76  80.713  -3.615  -7.720
  646    HE1  TYR  76           HE1      TYR  76  84.088  -1.416 -10.529
  647    HE2  TYR  76           HE2      TYR  76  82.883  -4.679  -8.054
  648    HH   TYR  76           HH       TYR  76  84.653  -4.594  -9.837
  649    H    ARG  77           HN       ARG  77  80.847   0.650 -11.294
  650    HA   ARG  77           HA       ARG  77  78.347   0.570 -12.836
  651    HB2  ARG  77           HB2      ARG  77  80.840   2.056 -13.704
  652    HB3  ARG  77           HB1      ARG  77  79.210   2.243 -14.310
  653    HG2  ARG  77           HG2      ARG  77  79.518   4.189 -13.083
  654    HG3  ARG  77           HG1      ARG  77  78.701   3.149 -11.915
  655    HD2  ARG  77           HD2      ARG  77  80.967   2.500 -11.047
  656    HD3  ARG  77           HD1      ARG  77  81.659   3.739 -12.089
  657    HE   ARG  77           HE       ARG  77  79.587   4.627 -10.298
  658   HH11  ARG  77          HH11      ARG  77  83.095   4.188 -10.677
  659   HH12  ARG  77          HH12      ARG  77  83.505   5.284  -9.446
  660   HH21  ARG  77          HH21      ARG  77  80.136   6.092  -8.682
  661   HH22  ARG  77          HH22      ARG  77  81.755   6.427  -8.229
  662    H    HIS  78           HN       HIS  78  81.810   0.418 -13.250
  663    HA   HIS  78           HA       HIS  78  83.151  -0.541 -14.518
  664    HB2  HIS  78           HB2      HIS  78  83.362  -3.021 -14.479
  665    HB3  HIS  78           HB1      HIS  78  83.178  -2.107 -12.978
  666    HD1  HIS  78           HD1      HIS  78  81.439  -4.736 -15.066
  667    HD2  HIS  78           HD2      HIS  78  81.182  -2.728 -11.505
  668    HE1  HIS  78           HE1      HIS  78  79.753  -6.034 -13.719
  669    H    TYR  79           HN       TYR  79  82.877   0.453 -16.235
  670    HA   TYR  79           HA       TYR  79  81.820  -1.100 -18.471
  671    HB2  TYR  79           HB2      TYR  79  81.437   1.822 -17.853
  672    HB3  TYR  79           HB1      TYR  79  81.246   1.174 -19.474
  673    HD1  TYR  79           HD1      TYR  79  80.081   0.349 -15.991
  674    HD2  TYR  79           HD2      TYR  79  79.130   0.701 -20.124
  675    HE1  TYR  79           HE1      TYR  79  77.748  -0.167 -15.506
  676    HE2  TYR  79           HE2      TYR  79  76.804   0.142 -19.646
  677    HH   TYR  79           HH       TYR  79  75.509  -0.971 -17.946
  678    H    SER  80           HN       SER  80  82.718   0.053 -20.543
  679    HA   SER  80           HA       SER  80  84.414   0.411 -21.866
  680    HB2  SER  80           HB2      SER  80  85.923   2.395 -21.264
  681    HB3  SER  80           HB1      SER  80  84.195   2.710 -21.288
  682    HG   SER  80           HG       SER  80  84.995   1.871 -18.869
  Start of MODEL   18
    1    H1   GLY  -1           HT1      GLY  -1  53.052   0.146  -6.736
    2    H2   GLY  -1           HT2      GLY  -1  52.871  -0.828  -8.105
    3    H3   GLY  -1           HT3      GLY  -1  53.758  -1.378  -6.763
    4    HA2  GLY  -1           HA1      GLY  -1  50.862  -0.812  -6.758
    5    HA3  GLY  -1           HA2      GLY  -1  51.601  -2.409  -6.840
    6    H    ALA   0           HN       ALA   0  50.481  -2.875  -4.853
    7    HA   ALA   0           HA       ALA   0  51.222  -1.436  -2.473
    8    HB1  ALA   0           HB1      ALA   0  49.786  -4.071  -2.802
    9    HB2  ALA   0           HB2      ALA   0  49.013  -2.492  -2.664
   10    HB3  ALA   0           HB3      ALA   0  49.922  -3.154  -1.303
   11    H    MET   1           HN       MET   1  52.747  -1.978  -1.032
   12    HA   MET   1           HA       MET   1  54.643  -2.816  -0.175
   13    HB2  MET   1           HB2      MET   1  53.377  -5.047  -0.194
   14    HB3  MET   1           HB1      MET   1  54.097  -5.370  -1.757
   15    HG2  MET   1           HG2      MET   1  56.278  -4.797  -0.156
   16    HG3  MET   1           HG1      MET   1  55.197  -5.655   0.918
   17    HE1  MET   1           HE1      MET   1  55.248  -6.406  -3.029
   18    HE2  MET   1           HE2      MET   1  56.776  -7.289  -3.100
   19    HE3  MET   1           HE3      MET   1  56.728  -5.599  -2.584
   20    H    PHE   2           HN       PHE   2  56.995  -3.690  -1.115
   21    HA   PHE   2           HA       PHE   2  57.062  -2.163  -3.479
   22    HB2  PHE   2           HB2      PHE   2  59.186  -2.711  -1.480
   23    HB3  PHE   2           HB1      PHE   2  59.610  -2.147  -3.079
   24    HD1  PHE   2           HD1      PHE   2  56.726  -1.202  -0.911
   25    HD2  PHE   2           HD2      PHE   2  60.251   0.057  -2.904
   26    HE1  PHE   2           HE1      PHE   2  56.202   1.087  -0.376
   27    HE2  PHE   2           HE2      PHE   2  59.799   2.284  -2.402
   28    HZ   PHE   2           HZ       PHE   2  57.728   2.915  -1.107
   29    H    GLN   3           HN       GLN   3  56.792  -3.154  -5.178
   30    HA   GLN   3           HA       GLN   3  58.241  -5.615  -5.716
   31    HB2  GLN   3           HB2      GLN   3  56.190  -6.312  -7.090
   32    HB3  GLN   3           HB1      GLN   3  56.181  -6.424  -5.342
   33    HG2  GLN   3           HG2      GLN   3  54.010  -5.682  -6.101
   34    HG3  GLN   3           HG1      GLN   3  54.790  -4.401  -5.197
   35   HE21  GLN   3          HE21      GLN   3  56.370  -3.366  -7.315
   36   HE22  GLN   3          HE22      GLN   3  55.400  -2.738  -8.526
   37    H    ASP   4           HN       ASP   4  58.271  -6.334  -7.905
   38    HA   ASP   4           HA       ASP   4  59.062  -4.289  -9.851
   39    HB2  ASP   4           HB2      ASP   4  60.382  -6.390  -9.620
   40    HB3  ASP   4           HB1      ASP   4  58.941  -7.363  -9.860
   41    HA   PRO   5           HA       PRO   5  58.742  -5.018 -12.703
   42    HB2  PRO   5           HB2      PRO   5  57.563  -3.560 -14.582
   43    HB3  PRO   5           HB1      PRO   5  57.197  -5.268 -14.237
   44    HG2  PRO   5           HG2      PRO   5  55.675  -2.887 -13.257
   45    HG3  PRO   5           HG1      PRO   5  55.063  -4.254 -14.210
   46    HD2  PRO   5           HD2      PRO   5  54.873  -4.224 -11.548
   47    HD3  PRO   5           HD1      PRO   5  55.214  -5.723 -12.433
   48    H    GLN   6           HN       GLN   6  56.907  -2.586 -11.399
   49    HA   GLN   6           HA       GLN   6  58.716  -0.470 -12.151
   50    HB2  GLN   6           HB2      GLN   6  56.312  -0.258 -10.337
   51    HB3  GLN   6           HB1      GLN   6  57.344   1.096 -10.765
   52    HG2  GLN   6           HG2      GLN   6  55.809  -0.596 -12.727
   53    HG3  GLN   6           HG1      GLN   6  55.347   1.014 -12.182
   54   HE21  GLN   6          HE21      GLN   6  56.014   0.014 -14.875
   55   HE22  GLN   6          HE22      GLN   6  57.299   1.026 -15.424
   56    H    GLU   7           HN       GLU   7  60.196  -1.841 -11.308
   57    HA   GLU   7           HA       GLU   7  61.199  -2.218  -8.893
   58    HB2  GLU   7           HB2      GLU   7  62.051  -3.053 -11.028
   59    HB3  GLU   7           HB1      GLU   7  62.669  -1.457 -11.396
   60    HG2  GLU   7           HG2      GLU   7  64.225  -1.622  -9.548
   61    HG3  GLU   7           HG1      GLU   7  63.562  -3.206  -9.121
   62    H    ARG   8           HN       ARG   8  61.078  -0.927  -7.670
   63    HA   ARG   8           HA       ARG   8  61.139   1.810  -7.146
   64    HB2  ARG   8           HB2      ARG   8  62.555  -0.046  -5.294
   65    HB3  ARG   8           HB1      ARG   8  61.467   1.266  -4.909
   66    HG2  ARG   8           HG2      ARG   8  60.563  -1.411  -6.062
   67    HG3  ARG   8           HG1      ARG   8  60.634  -0.976  -4.376
   68    HD2  ARG   8           HD2      ARG   8  58.349  -0.779  -5.449
   69    HD3  ARG   8           HD1      ARG   8  58.910   0.620  -4.560
   70    HE   ARG   8           HE       ARG   8  58.853   0.375  -7.490
   71   HH11  ARG   8          HH11      ARG   8  58.565   2.330  -4.528
   72   HH12  ARG   8          HH12      ARG   8  58.149   3.750  -5.397
   73   HH21  ARG   8          HH21      ARG   8  58.242   2.398  -8.591
   74   HH22  ARG   8          HH22      ARG   8  57.959   3.775  -7.660
   75    HA   PRO   9           HA       PRO   9  65.027   3.754  -7.880
   76    HB2  PRO   9           HB2      PRO   9  65.552   5.030  -5.522
   77    HB3  PRO   9           HB1      PRO   9  64.559   5.721  -6.755
   78    HG2  PRO   9           HG2      PRO   9  63.932   4.453  -4.228
   79    HG3  PRO   9           HG1      PRO   9  62.874   5.548  -5.169
   80    HD2  PRO   9           HD2      PRO   9  62.714   2.866  -4.695
   81    HD3  PRO   9           HD1      PRO   9  61.747   3.632  -5.940
   82    H    ARG  10           HN       ARG  10  67.243   3.647  -7.685
   83    HA   ARG  10           HA       ARG  10  68.281   1.774  -5.738
   84    HB2  ARG  10           HB2      ARG  10  69.317   2.958  -8.192
   85    HB3  ARG  10           HB1      ARG  10  70.506   2.718  -6.914
   86    HG2  ARG  10           HG2      ARG  10  70.451   0.807  -8.307
   87    HG3  ARG  10           HG1      ARG  10  69.807   0.389  -6.732
   88    HD2  ARG  10           HD2      ARG  10  67.532   0.616  -7.607
   89    HD3  ARG  10           HD1      ARG  10  68.196   0.979  -9.199
   90    HE   ARG  10           HE       ARG  10  69.060  -1.501  -8.006
   91   HH11  ARG  10          HH11      ARG  10  66.807   0.086 -10.255
   92   HH12  ARG  10          HH12      ARG  10  66.368  -1.391 -11.000
   93   HH21  ARG  10          HH21      ARG  10  68.441  -3.467  -9.101
   94   HH22  ARG  10          HH22      ARG  10  67.306  -3.395 -10.383
   95    H    LYS  11           HN       LYS  11  67.610   5.037  -5.608
   96    HA   LYS  11           HA       LYS  11  69.806   5.316  -3.748
   97    HB2  LYS  11           HB2      LYS  11  68.099   7.509  -4.818
   98    HB3  LYS  11           HB1      LYS  11  69.441   7.597  -3.754
   99    HG2  LYS  11           HG2      LYS  11  70.990   6.670  -5.338
  100    HG3  LYS  11           HG1      LYS  11  69.705   6.548  -6.539
  101    HD2  LYS  11           HD2      LYS  11  70.234   9.043  -5.150
  102    HD3  LYS  11           HD1      LYS  11  71.282   8.604  -6.533
  103    HE2  LYS  11           HE2      LYS  11  69.201   8.470  -7.880
  104    HE3  LYS  11           HE1      LYS  11  68.278   8.986  -6.470
  105    HZ1  LYS  11           HZ1      LYS  11  70.374  10.551  -7.859
  106    HZ2  LYS  11           HZ2      LYS  11  69.602  11.023  -6.457
  107    HZ3  LYS  11           HZ3      LYS  11  68.710  10.875  -7.876
  108    H    LEU  12           HN       LEU  12  69.511   5.608  -1.778
  109    HA   LEU  12           HA       LEU  12  67.264   4.762  -0.440
  110    HB2  LEU  12           HB2      LEU  12  69.346   4.559   0.581
  111    HB3  LEU  12           HB1      LEU  12  69.673   6.277   0.459
  112    HG   LEU  12           HG       LEU  12  67.908   6.717   2.068
  113   HD11  LEU  12          HD11      LEU  12  67.846   3.734   2.381
  114   HD12  LEU  12          HD12      LEU  12  66.568   4.690   1.617
  115   HD13  LEU  12          HD13      LEU  12  66.947   4.913   3.348
  116   HD21  LEU  12          HD21      LEU  12  69.092   5.989   3.988
  117   HD22  LEU  12          HD22      LEU  12  70.263   6.356   2.699
  118   HD23  LEU  12          HD23      LEU  12  69.812   4.685   3.060
  119    HA   PRO  13           HA       PRO  13  66.191   9.244   0.912
  120    HB2  PRO  13           HB2      PRO  13  66.992  11.374  -0.589
  121    HB3  PRO  13           HB1      PRO  13  68.009  10.635   0.661
  122    HG2  PRO  13           HG2      PRO  13  68.091  10.136  -2.283
  123    HG3  PRO  13           HG1      PRO  13  69.427  10.541  -1.185
  124    HD2  PRO  13           HD2      PRO  13  68.888   7.999  -1.897
  125    HD3  PRO  13           HD1      PRO  13  69.491   8.381  -0.299
  126    H    GLN  14           HN       GLN  14  66.468   8.715  -2.485
  127    HA   GLN  14           HA       GLN  14  63.938   9.801  -3.212
  128    HB2  GLN  14           HB2      GLN  14  66.041   8.280  -4.613
  129    HB3  GLN  14           HB1      GLN  14  64.415   8.099  -5.258
  130    HG2  GLN  14           HG2      GLN  14  64.224  10.483  -5.578
  131    HG3  GLN  14           HG1      GLN  14  65.763  10.743  -4.777
  132   HE21  GLN  14          HE21      GLN  14  65.561   8.042  -6.869
  133   HE22  GLN  14          HE22      GLN  14  66.394   8.738  -8.199
  134    H    LEU  15           HN       LEU  15  64.992   6.489  -2.330
  135    HA   LEU  15           HA       LEU  15  62.551   5.285  -2.833
  136    HB2  LEU  15           HB2      LEU  15  64.689   4.100  -2.405
  137    HB3  LEU  15           HB1      LEU  15  64.678   4.733  -0.843
  138    HG   LEU  15           HG       LEU  15  62.689   3.579  -0.224
  139   HD11  LEU  15          HD11      LEU  15  62.959   2.212  -2.909
  140   HD12  LEU  15          HD12      LEU  15  61.688   3.373  -2.493
  141   HD13  LEU  15          HD13      LEU  15  61.778   1.821  -1.658
  142   HD21  LEU  15          HD21      LEU  15  64.851   1.935  -1.406
  143   HD22  LEU  15          HD22      LEU  15  63.729   1.392  -0.134
  144   HD23  LEU  15          HD23      LEU  15  64.867   2.743   0.150
  145    H    CYS  16           HN       CYS  16  63.888   6.871  -0.028
  146    HA   CYS  16           HA       CYS  16  61.801   6.357   1.755
  147    HB2  CYS  16           HB2      CYS  16  63.518   8.843   1.548
  148    HB3  CYS  16           HB1      CYS  16  62.552   8.423   2.956
  149    HG   CYS  16           HG       CYS  16  65.220   6.680   1.737
  150    H    THR  17           HN       THR  17  62.168   8.901  -0.667
  151    HA   THR  17           HA       THR  17  59.859  10.363  -0.301
  152    HB   THR  17           HB       THR  17  61.612   9.676  -2.572
  153    HG1  THR  17           HG1      THR  17  61.007  11.987  -1.139
  154   HG21  THR  17          HG21      THR  17  59.539   9.755  -3.716
  155   HG22  THR  17          HG22      THR  17  60.383  11.261  -4.089
  156   HG23  THR  17          HG23      THR  17  59.048  11.256  -2.920
  157    H    GLU  18           HN       GLU  18  60.411   7.410  -2.083
  158    HA   GLU  18           HA       GLU  18  57.909   7.018  -3.192
  159    HB2  GLU  18           HB2      GLU  18  60.167   5.364  -2.431
  160    HB3  GLU  18           HB1      GLU  18  58.741   4.603  -3.145
  161    HG2  GLU  18           HG2      GLU  18  60.395   6.854  -4.274
  162    HG3  GLU  18           HG1      GLU  18  60.509   5.194  -4.805
  163    H    LEU  19           HN       LEU  19  59.318   5.566  -0.204
  164    HA   LEU  19           HA       LEU  19  56.908   4.501   0.765
  165    HB2  LEU  19           HB2      LEU  19  59.491   5.293   1.988
  166    HB3  LEU  19           HB1      LEU  19  58.250   4.662   2.978
  167    HG   LEU  19           HG       LEU  19  58.384   2.653   1.225
  168   HD11  LEU  19          HD11      LEU  19  60.654   2.237   0.552
  169   HD12  LEU  19          HD12      LEU  19  61.120   3.828   1.151
  170   HD13  LEU  19          HD13      LEU  19  60.007   3.689  -0.206
  171   HD21  LEU  19          HD21      LEU  19  60.246   3.215   3.448
  172   HD22  LEU  19          HD22      LEU  19  60.024   1.612   2.729
  173   HD23  LEU  19          HD23      LEU  19  58.677   2.414   3.573
  174    H    GLN  20           HN       GLN  20  57.744   7.676   0.391
  175    HA   GLN  20           HA       GLN  20  56.702   9.605   0.936
  176    HB2  GLN  20           HB2      GLN  20  54.733   7.656   2.036
  177    HB3  GLN  20           HB1      GLN  20  54.373   9.396   1.892
  178    HG2  GLN  20           HG2      GLN  20  54.648   9.161  -0.540
  179    HG3  GLN  20           HG1      GLN  20  55.017   7.451  -0.329
  180   HE21  GLN  20          HE21      GLN  20  52.935   8.636  -1.860
  181   HE22  GLN  20          HE22      GLN  20  51.445   8.060  -1.225
  182    H    THR  21           HN       THR  21  58.575   8.288   2.691
  183    HA   THR  21           HA       THR  21  57.943   9.680   5.157
  184    HB   THR  21           HB       THR  21  57.419   7.219   5.434
  185    HG1  THR  21           HG1      THR  21  58.418   7.118   7.430
  186   HG21  THR  21          HG21      THR  21  59.258   5.593   5.527
  187   HG22  THR  21          HG22      THR  21  60.398   6.848   5.059
  188   HG23  THR  21          HG23      THR  21  59.157   6.321   3.919
  189    H    THR  22           HN       THR  22  60.403   9.012   6.407
  190    HA   THR  22           HA       THR  22  62.308   9.953   4.373
  191    HB   THR  22           HB       THR  22  62.829  10.831   7.137
  192    HG1  THR  22           HG1      THR  22  60.433  11.131   6.581
  193   HG21  THR  22          HG21      THR  22  62.834  12.194   4.430
  194   HG22  THR  22          HG22      THR  22  64.229  11.460   5.207
  195   HG23  THR  22          HG23      THR  22  63.477  12.888   5.918
  196    H    ILE  23           HN       ILE  23  64.696   9.735   5.478
  197    HA   ILE  23           HA       ILE  23  65.259   7.097   5.670
  198    HB   ILE  23           HB       ILE  23  66.844   9.301   6.871
  199   HG12  ILE  23          HG12      ILE  23  66.388   8.451   4.067
  200   HG13  ILE  23          HG11      ILE  23  66.337  10.018   4.773
  201   HG21  ILE  23          HG21      ILE  23  67.608   6.622   5.624
  202   HG22  ILE  23          HG22      ILE  23  67.683   7.004   7.348
  203   HG23  ILE  23          HG23      ILE  23  68.784   7.804   6.215
  204   HD11  ILE  23          HD11      ILE  23  68.800  10.018   5.001
  205   HD12  ILE  23          HD12      ILE  23  68.300   9.761   3.310
  206   HD13  ILE  23          HD13      ILE  23  68.800   8.392   4.311
  207    H    HIS  24           HN       HIS  24  64.153   9.297   7.904
  208    HA   HIS  24           HA       HIS  24  65.362   8.512  10.306
  209    HB2  HIS  24           HB2      HIS  24  62.947  10.268   9.932
  210    HB3  HIS  24           HB1      HIS  24  64.151  10.390  11.187
  211    HD1  HIS  24           HD1      HIS  24  66.509  10.194   8.939
  212    HD2  HIS  24           HD2      HIS  24  63.400  12.838   9.187
  213    HE1  HIS  24           HE1      HIS  24  66.958  11.836   7.084
  214    H    ASP  25           HN       ASP  25  63.035   7.220   8.451
  215    HA   ASP  25           HA       ASP  25  61.567   5.961  10.660
  216    HB2  ASP  25           HB2      ASP  25  60.350   8.019   9.893
  217    HB3  ASP  25           HB1      ASP  25  60.220   7.268   8.336
  218    H    ILE  26           HN       ILE  26  62.399   6.007   7.248
  219    HA   ILE  26           HA       ILE  26  61.056   3.881   6.187
  220    HB   ILE  26           HB       ILE  26  62.421   5.321   4.801
  221   HG12  ILE  26          HG12      ILE  26  63.605   2.581   4.689
  222   HG13  ILE  26          HG11      ILE  26  62.010   2.784   4.099
  223   HG21  ILE  26          HG21      ILE  26  64.805   3.975   6.067
  224   HG22  ILE  26          HG22      ILE  26  64.252   5.602   6.419
  225   HG23  ILE  26          HG23      ILE  26  64.849   5.204   4.794
  226   HD11  ILE  26          HD11      ILE  26  64.546   4.016   3.045
  227   HD12  ILE  26          HD12      ILE  26  62.935   4.415   2.420
  228   HD13  ILE  26          HD13      ILE  26  63.556   2.757   2.319
  229    H    ILE  27           HN       ILE  27  60.998   1.756   6.304
  230    HA   ILE  27           HA       ILE  27  63.145   0.425   7.682
  231    HB   ILE  27           HB       ILE  27  60.377  -0.477   6.899
  232   HG12  ILE  27          HG12      ILE  27  60.418   1.049   8.794
  233   HG13  ILE  27          HG11      ILE  27  59.931  -0.570   9.268
  234   HG21  ILE  27          HG21      ILE  27  61.928  -2.308   6.700
  235   HG22  ILE  27          HG22      ILE  27  60.867  -2.558   8.094
  236   HG23  ILE  27          HG23      ILE  27  62.534  -2.014   8.330
  237   HD11  ILE  27          HD11      ILE  27  62.644   0.693   9.708
  238   HD12  ILE  27          HD12      ILE  27  62.208  -0.957  10.151
  239   HD13  ILE  27          HD13      ILE  27  61.412   0.407  10.937
  240    H    LEU  28           HN       LEU  28  64.642  -0.238   6.776
  241    HA   LEU  28           HA       LEU  28  64.329  -1.181   4.064
  242    HB2  LEU  28           HB2      LEU  28  65.747   0.988   4.930
  243    HB3  LEU  28           HB1      LEU  28  66.957  -0.281   4.789
  244    HG   LEU  28           HG       LEU  28  66.396  -0.674   2.509
  245   HD11  LEU  28          HD11      LEU  28  64.061   0.861   3.382
  246   HD12  LEU  28          HD12      LEU  28  64.125  -0.503   2.245
  247   HD13  LEU  28          HD13      LEU  28  64.565   1.130   1.710
  248   HD21  LEU  28          HD21      LEU  28  66.916   1.472   1.550
  249   HD22  LEU  28          HD22      LEU  28  67.847   1.290   3.042
  250   HD23  LEU  28          HD23      LEU  28  66.392   2.279   3.016
  251    H    GLU  29           HN       GLU  29  65.346  -3.301   3.845
  252    HA   GLU  29           HA       GLU  29  66.867  -3.863   6.290
  253    HB2  GLU  29           HB2      GLU  29  66.338  -6.203   5.928
  254    HB3  GLU  29           HB1      GLU  29  65.089  -5.196   6.758
  255    HG2  GLU  29           HG2      GLU  29  64.189  -5.062   4.436
  256    HG3  GLU  29           HG1      GLU  29  65.283  -6.461   4.190
  257    H    CYS  30           HN       CYS  30  68.396  -5.958   6.025
  258    HA   CYS  30           HA       CYS  30  69.915  -5.616   3.850
  259    HB2  CYS  30           HB2      CYS  30  69.416  -8.137   5.333
  260    HB3  CYS  30           HB1      CYS  30  70.753  -7.682   4.268
  261    H    VAL  31           HN       VAL  31  69.859  -6.342   2.083
  262    HA   VAL  31           HA       VAL  31  67.738  -7.810   0.849
  263    HB   VAL  31           HB       VAL  31  68.723  -6.210  -0.606
  264   HG11  VAL  31          HG11      VAL  31  70.523  -5.483   0.640
  265   HG12  VAL  31          HG12      VAL  31  71.073  -6.093  -0.949
  266   HG13  VAL  31          HG13      VAL  31  71.313  -7.085   0.491
  267   HG21  VAL  31          HG21      VAL  31  70.170  -7.243  -2.239
  268   HG22  VAL  31          HG22      VAL  31  68.674  -8.085  -1.922
  269   HG23  VAL  31          HG23      VAL  31  70.201  -8.710  -1.246
  270    H    TYR  32           HN       TYR  32  70.815  -8.359   2.069
  271    HA   TYR  32           HA       TYR  32  71.041 -11.038   1.049
  272    HB2  TYR  32           HB2      TYR  32  73.065  -9.491   2.644
  273    HB3  TYR  32           HB1      TYR  32  73.346 -10.948   1.689
  274    HD1  TYR  32           HD1      TYR  32  71.978 -10.505  -0.816
  275    HD2  TYR  32           HD2      TYR  32  74.095  -7.677   1.599
  276    HE1  TYR  32           HE1      TYR  32  72.350  -9.245  -2.710
  277    HE2  TYR  32           HE2      TYR  32  74.502  -6.276  -0.368
  278    HH   TYR  32           HH       TYR  32  72.917  -6.972  -3.406
  279    H    CYS  33           HN       CYS  33  70.804  -9.413   4.250
  280    HA   CYS  33           HA       CYS  33  71.035 -11.990   5.671
  281    HB2  CYS  33           HB2      CYS  33  70.828  -9.262   6.905
  282    HB3  CYS  33           HB1      CYS  33  71.339 -10.742   7.692
  283    H    LYS  34           HN       LYS  34  68.622  -9.745   4.572
  284    HA   LYS  34           HA       LYS  34  66.657  -9.087   5.158
  285    HB2  LYS  34           HB2      LYS  34  66.746 -11.931   5.937
  286    HB3  LYS  34           HB1      LYS  34  65.357 -11.016   6.489
  287    HG2  LYS  34           HG2      LYS  34  65.125 -12.277   4.345
  288    HG3  LYS  34           HG1      LYS  34  64.657 -10.557   4.304
  289    HD2  LYS  34           HD2      LYS  34  66.703 -10.062   3.118
  290    HD3  LYS  34           HD1      LYS  34  67.251 -11.733   3.302
  291    HE2  LYS  34           HE2      LYS  34  66.277 -11.187   1.048
  292    HE3  LYS  34           HE1      LYS  34  65.526 -12.546   1.876
  293    HZ1  LYS  34           HZ1      LYS  34  64.373  -9.774   1.757
  294    HZ2  LYS  34           HZ2      LYS  34  63.686 -11.096   2.519
  295    HZ3  LYS  34           HZ3      LYS  34  63.884 -11.102   0.864
  296    H    GLN  35           HN       GLN  35  68.793  -8.323   7.005
  297    HA   GLN  35           HA       GLN  35  67.453  -8.282   9.523
  298    HB2  GLN  35           HB2      GLN  35  69.467  -8.914  10.025
  299    HB3  GLN  35           HB1      GLN  35  70.199  -8.412   8.510
  300    HG2  GLN  35           HG2      GLN  35  71.317  -7.220  10.141
  301    HG3  GLN  35           HG1      GLN  35  70.094  -6.147   9.445
  302   HE21  GLN  35          HE21      GLN  35  69.196  -8.624  11.744
  303   HE22  GLN  35          HE22      GLN  35  68.809  -7.542  13.027
  304    H    GLN  36           HN       GLN  36  66.377  -6.519   9.977
  305    HA   GLN  36           HA       GLN  36  66.230  -4.355   8.240
  306    HB2  GLN  36           HB2      GLN  36  65.119  -5.152  10.862
  307    HB3  GLN  36           HB1      GLN  36  64.850  -3.542  10.224
  308    HG2  GLN  36           HG2      GLN  36  63.744  -4.356   8.342
  309    HG3  GLN  36           HG1      GLN  36  64.371  -5.974   8.612
  310   HE21  GLN  36          HE21      GLN  36  62.023  -3.602   9.640
  311   HE22  GLN  36          HE22      GLN  36  61.002  -4.683  10.505
  312    H    LEU  37           HN       LEU  37  67.694  -2.960   8.050
  313    HA   LEU  37           HA       LEU  37  69.897  -2.687   9.625
  314    HB2  LEU  37           HB2      LEU  37  68.737  -0.928   7.506
  315    HB3  LEU  37           HB1      LEU  37  69.989  -0.395   8.552
  316    HG   LEU  37           HG       LEU  37  71.374  -2.350   7.872
  317   HD11  LEU  37          HD11      LEU  37  70.821  -3.429   5.731
  318   HD12  LEU  37          HD12      LEU  37  69.209  -2.717   5.829
  319   HD13  LEU  37          HD13      LEU  37  69.746  -3.860   7.055
  320   HD21  LEU  37          HD21      LEU  37  71.796  -0.156   7.010
  321   HD22  LEU  37          HD22      LEU  37  70.548  -0.358   5.787
  322   HD23  LEU  37          HD23      LEU  37  72.012  -1.341   5.719
  323    H    LEU  38           HN       LEU  38  70.595  -1.567  11.222
  324    HA   LEU  38           HA       LEU  38  69.069  -0.214  13.085
  325    HB2  LEU  38           HB2      LEU  38  71.644  -1.116  12.698
  326    HB3  LEU  38           HB1      LEU  38  71.801   0.598  12.505
  327    HG   LEU  38           HG       LEU  38  70.615  -0.678  14.901
  328   HD11  LEU  38          HD11      LEU  38  72.911  -1.363  14.581
  329   HD12  LEU  38          HD12      LEU  38  72.806  -0.259  15.961
  330   HD13  LEU  38          HD13      LEU  38  73.418   0.315  14.399
  331   HD21  LEU  38          HD21      LEU  38  69.968   1.659  14.573
  332   HD22  LEU  38          HD22      LEU  38  71.661   2.121  14.427
  333   HD23  LEU  38          HD23      LEU  38  71.041   1.511  15.965
  334    H    ARG  39           HN       ARG  39  68.362   1.982  12.933
  335    HA   ARG  39           HA       ARG  39  68.224   3.201  10.482
  336    HB2  ARG  39           HB2      ARG  39  66.829   3.759  12.449
  337    HB3  ARG  39           HB1      ARG  39  68.189   4.663  13.106
  338    HG2  ARG  39           HG2      ARG  39  68.143   6.160  11.197
  339    HG3  ARG  39           HG1      ARG  39  66.813   5.244  10.497
  340    HD2  ARG  39           HD2      ARG  39  66.764   6.692  13.127
  341    HD3  ARG  39           HD1      ARG  39  66.001   7.239  11.639
  342    HE   ARG  39           HE       ARG  39  64.837   4.947  11.846
  343   HH11  ARG  39          HH11      ARG  39  65.510   7.259  14.434
  344   HH12  ARG  39          HH12      ARG  39  64.216   6.744  15.416
  345   HH21  ARG  39          HH21      ARG  39  63.067   4.257  13.211
  346   HH22  ARG  39          HH22      ARG  39  62.799   5.006  14.712
  347    H    ARG  40           HN       ARG  40  70.870   3.500  12.806
  348    HA   ARG  40           HA       ARG  40  72.162   5.669  11.624
  349    HB2  ARG  40           HB2      ARG  40  73.189   3.342  13.212
  350    HB3  ARG  40           HB1      ARG  40  74.132   4.757  12.780
  351    HG2  ARG  40           HG2      ARG  40  71.688   4.648  14.478
  352    HG3  ARG  40           HG1      ARG  40  73.340   4.962  15.037
  353    HD2  ARG  40           HD2      ARG  40  71.601   6.717  13.295
  354    HD3  ARG  40           HD1      ARG  40  72.194   7.071  14.915
  355    HE   ARG  40           HE       ARG  40  74.467   6.733  13.579
  356   HH11  ARG  40          HH11      ARG  40  71.702   8.879  12.993
  357   HH12  ARG  40          HH12      ARG  40  72.535   9.920  11.957
  358   HH21  ARG  40          HH21      ARG  40  75.619   8.199  12.186
  359   HH22  ARG  40          HH22      ARG  40  74.844   9.557  11.503
  360    H    GLU  41           HN       GLU  41  72.477   2.179  11.130
  361    HA   GLU  41           HA       GLU  41  74.456   2.260   9.065
  362    HB2  GLU  41           HB2      GLU  41  72.191   0.277   9.437
  363    HB3  GLU  41           HB1      GLU  41  73.587  -0.028   8.453
  364    HG2  GLU  41           HG2      GLU  41  73.347  -0.095  11.467
  365    HG3  GLU  41           HG1      GLU  41  73.939  -1.258  10.320
  366    H    VAL  42           HN       VAL  42  70.986   2.602   9.087
  367    HA   VAL  42           HA       VAL  42  70.642   2.585   6.275
  368    HB   VAL  42           HB       VAL  42  68.804   4.133   8.140
  369   HG11  VAL  42          HG11      VAL  42  68.266   2.528   5.684
  370   HG12  VAL  42          HG12      VAL  42  68.478   4.293   5.671
  371   HG13  VAL  42          HG13      VAL  42  67.101   3.556   6.519
  372   HG21  VAL  42          HG21      VAL  42  69.154   1.897   9.093
  373   HG22  VAL  42          HG22      VAL  42  68.701   1.190   7.541
  374   HG23  VAL  42          HG23      VAL  42  67.514   2.102   8.471
  375    H    TYR  43           HN       TYR  43  71.085   5.324   8.592
  376    HA   TYR  43           HA       TYR  43  71.074   7.362   6.675
  377    HB2  TYR  43           HB2      TYR  43  72.590   7.200   9.262
  378    HB3  TYR  43           HB1      TYR  43  72.642   8.619   8.219
  379    HD1  TYR  43           HD1      TYR  43  70.229   9.424   7.475
  380    HD2  TYR  43           HD2      TYR  43  71.077   7.194  10.967
  381    HE1  TYR  43           HE1      TYR  43  68.135  10.203   8.489
  382    HE2  TYR  43           HE2      TYR  43  68.992   7.963  11.971
  383    HH   TYR  43           HH       TYR  43  67.438   9.961  11.693
  384    H    ASP  44           HN       ASP  44  73.721   5.202   7.621
  385    HA   ASP  44           HA       ASP  44  75.893   6.434   6.500
  386    HB2  ASP  44           HB2      ASP  44  75.160   3.518   6.596
  387    HB3  ASP  44           HB1      ASP  44  76.710   4.101   6.151
  388    H    PHE  45           HN       PHE  45  73.479   4.508   5.112
  389    HA   PHE  45           HA       PHE  45  74.553   3.878   2.677
  390    HB2  PHE  45           HB2      PHE  45  72.277   3.377   4.009
  391    HB3  PHE  45           HB1      PHE  45  71.746   4.588   2.866
  392    HD1  PHE  45           HD2      PHE  45  73.326   1.303   3.189
  393    HD2  PHE  45           HD1      PHE  45  71.446   4.172   0.682
  394    HE1  PHE  45           HE2      PHE  45  73.040  -0.397   1.424
  395    HE2  PHE  45           HE1      PHE  45  71.219   2.499  -1.072
  396    HZ   PHE  45           HZ       PHE  45  71.973   0.229  -0.709
  397    H    ALA  46           HN       ALA  46  72.449   6.654   3.524
  398    HA   ALA  46           HA       ALA  46  72.871   7.891   0.930
  399    HB1  ALA  46           HB1      ALA  46  71.305   8.869   3.299
  400    HB2  ALA  46           HB2      ALA  46  70.631   8.058   1.864
  401    HB3  ALA  46           HB3      ALA  46  71.344   9.649   1.725
  402    H    ARG  47           HN       ARG  47  74.234   8.118   4.102
  403    HA   ARG  47           HA       ARG  47  75.230  10.769   3.791
  404    HB2  ARG  47           HB2      ARG  47  75.426   8.604   5.765
  405    HB3  ARG  47           HB1      ARG  47  76.843   9.613   5.743
  406    HG2  ARG  47           HG2      ARG  47  75.206  10.315   7.402
  407    HG3  ARG  47           HG1      ARG  47  75.488  11.570   6.201
  408    HD2  ARG  47           HD2      ARG  47  73.427  10.929   5.062
  409    HD3  ARG  47           HD1      ARG  47  73.160   9.656   6.248
  410    HE   ARG  47           HE       ARG  47  73.372  11.800   7.790
  411   HH11  ARG  47          HH11      ARG  47  71.571  11.434   4.767
  412   HH12  ARG  47          HH12      ARG  47  70.206  12.302   5.286
  413   HH21  ARG  47          HH21      ARG  47  71.487  13.074   8.502
  414   HH22  ARG  47          HH22      ARG  47  70.169  13.285   7.454
  415    H    ARG  48           HN       ARG  48  76.201   7.673   2.852
  416    HA   ARG  48           HA       ARG  48  78.748   8.665   1.796
  417    HB2  ARG  48           HB2      ARG  48  77.592   5.927   2.085
  418    HB3  ARG  48           HB1      ARG  48  79.232   6.264   1.555
  419    HG2  ARG  48           HG2      ARG  48  79.832   7.054   3.738
  420    HG3  ARG  48           HG1      ARG  48  78.146   7.040   4.256
  421    HD2  ARG  48           HD2      ARG  48  78.100   4.623   3.949
  422    HD3  ARG  48           HD1      ARG  48  79.801   4.655   3.505
  423    HE   ARG  48           HE       ARG  48  79.396   5.925   5.987
  424   HH11  ARG  48          HH11      ARG  48  79.585   2.657   4.605
  425   HH12  ARG  48          HH12      ARG  48  79.836   1.916   6.110
  426   HH21  ARG  48          HH21      ARG  48  79.777   4.867   8.018
  427   HH22  ARG  48          HH22      ARG  48  79.910   3.180   8.085
  428    H    ASP  49           HN       ASP  49  78.576   6.413  -0.241
  429    HA   ASP  49           HA       ASP  49  76.284   7.318  -1.770
  430    HB2  ASP  49           HB2      ASP  49  78.140   8.638  -2.693
  431    HB3  ASP  49           HB1      ASP  49  79.079   7.172  -2.934
  432    H    LEU  50           HN       LEU  50  75.640   5.278  -0.781
  433    HA   LEU  50           HA       LEU  50  76.566   3.046  -2.319
  434    HB2  LEU  50           HB2      LEU  50  74.719   3.199   0.054
  435    HB3  LEU  50           HB1      LEU  50  75.104   1.715  -0.787
  436    HG   LEU  50           HG       LEU  50  77.526   2.244  -0.255
  437   HD11  LEU  50          HD11      LEU  50  76.295   4.079   1.739
  438   HD12  LEU  50          HD12      LEU  50  77.327   4.486   0.369
  439   HD13  LEU  50          HD13      LEU  50  77.982   3.547   1.715
  440   HD21  LEU  50          HD21      LEU  50  77.396   1.299   1.974
  441   HD22  LEU  50          HD22      LEU  50  76.364   0.435   0.813
  442   HD23  LEU  50          HD23      LEU  50  75.656   1.582   1.971
  443    H    CYS  51           HN       CYS  51  74.633   1.469  -2.798
  444    HA   CYS  51           HA       CYS  51  72.419   2.949  -3.970
  445    HB2  CYS  51           HB2      CYS  51  72.630   1.418  -5.962
  446    HB3  CYS  51           HB1      CYS  51  73.936   2.590  -5.800
  447    HG   CYS  51           HG       CYS  51  74.528  -0.366  -4.346
  448    H    ILE  52           HN       ILE  52  70.525   1.843  -3.940
  449    HA   ILE  52           HA       ILE  52  70.393  -0.237  -1.975
  450    HB   ILE  52           HB       ILE  52  68.297   1.338  -3.437
  451   HG12  ILE  52          HG12      ILE  52  69.303   1.003  -0.690
  452   HG13  ILE  52          HG11      ILE  52  69.437   2.449  -1.733
  453   HG21  ILE  52          HG21      ILE  52  67.796  -0.908  -1.452
  454   HG22  ILE  52          HG22      ILE  52  67.386  -0.960  -3.165
  455   HG23  ILE  52          HG23      ILE  52  66.577   0.191  -2.103
  456   HD11  ILE  52          HD11      ILE  52  67.888   2.752  -0.024
  457   HD12  ILE  52          HD12      ILE  52  67.174   1.181  -0.468
  458   HD13  ILE  52          HD13      ILE  52  67.025   2.571  -1.600
  459    H    VAL  53           HN       VAL  53  69.719  -2.083  -2.125
  460    HA   VAL  53           HA       VAL  53  69.909  -3.361  -4.701
  461    HB   VAL  53           HB       VAL  53  70.729  -5.288  -3.030
  462   HG11  VAL  53          HG11      VAL  53  72.422  -2.933  -3.913
  463   HG12  VAL  53          HG12      VAL  53  71.979  -4.297  -4.936
  464   HG13  VAL  53          HG13      VAL  53  73.025  -4.550  -3.534
  465   HG21  VAL  53          HG21      VAL  53  72.096  -4.274  -1.231
  466   HG22  VAL  53          HG22      VAL  53  70.386  -3.919  -1.011
  467   HG23  VAL  53          HG23      VAL  53  71.467  -2.690  -1.653
  468    H    TYR  54           HN       TYR  54  68.091  -4.098  -5.234
  469    HA   TYR  54           HA       TYR  54  66.080  -4.861  -3.310
  470    HB2  TYR  54           HB2      TYR  54  66.086  -4.569  -6.308
  471    HB3  TYR  54           HB1      TYR  54  64.686  -5.055  -5.354
  472    HD1  TYR  54           HD1      TYR  54  67.075  -2.244  -5.899
  473    HD2  TYR  54           HD2      TYR  54  63.358  -3.471  -4.195
  474    HE1  TYR  54           HE1      TYR  54  66.459   0.124  -5.345
  475    HE2  TYR  54           HE2      TYR  54  62.839  -1.184  -3.721
  476    HH   TYR  54           HH       TYR  54  64.783   1.423  -4.713
  477    H    ARG  55           HN       ARG  55  66.027  -6.623  -2.666
  478    HA   ARG  55           HA       ARG  55  67.365  -8.788  -4.083
  479    HB2  ARG  55           HB2      ARG  55  66.930  -8.493  -1.309
  480    HB3  ARG  55           HB1      ARG  55  65.762  -9.688  -1.785
  481    HG2  ARG  55           HG2      ARG  55  68.798 -10.047  -2.211
  482    HG3  ARG  55           HG1      ARG  55  67.920 -10.655  -0.880
  483    HD2  ARG  55           HD2      ARG  55  67.997 -12.484  -2.333
  484    HD3  ARG  55           HD1      ARG  55  66.409 -11.814  -2.694
  485    HE   ARG  55           HE       ARG  55  68.607 -10.876  -4.332
  486   HH11  ARG  55          HH11      ARG  55  65.722 -12.938  -4.152
  487   HH12  ARG  55          HH12      ARG  55  65.841 -13.470  -5.756
  488   HH21  ARG  55          HH21      ARG  55  68.728 -11.585  -6.520
  489   HH22  ARG  55          HH22      ARG  55  67.564 -12.654  -7.177
  490    H    ASP  56           HN       ASP  56  65.945  -9.922  -5.529
  491    HA   ASP  56           HA       ASP  56  64.110 -10.656  -6.595
  492    HB2  ASP  56           HB2      ASP  56  62.723 -10.117  -3.988
  493    HB3  ASP  56           HB1      ASP  56  61.851 -10.723  -5.389
  494    H    GLY  57           HN       GLY  57  62.502  -8.254  -4.624
  495    HA2  GLY  57           HA2      GLY  57  62.954  -6.246  -6.518
  496    HA3  GLY  57           HA1      GLY  57  61.273  -6.801  -6.623
  497    H    ASN  58           HN       ASN  58  62.999  -6.837  -3.640
  498    HA   ASN  58           HA       ASN  58  61.153  -4.777  -2.575
  499    HB2  ASN  58           HB2      ASN  58  62.689  -6.813  -0.987
  500    HB3  ASN  58           HB1      ASN  58  61.278  -5.929  -0.469
  501   HD21  ASN  58          HD21      ASN  58  62.531  -8.557  -2.323
  502   HD22  ASN  58          HD22      ASN  58  61.089  -9.465  -2.449
  503    HA   PRO  59           HA       PRO  59  64.859  -2.633  -1.926
  504    HB2  PRO  59           HB2      PRO  59  63.719  -0.783  -0.078
  505    HB3  PRO  59           HB1      PRO  59  63.922  -0.583  -1.820
  506    HG2  PRO  59           HG2      PRO  59  61.404  -0.809  -0.688
  507    HG3  PRO  59           HG1      PRO  59  61.775  -1.328  -2.281
  508    HD2  PRO  59           HD2      PRO  59  61.687  -3.001   0.164
  509    HD3  PRO  59           HD1      PRO  59  60.978  -3.301  -1.428
  510    H    TYR  60           HN       TYR  60  66.615  -2.933  -0.953
  511    HA   TYR  60           HA       TYR  60  66.454  -3.044   1.835
  512    HB2  TYR  60           HB2      TYR  60  68.128  -5.277   0.747
  513    HB3  TYR  60           HB1      TYR  60  67.457  -4.887   2.104
  514    HD1  TYR  60           HD1      TYR  60  65.343  -5.291   2.828
  515    HD2  TYR  60           HD2      TYR  60  66.552  -6.339  -1.006
  516    HE1  TYR  60           HE1      TYR  60  63.474  -6.918   2.707
  517    HE2  TYR  60           HE2      TYR  60  64.678  -7.955  -1.189
  518    HH   TYR  60           HH       TYR  60  62.184  -8.088   1.108
  519    H    ALA  61           HN       ALA  61  68.204  -2.714   2.719
  520    HA   ALA  61           HA       ALA  61  70.012  -0.945   1.391
  521    HB1  ALA  61           HB1      ALA  61  68.656  -0.435   3.379
  522    HB2  ALA  61           HB2      ALA  61  70.430  -0.248   3.592
  523    HB3  ALA  61           HB3      ALA  61  69.581  -1.703   4.181
  524    H    VAL  62           HN       VAL  62  72.162  -1.254   2.903
  525    HA   VAL  62           HA       VAL  62  72.908  -4.066   2.934
  526    HB   VAL  62           HB       VAL  62  74.337  -1.678   1.670
  527   HG11  VAL  62          HG11      VAL  62  76.265  -2.977   1.260
  528   HG12  VAL  62          HG12      VAL  62  75.645  -4.245   2.334
  529   HG13  VAL  62          HG13      VAL  62  75.961  -2.611   2.951
  530   HG21  VAL  62          HG21      VAL  62  74.543  -3.150  -0.269
  531   HG22  VAL  62          HG22      VAL  62  72.911  -2.680   0.148
  532   HG23  VAL  62          HG23      VAL  62  73.488  -4.310   0.558
  533    H    CYS  63           HN       CYS  63  73.040  -4.438   5.034
  534    HA   CYS  63           HA       CYS  63  73.588  -2.480   6.975
  535    HB2  CYS  63           HB2      CYS  63  73.438  -4.227   8.559
  536    HB3  CYS  63           HB1      CYS  63  72.424  -4.663   7.168
  537    H    ASP  64           HN       ASP  64  75.236  -3.349   8.713
  538    HA   ASP  64           HA       ASP  64  77.831  -2.552   7.947
  539    HB2  ASP  64           HB2      ASP  64  76.842  -2.391  10.262
  540    HB3  ASP  64           HB1      ASP  64  76.977  -4.118  10.368
  541    H    LYS  65           HN       LYS  65  76.251  -5.607   8.351
  542    HA   LYS  65           HA       LYS  65  78.575  -7.247   8.131
  543    HB2  LYS  65           HB2      LYS  65  75.707  -7.992   7.751
  544    HB3  LYS  65           HB1      LYS  65  77.061  -9.092   7.932
  545    HG2  LYS  65           HG2      LYS  65  75.875  -7.263  10.009
  546    HG3  LYS  65           HG1      LYS  65  75.956  -9.026   9.873
  547    HD2  LYS  65           HD2      LYS  65  78.325  -9.033  10.219
  548    HD3  LYS  65           HD1      LYS  65  78.339  -7.264  10.267
  549    HE2  LYS  65           HE2      LYS  65  76.817  -7.337  12.206
  550    HE3  LYS  65           HE1      LYS  65  76.926  -9.091  12.196
  551    HZ1  LYS  65           HZ1      LYS  65  78.441  -8.096  13.823
  552    HZ2  LYS  65           HZ2      LYS  65  79.198  -7.236  12.599
  553    HZ3  LYS  65           HZ3      LYS  65  79.297  -8.914  12.617
  554    H    CYS  66           HN       CYS  66  75.838  -6.366   6.036
  555    HA   CYS  66           HA       CYS  66  76.455  -7.909   3.775
  556    HB2  CYS  66           HB2      CYS  66  74.965  -5.285   4.039
  557    HB3  CYS  66           HB1      CYS  66  75.199  -6.093   2.501
  558    H    LEU  67           HN       LEU  67  77.379  -4.625   4.652
  559    HA   LEU  67           HA       LEU  67  78.650  -3.799   2.383
  560    HB2  LEU  67           HB2      LEU  67  78.062  -2.765   4.757
  561    HB3  LEU  67           HB1      LEU  67  79.795  -2.973   4.945
  562    HG   LEU  67           HG       LEU  67  78.626  -1.613   2.566
  563   HD11  LEU  67          HD11      LEU  67  77.773  -0.535   4.453
  564   HD12  LEU  67          HD12      LEU  67  79.023   0.503   3.734
  565   HD13  LEU  67          HD13      LEU  67  79.362  -0.431   5.217
  566   HD21  LEU  67          HD21      LEU  67  80.978  -2.274   2.406
  567   HD22  LEU  67          HD22      LEU  67  81.331  -1.407   3.901
  568   HD23  LEU  67          HD23      LEU  67  80.826  -0.519   2.463
  569    H    LYS  68           HN       LYS  68  79.950  -5.731   5.080
  570    HA   LYS  68           HA       LYS  68  82.588  -5.597   3.934
  571    HB2  LYS  68           HB2      LYS  68  83.386  -6.931   5.781
  572    HB3  LYS  68           HB1      LYS  68  82.337  -5.669   6.397
  573    HG2  LYS  68           HG2      LYS  68  80.531  -7.350   6.598
  574    HG3  LYS  68           HG1      LYS  68  81.676  -8.590   6.086
  575    HD2  LYS  68           HD2      LYS  68  83.133  -7.954   7.993
  576    HD3  LYS  68           HD1      LYS  68  81.878  -6.835   8.530
  577    HE2  LYS  68           HE2      LYS  68  81.671  -8.837   9.799
  578    HE3  LYS  68           HE1      LYS  68  80.318  -8.786   8.670
  579    HZ1  LYS  68           HZ1      LYS  68  81.278 -10.992   8.740
  580    HZ2  LYS  68           HZ2      LYS  68  82.788 -10.405   8.429
  581    HZ3  LYS  68           HZ3      LYS  68  81.629 -10.344   7.219
  582    H    PHE  69           HN       PHE  69  79.864  -7.748   3.733
  583    HA   PHE  69           HA       PHE  69  81.105 -10.051   2.834
  584    HB2  PHE  69           HB2      PHE  69  78.540  -8.744   2.414
  585    HB3  PHE  69           HB1      PHE  69  78.839 -10.312   1.737
  586    HD1  PHE  69           HD1      PHE  69  80.362 -10.420   4.847
  587    HD2  PHE  69           HD2      PHE  69  76.539 -10.133   3.046
  588    HE1  PHE  69           HE1      PHE  69  79.337 -11.333   6.881
  589    HE2  PHE  69           HE2      PHE  69  75.492 -11.014   4.991
  590    HZ   PHE  69           HZ       PHE  69  76.878 -11.636   6.987
  591    H    TYR  70           HN       TYR  70  79.668  -7.239   1.289
  592    HA   TYR  70           HA       TYR  70  80.413  -8.199  -1.340
  593    HB2  TYR  70           HB2      TYR  70  78.281  -6.299  -0.408
  594    HB3  TYR  70           HB1      TYR  70  78.677  -6.534  -2.110
  595    HD1  TYR  70           HD1      TYR  70  77.386  -8.187   0.913
  596    HD2  TYR  70           HD2      TYR  70  78.011  -8.499  -3.263
  597    HE1  TYR  70           HE1      TYR  70  76.022 -10.206   0.897
  598    HE2  TYR  70           HE2      TYR  70  76.650 -10.508  -3.334
  599    HH   TYR  70           HH       TYR  70  75.815 -12.229  -1.923
  600    H    SER  71           HN       SER  71  82.287  -6.799   0.448
  601    HA   SER  71           HA       SER  71  82.647  -4.116  -0.280
  602    HB2  SER  71           HB2      SER  71  84.773  -6.132   0.464
  603    HB3  SER  71           HB1      SER  71  84.909  -4.382   0.580
  604    HG   SER  71           HG       SER  71  82.780  -4.894   1.930
  605    H    LYS  72           HN       LYS  72  83.949  -7.115  -1.672
  606    HA   LYS  72           HA       LYS  72  85.221  -5.611  -3.800
  607    HB2  LYS  72           HB2      LYS  72  86.435  -7.455  -2.651
  608    HB3  LYS  72           HB1      LYS  72  85.240  -8.573  -3.256
  609    HG2  LYS  72           HG2      LYS  72  87.256  -8.649  -4.612
  610    HG3  LYS  72           HG1      LYS  72  85.867  -8.095  -5.548
  611    HD2  LYS  72           HD2      LYS  72  86.634  -5.786  -5.330
  612    HD3  LYS  72           HD1      LYS  72  87.994  -6.317  -4.342
  613    HE2  LYS  72           HE2      LYS  72  88.825  -7.641  -6.232
  614    HE3  LYS  72           HE1      LYS  72  87.468  -7.085  -7.208
  615    HZ1  LYS  72           HZ1      LYS  72  88.286  -4.826  -7.039
  616    HZ2  LYS  72           HZ2      LYS  72  89.523  -5.852  -7.598
  617    HZ3  LYS  72           HZ3      LYS  72  89.538  -5.334  -6.019
  618    H    ILE  73           HN       ILE  73  82.850  -8.276  -3.378
  619    HA   ILE  73           HA       ILE  73  82.206  -8.180  -6.081
  620    HB   ILE  73           HB       ILE  73  80.280  -9.571  -5.379
  621   HG12  ILE  73          HG12      ILE  73  81.977  -9.872  -2.917
  622   HG13  ILE  73          HG11      ILE  73  80.376  -9.131  -2.993
  623   HG21  ILE  73          HG21      ILE  73  81.787 -11.605  -5.365
  624   HG22  ILE  73          HG22      ILE  73  83.152 -10.514  -5.123
  625   HG23  ILE  73          HG23      ILE  73  82.204 -10.423  -6.609
  626   HD11  ILE  73          HD11      ILE  73  79.456 -11.244  -3.689
  627   HD12  ILE  73          HD12      ILE  73  80.294 -11.412  -2.127
  628   HD13  ILE  73          HD13      ILE  73  81.066 -11.952  -3.644
  629    H    SER  74           HN       SER  74  81.883  -6.012  -6.031
  630    HA   SER  74           HA       SER  74  79.136  -5.443  -6.448
  631    HB2  SER  74           HB2      SER  74  79.466  -3.163  -5.212
  632    HB3  SER  74           HB1      SER  74  79.181  -4.591  -4.211
  633    HG   SER  74           HG       SER  74  81.067  -4.417  -3.417
  634    H    GLU  75           HN       GLU  75  82.367  -4.314  -6.196
  635    HA   GLU  75           HA       GLU  75  82.523  -2.702  -8.545
  636    HB2  GLU  75           HB2      GLU  75  84.158  -2.496  -6.740
  637    HB3  GLU  75           HB1      GLU  75  84.648  -4.168  -6.954
  638    HG2  GLU  75           HG2      GLU  75  85.503  -3.600  -9.188
  639    HG3  GLU  75           HG1      GLU  75  85.062  -1.916  -8.905
  640    H    TYR  76           HN       TYR  76  82.987  -6.038  -7.733
  641    HA   TYR  76           HA       TYR  76  84.035  -7.299  -9.953
  642    HB2  TYR  76           HB2      TYR  76  83.409  -8.434  -7.870
  643    HB3  TYR  76           HB1      TYR  76  81.704  -8.204  -8.264
  644    HD1  TYR  76           HD2      TYR  76  84.789  -9.539  -9.804
  645    HD2  TYR  76           HD1      TYR  76  80.611  -9.952  -9.265
  646    HE1  TYR  76           HE2      TYR  76  84.855 -11.539 -11.117
  647    HE2  TYR  76           HE1      TYR  76  80.629 -12.007 -10.603
  648    HH   TYR  76           HH       TYR  76  82.024 -12.970 -12.352
  649    H    ARG  77           HN       ARG  77  83.600  -7.011 -11.967
  650    HA   ARG  77           HA       ARG  77  80.913  -7.057 -13.059
  651    HB2  ARG  77           HB2      ARG  77  82.761  -4.702 -13.162
  652    HB3  ARG  77           HB1      ARG  77  81.523  -4.979 -14.380
  653    HG2  ARG  77           HG2      ARG  77  79.792  -4.832 -12.733
  654    HG3  ARG  77           HG1      ARG  77  80.988  -4.747 -11.436
  655    HD2  ARG  77           HD2      ARG  77  80.782  -2.908 -13.696
  656    HD3  ARG  77           HD1      ARG  77  80.020  -2.575 -12.115
  657    HE   ARG  77           HE       ARG  77  82.771  -3.203 -11.845
  658   HH11  ARG  77          HH11      ARG  77  80.719  -0.446 -12.762
  659   HH12  ARG  77          HH12      ARG  77  81.883   0.717 -12.350
  660   HH21  ARG  77          HH21      ARG  77  84.348  -1.630 -11.356
  661   HH22  ARG  77          HH22      ARG  77  84.016   0.034 -11.528
  662    H    HIS  78           HN       HIS  78  83.551  -8.298 -12.812
  663    HA   HIS  78           HA       HIS  78  84.652  -8.250 -15.478
  664    HB2  HIS  78           HB2      HIS  78  86.341  -7.786 -13.964
  665    HB3  HIS  78           HB1      HIS  78  85.607  -8.762 -12.707
  666    HD1  HIS  78           HD1      HIS  78  88.179  -8.893 -15.409
  667    HD2  HIS  78           HD2      HIS  78  86.058 -11.226 -12.838
  668    HE1  HIS  78           HE1      HIS  78  89.462 -11.059 -15.392
  669    H    TYR  79           HN       TYR  79  84.690 -10.084 -16.639
  670    HA   TYR  79           HA       TYR  79  82.993 -12.210 -15.601
  671    HB2  TYR  79           HB2      TYR  79  82.977 -10.857 -18.282
  672    HB3  TYR  79           HB1      TYR  79  82.271 -12.448 -18.039
  673    HD1  TYR  79           HD2      TYR  79  82.119  -9.253 -15.968
  674    HD2  TYR  79           HD1      TYR  79  80.011 -12.292 -18.091
  675    HE1  TYR  79           HE2      TYR  79  80.014  -8.271 -15.291
  676    HE2  TYR  79           HE1      TYR  79  77.891 -11.305 -17.400
  677    HH   TYR  79           HH       TYR  79  77.718  -8.203 -16.012
  678    H    SER  80           HN       SER  80  83.260 -14.256 -16.742
  679    HA   SER  80           HA       SER  80  84.454 -16.054 -17.161
  680    HB2  SER  80           HB2      SER  80  86.032 -15.906 -19.203
  681    HB3  SER  80           HB1      SER  80  84.328 -15.536 -19.450
  682    HG   SER  80           HG       SER  80  85.908 -13.428 -18.718
  Start of MODEL   19
    1    H1   GLY  -1           HT1      GLY  -1  56.909  -0.839   5.232
    2    H2   GLY  -1           HT2      GLY  -1  56.404  -0.658   3.651
    3    H3   GLY  -1           HT3      GLY  -1  57.218   0.620   4.419
    4    HA2  GLY  -1           HA1      GLY  -1  58.684  -0.562   2.901
    5    HA3  GLY  -1           HA2      GLY  -1  59.193  -0.792   4.572
    6    H    ALA   0           HN       ALA   0  60.252  -2.705   3.724
    7    HA   ALA   0           HA       ALA   0  60.542  -4.897   3.648
    8    HB1  ALA   0           HB1      ALA   0  58.906  -6.468   4.507
    9    HB2  ALA   0           HB2      ALA   0  57.644  -5.241   4.410
   10    HB3  ALA   0           HB3      ALA   0  58.976  -5.043   5.546
   11    H    MET   1           HN       MET   1  57.192  -4.843   2.472
   12    HA   MET   1           HA       MET   1  58.220  -5.856  -0.092
   13    HB2  MET   1           HB2      MET   1  56.514  -7.304   1.008
   14    HB3  MET   1           HB1      MET   1  55.394  -5.947   1.009
   15    HG2  MET   1           HG2      MET   1  56.087  -6.006  -1.603
   16    HG3  MET   1           HG1      MET   1  56.216  -7.713  -1.201
   17    HE1  MET   1           HE1      MET   1  52.418  -5.113  -0.885
   18    HE2  MET   1           HE2      MET   1  54.083  -4.528  -1.159
   19    HE3  MET   1           HE3      MET   1  53.597  -5.112   0.412
   20    H    PHE   2           HN       PHE   2  58.455  -4.118  -1.468
   21    HA   PHE   2           HA       PHE   2  56.520  -2.050  -1.150
   22    HB2  PHE   2           HB2      PHE   2  59.175  -1.764  -1.127
   23    HB3  PHE   2           HB1      PHE   2  58.956  -1.906  -2.831
   24    HD1  PHE   2           HD1      PHE   2  56.175  -0.292  -1.483
   25    HD2  PHE   2           HD2      PHE   2  60.154   0.239  -2.618
   26    HE1  PHE   2           HE1      PHE   2  55.762   2.140  -1.680
   27    HE2  PHE   2           HE2      PHE   2  59.848   2.607  -2.878
   28    HZ   PHE   2           HZ       PHE   2  57.602   3.623  -2.385
   29    H    GLN   3           HN       GLN   3  55.026  -1.914  -2.633
   30    HA   GLN   3           HA       GLN   3  55.339  -3.362  -5.170
   31    HB2  GLN   3           HB2      GLN   3  52.760  -3.278  -5.197
   32    HB3  GLN   3           HB1      GLN   3  53.538  -4.420  -4.121
   33    HG2  GLN   3           HG2      GLN   3  51.649  -3.358  -3.011
   34    HG3  GLN   3           HG1      GLN   3  53.155  -2.908  -2.225
   35   HE21  GLN   3          HE21      GLN   3  51.907  -1.607  -5.210
   36   HE22  GLN   3          HE22      GLN   3  51.826  -0.004  -4.658
   37    H    ASP   4           HN       ASP   4  54.535  -2.590  -7.116
   38    HA   ASP   4           HA       ASP   4  54.962   0.235  -7.452
   39    HB2  ASP   4           HB2      ASP   4  54.803  -0.235  -9.807
   40    HB3  ASP   4           HB1      ASP   4  55.719  -1.555  -9.103
   41    HA   PRO   5           HA       PRO   5  53.495   1.611 -10.119
   42    HB2  PRO   5           HB2      PRO   5  52.767   4.102  -9.351
   43    HB3  PRO   5           HB1      PRO   5  51.816   2.929 -10.284
   44    HG2  PRO   5           HG2      PRO   5  51.696   3.414  -7.333
   45    HG3  PRO   5           HG1      PRO   5  50.358   3.476  -8.502
   46    HD2  PRO   5           HD2      PRO   5  50.700   1.260  -7.147
   47    HD3  PRO   5           HD1      PRO   5  50.476   1.163  -8.903
   48    H    GLN   6           HN       GLN   6  53.759   1.975  -7.002
   49    HA   GLN   6           HA       GLN   6  56.024   3.763  -6.701
   50    HB2  GLN   6           HB2      GLN   6  55.165   1.555  -4.842
   51    HB3  GLN   6           HB1      GLN   6  56.271   2.851  -4.420
   52    HG2  GLN   6           HG2      GLN   6  54.573   4.487  -4.541
   53    HG3  GLN   6           HG1      GLN   6  53.448   3.367  -5.309
   54   HE21  GLN   6          HE21      GLN   6  54.048   1.169  -3.516
   55   HE22  GLN   6          HE22      GLN   6  53.342   1.601  -2.006
   56    H    GLU   7           HN       GLU   7  56.762   2.739  -8.513
   57    HA   GLU   7           HA       GLU   7  57.841   0.394  -9.201
   58    HB2  GLU   7           HB2      GLU   7  57.456   2.239 -10.679
   59    HB3  GLU   7           HB1      GLU   7  58.782   3.121  -9.963
   60    HG2  GLU   7           HG2      GLU   7  60.359   1.645 -10.887
   61    HG3  GLU   7           HG1      GLU   7  59.101   0.549 -11.474
   62    H    ARG   8           HN       ARG   8  59.271   2.352  -7.013
   63    HA   ARG   8           HA       ARG   8  61.111   2.119  -5.588
   64    HB2  ARG   8           HB2      ARG   8  61.544  -0.599  -6.916
   65    HB3  ARG   8           HB1      ARG   8  62.231  -0.051  -5.395
   66    HG2  ARG   8           HG2      ARG   8  60.446  -0.495  -4.226
   67    HG3  ARG   8           HG1      ARG   8  59.289  -0.023  -5.495
   68    HD2  ARG   8           HD2      ARG   8  60.898  -2.571  -5.254
   69    HD3  ARG   8           HD1      ARG   8  59.166  -2.394  -4.965
   70    HE   ARG   8           HE       ARG   8  60.262  -1.727  -7.577
   71   HH11  ARG   8          HH11      ARG   8  58.160  -3.857  -5.638
   72   HH12  ARG   8          HH12      ARG   8  57.537  -4.655  -7.014
   73   HH21  ARG   8          HH21      ARG   8  59.361  -2.824  -9.394
   74   HH22  ARG   8          HH22      ARG   8  58.222  -4.071  -9.160
   75    HA   PRO   9           HA       PRO   9  64.429   3.657  -8.337
   76    HB2  PRO   9           HB2      PRO   9  65.897   4.644  -6.276
   77    HB3  PRO   9           HB1      PRO   9  64.627   5.602  -6.940
   78    HG2  PRO   9           HG2      PRO   9  64.818   4.157  -4.446
   79    HG3  PRO   9           HG1      PRO   9  63.696   5.448  -4.896
   80    HD2  PRO   9           HD2      PRO   9  63.192   2.727  -4.595
   81    HD3  PRO   9           HD1      PRO   9  62.063   3.900  -5.269
   82    H    ARG  10           HN       ARG  10  67.054   3.817  -7.443
   83    HA   ARG  10           HA       ARG  10  67.665   1.327  -6.057
   84    HB2  ARG  10           HB2      ARG  10  68.870   2.479  -8.503
   85    HB3  ARG  10           HB1      ARG  10  69.921   1.688  -7.340
   86    HG2  ARG  10           HG2      ARG  10  69.386   0.095  -8.874
   87    HG3  ARG  10           HG1      ARG  10  68.376  -0.294  -7.504
   88    HD2  ARG  10           HD2      ARG  10  66.487   0.884  -8.626
   89    HD3  ARG  10           HD1      ARG  10  67.512   1.091 -10.045
   90    HE   ARG  10           HE       ARG  10  67.621  -1.318 -10.199
   91   HH11  ARG  10          HH11      ARG  10  64.977   0.021  -8.232
   92   HH12  ARG  10          HH12      ARG  10  63.912  -1.268  -8.517
   93   HH21  ARG  10          HH21      ARG  10  66.160  -3.164 -10.506
   94   HH22  ARG  10          HH22      ARG  10  64.605  -3.131  -9.828
   95    H    LYS  11           HN       LYS  11  67.486   4.555  -5.564
   96    HA   LYS  11           HA       LYS  11  69.901   4.412  -3.954
   97    HB2  LYS  11           HB2      LYS  11  68.573   6.919  -4.940
   98    HB3  LYS  11           HB1      LYS  11  70.022   6.739  -4.003
   99    HG2  LYS  11           HG2      LYS  11  71.084   5.446  -5.822
  100    HG3  LYS  11           HG1      LYS  11  69.674   5.808  -6.823
  101    HD2  LYS  11           HD2      LYS  11  70.094   8.185  -6.498
  102    HD3  LYS  11           HD1      LYS  11  71.516   7.731  -5.541
  103    HE2  LYS  11           HE2      LYS  11  72.555   6.697  -7.447
  104    HE3  LYS  11           HE1      LYS  11  71.110   6.949  -8.422
  105    HZ1  LYS  11           HZ1      LYS  11  72.907   9.078  -7.367
  106    HZ2  LYS  11           HZ2      LYS  11  71.475   9.342  -8.212
  107    HZ3  LYS  11           HZ3      LYS  11  72.750   8.571  -8.973
  108    H    LEU  12           HN       LEU  12  69.760   5.059  -1.852
  109    HA   LEU  12           HA       LEU  12  67.443   4.441  -0.499
  110    HB2  LEU  12           HB2      LEU  12  69.531   4.109   0.514
  111    HB3  LEU  12           HB1      LEU  12  69.974   5.795   0.350
  112    HG   LEU  12           HG       LEU  12  68.302   6.402   1.993
  113   HD11  LEU  12          HD11      LEU  12  67.200   4.696   3.298
  114   HD12  LEU  12          HD12      LEU  12  67.987   3.444   2.323
  115   HD13  LEU  12          HD13      LEU  12  66.750   4.487   1.585
  116   HD21  LEU  12          HD21      LEU  12  69.993   4.176   2.980
  117   HD22  LEU  12          HD22      LEU  12  69.437   5.587   3.905
  118   HD23  LEU  12          HD23      LEU  12  70.614   5.770   2.592
  119    HA   PRO  13           HA       PRO  13  66.692   9.120   0.485
  120    HB2  PRO  13           HB2      PRO  13  67.627  10.976  -1.294
  121    HB3  PRO  13           HB1      PRO  13  68.576  10.382   0.090
  122    HG2  PRO  13           HG2      PRO  13  68.696   9.480  -2.757
  123    HG3  PRO  13           HG1      PRO  13  70.027   9.966  -1.682
  124    HD2  PRO  13           HD2      PRO  13  69.423   7.382  -2.058
  125    HD3  PRO  13           HD1      PRO  13  69.932   7.971  -0.480
  126    H    GLN  14           HN       GLN  14  66.958   8.253  -2.882
  127    HA   GLN  14           HA       GLN  14  64.588   9.497  -3.780
  128    HB2  GLN  14           HB2      GLN  14  66.136   7.166  -4.884
  129    HB3  GLN  14           HB1      GLN  14  64.776   7.924  -5.699
  130    HG2  GLN  14           HG2      GLN  14  65.963  10.020  -5.790
  131    HG3  GLN  14           HG1      GLN  14  67.312   9.314  -4.908
  132   HE21  GLN  14          HE21      GLN  14  65.536   7.628  -7.439
  133   HE22  GLN  14          HE22      GLN  14  66.851   7.631  -8.560
  134    H    LEU  15           HN       LEU  15  65.274   6.244  -2.509
  135    HA   LEU  15           HA       LEU  15  62.767   5.165  -2.917
  136    HB2  LEU  15           HB2      LEU  15  64.785   3.926  -2.344
  137    HB3  LEU  15           HB1      LEU  15  64.807   4.708  -0.813
  138    HG   LEU  15           HG       LEU  15  62.772   3.702  -0.139
  139   HD11  LEU  15          HD11      LEU  15  62.905   2.196  -2.777
  140   HD12  LEU  15          HD12      LEU  15  61.734   3.468  -2.396
  141   HD13  LEU  15          HD13      LEU  15  61.708   1.952  -1.505
  142   HD21  LEU  15          HD21      LEU  15  64.775   1.829  -1.269
  143   HD22  LEU  15          HD22      LEU  15  63.636   1.444   0.041
  144   HD23  LEU  15          HD23      LEU  15  64.890   2.703   0.247
  145    H    CYS  16           HN       CYS  16  64.149   6.961  -0.289
  146    HA   CYS  16           HA       CYS  16  62.031   6.740   1.495
  147    HB2  CYS  16           HB2      CYS  16  63.975   9.043   1.113
  148    HB3  CYS  16           HB1      CYS  16  62.943   8.847   2.512
  149    HG   CYS  16           HG       CYS  16  65.457   6.753   1.537
  150    H    THR  17           HN       THR  17  62.589   8.980  -1.158
  151    HA   THR  17           HA       THR  17  60.433  10.707  -0.967
  152    HB   THR  17           HB       THR  17  61.950   9.516  -3.218
  153    HG1  THR  17           HG1      THR  17  62.924  11.517  -3.325
  154   HG21  THR  17          HG21      THR  17  60.972  11.249  -4.746
  155   HG22  THR  17          HG22      THR  17  59.749  11.581  -3.500
  156   HG23  THR  17          HG23      THR  17  59.885   9.970  -4.233
  157    H    GLU  18           HN       GLU  18  60.713   7.574  -2.465
  158    HA   GLU  18           HA       GLU  18  58.211   7.315  -3.600
  159    HB2  GLU  18           HB2      GLU  18  60.287   5.509  -2.672
  160    HB3  GLU  18           HB1      GLU  18  58.865   4.873  -3.508
  161    HG2  GLU  18           HG2      GLU  18  60.766   7.004  -4.504
  162    HG3  GLU  18           HG1      GLU  18  60.841   5.344  -5.022
  163    H    LEU  19           HN       LEU  19  59.435   5.858  -0.558
  164    HA   LEU  19           HA       LEU  19  56.937   5.170   0.503
  165    HB2  LEU  19           HB2      LEU  19  59.642   5.622   1.586
  166    HB3  LEU  19           HB1      LEU  19  58.378   5.268   2.685
  167    HG   LEU  19           HG       LEU  19  58.039   3.199   1.061
  168   HD11  LEU  19          HD11      LEU  19  60.133   2.351   0.241
  169   HD12  LEU  19          HD12      LEU  19  60.906   3.874   0.689
  170   HD13  LEU  19          HD13      LEU  19  59.654   3.850  -0.554
  171   HD21  LEU  19          HD21      LEU  19  59.520   1.911   2.502
  172   HD22  LEU  19          HD22      LEU  19  58.520   3.071   3.407
  173   HD23  LEU  19          HD23      LEU  19  60.218   3.440   3.053
  174    H    GLN  20           HN       GLN  20  57.983   8.240  -0.081
  175    HA   GLN  20           HA       GLN  20  57.286  10.297   0.559
  176    HB2  GLN  20           HB2      GLN  20  55.146   8.574   1.686
  177    HB3  GLN  20           HB1      GLN  20  55.002  10.347   1.758
  178    HG2  GLN  20           HG2      GLN  20  55.158  10.340  -0.728
  179    HG3  GLN  20           HG1      GLN  20  55.169   8.582  -0.694
  180   HE21  GLN  20          HE21      GLN  20  53.194   8.435   1.455
  181   HE22  GLN  20          HE22      GLN  20  51.680   8.833   0.758
  182    H    THR  21           HN       THR  21  59.148   8.890   2.231
  183    HA   THR  21           HA       THR  21  58.707  10.287   4.741
  184    HB   THR  21           HB       THR  21  57.887   7.909   4.978
  185    HG1  THR  21           HG1      THR  21  58.858   7.669   6.964
  186   HG21  THR  21          HG21      THR  21  59.529   6.089   5.087
  187   HG22  THR  21          HG22      THR  21  60.807   7.215   4.644
  188   HG23  THR  21          HG23      THR  21  59.537   6.832   3.481
  189    H    THR  22           HN       THR  22  61.017   9.338   6.042
  190    HA   THR  22           HA       THR  22  63.176   9.958   4.132
  191    HB   THR  22           HB       THR  22  63.571  10.752   6.955
  192    HG1  THR  22           HG1      THR  22  61.540  11.733   5.291
  193   HG21  THR  22          HG21      THR  22  64.652  12.706   5.793
  194   HG22  THR  22          HG22      THR  22  64.224  11.949   4.249
  195   HG23  THR  22          HG23      THR  22  65.332  11.150   5.347
  196    H    ILE  23           HN       ILE  23  65.365   9.363   5.253
  197    HA   ILE  23           HA       ILE  23  65.714   6.715   5.443
  198    HB   ILE  23           HB       ILE  23  67.362   8.745   6.847
  199   HG12  ILE  23          HG12      ILE  23  67.145   7.988   3.969
  200   HG13  ILE  23          HG11      ILE  23  67.012   9.560   4.690
  201   HG21  ILE  23          HG21      ILE  23  69.224   7.143   6.241
  202   HG22  ILE  23          HG22      ILE  23  68.006   6.067   5.545
  203   HG23  ILE  23          HG23      ILE  23  68.006   6.389   7.280
  204   HD11  ILE  23          HD11      ILE  23  69.090   9.341   3.490
  205   HD12  ILE  23          HD12      ILE  23  69.440   7.894   4.434
  206   HD13  ILE  23          HD13      ILE  23  69.419   9.477   5.239
  207    H    HIS  24           HN       HIS  24  64.804   8.945   7.836
  208    HA   HIS  24           HA       HIS  24  65.827   7.777  10.186
  209    HB2  HIS  24           HB2      HIS  24  63.717   9.912   9.937
  210    HB3  HIS  24           HB1      HIS  24  64.900   9.778  11.206
  211    HD1  HIS  24           HD1      HIS  24  67.296   9.389   9.151
  212    HD2  HIS  24           HD2      HIS  24  64.492  12.341   9.210
  213    HE1  HIS  24           HE1      HIS  24  68.035  10.960   7.315
  214    H    ASP  25           HN       ASP  25  63.131   7.258   8.233
  215    HA   ASP  25           HA       ASP  25  61.514   6.182  10.453
  216    HB2  ASP  25           HB2      ASP  25  60.608   8.306   9.538
  217    HB3  ASP  25           HB1      ASP  25  60.599   7.572   7.969
  218    H    ILE  26           HN       ILE  26  62.413   5.974   7.075
  219    HA   ILE  26           HA       ILE  26  60.897   3.874   6.142
  220    HB   ILE  26           HB       ILE  26  62.244   5.238   4.669
  221   HG12  ILE  26          HG12      ILE  26  63.354   2.485   4.561
  222   HG13  ILE  26          HG11      ILE  26  61.739   2.676   4.049
  223   HG21  ILE  26          HG21      ILE  26  64.671   4.977   4.527
  224   HG22  ILE  26          HG22      ILE  26  64.626   3.863   5.894
  225   HG23  ILE  26          HG23      ILE  26  64.170   5.552   6.121
  226   HD11  ILE  26          HD11      ILE  26  62.609   4.295   2.297
  227   HD12  ILE  26          HD12      ILE  26  63.179   2.613   2.186
  228   HD13  ILE  26          HD13      ILE  26  64.234   3.852   2.853
  229    H    ILE  27           HN       ILE  27  60.920   1.711   6.143
  230    HA   ILE  27           HA       ILE  27  62.936   0.421   7.742
  231    HB   ILE  27           HB       ILE  27  60.304  -0.612   6.705
  232   HG12  ILE  27          HG12      ILE  27  59.860   1.096   8.346
  233   HG13  ILE  27          HG11      ILE  27  59.540  -0.491   9.033
  234   HG21  ILE  27          HG21      ILE  27  61.949  -2.334   7.014
  235   HG22  ILE  27          HG22      ILE  27  60.662  -2.480   8.225
  236   HG23  ILE  27          HG23      ILE  27  62.236  -1.796   8.673
  237   HD11  ILE  27          HD11      ILE  27  60.612   0.967  10.648
  238   HD12  ILE  27          HD12      ILE  27  61.965   1.215   9.550
  239   HD13  ILE  27          HD13      ILE  27  61.673  -0.385  10.237
  240    H    LEU  28           HN       LEU  28  64.555  -0.087   6.789
  241    HA   LEU  28           HA       LEU  28  64.269  -1.195   4.142
  242    HB2  LEU  28           HB2      LEU  28  65.800   0.905   5.009
  243    HB3  LEU  28           HB1      LEU  28  66.930  -0.438   4.875
  244    HG   LEU  28           HG       LEU  28  66.298  -0.835   2.608
  245   HD11  LEU  28          HD11      LEU  28  64.079  -0.455   2.349
  246   HD12  LEU  28          HD12      LEU  28  64.618   1.165   1.823
  247   HD13  LEU  28          HD13      LEU  28  64.124   0.844   3.509
  248   HD21  LEU  28          HD21      LEU  28  67.954   0.938   3.055
  249   HD22  LEU  28          HD22      LEU  28  66.631   2.099   3.107
  250   HD23  LEU  28          HD23      LEU  28  66.994   1.241   1.604
  251    H    GLU  29           HN       GLU  29  65.061  -3.399   4.040
  252    HA   GLU  29           HA       GLU  29  66.557  -3.933   6.491
  253    HB2  GLU  29           HB2      GLU  29  65.910  -6.311   6.226
  254    HB3  GLU  29           HB1      GLU  29  64.787  -5.187   7.070
  255    HG2  GLU  29           HG2      GLU  29  63.725  -5.034   4.874
  256    HG3  GLU  29           HG1      GLU  29  64.720  -6.480   4.489
  257    H    CYS  30           HN       CYS  30  67.913  -6.333   6.292
  258    HA   CYS  30           HA       CYS  30  69.464  -5.791   4.052
  259    HB2  CYS  30           HB2      CYS  30  70.302  -6.957   6.224
  260    HB3  CYS  30           HB1      CYS  30  69.528  -8.377   5.576
  261    H    VAL  31           HN       VAL  31  69.294  -6.467   2.280
  262    HA   VAL  31           HA       VAL  31  67.238  -8.000   1.091
  263    HB   VAL  31           HB       VAL  31  68.438  -6.342  -0.248
  264   HG11  VAL  31          HG11      VAL  31  70.724  -6.616  -0.723
  265   HG12  VAL  31          HG12      VAL  31  70.861  -7.719   0.668
  266   HG13  VAL  31          HG13      VAL  31  70.357  -6.004   0.891
  267   HG21  VAL  31          HG21      VAL  31  67.949  -8.228  -1.598
  268   HG22  VAL  31          HG22      VAL  31  69.460  -9.002  -1.093
  269   HG23  VAL  31          HG23      VAL  31  69.497  -7.525  -2.058
  270    H    TYR  32           HN       TYR  32  70.344  -8.671   2.337
  271    HA   TYR  32           HA       TYR  32  70.419 -11.326   1.228
  272    HB2  TYR  32           HB2      TYR  32  72.588  -9.888   2.732
  273    HB3  TYR  32           HB1      TYR  32  72.756 -11.388   1.823
  274    HD1  TYR  32           HD2      TYR  32  71.212 -10.816  -0.653
  275    HD2  TYR  32           HD1      TYR  32  73.851  -8.290   1.598
  276    HE1  TYR  32           HE2      TYR  32  71.599  -9.590  -2.584
  277    HE2  TYR  32           HE1      TYR  32  74.271  -6.937  -0.396
  278    HH   TYR  32           HH       TYR  32  72.441  -7.373  -3.330
  279    H    CYS  33           HN       CYS  33  70.486  -9.728   4.439
  280    HA   CYS  33           HA       CYS  33  70.485 -12.387   5.707
  281    HB2  CYS  33           HB2      CYS  33  70.895  -9.759   7.131
  282    HB3  CYS  33           HB1      CYS  33  71.214 -11.379   7.694
  283    H    LYS  34           HN       LYS  34  68.352  -9.984   4.874
  284    HA   LYS  34           HA       LYS  34  66.320  -9.625   5.126
  285    HB2  LYS  34           HB2      LYS  34  66.256 -12.266   6.480
  286    HB3  LYS  34           HB1      LYS  34  64.812 -11.325   6.141
  287    HG2  LYS  34           HG2      LYS  34  65.075 -12.921   4.446
  288    HG3  LYS  34           HG1      LYS  34  65.444 -11.367   3.712
  289    HD2  LYS  34           HD2      LYS  34  67.807 -11.899   3.896
  290    HD3  LYS  34           HD1      LYS  34  67.412 -13.411   4.699
  291    HE2  LYS  34           HE2      LYS  34  66.148 -14.052   2.614
  292    HE3  LYS  34           HE1      LYS  34  66.793 -12.594   1.859
  293    HZ1  LYS  34           HZ1      LYS  34  68.161 -14.442   1.263
  294    HZ2  LYS  34           HZ2      LYS  34  68.322 -14.913   2.866
  295    HZ3  LYS  34           HZ3      LYS  34  69.050 -13.494   2.348
  296    H    GLN  35           HN       GLN  35  68.156  -9.208   8.003
  297    HA   GLN  35           HA       GLN  35  65.777  -8.496   9.361
  298    HB2  GLN  35           HB2      GLN  35  67.115  -8.055  11.197
  299    HB3  GLN  35           HB1      GLN  35  67.409  -9.712  10.700
  300    HG2  GLN  35           HG2      GLN  35  69.176  -7.418   9.985
  301    HG3  GLN  35           HG1      GLN  35  69.395  -8.274  11.526
  302   HE21  GLN  35          HE21      GLN  35  68.682 -10.816  10.085
  303   HE22  GLN  35          HE22      GLN  35  70.082 -11.170   9.165
  304    H    GLN  36           HN       GLN  36  65.396  -6.443  10.103
  305    HA   GLN  36           HA       GLN  36  65.813  -4.307   8.471
  306    HB2  GLN  36           HB2      GLN  36  64.275  -4.836  10.570
  307    HB3  GLN  36           HB1      GLN  36  65.525  -3.895  11.371
  308    HG2  GLN  36           HG2      GLN  36  65.179  -2.182   9.544
  309    HG3  GLN  36           HG1      GLN  36  63.790  -3.208   9.153
  310   HE21  GLN  36          HE21      GLN  36  65.117  -1.097  11.598
  311   HE22  GLN  36          HE22      GLN  36  63.650  -0.788  12.423
  312    H    LEU  37           HN       LEU  37  67.538  -3.052   8.146
  313    HA   LEU  37           HA       LEU  37  69.985  -3.257   9.509
  314    HB2  LEU  37           HB2      LEU  37  68.806  -1.328   7.576
  315    HB3  LEU  37           HB1      LEU  37  70.116  -0.849   8.590
  316    HG   LEU  37           HG       LEU  37  71.407  -2.782   7.797
  317   HD11  LEU  37          HD11      LEU  37  69.133  -3.037   5.859
  318   HD12  LEU  37          HD12      LEU  37  69.693  -4.231   7.025
  319   HD13  LEU  37          HD13      LEU  37  70.710  -3.793   5.650
  320   HD21  LEU  37          HD21      LEU  37  70.531  -0.749   5.768
  321   HD22  LEU  37          HD22      LEU  37  71.987  -1.739   5.649
  322   HD23  LEU  37          HD23      LEU  37  71.814  -0.570   6.961
  323    H    LEU  38           HN       LEU  38  70.964  -2.235  10.979
  324    HA   LEU  38           HA       LEU  38  69.687  -0.841  13.004
  325    HB2  LEU  38           HB2      LEU  38  72.190  -1.935  12.350
  326    HB3  LEU  38           HB1      LEU  38  72.418  -0.251  12.406
  327    HG   LEU  38           HG       LEU  38  71.114  -1.655  14.685
  328   HD11  LEU  38          HD11      LEU  38  73.288  -2.629  14.295
  329   HD12  LEU  38          HD12      LEU  38  73.316  -1.662  15.780
  330   HD13  LEU  38          HD13      LEU  38  74.032  -1.032  14.286
  331   HD21  LEU  38          HD21      LEU  38  70.806   0.765  14.591
  332   HD22  LEU  38          HD22      LEU  38  72.555   0.984  14.476
  333   HD23  LEU  38          HD23      LEU  38  71.845   0.325  15.948
  334    H    ARG  39           HN       ARG  39  69.275   1.367  13.041
  335    HA   ARG  39           HA       ARG  39  68.988   2.816  10.736
  336    HB2  ARG  39           HB2      ARG  39  67.928   3.283  12.934
  337    HB3  ARG  39           HB1      ARG  39  69.443   4.004  13.464
  338    HG2  ARG  39           HG2      ARG  39  68.071   5.811  12.796
  339    HG3  ARG  39           HG1      ARG  39  69.246   5.556  11.509
  340    HD2  ARG  39           HD2      ARG  39  67.016   5.949  10.588
  341    HD3  ARG  39           HD1      ARG  39  67.583   4.330  10.198
  342    HE   ARG  39           HE       ARG  39  66.027   4.467  12.593
  343   HH11  ARG  39          HH11      ARG  39  65.692   4.340   9.070
  344   HH12  ARG  39          HH12      ARG  39  64.280   3.407   9.064
  345   HH21  ARG  39          HH21      ARG  39  64.018   3.231  12.613
  346   HH22  ARG  39          HH22      ARG  39  63.267   2.786  11.186
  347    H    ARG  40           HN       ARG  40  71.977   2.375  12.531
  348    HA   ARG  40           HA       ARG  40  73.249   4.784  11.745
  349    HB2  ARG  40           HB2      ARG  40  74.366   2.131  12.671
  350    HB3  ARG  40           HB1      ARG  40  75.211   3.663  12.602
  351    HG2  ARG  40           HG2      ARG  40  72.844   3.095  14.363
  352    HG3  ARG  40           HG1      ARG  40  74.526   3.030  14.885
  353    HD2  ARG  40           HD2      ARG  40  74.784   5.392  14.403
  354    HD3  ARG  40           HD1      ARG  40  73.135   5.467  13.778
  355    HE   ARG  40           HE       ARG  40  73.035   4.440  16.349
  356   HH11  ARG  40          HH11      ARG  40  73.944   7.489  14.846
  357   HH12  ARG  40          HH12      ARG  40  73.401   8.440  16.157
  358   HH21  ARG  40          HH21      ARG  40  72.307   5.754  18.144
  359   HH22  ARG  40          HH22      ARG  40  72.466   7.430  18.057
  360    H    GLU  41           HN       GLU  41  73.283   1.383  10.809
  361    HA   GLU  41           HA       GLU  41  75.023   1.433   8.586
  362    HB2  GLU  41           HB2      GLU  41  72.663  -0.253   9.411
  363    HB3  GLU  41           HB1      GLU  41  73.687  -0.650   8.057
  364    HG2  GLU  41           HG2      GLU  41  73.903  -1.618  10.515
  365    HG3  GLU  41           HG1      GLU  41  75.281  -1.535   9.375
  366    H    VAL  42           HN       VAL  42  71.606   1.925   8.973
  367    HA   VAL  42           HA       VAL  42  70.922   2.072   6.224
  368    HB   VAL  42           HB       VAL  42  69.429   3.727   8.291
  369   HG11  VAL  42          HG11      VAL  42  68.483   2.187   5.906
  370   HG12  VAL  42          HG12      VAL  42  68.830   3.926   5.879
  371   HG13  VAL  42          HG13      VAL  42  67.508   3.288   6.879
  372   HG21  VAL  42          HG21      VAL  42  69.030   0.802   7.726
  373   HG22  VAL  42          HG22      VAL  42  68.032   1.799   8.784
  374   HG23  VAL  42          HG23      VAL  42  69.716   1.465   9.206
  375    H    TYR  43           HN       TYR  43  71.860   4.673   8.526
  376    HA   TYR  43           HA       TYR  43  71.736   6.745   6.652
  377    HB2  TYR  43           HB2      TYR  43  73.457   6.492   9.103
  378    HB3  TYR  43           HB1      TYR  43  73.414   7.954   8.105
  379    HD1  TYR  43           HD2      TYR  43  70.689   8.238   7.446
  380    HD2  TYR  43           HD1      TYR  43  72.385   6.896  11.070
  381    HE1  TYR  43           HE2      TYR  43  68.668   8.869   8.583
  382    HE2  TYR  43           HE1      TYR  43  70.331   7.536  12.269
  383    HH   TYR  43           HH       TYR  43  68.389   9.064  11.936
  384    H    ASP  44           HN       ASP  44  74.298   4.436   7.278
  385    HA   ASP  44           HA       ASP  44  76.417   5.642   5.984
  386    HB2  ASP  44           HB2      ASP  44  75.611   2.750   6.168
  387    HB3  ASP  44           HB1      ASP  44  77.101   3.254   5.512
  388    H    PHE  45           HN       PHE  45  73.801   3.867   4.790
  389    HA   PHE  45           HA       PHE  45  74.681   3.286   2.245
  390    HB2  PHE  45           HB2      PHE  45  72.467   2.793   3.770
  391    HB3  PHE  45           HB1      PHE  45  71.904   3.982   2.630
  392    HD1  PHE  45           HD2      PHE  45  73.424   0.634   2.919
  393    HD2  PHE  45           HD1      PHE  45  71.522   3.554   0.472
  394    HE1  PHE  45           HE2      PHE  45  73.002  -1.058   1.179
  395    HE2  PHE  45           HE1      PHE  45  71.152   1.877  -1.247
  396    HZ   PHE  45           HZ       PHE  45  71.835  -0.402  -0.905
  397    H    ALA  46           HN       ALA  46  72.676   6.062   3.355
  398    HA   ALA  46           HA       ALA  46  72.937   7.368   0.764
  399    HB1  ALA  46           HB1      ALA  46  71.466   9.106   1.632
  400    HB2  ALA  46           HB2      ALA  46  71.492   8.325   3.216
  401    HB3  ALA  46           HB3      ALA  46  70.764   7.510   1.826
  402    H    ARG  47           HN       ARG  47  74.532   7.524   3.850
  403    HA   ARG  47           HA       ARG  47  75.490  10.184   3.478
  404    HB2  ARG  47           HB2      ARG  47  75.981   7.958   5.384
  405    HB3  ARG  47           HB1      ARG  47  77.286   9.105   5.251
  406    HG2  ARG  47           HG2      ARG  47  75.716   9.559   7.113
  407    HG3  ARG  47           HG1      ARG  47  75.874  10.902   5.991
  408    HD2  ARG  47           HD2      ARG  47  73.762  10.343   4.964
  409    HD3  ARG  47           HD1      ARG  47  73.633   8.883   5.941
  410    HE   ARG  47           HE       ARG  47  73.687  10.559   7.868
  411   HH11  ARG  47          HH11      ARG  47  72.182  11.311   4.736
  412   HH12  ARG  47          HH12      ARG  47  70.911  12.210   5.432
  413   HH21  ARG  47          HH21      ARG  47  71.893  11.816   8.772
  414   HH22  ARG  47          HH22      ARG  47  70.743  12.497   7.718
  415    H    ARG  48           HN       ARG  48  76.339   7.074   2.458
  416    HA   ARG  48           HA       ARG  48  78.686   8.078   1.032
  417    HB2  ARG  48           HB2      ARG  48  77.622   5.325   1.500
  418    HB3  ARG  48           HB1      ARG  48  79.143   5.702   0.703
  419    HG2  ARG  48           HG2      ARG  48  80.085   6.521   2.714
  420    HG3  ARG  48           HG1      ARG  48  78.527   6.449   3.539
  421    HD2  ARG  48           HD2      ARG  48  78.482   4.044   3.254
  422    HD3  ARG  48           HD1      ARG  48  80.041   4.105   2.444
  423    HE   ARG  48           HE       ARG  48  80.562   5.309   4.748
  424   HH11  ARG  48          HH11      ARG  48  79.022   2.182   4.047
  425   HH12  ARG  48          HH12      ARG  48  79.355   1.550   5.605
  426   HH21  ARG  48          HH21      ARG  48  80.980   4.372   6.857
  427   HH22  ARG  48          HH22      ARG  48  80.455   2.784   7.192
  428    H    ASP  49           HN       ASP  49  78.187   5.806  -0.982
  429    HA   ASP  49           HA       ASP  49  75.797   6.932  -2.208
  430    HB2  ASP  49           HB2      ASP  49  78.526   6.750  -3.412
  431    HB3  ASP  49           HB1      ASP  49  77.078   6.778  -4.406
  432    H    LEU  50           HN       LEU  50  75.830   4.514  -0.923
  433    HA   LEU  50           HA       LEU  50  76.343   2.481  -2.847
  434    HB2  LEU  50           HB2      LEU  50  74.968   2.348  -0.170
  435    HB3  LEU  50           HB1      LEU  50  75.217   0.951  -1.194
  436    HG   LEU  50           HG       LEU  50  77.702   1.508  -1.073
  437   HD11  LEU  50          HD11      LEU  50  76.806   3.155   1.254
  438   HD12  LEU  50          HD12      LEU  50  77.546   3.729  -0.241
  439   HD13  LEU  50          HD13      LEU  50  78.473   2.712   0.868
  440   HD21  LEU  50          HD21      LEU  50  76.267   0.655   1.406
  441   HD22  LEU  50          HD22      LEU  50  77.981   0.418   1.068
  442   HD23  LEU  50          HD23      LEU  50  76.762  -0.393   0.066
  443    H    CYS  51           HN       CYS  51  74.675   0.942  -3.567
  444    HA   CYS  51           HA       CYS  51  72.226   2.402  -4.187
  445    HB2  CYS  51           HB2      CYS  51  72.124   0.972  -6.258
  446    HB3  CYS  51           HB1      CYS  51  73.458   2.115  -6.219
  447    HG   CYS  51           HG       CYS  51  74.355  -0.849  -4.998
  448    H    ILE  52           HN       ILE  52  70.323   1.254  -4.236
  449    HA   ILE  52           HA       ILE  52  70.234  -0.686  -2.127
  450    HB   ILE  52           HB       ILE  52  68.128   0.898  -3.548
  451   HG12  ILE  52          HG12      ILE  52  69.170   0.557  -0.812
  452   HG13  ILE  52          HG11      ILE  52  69.358   1.984  -1.882
  453   HG21  ILE  52          HG21      ILE  52  67.116  -1.351  -3.224
  454   HG22  ILE  52          HG22      ILE  52  66.402  -0.156  -2.140
  455   HG23  ILE  52          HG23      ILE  52  67.588  -1.305  -1.523
  456   HD11  ILE  52          HD11      ILE  52  67.838   2.423  -0.207
  457   HD12  ILE  52          HD12      ILE  52  67.116   0.824  -0.513
  458   HD13  ILE  52          HD13      ILE  52  66.940   2.131  -1.755
  459    H    VAL  53           HN       VAL  53  69.357  -2.460  -2.107
  460    HA   VAL  53           HA       VAL  53  69.553  -4.000  -4.529
  461    HB   VAL  53           HB       VAL  53  70.267  -5.773  -2.714
  462   HG11  VAL  53          HG11      VAL  53  72.596  -5.051  -3.052
  463   HG12  VAL  53          HG12      VAL  53  72.021  -3.439  -3.511
  464   HG13  VAL  53          HG13      VAL  53  71.656  -4.826  -4.533
  465   HG21  VAL  53          HG21      VAL  53  71.462  -4.719  -0.838
  466   HG22  VAL  53          HG22      VAL  53  69.759  -4.303  -0.772
  467   HG23  VAL  53          HG23      VAL  53  70.939  -3.135  -1.368
  468    H    TYR  54           HN       TYR  54  67.634  -4.567  -5.041
  469    HA   TYR  54           HA       TYR  54  65.604  -5.078  -3.050
  470    HB2  TYR  54           HB2      TYR  54  65.540  -4.986  -6.058
  471    HB3  TYR  54           HB1      TYR  54  64.146  -5.255  -5.016
  472    HD1  TYR  54           HD1      TYR  54  66.759  -2.788  -5.875
  473    HD2  TYR  54           HD2      TYR  54  63.015  -3.456  -3.972
  474    HE1  TYR  54           HE1      TYR  54  66.437  -0.360  -5.591
  475    HE2  TYR  54           HE2      TYR  54  62.710  -1.090  -3.737
  476    HH   TYR  54           HH       TYR  54  64.135   0.887  -3.505
  477    H    ARG  55           HN       ARG  55  65.471  -6.805  -2.305
  478    HA   ARG  55           HA       ARG  55  66.656  -9.056  -3.681
  479    HB2  ARG  55           HB2      ARG  55  66.179  -8.682  -0.929
  480    HB3  ARG  55           HB1      ARG  55  65.014  -9.897  -1.413
  481    HG2  ARG  55           HG2      ARG  55  68.035 -10.226  -1.934
  482    HG3  ARG  55           HG1      ARG  55  67.253 -10.792  -0.518
  483    HD2  ARG  55           HD2      ARG  55  65.801 -12.241  -1.885
  484    HD3  ARG  55           HD1      ARG  55  66.542 -11.594  -3.353
  485    HE   ARG  55           HE       ARG  55  68.476 -12.610  -1.554
  486   HH11  ARG  55          HH11      ARG  55  66.117 -13.706  -3.976
  487   HH12  ARG  55          HH12      ARG  55  66.996 -15.091  -4.386
  488   HH21  ARG  55          HH21      ARG  55  69.672 -14.537  -2.142
  489   HH22  ARG  55          HH22      ARG  55  69.024 -15.595  -3.310
  490    H    ASP  56           HN       ASP  56  65.232 -10.129  -5.168
  491    HA   ASP  56           HA       ASP  56  63.396 -10.913  -6.215
  492    HB2  ASP  56           HB2      ASP  56  62.557 -11.773  -4.043
  493    HB3  ASP  56           HB1      ASP  56  61.876 -10.187  -3.698
  494    H    GLY  57           HN       GLY  57  62.327  -8.170  -4.345
  495    HA2  GLY  57           HA2      GLY  57  62.486  -6.263  -6.266
  496    HA3  GLY  57           HA1      GLY  57  60.860  -6.936  -6.477
  497    H    ASN  58           HN       ASN  58  62.756  -6.530  -3.519
  498    HA   ASN  58           HA       ASN  58  60.786  -4.567  -2.541
  499    HB2  ASN  58           HB2      ASN  58  62.065  -6.703  -0.880
  500    HB3  ASN  58           HB1      ASN  58  60.689  -5.720  -0.465
  501   HD21  ASN  58          HD21      ASN  58  61.870  -8.484  -2.100
  502   HD22  ASN  58          HD22      ASN  58  60.395  -9.297  -2.345
  503    HA   PRO  59           HA       PRO  59  64.609  -2.748  -1.702
  504    HB2  PRO  59           HB2      PRO  59  63.571  -0.719   0.014
  505    HB3  PRO  59           HB1      PRO  59  63.889  -0.615  -1.720
  506    HG2  PRO  59           HG2      PRO  59  61.334  -0.562  -0.629
  507    HG3  PRO  59           HG1      PRO  59  61.695  -1.056  -2.264
  508    HD2  PRO  59           HD2      PRO  59  61.251  -2.782   0.138
  509    HD3  PRO  59           HD1      PRO  59  60.676  -2.986  -1.525
  510    H    TYR  60           HN       TYR  60  66.244  -3.213  -0.686
  511    HA   TYR  60           HA       TYR  60  66.081  -3.126   2.104
  512    HB2  TYR  60           HB2      TYR  60  67.504  -5.548   0.999
  513    HB3  TYR  60           HB1      TYR  60  66.956  -5.123   2.467
  514    HD1  TYR  60           HD1      TYR  60  64.689  -5.210   3.148
  515    HD2  TYR  60           HD2      TYR  60  65.949  -6.587  -0.586
  516    HE1  TYR  60           HE1      TYR  60  62.628  -6.564   2.976
  517    HE2  TYR  60           HE2      TYR  60  63.929  -7.951  -0.813
  518    HH   TYR  60           HH       TYR  60  61.274  -7.565   1.317
  519    H    ALA  61           HN       ALA  61  67.961  -2.962   2.898
  520    HA   ALA  61           HA       ALA  61  69.814  -1.424   1.355
  521    HB1  ALA  61           HB1      ALA  61  69.640  -2.037   4.204
  522    HB2  ALA  61           HB2      ALA  61  68.619  -0.832   3.472
  523    HB3  ALA  61           HB3      ALA  61  70.419  -0.611   3.472
  524    H    VAL  62           HN       VAL  62  72.050  -1.915   2.590
  525    HA   VAL  62           HA       VAL  62  72.527  -4.798   2.580
  526    HB   VAL  62           HB       VAL  62  74.203  -2.397   1.729
  527   HG11  VAL  62          HG11      VAL  62  75.591  -3.734   2.997
  528   HG12  VAL  62          HG12      VAL  62  76.033  -3.790   1.289
  529   HG13  VAL  62          HG13      VAL  62  75.188  -5.170   2.040
  530   HG21  VAL  62          HG21      VAL  62  74.410  -3.593  -0.396
  531   HG22  VAL  62          HG22      VAL  62  72.767  -3.119  -0.008
  532   HG23  VAL  62          HG23      VAL  62  73.285  -4.803   0.233
  533    H    CYS  63           HN       CYS  63  72.554  -5.431   4.670
  534    HA   CYS  63           HA       CYS  63  72.817  -3.681   6.821
  535    HB2  CYS  63           HB2      CYS  63  72.547  -5.516   8.189
  536    HB3  CYS  63           HB1      CYS  63  71.870  -6.000   6.627
  537    H    ASP  64           HN       ASP  64  74.331  -4.307   8.677
  538    HA   ASP  64           HA       ASP  64  76.837  -3.128   8.393
  539    HB2  ASP  64           HB2      ASP  64  75.713  -3.441  10.523
  540    HB3  ASP  64           HB1      ASP  64  75.924  -5.175  10.402
  541    H    LYS  65           HN       LYS  65  76.034  -6.513   8.431
  542    HA   LYS  65           HA       LYS  65  78.635  -7.643   8.350
  543    HB2  LYS  65           HB2      LYS  65  75.992  -8.691   7.368
  544    HB3  LYS  65           HB1      LYS  65  77.412  -9.680   7.603
  545    HG2  LYS  65           HG2      LYS  65  77.328  -9.409   9.937
  546    HG3  LYS  65           HG1      LYS  65  76.125  -8.123   9.809
  547    HD2  LYS  65           HD2      LYS  65  75.047 -10.201  10.450
  548    HD3  LYS  65           HD1      LYS  65  74.571  -9.680   8.827
  549    HE2  LYS  65           HE2      LYS  65  76.129 -11.282   7.848
  550    HE3  LYS  65           HE1      LYS  65  76.572 -11.837   9.468
  551    HZ1  LYS  65           HZ1      LYS  65  74.256 -12.481   9.794
  552    HZ2  LYS  65           HZ2      LYS  65  74.922 -13.290   8.471
  553    HZ3  LYS  65           HZ3      LYS  65  73.872 -12.001   8.238
  554    H    CYS  66           HN       CYS  66  76.230  -6.937   5.935
  555    HA   CYS  66           HA       CYS  66  77.779  -7.843   3.753
  556    HB2  CYS  66           HB2      CYS  66  75.164  -6.373   4.010
  557    HB3  CYS  66           HB1      CYS  66  75.762  -6.998   2.482
  558    H    LEU  67           HN       LEU  67  77.168  -4.725   5.224
  559    HA   LEU  67           HA       LEU  67  78.249  -2.983   3.362
  560    HB2  LEU  67           HB2      LEU  67  78.153  -2.896   6.315
  561    HB3  LEU  67           HB1      LEU  67  78.885  -1.605   5.389
  562    HG   LEU  67           HG       LEU  67  76.010  -2.510   5.245
  563   HD11  LEU  67          HD11      LEU  67  76.632  -1.262   7.203
  564   HD12  LEU  67          HD12      LEU  67  75.621  -0.279   6.100
  565   HD13  LEU  67          HD13      LEU  67  77.394  -0.078   6.133
  566   HD21  LEU  67          HD21      LEU  67  75.711  -0.569   3.766
  567   HD22  LEU  67          HD22      LEU  67  76.720  -1.801   3.034
  568   HD23  LEU  67          HD23      LEU  67  77.458  -0.347   3.717
  569    H    LYS  68           HN       LYS  68  79.874  -4.808   5.903
  570    HA   LYS  68           HA       LYS  68  82.401  -3.643   5.323
  571    HB2  LYS  68           HB2      LYS  68  83.371  -5.232   6.887
  572    HB3  LYS  68           HB1      LYS  68  81.906  -4.551   7.564
  573    HG2  LYS  68           HG2      LYS  68  80.724  -6.636   6.927
  574    HG3  LYS  68           HG1      LYS  68  82.272  -7.296   6.393
  575    HD2  LYS  68           HD2      LYS  68  83.170  -6.906   8.680
  576    HD3  LYS  68           HD1      LYS  68  81.568  -6.379   9.179
  577    HE2  LYS  68           HE2      LYS  68  81.888  -8.678   9.831
  578    HE3  LYS  68           HE1      LYS  68  80.673  -8.593   8.557
  579    HZ1  LYS  68           HZ1      LYS  68  82.357  -9.322   6.962
  580    HZ2  LYS  68           HZ2      LYS  68  82.252 -10.415   8.246
  581    HZ3  LYS  68           HZ3      LYS  68  83.523  -9.320   8.177
  582    H    PHE  69           HN       PHE  69  80.619  -6.300   3.967
  583    HA   PHE  69           HA       PHE  69  82.762  -7.602   2.705
  584    HB2  PHE  69           HB2      PHE  69  79.879  -7.346   2.311
  585    HB3  PHE  69           HB1      PHE  69  80.814  -8.335   1.243
  586    HD1  PHE  69           HD1      PHE  69  82.262  -8.935   4.322
  587    HD2  PHE  69           HD2      PHE  69  78.621  -9.522   2.224
  588    HE1  PHE  69           HE1      PHE  69  81.723 -10.844   5.773
  589    HE2  PHE  69           HE2      PHE  69  78.062 -11.394   3.631
  590    HZ   PHE  69           HZ       PHE  69  79.619 -12.087   5.442
  591    H    TYR  70           HN       TYR  70  80.182  -5.323   1.749
  592    HA   TYR  70           HA       TYR  70  81.570  -4.906  -0.754
  593    HB2  TYR  70           HB2      TYR  70  78.625  -4.706  -0.180
  594    HB3  TYR  70           HB1      TYR  70  79.411  -4.525  -1.746
  595    HD1  TYR  70           HD2      TYR  70  80.938  -6.570  -2.430
  596    HD2  TYR  70           HD1      TYR  70  77.749  -6.786   0.371
  597    HE1  TYR  70           HE2      TYR  70  80.846  -8.982  -2.740
  598    HE2  TYR  70           HE1      TYR  70  77.654  -9.226   0.081
  599    HH   TYR  70           HH       TYR  70  80.084 -10.963  -1.357
  600    H    SER  71           HN       SER  71  82.705  -3.253   0.699
  601    HA   SER  71           HA       SER  71  81.237  -0.761   0.904
  602    HB2  SER  71           HB2      SER  71  84.200  -1.325   1.292
  603    HB3  SER  71           HB1      SER  71  83.343   0.134   1.789
  604    HG   SER  71           HG       SER  71  82.097  -2.001   2.846
  605    H    LYS  72           HN       LYS  72  83.313  -2.527  -1.135
  606    HA   LYS  72           HA       LYS  72  84.399  -0.629  -2.883
  607    HB2  LYS  72           HB2      LYS  72  85.102  -2.962  -2.724
  608    HB3  LYS  72           HB1      LYS  72  83.562  -3.475  -3.377
  609    HG2  LYS  72           HG2      LYS  72  85.123  -3.624  -5.145
  610    HG3  LYS  72           HG1      LYS  72  84.115  -2.223  -5.474
  611    HD2  LYS  72           HD2      LYS  72  86.265  -1.483  -5.984
  612    HD3  LYS  72           HD1      LYS  72  86.001  -0.863  -4.360
  613    HE2  LYS  72           HE2      LYS  72  87.508  -3.406  -5.015
  614    HE3  LYS  72           HE1      LYS  72  88.278  -1.851  -4.729
  615    HZ1  LYS  72           HZ1      LYS  72  88.403  -3.155  -2.773
  616    HZ2  LYS  72           HZ2      LYS  72  86.788  -3.524  -2.748
  617    HZ3  LYS  72           HZ3      LYS  72  87.318  -1.930  -2.461
  618    H    ILE  73           HN       ILE  73  81.402  -2.498  -3.051
  619    HA   ILE  73           HA       ILE  73  80.619  -1.360  -5.575
  620    HB   ILE  73           HB       ILE  73  78.853  -2.857  -3.640
  621   HG12  ILE  73          HG12      ILE  73  80.531  -3.986  -5.900
  622   HG13  ILE  73          HG11      ILE  73  80.884  -4.194  -4.189
  623   HG21  ILE  73          HG21      ILE  73  78.671  -2.439  -6.633
  624   HG22  ILE  73          HG22      ILE  73  77.663  -1.667  -5.413
  625   HG23  ILE  73          HG23      ILE  73  77.554  -3.408  -5.673
  626   HD11  ILE  73          HD11      ILE  73  78.466  -5.231  -5.653
  627   HD12  ILE  73          HD12      ILE  73  78.797  -5.448  -3.933
  628   HD13  ILE  73          HD13      ILE  73  79.859  -6.180  -5.135
  629    H    SER  74           HN       SER  74  79.975   0.676  -5.646
  630    HA   SER  74           HA       SER  74  77.855   1.448  -3.901
  631    HB2  SER  74           HB2      SER  74  80.417   3.044  -4.105
  632    HB3  SER  74           HB1      SER  74  78.923   3.657  -3.399
  633    HG   SER  74           HG       SER  74  79.704   1.228  -2.395
  634    H    GLU  75           HN       GLU  75  76.352   2.178  -5.275
  635    HA   GLU  75           HA       GLU  75  75.271   3.247  -6.934
  636    HB2  GLU  75           HB2      GLU  75  76.609   5.182  -5.979
  637    HB3  GLU  75           HB1      GLU  75  77.833   4.881  -7.176
  638    HG2  GLU  75           HG2      GLU  75  75.032   5.585  -7.962
  639    HG3  GLU  75           HG1      GLU  75  76.182   6.818  -7.477
  640    H    TYR  76           HN       TYR  76  75.214   1.325  -8.014
  641    HA   TYR  76           HA       TYR  76  77.261   0.837 -10.058
  642    HB2  TYR  76           HB2      TYR  76  77.060  -0.758  -8.168
  643    HB3  TYR  76           HB1      TYR  76  75.423  -1.126  -8.708
  644    HD1  TYR  76           HD1      TYR  76  78.804  -0.809 -10.192
  645    HD2  TYR  76           HD2      TYR  76  75.232  -3.076  -9.931
  646    HE1  TYR  76           HE1      TYR  76  79.765  -2.430 -11.679
  647    HE2  TYR  76           HE2      TYR  76  76.183  -4.760 -11.449
  648    HH   TYR  76           HH       TYR  76  79.493  -4.795 -12.238
  649    H    ARG  77           HN       ARG  77  76.575   1.290 -12.019
  650    HA   ARG  77           HA       ARG  77  73.884   0.472 -12.772
  651    HB2  ARG  77           HB2      ARG  77  73.507   2.577 -14.038
  652    HB3  ARG  77           HB1      ARG  77  73.620   2.827 -12.304
  653    HG2  ARG  77           HG2      ARG  77  74.884   4.557 -13.058
  654    HG3  ARG  77           HG1      ARG  77  76.096   3.278 -12.849
  655    HD2  ARG  77           HD2      ARG  77  76.505   4.345 -14.988
  656    HD3  ARG  77           HD1      ARG  77  75.839   2.718 -15.230
  657    HE   ARG  77           HE       ARG  77  73.797   4.675 -15.170
  658   HH11  ARG  77          HH11      ARG  77  76.229   3.335 -17.341
  659   HH12  ARG  77          HH12      ARG  77  75.405   3.772 -18.765
  660   HH21  ARG  77          HH21      ARG  77  72.687   5.298 -17.108
  661   HH22  ARG  77          HH22      ARG  77  73.361   4.916 -18.636
  662    H    HIS  78           HN       HIS  78  76.855  -0.096 -13.148
  663    HA   HIS  78           HA       HIS  78  77.186  -0.002 -16.023
  664    HB2  HIS  78           HB2      HIS  78  78.836   0.161 -13.911
  665    HB3  HIS  78           HB1      HIS  78  79.071  -1.518 -14.264
  666    HD1  HIS  78           HD1      HIS  78  79.895  -1.856 -16.985
  667    HD2  HIS  78           HD2      HIS  78  80.282   1.736 -15.055
  668    HE1  HIS  78           HE1      HIS  78  81.600  -0.587 -18.337
  669    H    TYR  79           HN       TYR  79  75.428  -1.377 -16.583
  670    HA   TYR  79           HA       TYR  79  75.700  -4.172 -15.750
  671    HB2  TYR  79           HB2      TYR  79  73.278  -2.544 -16.454
  672    HB3  TYR  79           HB1      TYR  79  73.250  -4.297 -16.528
  673    HD1  TYR  79           HD2      TYR  79  74.263  -1.592 -14.130
  674    HD2  TYR  79           HD1      TYR  79  72.475  -5.409 -14.677
  675    HE1  TYR  79           HE2      TYR  79  73.746  -1.688 -11.751
  676    HE2  TYR  79           HE1      TYR  79  71.960  -5.523 -12.294
  677    HH   TYR  79           HH       TYR  79  72.169  -2.815 -10.251
  678    H    SER  80           HN       SER  80  75.061  -5.734 -17.409
  679    HA   SER  80           HA       SER  80  74.929  -4.800 -20.129
  680    HB2  SER  80           HB2      SER  80  77.014  -6.799 -19.186
  681    HB3  SER  80           HB1      SER  80  76.718  -6.335 -20.863
  682    HG   SER  80           HG       SER  80  77.017  -4.133 -19.523
  Start of MODEL   20
    1    H1   GLY  -1           HT1      GLY  -1  55.677  -2.761   7.511
    2    H2   GLY  -1           HT2      GLY  -1  56.346  -4.091   8.306
    3    H3   GLY  -1           HT3      GLY  -1  55.602  -4.264   6.771
    4    HA2  GLY  -1           HA1      GLY  -1  58.042  -2.712   7.327
    5    HA3  GLY  -1           HA2      GLY  -1  57.968  -4.274   6.510
    6    H    ALA   0           HN       ALA   0  59.096  -2.596   4.965
    7    HA   ALA   0           HA       ALA   0  57.163  -1.025   3.505
    8    HB1  ALA   0           HB1      ALA   0  59.082  -0.371   2.111
    9    HB2  ALA   0           HB2      ALA   0  60.104  -1.503   2.997
   10    HB3  ALA   0           HB3      ALA   0  59.410  -0.107   3.823
   11    H    MET   1           HN       MET   1  55.795  -2.473   2.597
   12    HA   MET   1           HA       MET   1  56.905  -4.764   1.252
   13    HB2  MET   1           HB2      MET   1  54.641  -4.607   2.606
   14    HB3  MET   1           HB1      MET   1  54.003  -4.071   1.061
   15    HG2  MET   1           HG2      MET   1  55.310  -6.723   1.676
   16    HG3  MET   1           HG1      MET   1  53.615  -6.435   1.340
   17    HE1  MET   1           HE1      MET   1  53.690  -5.683  -2.535
   18    HE2  MET   1           HE2      MET   1  53.808  -4.466  -1.274
   19    HE3  MET   1           HE3      MET   1  52.671  -5.814  -1.096
   20    H    PHE   2           HN       PHE   2  58.010  -3.810  -0.345
   21    HA   PHE   2           HA       PHE   2  56.409  -2.569  -2.438
   22    HB2  PHE   2           HB2      PHE   2  59.330  -2.553  -1.837
   23    HB3  PHE   2           HB1      PHE   2  58.848  -2.420  -3.522
   24    HD1  PHE   2           HD1      PHE   2  56.664  -0.937  -1.016
   25    HD2  PHE   2           HD2      PHE   2  60.027  -0.238  -3.545
   26    HE1  PHE   2           HE1      PHE   2  56.376   1.456  -0.756
   27    HE2  PHE   2           HE2      PHE   2  59.777   2.091  -3.295
   28    HZ   PHE   2           HZ       PHE   2  57.920   3.023  -1.886
   29    H    GLN   3           HN       GLN   3  56.694  -3.408  -4.587
   30    HA   GLN   3           HA       GLN   3  57.386  -6.240  -4.572
   31    HB2  GLN   3           HB2      GLN   3  55.500  -6.559  -6.250
   32    HB3  GLN   3           HB1      GLN   3  55.023  -6.230  -4.596
   33    HG2  GLN   3           HG2      GLN   3  53.552  -4.902  -5.752
   34    HG3  GLN   3           HG1      GLN   3  54.838  -3.756  -5.424
   35   HE21  GLN   3          HE21      GLN   3  56.329  -5.314  -7.445
   36   HE22  GLN   3          HE22      GLN   3  56.012  -4.740  -8.962
   37    H    ASP   4           HN       ASP   4  57.723  -7.202  -6.736
   38    HA   ASP   4           HA       ASP   4  60.055  -5.906  -7.837
   39    HB2  ASP   4           HB2      ASP   4  60.380  -8.108  -8.947
   40    HB3  ASP   4           HB1      ASP   4  59.903  -8.365  -7.290
   41    HA   PRO   5           HA       PRO   5  61.304  -6.681  -9.486
   42    HB2  PRO   5           HB2      PRO   5  62.445  -5.701 -11.821
   43    HB3  PRO   5           HB1      PRO   5  61.680  -7.279 -11.620
   44    HG2  PRO   5           HG2      PRO   5  60.745  -5.198 -13.276
   45    HG3  PRO   5           HG1      PRO   5  59.849  -6.651 -12.807
   46    HD2  PRO   5           HD2      PRO   5  59.771  -3.908 -11.599
   47    HD3  PRO   5           HD1      PRO   5  58.438  -5.048 -11.887
   48    H    GLN   6           HN       GLN   6  62.058  -3.916 -11.340
   49    HA   GLN   6           HA       GLN   6  63.765  -2.992  -9.096
   50    HB2  GLN   6           HB2      GLN   6  64.380  -3.008 -12.056
   51    HB3  GLN   6           HB1      GLN   6  65.410  -2.326 -10.812
   52    HG2  GLN   6           HG2      GLN   6  64.638  -5.231 -10.961
   53    HG3  GLN   6           HG1      GLN   6  66.112  -4.565 -11.649
   54   HE21  GLN   6          HE21      GLN   6  67.430  -5.782 -10.377
   55   HE22  GLN   6          HE22      GLN   6  67.599  -5.562  -8.669
   56    H    GLU   7           HN       GLU   7  61.105  -2.102  -9.890
   57    HA   GLU   7           HA       GLU   7  61.498   0.341 -11.301
   58    HB2  GLU   7           HB2      GLU   7  59.454  -1.019 -11.549
   59    HB3  GLU   7           HB1      GLU   7  59.042  -0.662  -9.879
   60    HG2  GLU   7           HG2      GLU   7  58.892   1.694 -10.412
   61    HG3  GLU   7           HG1      GLU   7  59.283   1.349 -12.096
   62    H    ARG   8           HN       ARG   8  61.803  -0.561  -8.212
   63    HA   ARG   8           HA       ARG   8  61.398   2.088  -7.033
   64    HB2  ARG   8           HB2      ARG   8  62.845  -0.081  -5.586
   65    HB3  ARG   8           HB1      ARG   8  61.658   1.049  -4.965
   66    HG2  ARG   8           HG2      ARG   8  61.143  -1.447  -6.547
   67    HG3  ARG   8           HG1      ARG   8  60.849  -1.191  -4.822
   68    HD2  ARG   8           HD2      ARG   8  59.001   0.247  -5.266
   69    HD3  ARG   8           HD1      ARG   8  59.563   0.574  -6.902
   70    HE   ARG   8           HE       ARG   8  58.682  -2.131  -6.266
   71   HH11  ARG   8          HH11      ARG   8  57.909   0.981  -7.759
   72   HH12  ARG   8          HH12      ARG   8  56.884   0.323  -8.942
   73   HH21  ARG   8          HH21      ARG   8  57.250  -3.017  -7.843
   74   HH22  ARG   8          HH22      ARG   8  56.478  -2.017  -8.984
   75    HA   PRO   9           HA       PRO   9  65.394   3.599  -7.951
   76    HB2  PRO   9           HB2      PRO   9  66.099   4.837  -5.649
   77    HB3  PRO   9           HB1      PRO   9  65.037   5.570  -6.796
   78    HG2  PRO   9           HG2      PRO   9  64.553   4.297  -4.252
   79    HG3  PRO   9           HG1      PRO   9  63.482   5.450  -5.108
   80    HD2  PRO   9           HD2      PRO   9  63.265   2.718  -4.688
   81    HD3  PRO   9           HD1      PRO   9  62.210   3.578  -5.777
   82    H    ARG  10           HN       ARG  10  67.654   3.499  -7.682
   83    HA   ARG  10           HA       ARG  10  68.559   1.543  -5.724
   84    HB2  ARG  10           HB2      ARG  10  69.422   2.303  -8.325
   85    HB3  ARG  10           HB1      ARG  10  70.739   2.497  -7.170
   86    HG2  ARG  10           HG2      ARG  10  70.708   0.298  -8.179
   87    HG3  ARG  10           HG1      ARG  10  70.504   0.226  -6.433
   88    HD2  ARG  10           HD2      ARG  10  69.005  -1.321  -7.612
   89    HD3  ARG  10           HD1      ARG  10  68.115  -0.101  -6.713
   90    HE   ARG  10           HE       ARG  10  68.574   0.748  -9.343
   91   HH11  ARG  10          HH11      ARG  10  66.662  -1.703  -7.701
   92   HH12  ARG  10          HH12      ARG  10  65.305  -1.510  -8.704
   93   HH21  ARG  10          HH21      ARG  10  66.739   1.006 -10.715
   94   HH22  ARG  10          HH22      ARG  10  65.338   0.073 -10.459
   95    H    LYS  11           HN       LYS  11  67.951   4.730  -5.449
   96    HA   LYS  11           HA       LYS  11  70.241   4.979  -3.685
   97    HB2  LYS  11           HB2      LYS  11  68.610   7.248  -4.748
   98    HB3  LYS  11           HB1      LYS  11  70.001   7.271  -3.743
   99    HG2  LYS  11           HG2      LYS  11  71.410   6.234  -5.414
  100    HG3  LYS  11           HG1      LYS  11  70.049   6.239  -6.545
  101    HD2  LYS  11           HD2      LYS  11  69.955   8.604  -6.484
  102    HD3  LYS  11           HD1      LYS  11  71.181   8.603  -5.194
  103    HE2  LYS  11           HE2      LYS  11  72.178   9.193  -7.405
  104    HE3  LYS  11           HE1      LYS  11  72.855   7.726  -6.712
  105    HZ1  LYS  11           HZ1      LYS  11  70.861   7.906  -8.911
  106    HZ2  LYS  11           HZ2      LYS  11  71.312   6.460  -8.184
  107    HZ3  LYS  11           HZ3      LYS  11  72.459   7.366  -9.022
  108    H    LEU  12           HN       LEU  12  69.882   5.297  -1.678
  109    HA   LEU  12           HA       LEU  12  67.578   4.519  -0.418
  110    HB2  LEU  12           HB2      LEU  12  69.607   4.267   0.670
  111    HB3  LEU  12           HB1      LEU  12  70.014   5.965   0.522
  112    HG   LEU  12           HG       LEU  12  68.272   6.514   2.129
  113   HD11  LEU  12          HD11      LEU  12  67.200   4.793   3.390
  114   HD12  LEU  12          HD12      LEU  12  68.064   3.548   2.468
  115   HD13  LEU  12          HD13      LEU  12  66.819   4.535   1.666
  116   HD21  LEU  12          HD21      LEU  12  69.398   5.750   4.045
  117   HD22  LEU  12          HD22      LEU  12  70.616   5.940   2.754
  118   HD23  LEU  12          HD23      LEU  12  69.981   4.348   3.169
  119    HA   PRO  13           HA       PRO  13  66.505   9.025   0.840
  120    HB2  PRO  13           HB2      PRO  13  67.419  11.119  -0.645
  121    HB3  PRO  13           HB1      PRO  13  68.348  10.395   0.685
  122    HG2  PRO  13           HG2      PRO  13  68.620   9.876  -2.245
  123    HG3  PRO  13           HG1      PRO  13  69.879  10.259  -1.051
  124    HD2  PRO  13           HD2      PRO  13  69.349   7.727  -1.817
  125    HD3  PRO  13           HD1      PRO  13  69.866   8.096  -0.186
  126    H    GLN  14           HN       GLN  14  67.001   8.445  -2.537
  127    HA   GLN  14           HA       GLN  14  64.684   9.708  -3.522
  128    HB2  GLN  14           HB2      GLN  14  66.837   9.084  -4.760
  129    HB3  GLN  14           HB1      GLN  14  66.229   7.447  -4.782
  130    HG2  GLN  14           HG2      GLN  14  64.408   8.033  -6.131
  131    HG3  GLN  14           HG1      GLN  14  64.738   9.762  -5.917
  132   HE21  GLN  14          HE21      GLN  14  65.665   6.874  -7.630
  133   HE22  GLN  14          HE22      GLN  14  66.768   7.635  -8.709
  134    H    LEU  15           HN       LEU  15  65.405   6.392  -2.368
  135    HA   LEU  15           HA       LEU  15  62.960   5.243  -3.034
  136    HB2  LEU  15           HB2      LEU  15  65.028   3.989  -2.389
  137    HB3  LEU  15           HB1      LEU  15  64.893   4.700  -0.854
  138    HG   LEU  15           HG       LEU  15  62.931   3.559  -0.275
  139   HD11  LEU  15          HD11      LEU  15  61.838   1.955  -1.717
  140   HD12  LEU  15          HD12      LEU  15  63.044   2.162  -2.952
  141   HD13  LEU  15          HD13      LEU  15  61.900   3.486  -2.597
  142   HD21  LEU  15          HD21      LEU  15  64.965   1.830  -1.564
  143   HD22  LEU  15          HD22      LEU  15  63.842   1.314  -0.281
  144   HD23  LEU  15          HD23      LEU  15  65.067   2.585   0.016
  145    H    CYS  16           HN       CYS  16  64.175   6.816  -0.156
  146    HA   CYS  16           HA       CYS  16  61.999   6.394   1.528
  147    HB2  CYS  16           HB2      CYS  16  63.798   8.842   1.392
  148    HB3  CYS  16           HB1      CYS  16  62.755   8.421   2.733
  149    HG   CYS  16           HG       CYS  16  65.405   6.571   1.630
  150    H    THR  17           HN       THR  17  62.489   8.751  -0.965
  151    HA   THR  17           HA       THR  17  60.296  10.435  -0.575
  152    HB   THR  17           HB       THR  17  61.658   9.614  -3.103
  153    HG1  THR  17           HG1      THR  17  62.571  10.931  -0.951
  154   HG21  THR  17          HG21      THR  17  59.607  10.821  -3.506
  155   HG22  THR  17          HG22      THR  17  60.995  11.833  -3.940
  156   HG23  THR  17          HG23      THR  17  60.120  12.121  -2.426
  157    H    GLU  18           HN       GLU  18  60.641   7.363  -2.254
  158    HA   GLU  18           HA       GLU  18  58.070   7.225  -3.341
  159    HB2  GLU  18           HB2      GLU  18  60.248   5.382  -2.828
  160    HB3  GLU  18           HB1      GLU  18  58.688   4.692  -3.311
  161    HG2  GLU  18           HG2      GLU  18  58.811   6.472  -5.165
  162    HG3  GLU  18           HG1      GLU  18  60.510   6.595  -4.726
  163    H    LEU  19           HN       LEU  19  59.443   5.761  -0.471
  164    HA   LEU  19           HA       LEU  19  57.011   4.838   0.567
  165    HB2  LEU  19           HB2      LEU  19  59.677   5.417   1.712
  166    HB3  LEU  19           HB1      LEU  19  58.427   4.789   2.705
  167    HG   LEU  19           HG       LEU  19  58.322   2.872   0.911
  168   HD11  LEU  19          HD11      LEU  19  60.434   2.387  -0.112
  169   HD12  LEU  19          HD12      LEU  19  61.053   3.945   0.444
  170   HD13  LEU  19          HD13      LEU  19  59.740   3.890  -0.720
  171   HD21  LEU  19          HD21      LEU  19  60.097   1.675   2.118
  172   HD22  LEU  19          HD22      LEU  19  58.946   2.514   3.169
  173   HD23  LEU  19          HD23      LEU  19  60.540   3.219   2.856
  174    H    GLN  20           HN       GLN  20  57.816   7.969   0.095
  175    HA   GLN  20           HA       GLN  20  56.906   9.926   0.747
  176    HB2  GLN  20           HB2      GLN  20  55.002   7.999   1.972
  177    HB3  GLN  20           HB1      GLN  20  54.706   9.746   2.048
  178    HG2  GLN  20           HG2      GLN  20  55.034   8.094  -0.438
  179    HG3  GLN  20           HG1      GLN  20  53.465   8.589   0.220
  180   HE21  GLN  20          HE21      GLN  20  54.490   9.121  -2.373
  181   HE22  GLN  20          HE22      GLN  20  54.629  10.832  -2.549
  182    H    THR  21           HN       THR  21  58.975   8.717   2.356
  183    HA   THR  21           HA       THR  21  58.480  10.053   4.865
  184    HB   THR  21           HB       THR  21  57.688   7.639   5.030
  185    HG1  THR  21           HG1      THR  21  58.716   7.334   7.077
  186   HG21  THR  21          HG21      THR  21  60.653   7.035   4.853
  187   HG22  THR  21          HG22      THR  21  59.422   6.553   3.687
  188   HG23  THR  21          HG23      THR  21  59.402   5.880   5.316
  189    H    THR  22           HN       THR  22  60.805   9.316   6.191
  190    HA   THR  22           HA       THR  22  62.891   9.975   4.226
  191    HB   THR  22           HB       THR  22  63.270  10.769   7.056
  192    HG1  THR  22           HG1      THR  22  61.262  11.669   6.856
  193   HG21  THR  22          HG21      THR  22  63.800  12.032   4.362
  194   HG22  THR  22          HG22      THR  22  64.994  11.287   5.419
  195   HG23  THR  22          HG23      THR  22  64.218  12.800   5.888
  196    H    ILE  23           HN       ILE  23  65.146   9.506   5.386
  197    HA   ILE  23           HA       ILE  23  65.602   6.866   5.600
  198    HB   ILE  23           HB       ILE  23  67.164   8.995   6.971
  199   HG12  ILE  23          HG12      ILE  23  66.958   8.157   4.129
  200   HG13  ILE  23          HG11      ILE  23  66.816   9.740   4.815
  201   HG21  ILE  23          HG21      ILE  23  67.897   6.689   7.488
  202   HG22  ILE  23          HG22      ILE  23  69.093   7.453   6.426
  203   HG23  ILE  23          HG23      ILE  23  67.921   6.306   5.766
  204   HD11  ILE  23          HD11      ILE  23  69.242   9.744   5.293
  205   HD12  ILE  23          HD12      ILE  23  68.899   9.471   3.564
  206   HD13  ILE  23          HD13      ILE  23  69.295   8.108   4.618
  207    H    HIS  24           HN       HIS  24  64.532   9.078   7.925
  208    HA   HIS  24           HA       HIS  24  65.606   8.027  10.298
  209    HB2  HIS  24           HB2      HIS  24  63.377  10.035   9.959
  210    HB3  HIS  24           HB1      HIS  24  64.519   9.985  11.275
  211    HD1  HIS  24           HD1      HIS  24  66.992   9.639   9.304
  212    HD2  HIS  24           HD2      HIS  24  64.101  12.507   9.227
  213    HE1  HIS  24           HE1      HIS  24  67.739  11.204   7.458
  214    H    ASP  25           HN       ASP  25  63.047   7.245   8.329
  215    HA   ASP  25           HA       ASP  25  61.472   5.973  10.478
  216    HB2  ASP  25           HB2      ASP  25  60.479   8.135   9.714
  217    HB3  ASP  25           HB1      ASP  25  60.417   7.463   8.121
  218    H    ILE  26           HN       ILE  26  62.523   5.982   7.124
  219    HA   ILE  26           HA       ILE  26  61.041   4.012   5.920
  220    HB   ILE  26           HB       ILE  26  62.604   5.351   4.645
  221   HG12  ILE  26          HG12      ILE  26  63.620   2.563   4.566
  222   HG13  ILE  26          HG11      ILE  26  62.069   2.822   3.903
  223   HG21  ILE  26          HG21      ILE  26  64.767   3.818   6.073
  224   HG22  ILE  26          HG22      ILE  26  64.349   5.505   6.341
  225   HG23  ILE  26          HG23      ILE  26  65.012   4.997   4.778
  226   HD11  ILE  26          HD11      ILE  26  64.695   3.972   2.977
  227   HD12  ILE  26          HD12      ILE  26  63.133   4.418   2.263
  228   HD13  ILE  26          HD13      ILE  26  63.713   2.742   2.194
  229    H    ILE  27           HN       ILE  27  60.910   1.887   5.813
  230    HA   ILE  27           HA       ILE  27  62.706   0.351   7.465
  231    HB   ILE  27           HB       ILE  27  60.128  -0.440   6.133
  232   HG12  ILE  27          HG12      ILE  27  59.610   1.174   7.855
  233   HG13  ILE  27          HG11      ILE  27  59.179  -0.436   8.412
  234   HG21  ILE  27          HG21      ILE  27  61.841  -1.852   8.151
  235   HG22  ILE  27          HG22      ILE  27  61.646  -2.265   6.450
  236   HG23  ILE  27          HG23      ILE  27  60.271  -2.426   7.559
  237   HD11  ILE  27          HD11      ILE  27  61.208  -0.507   9.763
  238   HD12  ILE  27          HD12      ILE  27  60.190   0.869  10.185
  239   HD13  ILE  27          HD13      ILE  27  61.632   1.112   9.203
  240    H    LEU  28           HN       LEU  28  64.396  -0.166   6.655
  241    HA   LEU  28           HA       LEU  28  64.291  -1.213   3.965
  242    HB2  LEU  28           HB2      LEU  28  65.658   0.973   4.861
  243    HB3  LEU  28           HB1      LEU  28  66.866  -0.309   4.815
  244    HG   LEU  28           HG       LEU  28  66.380  -0.783   2.531
  245   HD11  LEU  28          HD11      LEU  28  64.657   1.036   1.563
  246   HD12  LEU  28          HD12      LEU  28  64.027   0.797   3.247
  247   HD13  LEU  28          HD13      LEU  28  64.171  -0.553   2.152
  248   HD21  LEU  28          HD21      LEU  28  67.889   1.112   3.059
  249   HD22  LEU  28          HD22      LEU  28  66.492   2.183   2.951
  250   HD23  LEU  28          HD23      LEU  28  67.034   1.290   1.526
  251    H    GLU  29           HN       GLU  29  65.133  -3.365   3.906
  252    HA   GLU  29           HA       GLU  29  66.532  -3.846   6.439
  253    HB2  GLU  29           HB2      GLU  29  65.982  -6.178   6.211
  254    HB3  GLU  29           HB1      GLU  29  64.695  -5.100   6.876
  255    HG2  GLU  29           HG2      GLU  29  63.920  -5.103   4.539
  256    HG3  GLU  29           HG1      GLU  29  64.990  -6.538   4.378
  257    H    CYS  30           HN       CYS  30  67.999  -6.145   6.343
  258    HA   CYS  30           HA       CYS  30  69.592  -5.663   4.128
  259    HB2  CYS  30           HB2      CYS  30  70.355  -6.807   6.299
  260    HB3  CYS  30           HB1      CYS  30  69.567  -8.226   5.672
  261    H    VAL  31           HN       VAL  31  69.513  -6.372   2.375
  262    HA   VAL  31           HA       VAL  31  67.475  -7.834   1.114
  263    HB   VAL  31           HB       VAL  31  68.700  -6.291  -0.256
  264   HG11  VAL  31          HG11      VAL  31  71.033  -6.492  -0.558
  265   HG12  VAL  31          HG12      VAL  31  71.118  -7.521   0.891
  266   HG13  VAL  31          HG13      VAL  31  70.539  -5.818   0.992
  267   HG21  VAL  31          HG21      VAL  31  70.001  -7.512  -1.894
  268   HG22  VAL  31          HG22      VAL  31  68.404  -8.151  -1.602
  269   HG23  VAL  31          HG23      VAL  31  69.822  -8.971  -0.908
  270    H    TYR  32           HN       TYR  32  70.456  -8.637   2.470
  271    HA   TYR  32           HA       TYR  32  70.483 -11.307   1.411
  272    HB2  TYR  32           HB2      TYR  32  72.557  -9.986   3.145
  273    HB3  TYR  32           HB1      TYR  32  72.750 -11.445   2.173
  274    HD1  TYR  32           HD1      TYR  32  71.573 -10.804  -0.379
  275    HD2  TYR  32           HD2      TYR  32  73.848  -8.284   2.218
  276    HE1  TYR  32           HE1      TYR  32  72.129  -9.504  -2.213
  277    HE2  TYR  32           HE2      TYR  32  74.464  -6.854   0.315
  278    HH   TYR  32           HH       TYR  32  74.628  -7.068  -2.126
  279    H    CYS  33           HN       CYS  33  70.346  -9.626   4.592
  280    HA   CYS  33           HA       CYS  33  70.235 -12.251   5.927
  281    HB2  CYS  33           HB2      CYS  33  70.773  -9.655   7.387
  282    HB3  CYS  33           HB1      CYS  33  71.029 -11.293   7.872
  283    H    LYS  34           HN       LYS  34  68.174  -9.717   5.060
  284    HA   LYS  34           HA       LYS  34  66.191  -9.176   5.476
  285    HB2  LYS  34           HB2      LYS  34  66.211 -11.952   6.391
  286    HB3  LYS  34           HB1      LYS  34  64.807 -10.993   6.828
  287    HG2  LYS  34           HG2      LYS  34  64.680 -12.311   4.736
  288    HG3  LYS  34           HG1      LYS  34  64.263 -10.584   4.578
  289    HD2  LYS  34           HD2      LYS  34  66.471 -10.234   3.579
  290    HD3  LYS  34           HD1      LYS  34  66.844 -11.946   3.796
  291    HE2  LYS  34           HE2      LYS  34  66.092 -11.373   1.500
  292    HE3  LYS  34           HE1      LYS  34  65.083 -12.578   2.297
  293    HZ1  LYS  34           HZ1      LYS  34  64.393  -9.676   2.113
  294    HZ2  LYS  34           HZ2      LYS  34  63.428 -10.891   2.749
  295    HZ3  LYS  34           HZ3      LYS  34  63.783 -10.880   1.125
  296    H    GLN  35           HN       GLN  35  68.251  -9.117   8.174
  297    HA   GLN  35           HA       GLN  35  66.136  -8.326   9.797
  298    HB2  GLN  35           HB2      GLN  35  67.644  -8.225  11.511
  299    HB3  GLN  35           HB1      GLN  35  68.272  -9.520  10.551
  300    HG2  GLN  35           HG2      GLN  35  69.321  -6.756  10.276
  301    HG3  GLN  35           HG1      GLN  35  69.973  -7.875  11.505
  302   HE21  GLN  35          HE21      GLN  35  69.630  -6.982   8.297
  303   HE22  GLN  35          HE22      GLN  35  70.822  -8.021   7.641
  304    H    GLN  36           HN       GLN  36  65.504  -6.272  10.176
  305    HA   GLN  36           HA       GLN  36  65.821  -4.321   8.346
  306    HB2  GLN  36           HB2      GLN  36  64.181  -4.772  10.316
  307    HB3  GLN  36           HB1      GLN  36  65.312  -3.761  11.204
  308    HG2  GLN  36           HG2      GLN  36  65.052  -2.050   9.423
  309    HG3  GLN  36           HG1      GLN  36  63.868  -3.192   8.757
  310   HE21  GLN  36          HE21      GLN  36  61.940  -3.465   9.697
  311   HE22  GLN  36          HE22      GLN  36  61.292  -2.460  10.945
  312    H    LEU  37           HN       LEU  37  67.251  -2.713   8.108
  313    HA   LEU  37           HA       LEU  37  69.680  -2.766   9.591
  314    HB2  LEU  37           HB2      LEU  37  68.615  -1.059   7.410
  315    HB3  LEU  37           HB1      LEU  37  69.804  -0.447   8.501
  316    HG   LEU  37           HG       LEU  37  71.231  -2.415   8.008
  317   HD11  LEU  37          HD11      LEU  37  70.802  -3.607   5.885
  318   HD12  LEU  37          HD12      LEU  37  69.162  -2.930   5.909
  319   HD13  LEU  37          HD13      LEU  37  69.703  -3.984   7.205
  320   HD21  LEU  37          HD21      LEU  37  70.544  -0.560   5.750
  321   HD22  LEU  37          HD22      LEU  37  72.013  -1.534   5.850
  322   HD23  LEU  37          HD23      LEU  37  71.704  -0.270   7.043
  323    H    LEU  38           HN       LEU  38  70.448  -1.850  11.011
  324    HA   LEU  38           HA       LEU  38  69.074  -0.464  12.973
  325    HB2  LEU  38           HB2      LEU  38  71.648  -1.503  12.321
  326    HB3  LEU  38           HB1      LEU  38  71.817   0.086  12.919
  327    HG   LEU  38           HG       LEU  38  70.380  -2.120  14.413
  328   HD11  LEU  38          HD11      LEU  38  73.140  -0.981  14.793
  329   HD12  LEU  38          HD12      LEU  38  72.750  -2.591  14.187
  330   HD13  LEU  38          HD13      LEU  38  72.358  -2.154  15.853
  331   HD21  LEU  38          HD21      LEU  38  71.245   0.640  15.253
  332   HD22  LEU  38          HD22      LEU  38  70.543  -0.580  16.319
  333   HD23  LEU  38          HD23      LEU  38  69.582   0.105  15.006
  334    H    ARG  39           HN       ARG  39  68.790   1.755  13.123
  335    HA   ARG  39           HA       ARG  39  68.592   3.241  10.839
  336    HB2  ARG  39           HB2      ARG  39  68.054   5.153  12.096
  337    HB3  ARG  39           HB1      ARG  39  67.601   3.773  13.083
  338    HG2  ARG  39           HG2      ARG  39  70.187   5.231  13.444
  339    HG3  ARG  39           HG1      ARG  39  68.719   5.741  14.269
  340    HD2  ARG  39           HD2      ARG  39  70.091   3.044  14.535
  341    HD3  ARG  39           HD1      ARG  39  70.086   4.328  15.743
  342    HE   ARG  39           HE       ARG  39  67.447   3.493  15.031
  343   HH11  ARG  39          HH11      ARG  39  70.163   2.719  17.163
  344   HH12  ARG  39          HH12      ARG  39  69.231   1.802  18.246
  345   HH21  ARG  39          HH21      ARG  39  66.177   2.208  16.544
  346   HH22  ARG  39          HH22      ARG  39  66.944   1.504  17.889
  347    H    ARG  40           HN       ARG  40  71.598   2.838  12.634
  348    HA   ARG  40           HA       ARG  40  72.759   5.238  11.644
  349    HB2  ARG  40           HB2      ARG  40  73.848   2.796  12.998
  350    HB3  ARG  40           HB1      ARG  40  74.832   4.161  12.517
  351    HG2  ARG  40           HG2      ARG  40  73.430   5.600  13.991
  352    HG3  ARG  40           HG1      ARG  40  72.600   4.126  14.509
  353    HD2  ARG  40           HD2      ARG  40  74.621   3.212  15.397
  354    HD3  ARG  40           HD1      ARG  40  75.580   4.538  14.743
  355    HE   ARG  40           HE       ARG  40  73.812   5.757  16.367
  356   HH11  ARG  40          HH11      ARG  40  75.970   2.968  16.906
  357   HH12  ARG  40          HH12      ARG  40  76.364   3.373  18.492
  358   HH21  ARG  40          HH21      ARG  40  74.348   6.323  18.614
  359   HH22  ARG  40          HH22      ARG  40  75.375   5.321  19.514
  360    H    GLU  41           HN       GLU  41  72.850   1.821  11.008
  361    HA   GLU  41           HA       GLU  41  74.661   1.703   8.868
  362    HB2  GLU  41           HB2      GLU  41  72.217   0.077   9.604
  363    HB3  GLU  41           HB1      GLU  41  73.383  -0.396   8.391
  364    HG2  GLU  41           HG2      GLU  41  73.377  -1.321  10.825
  365    HG3  GLU  41           HG1      GLU  41  74.916  -1.095   9.945
  366    H    VAL  42           HN       VAL  42  71.233   2.252   9.080
  367    HA   VAL  42           HA       VAL  42  70.717   2.417   6.281
  368    HB   VAL  42           HB       VAL  42  69.121   4.088   8.245
  369   HG11  VAL  42          HG11      VAL  42  68.308   2.478   5.861
  370   HG12  VAL  42          HG12      VAL  42  68.657   4.213   5.812
  371   HG13  VAL  42          HG13      VAL  42  67.280   3.602   6.750
  372   HG21  VAL  42          HG21      VAL  42  67.704   2.190   8.751
  373   HG22  VAL  42          HG22      VAL  42  69.360   1.844   9.255
  374   HG23  VAL  42          HG23      VAL  42  68.719   1.150   7.763
  375    H    TYR  43           HN       TYR  43  71.431   4.969   8.730
  376    HA   TYR  43           HA       TYR  43  71.575   7.094   6.966
  377    HB2  TYR  43           HB2      TYR  43  73.018   6.611   9.566
  378    HB3  TYR  43           HB1      TYR  43  73.222   8.127   8.652
  379    HD1  TYR  43           HD1      TYR  43  70.514   8.556   7.739
  380    HD2  TYR  43           HD2      TYR  43  71.905   7.094  11.445
  381    HE1  TYR  43           HE1      TYR  43  68.462   9.300   8.773
  382    HE2  TYR  43           HE2      TYR  43  69.826   7.844  12.529
  383    HH   TYR  43           HH       TYR  43  68.047   9.616  12.037
  384    H    ASP  44           HN       ASP  44  74.128   4.744   7.742
  385    HA   ASP  44           HA       ASP  44  76.302   5.891   6.492
  386    HB2  ASP  44           HB2      ASP  44  75.447   2.994   6.652
  387    HB3  ASP  44           HB1      ASP  44  76.918   3.509   5.964
  388    H    PHE  45           HN       PHE  45  73.730   4.075   5.211
  389    HA   PHE  45           HA       PHE  45  74.720   3.480   2.733
  390    HB2  PHE  45           HB2      PHE  45  72.461   2.919   4.122
  391    HB3  PHE  45           HB1      PHE  45  71.901   4.115   2.983
  392    HD1  PHE  45           HD2      PHE  45  73.529   0.809   3.254
  393    HD2  PHE  45           HD1      PHE  45  71.617   3.718   0.795
  394    HE1  PHE  45           HE2      PHE  45  73.266  -0.845   1.445
  395    HE2  PHE  45           HE1      PHE  45  71.406   2.076  -0.988
  396    HZ   PHE  45           HZ       PHE  45  72.182  -0.182  -0.675
  397    H    ALA  46           HN       ALA  46  72.673   6.264   3.690
  398    HA   ALA  46           HA       ALA  46  73.019   7.497   1.070
  399    HB1  ALA  46           HB1      ALA  46  70.806   7.726   2.119
  400    HB2  ALA  46           HB2      ALA  46  71.546   9.291   1.874
  401    HB3  ALA  46           HB3      ALA  46  71.549   8.564   3.479
  402    H    ARG  47           HN       ARG  47  74.528   7.688   4.203
  403    HA   ARG  47           HA       ARG  47  75.514  10.345   3.804
  404    HB2  ARG  47           HB2      ARG  47  75.695   8.275   5.880
  405    HB3  ARG  47           HB1      ARG  47  77.070   9.347   5.840
  406    HG2  ARG  47           HG2      ARG  47  75.295  10.056   7.433
  407    HG3  ARG  47           HG1      ARG  47  75.620  11.266   6.196
  408    HD2  ARG  47           HD2      ARG  47  73.628  10.604   4.975
  409    HD3  ARG  47           HD1      ARG  47  73.339   9.284   6.106
  410    HE   ARG  47           HE       ARG  47  73.289  11.325   7.756
  411   HH11  ARG  47          HH11      ARG  47  71.827  11.304   4.486
  412   HH12  ARG  47          HH12      ARG  47  70.468  12.188   5.003
  413   HH21  ARG  47          HH21      ARG  47  71.369  12.542   8.363
  414   HH22  ARG  47          HH22      ARG  47  70.204  12.876   7.179
  415    H    ARG  48           HN       ARG  48  76.347   7.328   2.766
  416    HA   ARG  48           HA       ARG  48  78.873   8.301   1.662
  417    HB2  ARG  48           HB2      ARG  48  77.738   5.590   2.148
  418    HB3  ARG  48           HB1      ARG  48  79.274   5.867   1.347
  419    HG2  ARG  48           HG2      ARG  48  80.228   6.717   3.368
  420    HG3  ARG  48           HG1      ARG  48  78.648   6.714   4.170
  421    HD2  ARG  48           HD2      ARG  48  78.515   4.346   4.001
  422    HD3  ARG  48           HD1      ARG  48  79.975   4.292   3.032
  423    HE   ARG  48           HE       ARG  48  80.482   5.503   5.521
  424   HH11  ARG  48          HH11      ARG  48  79.870   2.336   4.093
  425   HH12  ARG  48          HH12      ARG  48  80.707   1.475   5.300
  426   HH21  ARG  48          HH21      ARG  48  81.687   4.304   7.170
  427   HH22  ARG  48          HH22      ARG  48  81.729   2.596   7.070
  428    H    ASP  49           HN       ASP  49  78.647   6.091  -0.327
  429    HA   ASP  49           HA       ASP  49  76.220   6.842  -1.727
  430    HB2  ASP  49           HB2      ASP  49  77.850   8.350  -2.696
  431    HB3  ASP  49           HB1      ASP  49  78.981   7.031  -2.950
  432    H    LEU  50           HN       LEU  50  75.652   4.790  -0.916
  433    HA   LEU  50           HA       LEU  50  76.751   2.640  -2.467
  434    HB2  LEU  50           HB2      LEU  50  74.912   2.611  -0.089
  435    HB3  LEU  50           HB1      LEU  50  75.425   1.180  -0.955
  436    HG   LEU  50           HG       LEU  50  77.792   1.923  -0.397
  437   HD11  LEU  50          HD11      LEU  50  76.353   3.584   1.623
  438   HD12  LEU  50          HD12      LEU  50  77.357   4.120   0.274
  439   HD13  LEU  50          HD13      LEU  50  78.090   3.226   1.611
  440   HD21  LEU  50          HD21      LEU  50  75.940   1.037   1.758
  441   HD22  LEU  50          HD22      LEU  50  77.701   0.905   1.801
  442   HD23  LEU  50          HD23      LEU  50  76.773  -0.005   0.591
  443    H    CYS  51           HN       CYS  51  75.014   1.006  -3.208
  444    HA   CYS  51           HA       CYS  51  72.672   2.470  -4.188
  445    HB2  CYS  51           HB2      CYS  51  72.730   0.923  -6.127
  446    HB3  CYS  51           HB1      CYS  51  74.190   1.897  -6.022
  447    HG   CYS  51           HG       CYS  51  74.178  -1.152  -4.602
  448    H    ILE  52           HN       ILE  52  70.756   1.414  -4.145
  449    HA   ILE  52           HA       ILE  52  70.594  -0.491  -2.011
  450    HB   ILE  52           HB       ILE  52  68.501   1.062  -3.498
  451   HG12  ILE  52          HG12      ILE  52  69.531   0.727  -0.777
  452   HG13  ILE  52          HG11      ILE  52  69.678   2.179  -1.817
  453   HG21  ILE  52          HG21      ILE  52  67.524  -1.206  -3.168
  454   HG22  ILE  52          HG22      ILE  52  66.761  -0.003  -2.127
  455   HG23  ILE  52          HG23      ILE  52  67.952  -1.121  -1.458
  456   HD11  ILE  52          HD11      ILE  52  67.399   0.960  -0.483
  457   HD12  ILE  52          HD12      ILE  52  67.262   2.360  -1.605
  458   HD13  ILE  52          HD13      ILE  52  68.178   2.488  -0.044
  459    H    VAL  53           HN       VAL  53  69.829  -2.302  -1.956
  460    HA   VAL  53           HA       VAL  53  70.118  -3.819  -4.375
  461    HB   VAL  53           HB       VAL  53  70.768  -5.619  -2.566
  462   HG11  VAL  53          HG11      VAL  53  73.109  -4.878  -2.809
  463   HG12  VAL  53          HG12      VAL  53  72.554  -3.271  -3.290
  464   HG13  VAL  53          HG13      VAL  53  72.246  -4.656  -4.336
  465   HG21  VAL  53          HG21      VAL  53  70.163  -4.166  -0.653
  466   HG22  VAL  53          HG22      VAL  53  71.386  -2.999  -1.169
  467   HG23  VAL  53          HG23      VAL  53  71.866  -4.593  -0.637
  468    H    TYR  54           HN       TYR  54  68.288  -4.428  -5.001
  469    HA   TYR  54           HA       TYR  54  66.154  -5.123  -3.189
  470    HB2  TYR  54           HB2      TYR  54  66.336  -4.888  -6.189
  471    HB3  TYR  54           HB1      TYR  54  64.881  -5.346  -5.306
  472    HD1  TYR  54           HD2      TYR  54  67.353  -2.579  -5.671
  473    HD2  TYR  54           HD1      TYR  54  63.464  -3.718  -4.376
  474    HE1  TYR  54           HE2      TYR  54  66.715  -0.189  -5.236
  475    HE2  TYR  54           HE1      TYR  54  62.928  -1.407  -4.023
  476    HH   TYR  54           HH       TYR  54  64.989   1.143  -4.874
  477    H    ARG  55           HN       ARG  55  65.938  -6.885  -2.562
  478    HA   ARG  55           HA       ARG  55  67.359  -9.061  -3.845
  479    HB2  ARG  55           HB2      ARG  55  66.698  -8.731  -1.129
  480    HB3  ARG  55           HB1      ARG  55  65.559  -9.913  -1.689
  481    HG2  ARG  55           HG2      ARG  55  68.572 -10.298  -2.003
  482    HG3  ARG  55           HG1      ARG  55  67.688 -10.867  -0.644
  483    HD2  ARG  55           HD2      ARG  55  66.201 -12.163  -2.277
  484    HD3  ARG  55           HD1      ARG  55  67.309 -11.653  -3.546
  485    HE   ARG  55           HE       ARG  55  68.579 -12.941  -1.328
  486   HH11  ARG  55          HH11      ARG  55  67.168 -13.424  -4.551
  487   HH12  ARG  55          HH12      ARG  55  67.752 -15.005  -4.726
  488   HH21  ARG  55          HH21      ARG  55  69.421 -15.088  -1.589
  489   HH22  ARG  55          HH22      ARG  55  69.098 -15.981  -3.008
  490    H    ASP  56           HN       ASP  56  66.082 -10.116  -5.491
  491    HA   ASP  56           HA       ASP  56  64.406 -10.722  -6.827
  492    HB2  ASP  56           HB2      ASP  56  63.392 -11.960  -4.965
  493    HB3  ASP  56           HB1      ASP  56  62.639 -10.479  -4.380
  494    H    GLY  57           HN       GLY  57  62.765  -8.409  -4.739
  495    HA2  GLY  57           HA2      GLY  57  63.099  -6.288  -6.502
  496    HA3  GLY  57           HA1      GLY  57  61.490  -6.978  -6.781
  497    H    ASN  58           HN       ASN  58  63.191  -6.839  -3.728
  498    HA   ASN  58           HA       ASN  58  61.168  -4.922  -2.754
  499    HB2  ASN  58           HB2      ASN  58  62.584  -6.979  -1.069
  500    HB3  ASN  58           HB1      ASN  58  61.159  -6.063  -0.650
  501   HD21  ASN  58          HD21      ASN  58  62.446  -8.725  -2.445
  502   HD22  ASN  58          HD22      ASN  58  60.969  -9.579  -2.608
  503    HA   PRO  59           HA       PRO  59  64.852  -2.844  -1.934
  504    HB2  PRO  59           HB2      PRO  59  63.611  -0.877  -0.266
  505    HB3  PRO  59           HB1      PRO  59  63.974  -0.763  -1.986
  506    HG2  PRO  59           HG2      PRO  59  61.347  -0.889  -1.087
  507    HG3  PRO  59           HG1      PRO  59  61.841  -1.490  -2.611
  508    HD2  PRO  59           HD2      PRO  59  61.497  -3.030  -0.112
  509    HD3  PRO  59           HD1      PRO  59  60.943  -3.407  -1.742
  510    H    TYR  60           HN       TYR  60  66.577  -3.078  -0.814
  511    HA   TYR  60           HA       TYR  60  66.263  -3.095   1.960
  512    HB2  TYR  60           HB2      TYR  60  67.923  -5.429   1.060
  513    HB3  TYR  60           HB1      TYR  60  67.149  -4.983   2.366
  514    HD1  TYR  60           HD2      TYR  60  65.026  -5.394   2.963
  515    HD2  TYR  60           HD1      TYR  60  66.403  -6.513  -0.827
  516    HE1  TYR  60           HE2      TYR  60  63.131  -6.973   2.755
  517    HE2  TYR  60           HE1      TYR  60  64.504  -8.090  -1.073
  518    HH   TYR  60           HH       TYR  60  61.900  -8.170   1.114
  519    H    ALA  61           HN       ALA  61  68.090  -2.888   2.879
  520    HA   ALA  61           HA       ALA  61  69.998  -1.270   1.477
  521    HB1  ALA  61           HB1      ALA  61  68.672  -0.609   3.451
  522    HB2  ALA  61           HB2      ALA  61  70.458  -0.505   3.630
  523    HB3  ALA  61           HB3      ALA  61  69.546  -1.882   4.302
  524    H    VAL  62           HN       VAL  62  72.183  -1.690   2.763
  525    HA   VAL  62           HA       VAL  62  72.701  -4.564   2.802
  526    HB   VAL  62           HB       VAL  62  74.433  -2.166   2.100
  527   HG11  VAL  62          HG11      VAL  62  75.701  -3.586   3.398
  528   HG12  VAL  62          HG12      VAL  62  76.246  -3.590   1.720
  529   HG13  VAL  62          HG13      VAL  62  75.334  -4.982   2.366
  530   HG21  VAL  62          HG21      VAL  62  73.049  -2.850   0.273
  531   HG22  VAL  62          HG22      VAL  62  73.614  -4.520   0.477
  532   HG23  VAL  62          HG23      VAL  62  74.736  -3.266  -0.043
  533    H    CYS  63           HN       CYS  63  72.669  -5.233   4.864
  534    HA   CYS  63           HA       CYS  63  72.843  -3.550   7.079
  535    HB2  CYS  63           HB2      CYS  63  72.528  -5.461   8.365
  536    HB3  CYS  63           HB1      CYS  63  71.900  -5.872   6.773
  537    H    ASP  64           HN       ASP  64  74.386  -4.021   8.952
  538    HA   ASP  64           HA       ASP  64  76.941  -2.939   8.558
  539    HB2  ASP  64           HB2      ASP  64  75.914  -3.065  10.767
  540    HB3  ASP  64           HB1      ASP  64  76.010  -4.811  10.740
  541    H    LYS  65           HN       LYS  65  76.068  -6.283   8.848
  542    HA   LYS  65           HA       LYS  65  78.583  -7.525   8.681
  543    HB2  LYS  65           HB2      LYS  65  75.934  -8.419   7.585
  544    HB3  LYS  65           HB1      LYS  65  77.315  -9.460   7.801
  545    HG2  LYS  65           HG2      LYS  65  77.150  -9.361  10.131
  546    HG3  LYS  65           HG1      LYS  65  76.008  -8.013  10.070
  547    HD2  LYS  65           HD2      LYS  65  74.805 -10.073  10.490
  548    HD3  LYS  65           HD1      LYS  65  74.431  -9.437   8.884
  549    HE2  LYS  65           HE2      LYS  65  76.030 -11.020   7.895
  550    HE3  LYS  65           HE1      LYS  65  76.317 -11.704   9.497
  551    HZ1  LYS  65           HZ1      LYS  65  73.961 -12.280   9.585
  552    HZ2  LYS  65           HZ2      LYS  65  74.762 -13.024   8.340
  553    HZ3  LYS  65           HZ3      LYS  65  73.744 -11.703   8.007
  554    H    CYS  66           HN       CYS  66  76.185  -6.879   6.198
  555    HA   CYS  66           HA       CYS  66  77.768  -7.891   4.122
  556    HB2  CYS  66           HB2      CYS  66  75.158  -6.444   4.238
  557    HB3  CYS  66           HB1      CYS  66  75.780  -7.058   2.723
  558    H    LEU  67           HN       LEU  67  77.340  -4.757   5.507
  559    HA   LEU  67           HA       LEU  67  78.207  -3.036   3.545
  560    HB2  LEU  67           HB2      LEU  67  78.511  -3.029   6.477
  561    HB3  LEU  67           HB1      LEU  67  79.272  -1.768   5.547
  562    HG   LEU  67           HG       LEU  67  76.324  -2.384   5.717
  563   HD11  LEU  67          HD11      LEU  67  77.293  -1.195   7.560
  564   HD12  LEU  67          HD12      LEU  67  76.271  -0.112   6.566
  565   HD13  LEU  67          HD13      LEU  67  78.046  -0.101   6.397
  566   HD21  LEU  67          HD21      LEU  67  76.029  -0.408   4.269
  567   HD22  LEU  67          HD22      LEU  67  76.771  -1.744   3.420
  568   HD23  LEU  67          HD23      LEU  67  77.763  -0.388   3.963
  569    H    LYS  68           HN       LYS  68  80.158  -5.011   5.703
  570    HA   LYS  68           HA       LYS  68  82.522  -4.016   4.428
  571    HB2  LYS  68           HB2      LYS  68  83.786  -5.559   5.892
  572    HB3  LYS  68           HB1      LYS  68  82.813  -4.366   6.738
  573    HG2  LYS  68           HG2      LYS  68  82.543  -6.284   8.010
  574    HG3  LYS  68           HG1      LYS  68  81.120  -6.322   6.974
  575    HD2  LYS  68           HD2      LYS  68  82.206  -7.925   5.507
  576    HD3  LYS  68           HD1      LYS  68  83.680  -7.830   6.470
  577    HE2  LYS  68           HE2      LYS  68  82.424  -8.662   8.430
  578    HE3  LYS  68           HE1      LYS  68  80.996  -8.837   7.413
  579    HZ1  LYS  68           HZ1      LYS  68  83.576 -10.235   7.011
  580    HZ2  LYS  68           HZ2      LYS  68  82.201 -10.468   6.079
  581    HZ3  LYS  68           HZ3      LYS  68  82.213 -10.925   7.703
  582    H    PHE  69           HN       PHE  69  80.382  -6.399   3.703
  583    HA   PHE  69           HA       PHE  69  82.009  -8.346   2.439
  584    HB2  PHE  69           HB2      PHE  69  79.240  -7.555   2.583
  585    HB3  PHE  69           HB1      PHE  69  79.671  -8.499   1.189
  586    HD1  PHE  69           HD2      PHE  69  80.347  -8.573   4.841
  587    HD2  PHE  69           HD1      PHE  69  79.049 -10.658   1.403
  588    HE1  PHE  69           HE2      PHE  69  79.943 -10.539   6.206
  589    HE2  PHE  69           HE1      PHE  69  78.616 -12.631   2.728
  590    HZ   PHE  69           HZ       PHE  69  79.055 -12.590   5.175
  591    H    TYR  70           HN       TYR  70  79.869  -5.701   1.323
  592    HA   TYR  70           HA       TYR  70  80.878  -6.098  -1.362
  593    HB2  TYR  70           HB2      TYR  70  78.157  -5.308  -0.397
  594    HB3  TYR  70           HB1      TYR  70  78.669  -5.199  -2.077
  595    HD1  TYR  70           HD1      TYR  70  79.362  -7.297  -3.260
  596    HD2  TYR  70           HD2      TYR  70  77.464  -7.381   0.539
  597    HE1  TYR  70           HE1      TYR  70  78.824  -9.641  -3.601
  598    HE2  TYR  70           HE2      TYR  70  76.910  -9.761   0.217
  599    HH   TYR  70           HH       TYR  70  76.582 -11.297  -1.674
  600    H    SER  71           HN       SER  71  82.417  -4.566  -1.526
  601    HA   SER  71           HA       SER  71  81.609  -1.782  -1.176
  602    HB2  SER  71           HB2      SER  71  83.850  -2.580  -0.288
  603    HB3  SER  71           HB1      SER  71  84.318  -2.927  -1.947
  604    HG   SER  71           HG       SER  71  83.341  -0.430  -1.691
  605    H    LYS  72           HN       LYS  72  81.734  -4.271  -3.362
  606    HA   LYS  72           HA       LYS  72  82.434  -3.186  -5.823
  607    HB2  LYS  72           HB2      LYS  72  82.167  -5.572  -5.383
  608    HB3  LYS  72           HB1      LYS  72  80.448  -5.350  -5.142
  609    HG2  LYS  72           HG2      LYS  72  80.892  -6.327  -7.306
  610    HG3  LYS  72           HG1      LYS  72  80.199  -4.718  -7.492
  611    HD2  LYS  72           HD2      LYS  72  82.396  -3.796  -7.957
  612    HD3  LYS  72           HD1      LYS  72  83.141  -5.367  -7.655
  613    HE2  LYS  72           HE2      LYS  72  81.139  -4.774  -9.830
  614    HE3  LYS  72           HE1      LYS  72  82.880  -4.882 -10.062
  615    HZ1  LYS  72           HZ1      LYS  72  81.067  -7.081  -9.190
  616    HZ2  LYS  72           HZ2      LYS  72  82.737  -7.204  -9.245
  617    HZ3  LYS  72           HZ3      LYS  72  81.868  -6.971 -10.669
  618    H    ILE  73           HN       ILE  73  79.117  -3.637  -4.482
  619    HA   ILE  73           HA       ILE  73  78.266  -1.865  -6.498
  620    HB   ILE  73           HB       ILE  73  75.981  -2.499  -5.420
  621   HG12  ILE  73          HG12      ILE  73  76.057  -5.018  -5.062
  622   HG13  ILE  73          HG11      ILE  73  77.754  -4.824  -4.693
  623   HG21  ILE  73          HG21      ILE  73  75.782  -4.272  -7.155
  624   HG22  ILE  73          HG22      ILE  73  77.532  -4.193  -7.371
  625   HG23  ILE  73          HG23      ILE  73  76.532  -2.788  -7.744
  626   HD11  ILE  73          HD11      ILE  73  75.449  -3.574  -3.197
  627   HD12  ILE  73          HD12      ILE  73  77.156  -3.296  -2.847
  628   HD13  ILE  73          HD13      ILE  73  76.464  -4.907  -2.643
  629    H    SER  74           HN       SER  74  78.589   0.143  -6.036
  630    HA   SER  74           HA       SER  74  77.160   1.187  -3.768
  631    HB2  SER  74           HB2      SER  74  80.089   1.788  -4.223
  632    HB3  SER  74           HB1      SER  74  79.068   2.592  -3.029
  633    HG   SER  74           HG       SER  74  78.816  -0.061  -2.825
  634    H    GLU  75           HN       GLU  75  79.211   2.185  -6.396
  635    HA   GLU  75           HA       GLU  75  77.302   4.362  -6.903
  636    HB2  GLU  75           HB2      GLU  75  79.092   5.408  -8.258
  637    HB3  GLU  75           HB1      GLU  75  79.536   5.201  -6.575
  638    HG2  GLU  75           HG2      GLU  75  80.991   3.414  -7.099
  639    HG3  GLU  75           HG1      GLU  75  80.364   3.309  -8.747
  640    H    TYR  76           HN       TYR  76  76.750   1.739  -7.596
  641    HA   TYR  76           HA       TYR  76  77.391   1.293 -10.373
  642    HB2  TYR  76           HB2      TYR  76  77.187  -0.528  -8.714
  643    HB3  TYR  76           HB1      TYR  76  75.460  -0.191  -8.587
  644    HD1  TYR  76           HD2      TYR  76  77.932  -0.608 -11.323
  645    HD2  TYR  76           HD1      TYR  76  74.150  -1.723  -9.757
  646    HE1  TYR  76           HE2      TYR  76  77.594  -2.037 -13.241
  647    HE2  TYR  76           HE1      TYR  76  73.778  -3.192 -11.697
  648    HH   TYR  76           HH       TYR  76  76.296  -4.017 -13.806
  649    H    ARG  77           HN       ARG  77  76.452   2.425 -11.899
  650    HA   ARG  77           HA       ARG  77  73.639   2.518 -11.957
  651    HB2  ARG  77           HB2      ARG  77  73.381   4.865 -12.392
  652    HB3  ARG  77           HB1      ARG  77  74.244   4.722 -10.881
  653    HG2  ARG  77           HG2      ARG  77  75.584   5.151 -13.474
  654    HG3  ARG  77           HG1      ARG  77  74.977   6.518 -12.515
  655    HD2  ARG  77           HD2      ARG  77  76.455   5.705 -10.666
  656    HD3  ARG  77           HD1      ARG  77  77.083   4.485 -11.771
  657    HE   ARG  77           HE       ARG  77  77.332   7.016 -12.940
  658   HH11  ARG  77          HH11      ARG  77  78.740   5.046 -10.399
  659   HH12  ARG  77          HH12      ARG  77  80.255   5.823 -10.356
  660   HH21  ARG  77          HH21      ARG  77  79.427   8.143 -12.939
  661   HH22  ARG  77          HH22      ARG  77  80.638   7.667 -11.851
  662    H    HIS  78           HN       HIS  78  72.988   2.061 -13.815
  663    HA   HIS  78           HA       HIS  78  74.833   2.264 -16.013
  664    HB2  HIS  78           HB2      HIS  78  74.017  -0.006 -16.712
  665    HB3  HIS  78           HB1      HIS  78  75.025   0.007 -15.239
  666    HD1  HIS  78           HD1      HIS  78  71.824  -1.128 -16.665
  667    HD2  HIS  78           HD2      HIS  78  73.496  -0.350 -13.019
  668    HE1  HIS  78           HE1      HIS  78  70.312  -2.303 -15.005
  669    H    TYR  79           HN       TYR  79  72.659   3.887 -15.335
  670    HA   TYR  79           HA       TYR  79  70.251   2.832 -16.561
  671    HB2  TYR  79           HB2      TYR  79  70.691   5.133 -14.702
  672    HB3  TYR  79           HB1      TYR  79  69.121   4.652 -15.337
  673    HD1  TYR  79           HD2      TYR  79  72.026   3.324 -13.429
  674    HD2  TYR  79           HD1      TYR  79  67.867   3.066 -14.195
  675    HE1  TYR  79           HE2      TYR  79  71.803   1.752 -11.597
  676    HE2  TYR  79           HE1      TYR  79  67.640   1.459 -12.375
  677    HH   TYR  79           HH       TYR  79  69.214  -0.171 -11.211
  678    H    SER  80           HN       SER  80  69.033   4.114 -17.943
  679    HA   SER  80           HA       SER  80  68.569   5.430 -19.651
  680    HB2  SER  80           HB2      SER  80  70.511   7.374 -18.380
  681    HB3  SER  80           HB1      SER  80  69.249   7.770 -19.550
  682    HG   SER  80           HG       SER  80  69.098   7.434 -16.873