*HEADER    SIGNALING PROTEIN                       17-NOV-10   2L6A              
*TITLE     THREE-DIMENSIONAL STRUCTURE OF THE N-TERMINAL EFFECTOR PYRIN DOMAIN OF
*TITLE    2 NLRP12                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NACHT, LRR AND PYD DOMAINS-CONTAINING PROTEIN 12;          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 1-98;                                         
*COMPND   5 SYNONYM: MONARCH-1, PYRIN-CONTAINING APAF1-LIKE PROTEIN 7, REGULATED 
*COMPND   6 BY NITRIC OXIDE;                                                     
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: NLRP12, NALP12, PYPAF7, RNO;                                   
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3)-RIL;                            
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PHIS PARALLEL STOP                         
*KEYWDS    NLRP12, PYRIN, DEATH DOMAIN, SIGNALING PROTEIN                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    A.S.PINHEIRO, W.PETI                                                  
*REVDAT   1   02-NOV-11 2L6A    0                                                


! Distance constraint file from UNIO
! UNIO version 1.0.2
! File format   : cns
! File generated: 2010 October 28th, 13:59:42

assign  ((resid   36 and name HB   )) ((resid   37 and name HN   ))   4.52  2.72  0.00 ! #SUP  1.00
assign  ((resid   36 and name HN   )) ((resid   36 and name HB   ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   17 and name HN   )) ((resid   17 and name HB   ))   3.21  1.41  0.00 ! #SUP  1.00
assign  ((resid   17 and name HB   )) ((resid   18 and name HN   ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   17 and name HB   )) ((resid   18 and name HD*  ))   4.20  2.40  0.00 ! #SUP  1.00
assign  ((resid   38 and name HN   )) ((resid   38 and name HB   ))   3.82  2.02  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   68 and name HA   ))   4.23  2.43  0.00 ! #SUP  1.00
assign  ((resid   17 and name HA   )) ((resid   20 and name HN   ))   3.98  2.18  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   64 and name HA   ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   55 and name HA   )) ((resid   58 and name HN   ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   19 and name HB2  )) ((resid   55 and name HA   ))   3.98  2.18  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD1* )) ((resid   55 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   68 and name HA   )) ((resid   71 and name HN   ))   4.78  2.98  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   68 and name HA   ))   3.16  1.36  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   63 and name HG12 ))   3.48  1.68  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   71 and name HB*  ))   3.07  1.27  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   63 and name HD1* ))   2.91  1.11  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   66 and name HB2  ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   25 and name HA   )) ((resid   29 and name HN   ))   5.36  3.56  0.00 ! #SUP  1.00
assign  ((resid   25 and name HA   )) ((resid   28 and name HN   ))   3.83  2.03  0.00 ! #SUP  1.00
assign  ((resid   25 and name HA   )) ((resid   25 and name HG2* ))   2.98  1.18  0.00 ! #SUP  1.00
assign  ((resid   46 and name HA   )) ((resid   47 and name HB1  ))   5.00  3.20  0.00 ! #SUP  1.00
assign  ((resid   18 and name HA   )) ((resid   20 and name HN   ))   4.55  2.75  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   49 and name HB*  ))   3.71  1.91  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   46 and name HA   ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   18 and name HA   )) ((resid   18 and name HD*  ))   3.60  1.80  0.00 ! #SUP  1.00
assign  ((resid   18 and name HA   )) ((resid   79 and name HZ   ))   5.37  3.57  0.00 ! #SUP  1.00
assign  ((resid   18 and name HA   )) ((resid   21 and name HG*  ))   3.53  1.73  0.00 ! #SUP  1.00
assign  ((resid   17 and name HG2* )) ((resid   18 and name HA   ))   4.27  2.47  0.00 ! #SUP  1.00
assign  ((resid   18 and name HA   )) ((resid   87 and name HD1* ))   4.89  3.09  0.00 ! #SUP  1.00
assign  ((resid   77 and name HB*  )) ((resid   78 and name HN   ))   3.73  1.93  0.00 ! #SUP  1.00
assign  ((resid   74 and name HD2* )) ((resid   77 and name HB*  ))   5.27  3.47  0.00 ! #SUP  1.00
assign  ((resid   97 and name HA   )) ((resid   97 and name HG*  ))   3.26  1.46  0.00 ! #SUP  1.00
assign  ((resid   88 and name HA   )) ((resid   88 and name HD1  ))   4.27  2.47  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   88 and name HA   ))   3.48  1.68  0.00 ! #SUP  1.00
assign  ((resid   13 and name HA   )) ((resid   13 and name HB*  ))   2.94  1.14  0.00 ! #SUP  1.00
assign  ((resid   13 and name HA   )) ((resid   59 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   33 and name HA   )) ((resid   36 and name HN   ))   4.55  2.75  0.00 ! #SUP  1.00
assign  ((resid   33 and name HA   )) ((resid   36 and name HG2* ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   32 and name HD1* )) ((resid   33 and name HA   ))   5.39  3.59  0.00 ! #SUP  1.00
assign  ((resid   33 and name HA   )) ((resid   82 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   32 and name HD2* )) ((resid   33 and name HA   ))   5.39  3.59  0.00 ! #SUP  1.00
assign  ((resid   30 and name HA   )) ((resid   82 and name HD1* ))   3.99  2.19  0.00 ! #SUP  1.00
assign  ((resid   30 and name HA   )) ((resid   82 and name HG2* ))   3.31  1.51  0.00 ! #SUP  1.00
assign  ((resid   30 and name HA   )) ((resid   78 and name HG2* ))   3.20  1.40  0.00 ! #SUP  1.00
assign  ((resid   30 and name HA   )) ((resid   30 and name HD*  ))   3.66  1.86  0.00 ! #SUP  1.00
assign  ((resid   82 and name HA   )) ((resid   82 and name HG2* ))   3.01  1.21  0.00 ! #SUP  1.00
assign  ((resid   77 and name HA   )) ((resid   79 and name HN   ))   4.61  2.81  0.00 ! #SUP  1.00
assign  ((resid   77 and name HA   )) ((resid   80 and name HN   ))   4.23  2.43  0.00 ! #SUP  1.00
assign  ((resid   77 and name HA   )) ((resid   77 and name HB*  ))   2.82  1.02  0.00 ! #SUP  1.00
assign  ((resid   77 and name HA   )) ((resid   80 and name HG*  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   77 and name HA   )) ((resid   80 and name HB1  ))   4.81  3.01  0.00 ! #SUP  1.00
assign  ((resid   30 and name HA   )) ((resid   33 and name HB2  ))   4.62  2.82  0.00 ! #SUP  1.00
assign  ((resid   30 and name HA   )) ((resid   33 and name HB1  ))   4.62  2.82  0.00 ! #SUP  1.00
assign  ((resid   51 and name HA   )) ((resid   53 and name HN   ))   4.74  2.94  0.00 ! #SUP  1.00
assign  ((resid   51 and name HA   )) ((resid   51 and name HG1  ))   3.91  2.11  0.00 ! #SUP  1.00
assign  ((resid   51 and name HA   )) ((resid   51 and name HG2  ))   3.91  2.11  0.00 ! #SUP  1.00
assign  ((resid   28 and name HA   )) ((resid   31 and name HN   ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   28 and name HA   )) ((resid   31 and name HB1  ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   80 and name HA   )) ((resid   85 and name HN   ))   4.73  2.93  0.00 ! #SUP  1.00
assign  ((resid   80 and name HA   )) ((resid   85 and name HA   ))   3.54  1.74  0.00 ! #SUP  1.00
assign  ((resid   80 and name HA   )) ((resid   80 and name HG*  ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   49 and name HA   )) ((resid   49 and name HB*  ))   2.93  1.13  0.00 ! #SUP  1.00
assign  ((resid   69 and name HA   )) ((resid   72 and name HN   ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid   69 and name HA   )) ((resid   72 and name HB1  ))   3.73  1.93  0.00 ! #SUP  1.00
assign  ((resid   69 and name HA   )) ((resid   69 and name HG1  ))   4.15  2.35  0.00 ! #SUP  1.00
assign  ((resid   69 and name HA   )) ((resid   69 and name HB*  ))   2.99  1.19  0.00 ! #SUP  1.00
assign  ((resid   28 and name HA   )) ((resid   32 and name HN   ))   5.06  3.26  0.00 ! #SUP  1.00
assign  ((resid   64 and name HG2* )) ((resid   65 and name HA   ))   4.08  2.28  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   65 and name HA   ))   5.46  3.66  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   57 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   57 and name HA   )) ((resid   61 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   29 and name HA   )) ((resid   32 and name HN   ))   4.27  2.47  0.00 ! #SUP  1.00
assign  ((resid   29 and name HA   )) ((resid   33 and name HN   ))   4.83  3.03  0.00 ! #SUP  1.00
assign  ((resid   57 and name HA   )) ((resid   57 and name HG2  ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   29 and name HA   )) ((resid   32 and name HD1* ))   4.55  2.75  0.00 ! #SUP  1.00
assign  ((resid   30 and name HD*  )) ((resid   31 and name HA   ))   3.88  2.08  0.00 ! #SUP  1.00
assign  ((resid   31 and name HA   )) ((resid   34 and name HG   ))   3.75  1.95  0.00 ! #SUP  1.00
assign  ((resid   31 and name HA   )) ((resid   34 and name HD2* ))   3.57  1.77  0.00 ! #SUP  1.00
assign  ((resid   73 and name HA   )) ((resid   76 and name HB1  ))   4.43  2.63  0.00 ! #SUP  1.00
assign  ((resid   73 and name HA   )) ((resid   76 and name HD2* ))   3.79  1.99  0.00 ! #SUP  1.00
assign  ((resid   57 and name HA   )) ((resid   57 and name HG1  ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   29 and name HA   )) ((resid   32 and name HD2* ))   4.55  2.75  0.00 ! #SUP  1.00
assign  ((resid   85 and name HA   )) ((resid   89 and name HN   ))   4.31  2.51  0.00 ! #SUP  1.00
assign  ((resid   71 and name HB*  )) ((resid   72 and name HA   ))   4.94  3.14  0.00 ! #SUP  1.00
assign  ((resid   72 and name HA   )) ((resid   75 and name HN   ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   72 and name HA   )) ((resid   72 and name HE3  ))   3.19  1.39  0.00 ! #SUP  1.00
assign  ((resid   72 and name HA   )) ((resid   75 and name HB*  ))   3.73  1.93  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD1* )) ((resid   72 and name HA   ))   4.42  2.62  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD2* )) ((resid   72 and name HA   ))   4.42  2.62  0.00 ! #SUP  1.00
assign  ((resid   61 and name HA   )) ((resid   64 and name HN   ))   4.45  2.65  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   64 and name HN   ))   4.82  3.02  0.00 ! #SUP  1.00
assign  ((resid   85 and name HA   )) ((resid   88 and name HN   ))   3.52  1.72  0.00 ! #SUP  1.00
assign  ((resid   85 and name HA   )) ((resid   88 and name HB2  ))   3.58  1.78  0.00 ! #SUP  1.00
assign  ((resid   85 and name HA   )) ((resid   88 and name HB1  ))   3.58  1.78  0.00 ! #SUP  1.00
assign  ((resid   66 and name HA   )) ((resid   66 and name HD*  ))   3.22  1.42  0.00 ! #SUP  1.00
assign  ((resid   15 and name HA   )) ((resid   18 and name HN   ))   4.23  2.43  0.00 ! #SUP  1.00
assign  ((resid   15 and name HA   )) ((resid   18 and name HD*  ))   4.13  2.33  0.00 ! #SUP  1.00
assign  ((resid   15 and name HA   )) ((resid   15 and name HD1* ))   4.08  2.28  0.00 ! #SUP  1.00
assign  ((resid   15 and name HA   )) ((resid   72 and name HZ3  ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   66 and name HD*  ))   3.57  1.77  0.00 ! #SUP  1.00
assign  ((resid   61 and name HA   )) ((resid   65 and name HD2  ))   4.38  2.58  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   65 and name HD2  ))   4.84  3.04  0.00 ! #SUP  1.00
assign  ((resid   60 and name HA   )) ((resid   64 and name HN   ))   4.63  2.83  0.00 ! #SUP  1.00
assign  ((resid   45 and name HA   )) ((resid   46 and name HD2  ))   3.15  1.35  0.00 ! #SUP  1.00
assign  ((resid   45 and name HA   )) ((resid   45 and name HD1* ))   3.80  2.00  0.00 ! #SUP  1.00
assign  ((resid   79 and name HA   )) ((resid   82 and name HN   ))   4.28  2.48  0.00 ! #SUP  1.00
assign  ((resid   79 and name HA   )) ((resid   82 and name HG12 ))   3.58  1.78  0.00 ! #SUP  1.00
assign  ((resid   79 and name HA   )) ((resid   82 and name HG11 ))   3.58  1.78  0.00 ! #SUP  1.00
assign  ((resid   79 and name HA   )) ((resid   82 and name HG2* ))   4.85  3.05  0.00 ! #SUP  1.00
assign  ((resid   56 and name HA   )) ((resid   56 and name HD2* ))   4.58  2.78  0.00 ! #SUP  1.00
assign  ((resid   32 and name HA   )) ((resid   32 and name HD1* ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   32 and name HA   )) ((resid   32 and name HD2* ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   20 and name HA   )) ((resid   20 and name HG2  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   81 and name HA   )) ((resid   81 and name HB*  ))   2.81  1.01  0.00 ! #SUP  1.00
assign  ((resid   19 and name HA   )) ((resid   19 and name HG   ))   3.63  1.83  0.00 ! #SUP  1.00
assign  ((resid   45 and name HA   )) ((resid   45 and name HG12 ))   3.83  2.03  0.00 ! #SUP  1.00
assign  ((resid   45 and name HA   )) ((resid   45 and name HG11 ))   3.89  2.09  0.00 ! #SUP  1.00
assign  ((resid   76 and name HA   )) ((resid   79 and name HD*  ))   3.36  1.56  0.00 ! #SUP  1.00
assign  ((resid   76 and name HA   )) ((resid   88 and name HA   ))   5.00  3.20  0.00 ! #SUP  1.00
assign  ((resid   66 and name HD*  )) ((resid   70 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   70 and name HA   )) ((resid   73 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   70 and name HA   )) ((resid   74 and name HN   ))   4.76  2.96  0.00 ! #SUP  1.00
assign  ((resid   70 and name HA   )) ((resid   73 and name HN   ))   3.76  1.96  0.00 ! #SUP  1.00
assign  ((resid   27 and name HA   )) ((resid   30 and name HB1  ))   3.70  1.90  0.00 ! #SUP  1.00
assign  ((resid   27 and name HA   )) ((resid   30 and name HD*  ))   4.23  2.43  0.00 ! #SUP  1.00
assign  ((resid   27 and name HA   )) ((resid   30 and name HB2  ))   5.23  3.43  0.00 ! #SUP  1.00
assign  ((resid   27 and name HA   )) ((resid   27 and name HD2* ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid   94 and name HA   )) ((resid   94 and name HB*  ))   2.97  1.17  0.00 ! #SUP  1.00
assign  ((resid   24 and name HA   )) ((resid   27 and name HN   ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   87 and name HA   )) ((resid   91 and name HN   ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   92 and name HA   )) ((resid   95 and name HN   ))   4.97  3.17  0.00 ! #SUP  1.00
assign  ((resid   33 and name HD*  )) ((resid   34 and name HA   ))   5.03  3.23  0.00 ! #SUP  1.00
assign  ((resid   42 and name HA   )) ((resid   42 and name HG*  ))   3.35  1.55  0.00 ! #SUP  1.00
assign  ((resid   93 and name HA   )) ((resid   95 and name HN   ))   4.67  2.87  0.00 ! #SUP  1.00
assign  ((resid   44 and name HA   )) ((resid   44 and name HB*  ))   2.84  1.04  0.00 ! #SUP  1.00
assign  ((resid   44 and name HA   )) ((resid   45 and name HD1* ))   5.48  3.68  0.00 ! #SUP  1.00
assign  ((resid   24 and name HA   )) ((resid   26 and name HN   ))   4.71  2.91  0.00 ! #SUP  1.00
assign  ((resid   87 and name HA   )) ((resid   90 and name HN   ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid   86 and name HA   )) ((resid   89 and name HN   ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   97 and name HG*  )) ((resid   98 and name HA   ))   4.87  3.07  0.00 ! #SUP  1.00
assign  ((resid   50 and name HA   )) ((resid   53 and name HB*  ))   3.11  1.31  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   87 and name HA   ))   5.35  3.55  0.00 ! #SUP  1.00
assign  ((resid   58 and name HA   )) ((resid   61 and name HB1  ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   58 and name HA   )) ((resid   61 and name HD1* ))   4.13  2.33  0.00 ! #SUP  1.00
assign  ((resid   15 and name HG   )) ((resid   59 and name HA   ))   4.40  2.60  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB2  )) ((resid   71 and name HA   ))   4.07  2.27  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB2  )) ((resid   71 and name HA   ))   4.65  2.85  0.00 ! #SUP  1.00
assign  ((resid   71 and name HA   )) ((resid   74 and name HB1  ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   71 and name HA   )) ((resid   74 and name HG   ))   4.32  2.52  0.00 ! #SUP  1.00
assign  ((resid   71 and name HA   )) ((resid   74 and name HB2  ))   3.25  1.45  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD1* )) ((resid   71 and name HA   ))   4.65  2.85  0.00 ! #SUP  1.00
assign  ((resid   71 and name HA   )) ((resid   74 and name HD2* ))   4.27  2.47  0.00 ! #SUP  1.00
assign  ((resid   30 and name HD*  )) ((resid   75 and name HA   ))   3.60  1.80  0.00 ! #SUP  1.00
assign  ((resid   30 and name HE*  )) ((resid   75 and name HA   ))   3.34  1.54  0.00 ! #SUP  1.00
assign  ((resid   75 and name HA   )) ((resid   78 and name HB   ))   3.54  1.74  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD2* )) ((resid   75 and name HA   ))   4.68  2.88  0.00 ! #SUP  1.00
assign  ((resid   75 and name HA   )) ((resid   78 and name HG2* ))   4.90  3.10  0.00 ! #SUP  1.00
assign  ((resid   40 and name HA   )) ((resid   40 and name HG   ))   3.64  1.84  0.00 ! #SUP  1.00
assign  ((resid   96 and name HA   )) ((resid   96 and name HG   ))   3.64  1.84  0.00 ! #SUP  1.00
assign  ((resid   75 and name HA   )) ((resid   77 and name HN   ))   4.52  2.72  0.00 ! #SUP  1.00
assign  ((resid   75 and name HA   )) ((resid   78 and name HN   ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   83 and name HA   )) ((resid   84 and name HN   ))   3.30  1.50  0.00 ! #SUP  1.00
assign  ((resid   22 and name HA   )) ((resid   23 and name HN   ))   2.99  1.19  0.00 ! #SUP  1.00
assign  ((resid   22 and name HA   )) ((resid   26 and name HB1  ))   4.06  2.26  0.00 ! #SUP  1.00
assign  ((resid   37 and name HA   )) ((resid   39 and name HN   ))   4.78  2.98  0.00 ! #SUP  1.00
assign  ((resid   53 and name HA   )) ((resid   57 and name HN   ))   5.13  3.33  0.00 ! #SUP  1.00
assign  ((resid   53 and name HA   )) ((resid   57 and name HB2  ))   3.73  1.93  0.00 ! #SUP  1.00
assign  ((resid   53 and name HA   )) ((resid   57 and name HB1  ))   3.73  1.93  0.00 ! #SUP  1.00
assign  ((resid   84 and name HA   )) ((resid   86 and name HN   ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   84 and name HA   )) ((resid   84 and name HD2  ))   3.66  1.86  0.00 ! #SUP  1.00
assign  ((resid   84 and name HA   )) ((resid   84 and name HD1  ))   3.66  1.86  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   46 and name HD1  ))   4.23  2.43  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG12 )) ((resid   46 and name HD2  ))   5.05  3.25  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   46 and name HD2  ))   3.33  1.53  0.00 ! #SUP  1.00
assign  ((resid   67 and name HA2  )) ((resid   68 and name HD2  ))   3.44  1.64  0.00 ! #SUP  1.00
assign  ((resid   67 and name HA1  )) ((resid   68 and name HD2  ))   3.44  1.64  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   68 and name HD2  ))   4.01  2.21  0.00 ! #SUP  1.00
assign  ((resid   68 and name HD1  )) ((resid   69 and name HN   ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   68 and name HD1  ))   4.01  2.21  0.00 ! #SUP  1.00
assign  ((resid   67 and name HA2  )) ((resid   68 and name HD1  ))   3.44  1.64  0.00 ! #SUP  1.00
assign  ((resid   67 and name HA1  )) ((resid   68 and name HD1  ))   3.44  1.64  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   55 and name HD2  ))   5.13  3.33  0.00 ! #SUP  1.00
assign  ((resid   54 and name HA2  )) ((resid   55 and name HD2  ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid   54 and name HA2  )) ((resid   55 and name HD1  ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid   91 and name HA1  )) ((resid   94 and name HB*  ))   4.89  3.09  0.00 ! #SUP  1.00
assign  ((resid   72 and name HZ2  )) ((resid   91 and name HA2  ))   4.09  2.29  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   91 and name HA2  ))   4.79  2.99  0.00 ! #SUP  1.00
assign  ((resid   72 and name HZ2  )) ((resid   91 and name HA1  ))   4.09  2.29  0.00 ! #SUP  1.00
assign  ((resid   91 and name HA1  )) ((resid   94 and name HG*  ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   91 and name HA2  )) ((resid   94 and name HB*  ))   4.89  3.09  0.00 ! #SUP  1.00
assign  ((resid   48 and name HA1  )) ((resid   50 and name HN   ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA1  )) ((resid   36 and name HG2* ))   4.90  3.10  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA2  )) ((resid   37 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   67 and name HA2  ))   4.81  3.01  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   67 and name HA1  ))   4.81  3.01  0.00 ! #SUP  1.00
assign  ((resid   54 and name HA1  )) ((resid   55 and name HD1  ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid   90 and name HA   )) ((resid   90 and name HD2  ))   5.15  3.35  0.00 ! #SUP  1.00
assign  ((resid   90 and name HB1  )) ((resid   90 and name HD2  ))   4.14  2.34  0.00 ! #SUP  1.00
assign  ((resid   90 and name HA   )) ((resid   90 and name HD1  ))   5.15  3.35  0.00 ! #SUP  1.00
assign  ((resid   90 and name HB1  )) ((resid   90 and name HD1  ))   4.14  2.34  0.00 ! #SUP  1.00
assign  ((resid   54 and name HA1  )) ((resid   55 and name HD2  ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid   93 and name HN   )) ((resid   93 and name HD*  ))   4.64  2.84  0.00 ! #SUP  1.00
assign  ((resid   93 and name HA   )) ((resid   93 and name HD*  ))   4.42  2.62  0.00 ! #SUP  1.00
assign  ((resid   93 and name HB2  )) ((resid   93 and name HD*  ))   3.80  2.00  0.00 ! #SUP  1.00
assign  ((resid   98 and name HA   )) ((resid   98 and name HD*  ))   5.20  3.40  0.00 ! #SUP  1.00
assign  ((resid   97 and name HG*  )) ((resid   98 and name HD*  ))   4.84  3.04  0.00 ! #SUP  1.00
assign  ((resid   81 and name HA   )) ((resid   81 and name HD*  ))   4.10  2.30  0.00 ! #SUP  1.00
assign  ((resid   33 and name HE*  )) ((resid   81 and name HD*  ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   78 and name HA   )) ((resid   81 and name HD*  ))   4.26  2.46  0.00 ! #SUP  1.00
assign  ((resid   78 and name HG2* )) ((resid   81 and name HD*  ))   4.45  2.65  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB2  )) ((resid   63 and name HN   ))   4.08  2.28  0.00 ! #SUP  1.00
assign  ((resid   59 and name HA   )) ((resid   62 and name HB2  ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid   61 and name HN   )) ((resid   61 and name HB2  ))   3.58  1.78  0.00 ! #SUP  1.00
assign  ((resid   58 and name HA   )) ((resid   61 and name HB2  ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   61 and name HN   )) ((resid   61 and name HB1  ))   3.58  1.78  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB1  )) ((resid   63 and name HN   ))   4.97  3.17  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG2* )) ((resid   28 and name HE*  ))   5.06  3.26  0.00 ! #SUP  1.00
assign  ((resid   28 and name HG2  )) ((resid   28 and name HE*  ))   3.97  2.17  0.00 ! #SUP  1.00
assign  ((resid   28 and name HG1  )) ((resid   28 and name HE*  ))   3.97  2.17  0.00 ! #SUP  1.00
assign  ((resid   44 and name HG2  )) ((resid   44 and name HE*  ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid   52 and name HG*  )) ((resid   52 and name HE*  ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   25 and name HB   )) ((resid   29 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   44 and name HA   )) ((resid   44 and name HE*  ))   4.09  2.29  0.00 ! #SUP  1.00
assign  ((resid   12 and name HB1  )) ((resid   13 and name HN   ))   3.93  2.13  0.00 ! #SUP  1.00
assign  ((resid   32 and name HB1  )) ((resid   32 and name HD1* ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   32 and name HB1  )) ((resid   32 and name HD2* ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   74 and name HB2  )) ((resid   75 and name HN   ))   3.91  2.11  0.00 ! #SUP  1.00
assign  ((resid   34 and name HN   )) ((resid   34 and name HB2  ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   34 and name HB2  )) ((resid   34 and name HD1* ))   3.31  1.51  0.00 ! #SUP  1.00
assign  ((resid   74 and name HB2  )) ((resid   74 and name HD2* ))   3.50  1.70  0.00 ! #SUP  1.00
assign  ((resid   34 and name HB1  )) ((resid   34 and name HD2* ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   34 and name HB1  )) ((resid   78 and name HG2* ))   3.89  2.09  0.00 ! #SUP  1.00
assign  ((resid   34 and name HN   )) ((resid   34 and name HB1  ))   3.88  2.08  0.00 ! #SUP  1.00
assign  ((resid   74 and name HB1  )) ((resid   75 and name HN   ))   4.33  2.53  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD2* )) ((resid   74 and name HB1  ))   4.90  3.10  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   74 and name HB1  ))   5.05  3.25  0.00 ! #SUP  1.00
assign  ((resid   79 and name HB1  )) ((resid   87 and name HB1  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   19 and name HB2  )) ((resid   19 and name HD1* ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   76 and name HB1  )) ((resid   76 and name HD2* ))   3.71  1.91  0.00 ! #SUP  1.00
assign  ((resid   76 and name HB1  )) ((resid   77 and name HN   ))   4.15  2.35  0.00 ! #SUP  1.00
assign  ((resid   76 and name HB2  )) ((resid   77 and name HN   ))   4.74  2.94  0.00 ! #SUP  1.00
assign  ((resid   76 and name HB2  )) ((resid   88 and name HD1  ))   5.07  3.27  0.00 ! #SUP  1.00
assign  ((resid   76 and name HN   )) ((resid   76 and name HB2  ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   76 and name HB2  )) ((resid   76 and name HD1* ))   3.47  1.67  0.00 ! #SUP  1.00
assign  ((resid   19 and name HB1  )) ((resid   55 and name HA   ))   3.98  2.18  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB1  )) ((resid   70 and name HB2  ))   3.70  1.90  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB1  )) ((resid   71 and name HB*  ))   4.76  2.96  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB1  )) ((resid   74 and name HB2  ))   5.47  3.67  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB1  )) ((resid   71 and name HA   ))   4.93  3.13  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB2  )) ((resid   67 and name HN   ))   4.29  2.49  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB2  )) ((resid   26 and name HB1  ))   4.54  2.74  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB2  )) ((resid   23 and name HN   ))   4.76  2.96  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB1  )) ((resid   23 and name HN   ))   4.76  2.96  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB1  )) ((resid   26 and name HB1  ))   4.01  2.21  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB1  )) ((resid   22 and name HD2* ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   27 and name HB1  )) ((resid   28 and name HN   ))   4.50  2.70  0.00 ! #SUP  1.00
assign  ((resid   30 and name HN   )) ((resid   30 and name HB2  ))   3.65  1.85  0.00 ! #SUP  1.00
assign  ((resid   30 and name HB2  )) ((resid   31 and name HN   ))   4.50  2.70  0.00 ! #SUP  1.00
assign  ((resid   30 and name HB1  )) ((resid   31 and name HN   ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid   30 and name HB1  )) ((resid   82 and name HG2* ))   4.25  2.45  0.00 ! #SUP  1.00
assign  ((resid   18 and name HN   )) ((resid   18 and name HB1  ))   3.94  2.14  0.00 ! #SUP  1.00
assign  ((resid   18 and name HB1  )) ((resid   79 and name HZ   ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   18 and name HB1  )) ((resid   79 and name HE*  ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   33 and name HB2  )) ((resid   81 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   33 and name HB2  )) ((resid   34 and name HN   ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid   33 and name HB2  )) ((resid   82 and name HG2* ))   4.32  2.52  0.00 ! #SUP  1.00
assign  ((resid   33 and name HB1  )) ((resid   82 and name HG2* ))   4.32  2.52  0.00 ! #SUP  1.00
assign  ((resid   33 and name HN   )) ((resid   33 and name HB1  ))   3.41  1.61  0.00 ! #SUP  1.00
assign  ((resid   33 and name HB1  )) ((resid   34 and name HN   ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid   82 and name HB   )) ((resid   82 and name HD1* ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   63 and name HB   )) ((resid   68 and name HA   ))   4.98  3.18  0.00 ! #SUP  1.00
assign  ((resid   60 and name HA   )) ((resid   63 and name HB   ))   3.79  1.99  0.00 ! #SUP  1.00
assign  ((resid   79 and name HB1  )) ((resid   87 and name HB2  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   69 and name HN   )) ((resid   69 and name HG2  ))   3.93  2.13  0.00 ! #SUP  1.00
assign  ((resid   69 and name HA   )) ((resid   69 and name HG2  ))   4.15  2.35  0.00 ! #SUP  1.00
assign  ((resid   20 and name HA   )) ((resid   20 and name HG1  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   57 and name HG1  ))   4.72  2.92  0.00 ! #SUP  1.00
assign  ((resid   79 and name HB1  )) ((resid   84 and name HB2  ))   4.88  3.08  0.00 ! #SUP  1.00
assign  ((resid   83 and name HN   )) ((resid   83 and name HB2  ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   88 and name HE3  )) ((resid   89 and name HG2  ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   89 and name HA   )) ((resid   89 and name HG2  ))   3.95  2.15  0.00 ! #SUP  1.00
assign  ((resid   69 and name HN   )) ((resid   69 and name HG1  ))   3.93  2.13  0.00 ! #SUP  1.00
assign  ((resid   89 and name HN   )) ((resid   89 and name HG1  ))   4.09  2.29  0.00 ! #SUP  1.00
assign  ((resid   88 and name HE3  )) ((resid   89 and name HG1  ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   89 and name HA   )) ((resid   89 and name HG1  ))   3.95  2.15  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   26 and name HG1  ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   23 and name HA   )) ((resid   23 and name HG1  ))   4.09  2.29  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG1* )) ((resid   26 and name HG1  ))   4.85  3.05  0.00 ! #SUP  1.00
assign  ((resid   94 and name HN   )) ((resid   94 and name HG*  ))   3.76  1.96  0.00 ! #SUP  1.00
assign  ((resid   93 and name HN   )) ((resid   94 and name HG*  ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   23 and name HA   )) ((resid   23 and name HG2  ))   4.09  2.29  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG1* )) ((resid   26 and name HG2  ))   4.85  3.05  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   26 and name HG2  ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   39 and name HG*  )) ((resid   40 and name HN   ))   4.01  2.21  0.00 ! #SUP  1.00
assign  ((resid   21 and name HA   )) ((resid   21 and name HG*  ))   3.22  1.42  0.00 ! #SUP  1.00
assign  ((resid   39 and name HB1  )) ((resid   39 and name HG*  ))   2.68  0.88  0.00 ! #SUP  1.00
assign  ((resid   21 and name HN   )) ((resid   21 and name HG*  ))   3.31  1.51  0.00 ! #SUP  1.00
assign  ((resid   80 and name HG*  )) ((resid   81 and name HA   ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid   80 and name HG*  )) ((resid   88 and name HB2  ))   4.90  3.10  0.00 ! #SUP  1.00
assign  ((resid   80 and name HG*  )) ((resid   81 and name HD*  ))   4.75  2.95  0.00 ! #SUP  1.00
assign  ((resid   70 and name HN   )) ((resid   70 and name HG2  ))   4.77  2.97  0.00 ! #SUP  1.00
assign  ((resid   66 and name HD*  )) ((resid   70 and name HG2  ))   4.74  2.94  0.00 ! #SUP  1.00
assign  ((resid   70 and name HN   )) ((resid   70 and name HG1  ))   4.77  2.97  0.00 ! #SUP  1.00
assign  ((resid   66 and name HD*  )) ((resid   70 and name HG1  ))   4.74  2.94  0.00 ! #SUP  1.00
assign  ((resid   60 and name HN   )) ((resid   60 and name HG1  ))   4.33  2.53  0.00 ! #SUP  1.00
assign  ((resid   60 and name HA   )) ((resid   60 and name HG1  ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   59 and name HB*  )) ((resid   60 and name HG1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD1* )) ((resid   60 and name HG1  ))   3.88  2.08  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD2* )) ((resid   60 and name HG1  ))   3.88  2.08  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD1* )) ((resid   60 and name HG2  ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD2* )) ((resid   60 and name HG2  ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   60 and name HN   )) ((resid   60 and name HG2  ))   4.65  2.85  0.00 ! #SUP  1.00
assign  ((resid   60 and name HA   )) ((resid   60 and name HG2  ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   59 and name HB*  )) ((resid   60 and name HG2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   31 and name HB2  )) ((resid   32 and name HN   ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid   28 and name HA   )) ((resid   31 and name HB2  ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   31 and name HN   )) ((resid   31 and name HB2  ))   3.96  2.16  0.00 ! #SUP  1.00
assign  ((resid   44 and name HB*  )) ((resid   44 and name HE*  ))   4.25  2.45  0.00 ! #SUP  1.00
assign  ((resid   44 and name HB*  )) ((resid   45 and name HD1* ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   44 and name HB*  )) ((resid   45 and name HA   ))   4.92  3.12  0.00 ! #SUP  1.00
assign  ((resid   58 and name HG2  )) ((resid   59 and name HN   ))   4.81  3.01  0.00 ! #SUP  1.00
assign  ((resid   29 and name HN   )) ((resid   29 and name HB2  ))   3.99  2.19  0.00 ! #SUP  1.00
assign  ((resid   89 and name HA   )) ((resid   92 and name HG2  ))   4.74  2.94  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD2* )) ((resid   92 and name HG2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   89 and name HA   )) ((resid   92 and name HG1  ))   4.74  2.94  0.00 ! #SUP  1.00
assign  ((resid   58 and name HA   )) ((resid   58 and name HG1  ))   4.11  2.31  0.00 ! #SUP  1.00
assign  ((resid   50 and name HG2  )) ((resid   61 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   55 and name HB1  )) ((resid   56 and name HN   ))   4.58  2.78  0.00 ! #SUP  1.00
assign  ((resid   20 and name HA   )) ((resid   55 and name HB1  ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   96 and name HG   )) ((resid   97 and name HB   ))   4.28  2.48  0.00 ! #SUP  1.00
assign  ((resid   29 and name HN   )) ((resid   29 and name HB1  ))   3.99  2.19  0.00 ! #SUP  1.00
assign  ((resid   68 and name HB1  )) ((resid   69 and name HN   ))   4.29  2.49  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   68 and name HB1  ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   50 and name HG2  ))   3.93  2.13  0.00 ! #SUP  1.00
assign  ((resid   28 and name HN   )) ((resid   28 and name HB2  ))   3.69  1.89  0.00 ! #SUP  1.00
assign  ((resid   46 and name HB1  )) ((resid   49 and name HN   ))   5.29  3.49  0.00 ! #SUP  1.00
assign  ((resid   52 and name HN   )) ((resid   52 and name HB1  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   24 and name HB*  )) ((resid   25 and name HB   ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   25 and name HB   )) ((resid   26 and name HN   ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   90 and name HB1  ))   3.99  2.19  0.00 ! #SUP  1.00
assign  ((resid   58 and name HN   )) ((resid   58 and name HB1  ))   3.61  1.81  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   58 and name HB1  ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   55 and name HA   )) ((resid   58 and name HB2  ))   4.04  2.24  0.00 ! #SUP  1.00
assign  ((resid   90 and name HB1  )) ((resid   91 and name HN   ))   3.94  2.14  0.00 ! #SUP  1.00
assign  ((resid   90 and name HB2  )) ((resid   91 and name HN   ))   4.23  2.43  0.00 ! #SUP  1.00
assign  ((resid   90 and name HN   )) ((resid   90 and name HB2  ))   3.42  1.62  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   23 and name HB2  ))   4.04  2.24  0.00 ! #SUP  1.00
assign  ((resid   23 and name HB2  )) ((resid   25 and name HG1* ))   4.68  2.88  0.00 ! #SUP  1.00
assign  ((resid   26 and name HN   )) ((resid   26 and name HB2  ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   26 and name HB2  )) ((resid   82 and name HD1* ))   4.78  2.98  0.00 ! #SUP  1.00
assign  ((resid   93 and name HN   )) ((resid   93 and name HB2  ))   3.89  2.09  0.00 ! #SUP  1.00
assign  ((resid   93 and name HN   )) ((resid   93 and name HB1  ))   3.89  2.09  0.00 ! #SUP  1.00
assign  ((resid   93 and name HB1  )) ((resid   93 and name HD*  ))   3.80  2.00  0.00 ! #SUP  1.00
assign  ((resid   73 and name HB1  )) ((resid   77 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG12 )) ((resid   68 and name HA   ))   4.42  2.62  0.00 ! #SUP  1.00
assign  ((resid   78 and name HG2* )) ((resid   81 and name HB*  ))   4.91  3.11  0.00 ! #SUP  1.00
assign  ((resid   23 and name HB1  )) ((resid   26 and name HN   ))   4.75  2.95  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG11 )) ((resid   68 and name HA   ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   63 and name HG11 ))   3.83  2.03  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG11 )) ((resid   71 and name HB*  ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   63 and name HN   )) ((resid   63 and name HG11 ))   4.66  2.86  0.00 ! #SUP  1.00
assign  ((resid   72 and name HB1  )) ((resid   73 and name HN   ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   72 and name HN   )) ((resid   72 and name HB1  ))   3.34  1.54  0.00 ! #SUP  1.00
assign  ((resid   65 and name HB2  )) ((resid   66 and name HN   ))   4.20  2.40  0.00 ! #SUP  1.00
assign  ((resid   23 and name HB2  )) ((resid   26 and name HN   ))   4.75  2.95  0.00 ! #SUP  1.00
assign  ((resid   21 and name HB1  )) ((resid   87 and name HD1* ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   21 and name HB2  )) ((resid   87 and name HD2* ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   21 and name HB2  )) ((resid   87 and name HD1* ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   28 and name HD*  )) ((resid   29 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   78 and name HA   )) ((resid   81 and name HB*  ))   3.82  2.02  0.00 ! #SUP  1.00
assign  ((resid   81 and name HB*  )) ((resid   82 and name HG2* ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   81 and name HB*  )) ((resid   81 and name HD*  ))   3.79  1.99  0.00 ! #SUP  1.00
assign  ((resid   23 and name HB1  )) ((resid   25 and name HG1* ))   4.68  2.88  0.00 ! #SUP  1.00
assign  ((resid   47 and name HB2  )) ((resid   48 and name HN   ))   4.90  3.10  0.00 ! #SUP  1.00
assign  ((resid   88 and name HE3  )) ((resid   89 and name HB2  ))   4.23  2.43  0.00 ! #SUP  1.00
assign  ((resid   89 and name HN   )) ((resid   89 and name HB2  ))   3.47  1.67  0.00 ! #SUP  1.00
assign  ((resid   88 and name HZ3  )) ((resid   89 and name HB2  ))   5.05  3.25  0.00 ! #SUP  1.00
assign  ((resid   86 and name HA   )) ((resid   89 and name HB2  ))   4.25  2.45  0.00 ! #SUP  1.00
assign  ((resid   20 and name HN   )) ((resid   20 and name HB1  ))   3.71  1.91  0.00 ! #SUP  1.00
assign  ((resid   69 and name HN   )) ((resid   69 and name HB*  ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   89 and name HN   )) ((resid   89 and name HB1  ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   89 and name HB1  )) ((resid   90 and name HN   ))   3.88  2.08  0.00 ! #SUP  1.00
assign  ((resid   86 and name HA   )) ((resid   89 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   94 and name HB*  )) ((resid   95 and name HN   ))   4.53  2.73  0.00 ! #SUP  1.00
assign  ((resid   28 and name HA   )) ((resid   28 and name HD*  ))   4.35  2.55  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG2* )) ((resid   28 and name HD*  ))   4.50  2.70  0.00 ! #SUP  1.00
assign  ((resid   88 and name HB1  )) ((resid   89 and name HN   ))   4.10  2.30  0.00 ! #SUP  1.00
assign  ((resid   80 and name HG*  )) ((resid   88 and name HB1  ))   4.90  3.10  0.00 ! #SUP  1.00
assign  ((resid   80 and name HB1  )) ((resid   88 and name HB1  ))   4.66  2.86  0.00 ! #SUP  1.00
assign  ((resid   39 and name HN   )) ((resid   39 and name HB2  ))   4.14  2.34  0.00 ! #SUP  1.00
assign  ((resid   39 and name HB2  )) ((resid   39 and name HG*  ))   2.68  0.88  0.00 ! #SUP  1.00
assign  ((resid   44 and name HA   )) ((resid   44 and name HD2  ))   4.35  2.55  0.00 ! #SUP  1.00
assign  ((resid   80 and name HB1  )) ((resid   88 and name HB2  ))   4.66  2.86  0.00 ! #SUP  1.00
assign  ((resid   70 and name HN   )) ((resid   70 and name HB1  ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB1  )) ((resid   70 and name HB1  ))   3.70  1.90  0.00 ! #SUP  1.00
assign  ((resid   39 and name HN   )) ((resid   39 and name HB1  ))   4.14  2.34  0.00 ! #SUP  1.00
assign  ((resid   92 and name HN   )) ((resid   92 and name HB1  ))   4.13  2.33  0.00 ! #SUP  1.00
assign  ((resid   44 and name HA   )) ((resid   44 and name HD1  ))   4.35  2.55  0.00 ! #SUP  1.00
assign  ((resid   52 and name HG*  )) ((resid   52 and name HD*  ))   2.87  1.07  0.00 ! #SUP  1.00
assign  ((resid   20 and name HA   )) ((resid   55 and name HG2  ))   3.80  2.00  0.00 ! #SUP  1.00
assign  ((resid   92 and name HN   )) ((resid   92 and name HB2  ))   4.13  2.33  0.00 ! #SUP  1.00
assign  ((resid   20 and name HA   )) ((resid   55 and name HG1  ))   3.80  2.00  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   68 and name HG2  ))   4.73  2.93  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   62 and name HG   ))   3.94  2.14  0.00 ! #SUP  1.00
assign  ((resid   73 and name HA   )) ((resid   73 and name HG2  ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid   61 and name HG   )) ((resid   65 and name HD2  ))   4.71  2.91  0.00 ! #SUP  1.00
assign  ((resid   27 and name HG   )) ((resid   28 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   27 and name HA   )) ((resid   27 and name HG   ))   4.08  2.28  0.00 ! #SUP  1.00
assign  ((resid   27 and name HG   )) ((resid   58 and name HG1  ))   4.86  3.06  0.00 ! #SUP  1.00
assign  ((resid   40 and name HN   )) ((resid   40 and name HG   ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   73 and name HA   )) ((resid   73 and name HG1  ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid   39 and name HG*  )) ((resid   40 and name HG   ))   5.26  3.46  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG12 )) ((resid   66 and name HE*  ))   4.77  2.97  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG12 )) ((resid   66 and name HZ   ))   4.98  3.18  0.00 ! #SUP  1.00
assign  ((resid   45 and name HN   )) ((resid   45 and name HG11 ))   4.20  2.40  0.00 ! #SUP  1.00
assign  ((resid   10 and name HA   )) ((resid   13 and name HB*  ))   4.67  2.87  0.00 ! #SUP  1.00
assign  ((resid   29 and name HG2  )) ((resid   29 and name HE*  ))   4.15  2.35  0.00 ! #SUP  1.00
assign  ((resid   73 and name HN   )) ((resid   73 and name HG2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   73 and name HG2  )) ((resid   77 and name HN   ))   5.36  3.56  0.00 ! #SUP  1.00
assign  ((resid   61 and name HN   )) ((resid   61 and name HG   ))   4.49  2.69  0.00 ! #SUP  1.00
assign  ((resid   61 and name HA   )) ((resid   61 and name HG   ))   3.95  2.15  0.00 ! #SUP  1.00
assign  ((resid   32 and name HG   )) ((resid   33 and name HN   ))   4.28  2.48  0.00 ! #SUP  1.00
assign  ((resid   32 and name HG   )) ((resid   33 and name HD*  ))   4.75  2.95  0.00 ! #SUP  1.00
assign  ((resid   96 and name HG   )) ((resid   97 and name HN   ))   3.98  2.18  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA1  )) ((resid   45 and name HG12 ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   44 and name HA   )) ((resid   45 and name HG12 ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   74 and name HN   )) ((resid   74 and name HG   ))   4.35  2.55  0.00 ! #SUP  1.00
assign  ((resid   71 and name HN   )) ((resid   74 and name HG   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   74 and name HA   )) ((resid   74 and name HG   ))   4.01  2.21  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   74 and name HG   ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   30 and name HD*  )) ((resid   34 and name HD2* ))   3.71  1.91  0.00 ! #SUP  1.00
assign  ((resid   30 and name HA   )) ((resid   34 and name HD2* ))   4.69  2.89  0.00 ! #SUP  1.00
assign  ((resid   34 and name HA   )) ((resid   34 and name HD2* ))   4.96  3.16  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD2* )) ((resid   62 and name HG   ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   22 and name HG   )) ((resid   79 and name HE*  ))   4.76  2.96  0.00 ! #SUP  1.00
assign  ((resid   84 and name HN   )) ((resid   84 and name HB1  ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   84 and name HB1  )) ((resid   88 and name HN   ))   5.08  3.28  0.00 ! #SUP  1.00
assign  ((resid   87 and name HN   )) ((resid   87 and name HG   ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   15 and name HB*  )) ((resid   15 and name HD1* ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB1  )) ((resid   62 and name HD1* ))   3.24  1.44  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD1* )) ((resid   79 and name HE*  ))   4.10  2.30  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB1  )) ((resid   22 and name HD1* ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   19 and name HN   )) ((resid   19 and name HD1* ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD1* )) ((resid   58 and name HB2  ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   19 and name HB1  )) ((resid   19 and name HD1* ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   29 and name HN   )) ((resid   29 and name HG2  ))   3.97  2.17  0.00 ! #SUP  1.00
assign  ((resid   29 and name HG1  )) ((resid   29 and name HE*  ))   4.15  2.35  0.00 ! #SUP  1.00
assign  ((resid   30 and name HE*  )) ((resid   62 and name HD1* ))   4.92  3.12  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB2  )) ((resid   62 and name HD1* ))   3.64  1.84  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD2* )) ((resid   62 and name HD1* ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   62 and name HD1* ))   4.25  2.45  0.00 ! #SUP  1.00
assign  ((resid   76 and name HG   )) ((resid   77 and name HN   ))   4.14  2.34  0.00 ! #SUP  1.00
assign  ((resid   28 and name HN   )) ((resid   28 and name HG2  ))   4.89  3.09  0.00 ! #SUP  1.00
assign  ((resid   28 and name HG1  )) ((resid   29 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   27 and name HN   )) ((resid   27 and name HD1* ))   4.38  2.58  0.00 ! #SUP  1.00
assign  ((resid   27 and name HB2  )) ((resid   27 and name HD1* ))   3.66  1.86  0.00 ! #SUP  1.00
assign  ((resid   27 and name HB1  )) ((resid   27 and name HD1* ))   3.78  1.98  0.00 ! #SUP  1.00
assign  ((resid   76 and name HG   )) ((resid   77 and name HB*  ))   3.47  1.67  0.00 ! #SUP  1.00
assign  ((resid   44 and name HN   )) ((resid   44 and name HG2  ))   4.61  2.81  0.00 ! #SUP  1.00
assign  ((resid   52 and name HA   )) ((resid   52 and name HG*  ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   50 and name HN   )) ((resid   61 and name HD1* ))   4.88  3.08  0.00 ! #SUP  1.00
assign  ((resid   44 and name HA   )) ((resid   44 and name HG2  ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   44 and name HG1  )) ((resid   44 and name HE*  ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid   44 and name HN   )) ((resid   44 and name HG1  ))   4.61  2.81  0.00 ! #SUP  1.00
assign  ((resid   44 and name HA   )) ((resid   44 and name HG1  ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   66 and name HD*  )) ((resid   74 and name HD1* ))   4.62  2.82  0.00 ! #SUP  1.00
assign  ((resid   66 and name HZ   )) ((resid   74 and name HD1* ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   74 and name HA   )) ((resid   74 and name HD1* ))   3.31  1.51  0.00 ! #SUP  1.00
assign  ((resid   74 and name HB2  )) ((resid   74 and name HD1* ))   4.19  2.39  0.00 ! #SUP  1.00
assign  ((resid   74 and name HB1  )) ((resid   74 and name HD1* ))   3.26  1.46  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   74 and name HD1* ))   3.35  1.55  0.00 ! #SUP  1.00
assign  ((resid   73 and name HN   )) ((resid   76 and name HD2* ))   4.96  3.16  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD2* )) ((resid   77 and name HN   ))   5.36  3.56  0.00 ! #SUP  1.00
assign  ((resid   72 and name HZ2  )) ((resid   76 and name HD2* ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   76 and name HA   )) ((resid   76 and name HD2* ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   30 and name HE*  )) ((resid   62 and name HD2* ))   4.92  3.12  0.00 ! #SUP  1.00
assign  ((resid   62 and name HN   )) ((resid   62 and name HD2* ))   4.36  2.56  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD2* )) ((resid   71 and name HA   ))   4.65  2.85  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB2  )) ((resid   62 and name HD2* ))   3.64  1.84  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB1  )) ((resid   62 and name HD2* ))   3.24  1.44  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD2* )) ((resid   62 and name HD2* ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   62 and name HD2* ))   4.25  2.45  0.00 ! #SUP  1.00
assign  ((resid   15 and name HA   )) ((resid   15 and name HD2* ))   4.08  2.28  0.00 ! #SUP  1.00
assign  ((resid   15 and name HB*  )) ((resid   15 and name HD2* ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   27 and name HB2  )) ((resid   27 and name HD2* ))   3.66  1.86  0.00 ! #SUP  1.00
assign  ((resid   27 and name HB1  )) ((resid   27 and name HD2* ))   3.78  1.98  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD2* )) ((resid   79 and name HE*  ))   4.10  2.30  0.00 ! #SUP  1.00
assign  ((resid   32 and name HB2  )) ((resid   32 and name HD2* ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   78 and name HG2* )) ((resid   82 and name HG2* ))   2.87  1.07  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   37 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   66 and name HE*  ))   5.09  3.29  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   66 and name HZ   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   34 and name HN   )) ((resid   34 and name HD1* ))   4.09  2.29  0.00 ! #SUP  1.00
assign  ((resid   34 and name HA   )) ((resid   34 and name HD1* ))   3.64  1.84  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   35 and name HA2  ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   62 and name HG   ))   4.15  2.35  0.00 ! #SUP  1.00
assign  ((resid   66 and name HE*  )) ((resid   74 and name HD2* ))   4.87  3.07  0.00 ! #SUP  1.00
assign  ((resid   74 and name HA   )) ((resid   74 and name HD2* ))   3.34  1.54  0.00 ! #SUP  1.00
assign  ((resid   70 and name HA   )) ((resid   74 and name HD2* ))   4.26  2.46  0.00 ! #SUP  1.00
assign  ((resid   40 and name HD2* )) ((resid   66 and name HE*  ))   4.30  2.50  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA2  )) ((resid   40 and name HD2* ))   4.62  2.82  0.00 ! #SUP  1.00
assign  ((resid   34 and name HN   )) ((resid   78 and name HG2* ))   4.38  2.58  0.00 ! #SUP  1.00
assign  ((resid   30 and name HD*  )) ((resid   78 and name HG2* ))   3.13  1.33  0.00 ! #SUP  1.00
assign  ((resid   78 and name HA   )) ((resid   78 and name HG2* ))   3.29  1.49  0.00 ! #SUP  1.00
assign  ((resid   78 and name HG2* )) ((resid   79 and name HN   ))   4.28  2.48  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   77 and name HA   ))   3.86  2.06  0.00 ! #SUP  1.00
assign  ((resid   76 and name HA   )) ((resid   76 and name HD1* ))   3.32  1.52  0.00 ! #SUP  1.00
assign  ((resid   19 and name HB2  )) ((resid   19 and name HD2* ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   19 and name HB1  )) ((resid   19 and name HD2* ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   38 and name HN   )) ((resid   38 and name HG2* ))   4.39  2.59  0.00 ! #SUP  1.00
assign  ((resid   38 and name HA   )) ((resid   38 and name HG2* ))   2.91  1.11  0.00 ! #SUP  1.00
assign  ((resid   25 and name HN   )) ((resid   25 and name HG2* ))   3.92  2.12  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG2* )) ((resid   26 and name HN   ))   4.14  2.34  0.00 ! #SUP  1.00
assign  ((resid   33 and name HD*  )) ((resid   36 and name HG2* ))   4.51  2.71  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG2* )) ((resid   29 and name HE*  ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   17 and name HG2* )) ((resid   18 and name HN   ))   4.49  2.69  0.00 ! #SUP  1.00
assign  ((resid   17 and name HG2* )) ((resid   18 and name HD*  ))   4.38  2.58  0.00 ! #SUP  1.00
assign  ((resid   17 and name HG2* )) ((resid   18 and name HE*  ))   5.14  3.34  0.00 ! #SUP  1.00
assign  ((resid   17 and name HA   )) ((resid   17 and name HG2* ))   3.04  1.24  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA2  )) ((resid   36 and name HG2* ))   5.24  3.44  0.00 ! #SUP  1.00
assign  ((resid   36 and name HG2* )) ((resid   37 and name HN   ))   4.61  2.81  0.00 ! #SUP  1.00
assign  ((resid    6 and name HA   )) ((resid    6 and name HG2* ))   3.47  1.67  0.00 ! #SUP  1.00
assign  ((resid   32 and name HD1* )) ((resid   36 and name HG2* ))   4.57  2.77  0.00 ! #SUP  1.00
assign  ((resid   32 and name HD2* )) ((resid   36 and name HG2* ))   4.57  2.77  0.00 ! #SUP  1.00
assign  ((resid   18 and name HD*  )) ((resid   87 and name HD2* ))   4.23  2.43  0.00 ! #SUP  1.00
assign  ((resid   87 and name HN   )) ((resid   87 and name HD2* ))   4.06  2.26  0.00 ! #SUP  1.00
assign  ((resid   18 and name HA   )) ((resid   87 and name HD2* ))   4.89  3.09  0.00 ! #SUP  1.00
assign  ((resid   21 and name HB1  )) ((resid   87 and name HD2* ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG1* )) ((resid   26 and name HN   ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   25 and name HA   )) ((resid   25 and name HG1* ))   3.35  1.55  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG1* )) ((resid   29 and name HE*  ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid  100 and name HB   )) ((resid  101 and name HG*  ))   4.26  2.46  0.00 ! #SUP  1.00
assign  ((resid   97 and name HN   )) ((resid   97 and name HG*  ))   3.42  1.62  0.00 ! #SUP  1.00
assign  ((resid   68 and name HA   )) ((resid   71 and name HB*  ))   3.41  1.61  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB2  )) ((resid   71 and name HB*  ))   3.72  1.92  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB2  )) ((resid   71 and name HB*  ))   4.07  2.27  0.00 ! #SUP  1.00
assign  ((resid   51 and name HA   )) ((resid   53 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   54 and name HN   ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   58 and name HA   ))   4.29  2.49  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   57 and name HG2  ))   4.72  2.92  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   58 and name HG2  ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   57 and name HB2  ))   3.15  1.35  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   57 and name HB1  ))   3.15  1.35  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   61 and name HD1* ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   16 and name HN   )) ((resid   59 and name HB*  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   37 and name HB*  )) ((resid   39 and name HG*  ))   4.28  2.48  0.00 ! #SUP  1.00
assign  ((resid   36 and name HN   )) ((resid   37 and name HB*  ))   4.39  2.59  0.00 ! #SUP  1.00
assign  ((resid   15 and name HB*  )) ((resid   59 and name HB*  ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   15 and name HG   )) ((resid   59 and name HB*  ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   34 and name HA   )) ((resid   37 and name HB*  ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   37 and name HB*  )) ((resid   38 and name HN   ))   4.25  2.45  0.00 ! #SUP  1.00
assign  ((resid   75 and name HB*  )) ((resid   77 and name HN   ))   4.31  2.51  0.00 ! #SUP  1.00
assign  ((resid   75 and name HB*  )) ((resid   79 and name HE*  ))   3.52  1.72  0.00 ! #SUP  1.00
assign  ((resid   30 and name HE*  )) ((resid   75 and name HB*  ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid   23 and name HA   )) ((resid   24 and name HB*  ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   33 and name HE*  )) ((resid   82 and name HG2* ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   33 and name HD*  )) ((resid   82 and name HG2* ))   3.82  2.02  0.00 ! #SUP  1.00
assign  ((resid   82 and name HG2* )) ((resid   82 and name HD1* ))   3.03  1.23  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   50 and name HN   ))   4.31  2.51  0.00 ! #SUP  1.00
assign  ((resid   45 and name HA   )) ((resid   45 and name HG2* ))   3.24  1.44  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   46 and name HD1  ))   3.30  1.50  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   46 and name HG2  ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   45 and name HG12 ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   45 and name HG11 ))   3.56  1.76  0.00 ! #SUP  1.00
assign  ((resid   45 and name HN   )) ((resid   45 and name HG2* ))   4.33  2.53  0.00 ! #SUP  1.00
assign  ((resid   30 and name HN   )) ((resid   82 and name HD1* ))   3.96  2.16  0.00 ! #SUP  1.00
assign  ((resid   79 and name HA   )) ((resid   82 and name HD1* ))   4.04  2.24  0.00 ! #SUP  1.00
assign  ((resid   30 and name HB2  )) ((resid   82 and name HD1* ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   30 and name HB1  )) ((resid   82 and name HD1* ))   3.57  1.77  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD1* )) ((resid   82 and name HD1* ))   3.44  1.64  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD2* )) ((resid   82 and name HD1* ))   3.44  1.64  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   66 and name HE*  ))   3.50  1.70  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   62 and name HA   ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   65 and name HB2  ))   4.35  2.55  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   65 and name HB1  ))   4.35  2.55  0.00 ! #SUP  1.00
assign  ((resid   45 and name HB   )) ((resid   45 and name HD1* ))   3.41  1.61  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   71 and name HN   ))   4.61  2.81  0.00 ! #SUP  1.00
assign  ((resid   63 and name HN   )) ((resid   63 and name HD1* ))   4.49  2.69  0.00 ! #SUP  1.00
assign  ((resid   63 and name HB   )) ((resid   63 and name HD1* ))   3.24  1.44  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   71 and name HB*  ))   3.52  1.72  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   46 and name HG2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   64 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   26 and name HB1  )) ((resid   82 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   44 and name HB*  )) ((resid   45 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   50 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA2  )) ((resid   45 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   50 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   47 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   34 and name HB1  )) ((resid   82 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   29 and name HA   )) ((resid   82 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   78 and name HA   )) ((resid   82 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   33 and name HN   )) ((resid   82 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   24 and name HB*  )) ((resid   25 and name HG1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   38 and name HB   )) ((resid   39 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   30 and name HD*  )) ((resid   78 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   25 and name HA   )) ((resid   27 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   25 and name HA   )) ((resid   28 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   25 and name HA   )) ((resid   28 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD2* )) ((resid   55 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   50 and name HN   )) ((resid   51 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   45 and name HB   )) ((resid   46 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   73 and name HB2  )) ((resid   77 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   82 and name HA   )) ((resid   82 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   77 and name HA   )) ((resid   80 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   31 and name HA   )) ((resid   34 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   89 and name HB1  )) ((resid   90 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   31 and name HA   )) ((resid   34 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   29 and name HA   )) ((resid   32 and name HG   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   66 and name HA   )) ((resid   66 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   83 and name HA   )) ((resid   84 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   53 and name HA   )) ((resid   57 and name HG1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   53 and name HA   )) ((resid   58 and name HG2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   53 and name HA   )) ((resid   57 and name HG2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   43 and name HA1  )) ((resid   44 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   43 and name HA2  )) ((resid   44 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   14 and name HA   )) ((resid   17 and name HB   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   17 and name HG2* )) ((resid   20 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   17 and name HG2* )) ((resid   21 and name HG*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   12 and name HA   )) ((resid   63 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD1* )) ((resid   58 and name HG2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG1* )) ((resid   26 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG1* )) ((resid   26 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG1* )) ((resid   28 and name HD*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG1* )) ((resid   29 and name HG2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG1* )) ((resid   27 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB1  )) ((resid   25 and name HG1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG1* )) ((resid   29 and name HG1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   32 and name HG   )) ((resid   36 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   24 and name HB*  )) ((resid   25 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB2  )) ((resid   27 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   34 and name HA   )) ((resid   78 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   15 and name HG   )) ((resid   71 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   62 and name HG   )) ((resid   71 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   33 and name HB1  )) ((resid   81 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD2* )) ((resid   75 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD2* )) ((resid   74 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   37 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   37 and name HB*  )) ((resid   40 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   37 and name HB*  )) ((resid   40 and name HG   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   33 and name HD*  )) ((resid   37 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   37 and name HB*  )) ((resid   39 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   45 and name HB   )) ((resid   46 and name HD2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   49 and name HA   )) ((resid   51 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   50 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   15 and name HB*  )) ((resid   59 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   59 and name HA   )) ((resid   62 and name HG   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   60 and name HG1  )) ((resid   61 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   63 and name HB   )) ((resid   64 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   63 and name HB   )) ((resid   71 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   63 and name HB   )) ((resid   71 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG11 )) ((resid   68 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   66 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB2  )) ((resid   74 and name HG   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB1  )) ((resid   70 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   71 and name HA   )) ((resid   74 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   59 and name HA   )) ((resid   71 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   67 and name HN   )) ((resid   71 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   68 and name HB1  )) ((resid   71 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA1  )) ((resid   74 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   74 and name HD1* )) ((resid   75 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   19 and name HG   )) ((resid   75 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   74 and name HB2  )) ((resid   75 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   75 and name HB*  )) ((resid   79 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   58 and name HB1  )) ((resid   75 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   15 and name HB*  )) ((resid   75 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   19 and name HG   )) ((resid   75 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   75 and name HB*  )) ((resid   76 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   79 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   76 and name HB2  )) ((resid   77 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   78 and name HG2* )) ((resid   82 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   79 and name HB1  )) ((resid   84 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   26 and name HB1  )) ((resid   82 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   88 and name HA   )) ((resid   91 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD2* )) ((resid   92 and name HG1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   93 and name HD*  )) ((resid   94 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   97 and name HG*  )) ((resid   98 and name HG*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   15 and name HA   )) ((resid   59 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   37 and name HB*  )) ((resid   40 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA1  )) ((resid   45 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA1  )) ((resid   45 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   77 and name HB*  )) ((resid   88 and name HE1  ))   5.26  3.46  0.00 ! #SUP  1.00
assign  ((resid   80 and name HG*  )) ((resid   88 and name HE1  ))   4.30  2.50  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   88 and name HE1  ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   77 and name HA   )) ((resid   88 and name HE1  ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   80 and name HB2  )) ((resid   88 and name HE1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   72 and name HE1  )) ((resid   76 and name HG   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   72 and name HE1  )) ((resid   76 and name HD2* ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid  101 and name HB   )) ((resid  102 and name HN   ))   4.88  3.08  0.00 ! #SUP  1.00
assign  ((resid   23 and name HA   )) ((resid   24 and name HN   ))   3.17  1.37  0.00 ! #SUP  1.00
assign  ((resid   24 and name HN   )) ((resid   24 and name HB*  ))   2.95  1.15  0.00 ! #SUP  1.00
assign  ((resid    4 and name HA   )) ((resid    5 and name HN   ))   3.21  1.41  0.00 ! #SUP  1.00
assign  ((resid   46 and name HB2  )) ((resid   47 and name HN   ))   4.33  2.53  0.00 ! #SUP  1.00
assign  ((resid   46 and name HB1  )) ((resid   47 and name HN   ))   4.33  2.53  0.00 ! #SUP  1.00
assign  ((resid   46 and name HA   )) ((resid   47 and name HN   ))   3.04  1.24  0.00 ! #SUP  1.00
assign  ((resid   47 and name HN   )) ((resid   47 and name HB2  ))   3.62  1.82  0.00 ! #SUP  1.00
assign  ((resid   47 and name HN   )) ((resid   47 and name HB1  ))   3.73  1.93  0.00 ! #SUP  1.00
assign  ((resid   35 and name HN   )) ((resid   37 and name HN   ))   4.04  2.24  0.00 ! #SUP  1.00
assign  ((resid   36 and name HN   )) ((resid   37 and name HN   ))   3.15  1.35  0.00 ! #SUP  1.00
assign  ((resid   37 and name HN   )) ((resid   37 and name HB*  ))   2.84  1.04  0.00 ! #SUP  1.00
assign  ((resid   74 and name HD2* )) ((resid   75 and name HN   ))   4.99  3.19  0.00 ! #SUP  1.00
assign  ((resid   75 and name HN   )) ((resid   76 and name HD2* ))   5.29  3.49  0.00 ! #SUP  1.00
assign  ((resid   75 and name HN   )) ((resid   76 and name HN   ))   3.40  1.60  0.00 ! #SUP  1.00
assign  ((resid   73 and name HA   )) ((resid   75 and name HN   ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid   75 and name HN   )) ((resid   75 and name HB*  ))   2.75  0.95  0.00 ! #SUP  1.00
assign  ((resid   11 and name HN   )) ((resid   12 and name HN   ))   3.82  2.02  0.00 ! #SUP  1.00
assign  ((resid   12 and name HN   )) ((resid   12 and name HB2  ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid   12 and name HN   )) ((resid   12 and name HB1  ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid   12 and name HN   )) ((resid   12 and name HD1* ))   5.10  3.30  0.00 ! #SUP  1.00
assign  ((resid   12 and name HN   )) ((resid   12 and name HD2* ))   5.10  3.30  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   26 and name HB2  ))   4.26  2.46  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   26 and name HN   ))   4.13  2.33  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   26 and name HB1  ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   26 and name HG*  ))   3.37  1.57  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   23 and name HB1  ))   4.04  2.24  0.00 ! #SUP  1.00
assign  ((resid   44 and name HA   )) ((resid   45 and name HN   ))   3.42  1.62  0.00 ! #SUP  1.00
assign  ((resid   44 and name HB*  )) ((resid   45 and name HN   ))   3.75  1.95  0.00 ! #SUP  1.00
assign  ((resid   45 and name HN   )) ((resid   45 and name HB   ))   3.24  1.44  0.00 ! #SUP  1.00
assign  ((resid   45 and name HN   )) ((resid   45 and name HG12 ))   3.38  1.58  0.00 ! #SUP  1.00
assign  ((resid   45 and name HN   )) ((resid   45 and name HD1* ))   3.60  1.80  0.00 ! #SUP  1.00
assign  ((resid   52 and name HN   )) ((resid   53 and name HN   ))   3.21  1.41  0.00 ! #SUP  1.00
assign  ((resid   51 and name HN   )) ((resid   53 and name HN   ))   4.24  2.44  0.00 ! #SUP  1.00
assign  ((resid   52 and name HB2  )) ((resid   53 and name HN   ))   4.55  2.75  0.00 ! #SUP  1.00
assign  ((resid   53 and name HN   )) ((resid   53 and name HB*  ))   2.71  0.91  0.00 ! #SUP  1.00
assign  ((resid   50 and name HA   )) ((resid   53 and name HN   ))   3.78  1.98  0.00 ! #SUP  1.00
assign  ((resid   52 and name HB1  )) ((resid   53 and name HN   ))   4.55  2.75  0.00 ! #SUP  1.00
assign  ((resid   85 and name HN   )) ((resid   87 and name HN   ))   4.64  2.84  0.00 ! #SUP  1.00
assign  ((resid   59 and name HN   )) ((resid   59 and name HB*  ))   3.03  1.23  0.00 ! #SUP  1.00
assign  ((resid   58 and name HB1  )) ((resid   59 and name HN   ))   3.86  2.06  0.00 ! #SUP  1.00
assign  ((resid   58 and name HB2  )) ((resid   59 and name HN   ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   85 and name HN   )) ((resid   86 and name HN   ))   3.11  1.31  0.00 ! #SUP  1.00
assign  ((resid   84 and name HA   )) ((resid   85 and name HN   ))   3.10  1.30  0.00 ! #SUP  1.00
assign  ((resid   83 and name HA   )) ((resid   85 and name HN   ))   4.43  2.63  0.00 ! #SUP  1.00
assign  ((resid   85 and name HN   )) ((resid   85 and name HB2  ))   3.30  1.50  0.00 ! #SUP  1.00
assign  ((resid   85 and name HN   )) ((resid   85 and name HB1  ))   3.30  1.50  0.00 ! #SUP  1.00
assign  ((resid   84 and name HB1  )) ((resid   85 and name HN   ))   4.58  2.78  0.00 ! #SUP  1.00
assign  ((resid   85 and name HN   )) ((resid   85 and name HG*  ))   4.82  3.02  0.00 ! #SUP  1.00
assign  ((resid   56 and name HA   )) ((resid   59 and name HN   ))   4.37  2.57  0.00 ! #SUP  1.00
assign  ((resid   14 and name HN   )) ((resid   15 and name HN   ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   13 and name HB*  )) ((resid   14 and name HN   ))   3.62  1.82  0.00 ! #SUP  1.00
assign  ((resid   14 and name HN   )) ((resid   14 and name HB2  ))   3.73  1.93  0.00 ! #SUP  1.00
assign  ((resid   14 and name HN   )) ((resid   14 and name HB1  ))   3.73  1.93  0.00 ! #SUP  1.00
assign  ((resid   58 and name HA   )) ((resid   61 and name HN   ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   61 and name HN   )) ((resid   63 and name HG2* ))   5.23  3.43  0.00 ! #SUP  1.00
assign  ((resid   29 and name HN   )) ((resid   30 and name HN   ))   3.38  1.58  0.00 ! #SUP  1.00
assign  ((resid   30 and name HN   )) ((resid   30 and name HB1  ))   3.27  1.47  0.00 ! #SUP  1.00
assign  ((resid   30 and name HN   )) ((resid   82 and name HG2* ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   30 and name HN   )) ((resid   30 and name HD*  ))   4.04  2.24  0.00 ! #SUP  1.00
assign  ((resid   41 and name HN   )) ((resid   42 and name HN   ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid   42 and name HN   )) ((resid   42 and name HG*  ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   51 and name HN   )) ((resid   52 and name HN   ))   4.04  2.24  0.00 ! #SUP  1.00
assign  ((resid   50 and name HN   )) ((resid   51 and name HN   ))   3.47  1.67  0.00 ! #SUP  1.00
assign  ((resid   51 and name HN   )) ((resid   51 and name HB2  ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   51 and name HN   )) ((resid   51 and name HB1  ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   27 and name HN   )) ((resid   29 and name HN   ))   4.71  2.91  0.00 ! #SUP  1.00
assign  ((resid   27 and name HN   )) ((resid   27 and name HB2  ))   3.32  1.52  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD1* )) ((resid   27 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD2* )) ((resid   27 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   27 and name HN   )) ((resid   28 and name HN   ))   3.28  1.48  0.00 ! #SUP  1.00
assign  ((resid   26 and name HB1  )) ((resid   27 and name HN   ))   4.19  2.39  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB1  )) ((resid   27 and name HN   ))   3.97  2.17  0.00 ! #SUP  1.00
assign  ((resid   27 and name HN   )) ((resid   27 and name HB1  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   27 and name HN   )) ((resid   27 and name HD2* ))   4.38  2.58  0.00 ! #SUP  1.00
assign  ((resid   84 and name HA   )) ((resid   87 and name HN   ))   4.42  2.62  0.00 ! #SUP  1.00
assign  ((resid   70 and name HN   )) ((resid   73 and name HN   ))   4.93  3.13  0.00 ! #SUP  1.00
assign  ((resid   69 and name HN   )) ((resid   70 and name HN   ))   3.09  1.29  0.00 ! #SUP  1.00
assign  ((resid   69 and name HG*  )) ((resid   70 and name HN   ))   4.29  2.49  0.00 ! #SUP  1.00
assign  ((resid   70 and name HN   )) ((resid   70 and name HB2  ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB1  )) ((resid   70 and name HN   ))   4.98  3.18  0.00 ! #SUP  1.00
assign  ((resid   39 and name HN   )) ((resid   39 and name HG*  ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   38 and name HG2* )) ((resid   39 and name HN   ))   4.50  2.70  0.00 ! #SUP  1.00
assign  ((resid   95 and name HN   )) ((resid   96 and name HN   ))   4.73  2.93  0.00 ! #SUP  1.00
assign  ((resid   95 and name HA   )) ((resid   96 and name HN   ))   3.04  1.24  0.00 ! #SUP  1.00
assign  ((resid   95 and name HB2  )) ((resid   96 and name HN   ))   4.27  2.47  0.00 ! #SUP  1.00
assign  ((resid   95 and name HB1  )) ((resid   96 and name HN   ))   4.27  2.47  0.00 ! #SUP  1.00
assign  ((resid   86 and name HN   )) ((resid   87 and name HN   ))   3.18  1.38  0.00 ! #SUP  1.00
assign  ((resid   87 and name HN   )) ((resid   88 and name HN   ))   3.32  1.52  0.00 ! #SUP  1.00
assign  ((resid   87 and name HN   )) ((resid   87 and name HB2  ))   4.04  2.24  0.00 ! #SUP  1.00
assign  ((resid   87 and name HN   )) ((resid   87 and name HB1  ))   4.04  2.24  0.00 ! #SUP  1.00
assign  ((resid   38 and name HN   )) ((resid   39 and name HN   ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   39 and name HN   )) ((resid   40 and name HN   ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   39 and name HN   )) ((resid   39 and name HB*  ))   3.42  1.62  0.00 ! #SUP  1.00
assign  ((resid   87 and name HN   )) ((resid   87 and name HD1* ))   4.06  2.26  0.00 ! #SUP  1.00
assign  ((resid   78 and name HN   )) ((resid   79 and name HN   ))   3.23  1.43  0.00 ! #SUP  1.00
assign  ((resid   79 and name HN   )) ((resid   80 and name HN   ))   3.40  1.60  0.00 ! #SUP  1.00
assign  ((resid   79 and name HN   )) ((resid   79 and name HD*  ))   4.11  2.31  0.00 ! #SUP  1.00
assign  ((resid   78 and name HB   )) ((resid   79 and name HN   ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   76 and name HA   )) ((resid   79 and name HN   ))   3.71  1.91  0.00 ! #SUP  1.00
assign  ((resid   79 and name HN   )) ((resid   79 and name HB2  ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   79 and name HN   )) ((resid   80 and name HG*  ))   4.42  2.62  0.00 ! #SUP  1.00
assign  ((resid   79 and name HN   )) ((resid   80 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   75 and name HB*  )) ((resid   79 and name HN   ))   5.04  3.24  0.00 ! #SUP  1.00
assign  ((resid   79 and name HN   )) ((resid   82 and name HD1* ))   5.36  3.56  0.00 ! #SUP  1.00
assign  ((resid   18 and name HN   )) ((resid   18 and name HD*  ))   3.63  1.83  0.00 ! #SUP  1.00
assign  ((resid   18 and name HN   )) ((resid   18 and name HB2  ))   3.94  2.14  0.00 ! #SUP  1.00
assign  ((resid   79 and name HN   )) ((resid   82 and name HG2* ))   5.30  3.50  0.00 ! #SUP  1.00
assign  ((resid    8 and name HA*  )) ((resid    9 and name HN   ))   3.24  1.44  0.00 ! #SUP  1.00
assign  ((resid    9 and name HN   )) ((resid    9 and name HB1  ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid    9 and name HN   )) ((resid    9 and name HB2  ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid    8 and name HN   )) ((resid    9 and name HN   ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   26 and name HN   )) ((resid   27 and name HN   ))   3.12  1.32  0.00 ! #SUP  1.00
assign  ((resid   26 and name HN   )) ((resid   26 and name HB1  ))   3.91  2.11  0.00 ! #SUP  1.00
assign  ((resid   26 and name HN   )) ((resid   29 and name HN   ))   5.26  3.46  0.00 ! #SUP  1.00
assign  ((resid   26 and name HN   )) ((resid   28 and name HN   ))   4.71  2.91  0.00 ! #SUP  1.00
assign  ((resid   96 and name HA   )) ((resid   97 and name HN   ))   3.41  1.61  0.00 ! #SUP  1.00
assign  ((resid   97 and name HN   )) ((resid   97 and name HB   ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   71 and name HN   ))   4.68  2.88  0.00 ! #SUP  1.00
assign  ((resid   66 and name HA   )) ((resid   71 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   33 and name HN   )) ((resid   33 and name HD*  ))   4.32  2.52  0.00 ! #SUP  1.00
assign  ((resid   88 and name HN   )) ((resid   89 and name HN   ))   3.43  1.63  0.00 ! #SUP  1.00
assign  ((resid   88 and name HN   )) ((resid   88 and name HB2  ))   3.44  1.64  0.00 ! #SUP  1.00
assign  ((resid   88 and name HN   )) ((resid   88 and name HB1  ))   3.44  1.64  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB1  )) ((resid   71 and name HN   ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   70 and name HN   )) ((resid   71 and name HN   ))   3.14  1.34  0.00 ! #SUP  1.00
assign  ((resid   71 and name HN   )) ((resid   72 and name HN   ))   3.40  1.60  0.00 ! #SUP  1.00
assign  ((resid   70 and name HB2  )) ((resid   71 and name HN   ))   3.77  1.97  0.00 ! #SUP  1.00
assign  ((resid   70 and name HB1  )) ((resid   71 and name HN   ))   3.77  1.97  0.00 ! #SUP  1.00
assign  ((resid   71 and name HN   )) ((resid   71 and name HB*  ))   2.86  1.06  0.00 ! #SUP  1.00
assign  ((resid   33 and name HN   )) ((resid   33 and name HB2  ))   3.41  1.61  0.00 ! #SUP  1.00
assign  ((resid   32 and name HB2  )) ((resid   33 and name HN   ))   4.53  2.73  0.00 ! #SUP  1.00
assign  ((resid   32 and name HB1  )) ((resid   33 and name HN   ))   4.53  2.73  0.00 ! #SUP  1.00
assign  ((resid   94 and name HA   )) ((resid   95 and name HN   ))   3.51  1.71  0.00 ! #SUP  1.00
assign  ((resid   20 and name HN   )) ((resid   21 and name HN   ))   3.30  1.50  0.00 ! #SUP  1.00
assign  ((resid   20 and name HN   )) ((resid   20 and name HB2  ))   3.71  1.91  0.00 ! #SUP  1.00
assign  ((resid   63 and name HN   )) ((resid   63 and name HG2* ))   3.29  1.49  0.00 ! #SUP  1.00
assign  ((resid   63 and name HN   )) ((resid   64 and name HN   ))   3.38  1.58  0.00 ! #SUP  1.00
assign  ((resid   62 and name HN   )) ((resid   63 and name HN   ))   3.71  1.91  0.00 ! #SUP  1.00
assign  ((resid   33 and name HD*  )) ((resid   34 and name HN   ))   5.33  3.53  0.00 ! #SUP  1.00
assign  ((resid   33 and name HN   )) ((resid   34 and name HN   ))   3.27  1.47  0.00 ! #SUP  1.00
assign  ((resid   34 and name HN   )) ((resid   34 and name HG   ))   3.32  1.52  0.00 ! #SUP  1.00
assign  ((resid   34 and name HN   )) ((resid   34 and name HD2* ))   3.49  1.69  0.00 ! #SUP  1.00
assign  ((resid   34 and name HN   )) ((resid   35 and name HN   ))   3.34  1.54  0.00 ! #SUP  1.00
assign  ((resid   74 and name HN   )) ((resid   75 and name HN   ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   74 and name HN   )) ((resid   74 and name HB1  ))   3.46  1.66  0.00 ! #SUP  1.00
assign  ((resid   73 and name HN   )) ((resid   74 and name HN   ))   3.30  1.50  0.00 ! #SUP  1.00
assign  ((resid   74 and name HN   )) ((resid   74 and name HB2  ))   3.26  1.46  0.00 ! #SUP  1.00
assign  ((resid   74 and name HN   )) ((resid   74 and name HD1* ))   4.52  2.72  0.00 ! #SUP  1.00
assign  ((resid   74 and name HN   )) ((resid   74 and name HD2* ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   63 and name HN   )) ((resid   63 and name HB   ))   3.09  1.29  0.00 ! #SUP  1.00
assign  ((resid   63 and name HN   )) ((resid   63 and name HG12 ))   4.01  2.21  0.00 ! #SUP  1.00
assign  ((resid   63 and name HN   )) ((resid   71 and name HB*  ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   75 and name HB*  )) ((resid   78 and name HN   ))   4.70  2.90  0.00 ! #SUP  1.00
assign  ((resid   78 and name HN   )) ((resid   78 and name HG2* ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   32 and name HA   )) ((resid   34 and name HN   ))   4.92  3.12  0.00 ! #SUP  1.00
assign  ((resid   88 and name HN   )) ((resid   90 and name HN   ))   4.54  2.74  0.00 ! #SUP  1.00
assign  ((resid   89 and name HB2  )) ((resid   90 and name HN   ))   3.86  2.06  0.00 ! #SUP  1.00
assign  ((resid   38 and name HA   )) ((resid   40 and name HN   ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   37 and name HB*  )) ((resid   40 and name HN   ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   40 and name HN   )) ((resid   40 and name HD1* ))   4.32  2.52  0.00 ! #SUP  1.00
assign  ((resid   40 and name HN   )) ((resid   40 and name HD2* ))   4.32  2.52  0.00 ! #SUP  1.00
assign  ((resid   12 and name HN   )) ((resid   13 and name HN   ))   3.99  2.19  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD1* )) ((resid   13 and name HN   ))   4.99  3.19  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD2* )) ((resid   13 and name HN   ))   4.99  3.19  0.00 ! #SUP  1.00
assign  ((resid   13 and name HN   )) ((resid   13 and name HB*  ))   3.31  1.51  0.00 ! #SUP  1.00
assign  ((resid   57 and name HN   )) ((resid   57 and name HG2  ))   4.08  2.28  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   57 and name HN   ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   28 and name HN   )) ((resid   29 and name HN   ))   3.60  1.80  0.00 ! #SUP  1.00
assign  ((resid   27 and name HB2  )) ((resid   28 and name HN   ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   28 and name HN   )) ((resid   28 and name HB1  ))   3.69  1.89  0.00 ! #SUP  1.00
assign  ((resid   94 and name HN   )) ((resid   94 and name HB*  ))   3.49  1.69  0.00 ! #SUP  1.00
assign  ((resid   28 and name HN   )) ((resid   28 and name HG1  ))   4.89  3.09  0.00 ! #SUP  1.00
assign  ((resid   94 and name HN   )) ((resid   95 and name HN   ))   4.38  2.58  0.00 ! #SUP  1.00
assign  ((resid   60 and name HA   )) ((resid   62 and name HN   ))   4.96  3.16  0.00 ! #SUP  1.00
assign  ((resid   12 and name HB2  )) ((resid   13 and name HN   ))   3.93  2.13  0.00 ! #SUP  1.00
assign  ((resid   57 and name HN   )) ((resid   58 and name HN   ))   3.13  1.33  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   57 and name HN   ))   3.83  2.03  0.00 ! #SUP  1.00
assign  ((resid   56 and name HN   )) ((resid   57 and name HN   ))   3.34  1.54  0.00 ! #SUP  1.00
assign  ((resid   57 and name HN   )) ((resid   57 and name HG1  ))   4.08  2.28  0.00 ! #SUP  1.00
assign  ((resid   57 and name HN   )) ((resid   57 and name HB2  ))   3.77  1.97  0.00 ! #SUP  1.00
assign  ((resid   57 and name HN   )) ((resid   57 and name HB1  ))   3.77  1.97  0.00 ! #SUP  1.00
assign  ((resid   56 and name HB*  )) ((resid   57 and name HN   ))   3.95  2.15  0.00 ! #SUP  1.00
assign  ((resid   27 and name HA   )) ((resid   29 and name HN   ))   4.38  2.58  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG2* )) ((resid   29 and name HN   ))   4.90  3.10  0.00 ! #SUP  1.00
assign  ((resid   89 and name HA   )) ((resid   92 and name HN   ))   4.32  2.52  0.00 ! #SUP  1.00
assign  ((resid   92 and name HN   )) ((resid   92 and name HG1  ))   3.98  2.18  0.00 ! #SUP  1.00
assign  ((resid   91 and name HN   )) ((resid   92 and name HN   ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid   92 and name HN   )) ((resid   92 and name HG2  ))   3.98  2.18  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   92 and name HN   ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   44 and name HN   )) ((resid   45 and name HN   ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   43 and name HA2  )) ((resid   44 and name HN   ))   3.56  1.76  0.00 ! #SUP  1.00
assign  ((resid   43 and name HA1  )) ((resid   44 and name HN   ))   3.56  1.76  0.00 ! #SUP  1.00
assign  ((resid   44 and name HN   )) ((resid   44 and name HE*  ))   5.00  3.20  0.00 ! #SUP  1.00
assign  ((resid   44 and name HN   )) ((resid   44 and name HB*  ))   3.01  1.21  0.00 ! #SUP  1.00
assign  ((resid   44 and name HN   )) ((resid   45 and name HG12 ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid   69 and name HN   )) ((resid   69 and name HG*  ))   3.64  1.84  0.00 ! #SUP  1.00
assign  ((resid   68 and name HB2  )) ((resid   69 and name HN   ))   3.03  1.23  0.00 ! #SUP  1.00
assign  ((resid   29 and name HN   )) ((resid   32 and name HN   ))   5.41  3.61  0.00 ! #SUP  1.00
assign  ((resid   29 and name HN   )) ((resid   29 and name HG1  ))   3.97  2.17  0.00 ! #SUP  1.00
assign  ((resid   68 and name HD2  )) ((resid   69 and name HN   ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   31 and name HB1  )) ((resid   32 and name HN   ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid   31 and name HN   )) ((resid   32 and name HN   ))   3.73  1.93  0.00 ! #SUP  1.00
assign  ((resid   32 and name HN   )) ((resid   32 and name HB2  ))   3.76  1.96  0.00 ! #SUP  1.00
assign  ((resid   32 and name HN   )) ((resid   32 and name HG   ))   3.82  2.02  0.00 ! #SUP  1.00
assign  ((resid   32 and name HN   )) ((resid   32 and name HB1  ))   3.76  1.96  0.00 ! #SUP  1.00
assign  ((resid   32 and name HN   )) ((resid   32 and name HD1* ))   4.32  2.52  0.00 ! #SUP  1.00
assign  ((resid   32 and name HN   )) ((resid   32 and name HD2* ))   4.32  2.52  0.00 ! #SUP  1.00
assign  ((resid   80 and name HB2  )) ((resid   81 and name HN   ))   4.31  2.51  0.00 ! #SUP  1.00
assign  ((resid   80 and name HG*  )) ((resid   81 and name HN   ))   3.21  1.41  0.00 ! #SUP  1.00
assign  ((resid   81 and name HN   )) ((resid   81 and name HB*  ))   3.42  1.62  0.00 ! #SUP  1.00
assign  ((resid   88 and name HD1  )) ((resid   89 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   82 and name HN   )) ((resid   84 and name HN   ))   4.01  2.21  0.00 ! #SUP  1.00
assign  ((resid   80 and name HA   )) ((resid   84 and name HN   ))   3.86  2.06  0.00 ! #SUP  1.00
assign  ((resid   82 and name HD1* )) ((resid   84 and name HN   ))   5.12  3.32  0.00 ! #SUP  1.00
assign  ((resid   81 and name HN   )) ((resid   81 and name HD*  ))   4.54  2.74  0.00 ! #SUP  1.00
assign  ((resid   78 and name HA   )) ((resid   81 and name HN   ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   81 and name HN   )) ((resid   82 and name HG2* ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   64 and name HN   )) ((resid   64 and name HB   ))   3.14  1.34  0.00 ! #SUP  1.00
assign  ((resid   63 and name HB   )) ((resid   64 and name HN   ))   3.78  1.98  0.00 ! #SUP  1.00
assign  ((resid   64 and name HN   )) ((resid   64 and name HG2* ))   3.62  1.82  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG2* )) ((resid   64 and name HN   ))   3.66  1.86  0.00 ! #SUP  1.00
assign  ((resid   59 and name HA   )) ((resid   62 and name HN   ))   4.26  2.46  0.00 ! #SUP  1.00
assign  ((resid   62 and name HN   )) ((resid   62 and name HB2  ))   3.23  1.43  0.00 ! #SUP  1.00
assign  ((resid   62 and name HN   )) ((resid   62 and name HG   ))   3.08  1.28  0.00 ! #SUP  1.00
assign  ((resid   62 and name HN   )) ((resid   62 and name HD1* ))   4.36  2.56  0.00 ! #SUP  1.00
assign  ((resid   62 and name HN   )) ((resid   63 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   15 and name HN   )) ((resid   18 and name HD*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   15 and name HN   )) ((resid   72 and name HE3  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   15 and name HN   )) ((resid   15 and name HB*  ))   3.28  1.48  0.00 ! #SUP  1.00
assign  ((resid   15 and name HN   )) ((resid   15 and name HD1* ))   5.00  3.20  0.00 ! #SUP  1.00
assign  ((resid   15 and name HN   )) ((resid   15 and name HD2* ))   5.00  3.20  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   58 and name HN   ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   89 and name HN   )) ((resid   90 and name HN   ))   3.40  1.60  0.00 ! #SUP  1.00
assign  ((resid   88 and name HE3  )) ((resid   89 and name HN   ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid   88 and name HB2  )) ((resid   89 and name HN   ))   4.10  2.30  0.00 ! #SUP  1.00
assign  ((resid   89 and name HN   )) ((resid   89 and name HG2  ))   4.09  2.29  0.00 ! #SUP  1.00
assign  ((resid   58 and name HN   )) ((resid   59 and name HN   ))   3.21  1.41  0.00 ! #SUP  1.00
assign  ((resid   58 and name HN   )) ((resid   58 and name HG1  ))   3.78  1.98  0.00 ! #SUP  1.00
assign  ((resid   58 and name HN   )) ((resid   59 and name HB*  ))   4.68  2.88  0.00 ! #SUP  1.00
assign  ((resid   58 and name HN   )) ((resid   58 and name HB2  ))   3.38  1.58  0.00 ! #SUP  1.00
assign  ((resid   88 and name HZ3  )) ((resid   89 and name HN   ))   4.84  3.04  0.00 ! #SUP  1.00
assign  ((resid   55 and name HB2  )) ((resid   56 and name HN   ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   56 and name HN   )) ((resid   56 and name HB*  ))   2.97  1.17  0.00 ! #SUP  1.00
assign  ((resid   15 and name HN   )) ((resid   17 and name HB   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   69 and name HA   )) ((resid   73 and name HN   ))   5.13  3.33  0.00 ! #SUP  1.00
assign  ((resid   20 and name HN   )) ((resid   22 and name HN   ))   4.65  2.85  0.00 ! #SUP  1.00
assign  ((resid   73 and name HN   )) ((resid   75 and name HN   ))   4.27  2.47  0.00 ! #SUP  1.00
assign  ((resid   22 and name HN   )) ((resid   23 and name HN   ))   4.69  2.89  0.00 ! #SUP  1.00
assign  ((resid   21 and name HN   )) ((resid   22 and name HN   ))   3.01  1.21  0.00 ! #SUP  1.00
assign  ((resid   19 and name HA   )) ((resid   22 and name HN   ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   20 and name HA   )) ((resid   22 and name HN   ))   4.53  2.73  0.00 ! #SUP  1.00
assign  ((resid   22 and name HN   )) ((resid   22 and name HB2  ))   3.42  1.62  0.00 ! #SUP  1.00
assign  ((resid   22 and name HN   )) ((resid   22 and name HG   ))   3.95  2.15  0.00 ! #SUP  1.00
assign  ((resid   22 and name HN   )) ((resid   22 and name HB1  ))   3.89  2.09  0.00 ! #SUP  1.00
assign  ((resid   22 and name HN   )) ((resid   22 and name HD1* ))   4.42  2.62  0.00 ! #SUP  1.00
assign  ((resid   22 and name HN   )) ((resid   22 and name HD2* ))   4.42  2.62  0.00 ! #SUP  1.00
assign  ((resid   72 and name HN   )) ((resid   73 and name HN   ))   3.33  1.53  0.00 ! #SUP  1.00
assign  ((resid   72 and name HB*  )) ((resid   73 and name HN   ))   3.49  1.69  0.00 ! #SUP  1.00
assign  ((resid   73 and name HN   )) ((resid   73 and name HB2  ))   3.54  1.74  0.00 ! #SUP  1.00
assign  ((resid   73 and name HN   )) ((resid   73 and name HB1  ))   3.54  1.74  0.00 ! #SUP  1.00
assign  ((resid   71 and name HB*  )) ((resid   73 and name HN   ))   5.16  3.36  0.00 ! #SUP  1.00
assign  ((resid   73 and name HN   )) ((resid   73 and name HG1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   73 and name HN   )) ((resid   75 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   86 and name HN   )) ((resid   88 and name HN   ))   4.62  2.82  0.00 ! #SUP  1.00
assign  ((resid   85 and name HB1  )) ((resid   86 and name HN   ))   4.29  2.49  0.00 ! #SUP  1.00
assign  ((resid   86 and name HN   )) ((resid   86 and name HB2  ))   3.88  2.08  0.00 ! #SUP  1.00
assign  ((resid   86 and name HN   )) ((resid   86 and name HB1  ))   3.88  2.08  0.00 ! #SUP  1.00
assign  ((resid   85 and name HB2  )) ((resid   86 and name HN   ))   4.29  2.49  0.00 ! #SUP  1.00
assign  ((resid   85 and name HG*  )) ((resid   86 and name HN   ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   86 and name HN   )) ((resid   87 and name HA   ))   5.45  3.65  0.00 ! #SUP  1.00
assign  ((resid   64 and name HN   )) ((resid   65 and name HN   ))   3.46  1.66  0.00 ! #SUP  1.00
assign  ((resid   65 and name HN   )) ((resid   65 and name HD2  ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG2* )) ((resid   65 and name HN   ))   4.76  2.96  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   65 and name HN   ))   5.33  3.53  0.00 ! #SUP  1.00
assign  ((resid   65 and name HN   )) ((resid   66 and name HN   ))   3.25  1.45  0.00 ! #SUP  1.00
assign  ((resid   65 and name HN   )) ((resid   66 and name HD*  ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   64 and name HB   )) ((resid   65 and name HN   ))   4.49  2.69  0.00 ! #SUP  1.00
assign  ((resid   65 and name HN   )) ((resid   65 and name HB2  ))   3.92  2.12  0.00 ! #SUP  1.00
assign  ((resid   65 and name HN   )) ((resid   65 and name HB1  ))   3.92  2.12  0.00 ! #SUP  1.00
assign  ((resid   64 and name HG2* )) ((resid   65 and name HN   ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   80 and name HN   )) ((resid   80 and name HB1  ))   3.24  1.44  0.00 ! #SUP  1.00
assign  ((resid   79 and name HB2  )) ((resid   80 and name HN   ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   80 and name HN   )) ((resid   80 and name HB2  ))   3.62  1.82  0.00 ! #SUP  1.00
assign  ((resid   80 and name HN   )) ((resid   80 and name HG*  ))   3.44  1.64  0.00 ! #SUP  1.00
assign  ((resid   30 and name HN   )) ((resid   31 and name HN   ))   3.58  1.78  0.00 ! #SUP  1.00
assign  ((resid   31 and name HN   )) ((resid   31 and name HB1  ))   3.96  2.16  0.00 ! #SUP  1.00
assign  ((resid   17 and name HN   )) ((resid   17 and name HG2* ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   48 and name HA2  )) ((resid   50 and name HN   ))   3.86  2.06  0.00 ! #SUP  1.00
assign  ((resid   49 and name HB*  )) ((resid   50 and name HN   ))   4.33  2.53  0.00 ! #SUP  1.00
assign  ((resid   50 and name HN   )) ((resid   50 and name HB2  ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   50 and name HN   )) ((resid   61 and name HD2* ))   4.88  3.08  0.00 ! #SUP  1.00
assign  ((resid   50 and name HN   )) ((resid   53 and name HB*  ))   4.80  3.00  0.00 ! #SUP  1.00
assign  ((resid   50 and name HN   )) ((resid   50 and name HB1  ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   25 and name HN   )) ((resid   27 and name HB2  ))   5.05  3.25  0.00 ! #SUP  1.00
assign  ((resid   18 and name HB1  )) ((resid   19 and name HN   ))   4.58  2.78  0.00 ! #SUP  1.00
assign  ((resid   19 and name HN   )) ((resid   19 and name HG   ))   3.99  2.19  0.00 ! #SUP  1.00
assign  ((resid   18 and name HD*  )) ((resid   19 and name HN   ))   5.09  3.29  0.00 ! #SUP  1.00
assign  ((resid   19 and name HN   )) ((resid   21 and name HN   ))   5.35  3.55  0.00 ! #SUP  1.00
assign  ((resid   18 and name HB2  )) ((resid   19 and name HN   ))   4.58  2.78  0.00 ! #SUP  1.00
assign  ((resid   19 and name HN   )) ((resid   19 and name HB2  ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   19 and name HN   )) ((resid   19 and name HB1  ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   25 and name HN   )) ((resid   26 and name HN   ))   3.27  1.47  0.00 ! #SUP  1.00
assign  ((resid   25 and name HN   )) ((resid   25 and name HG1* ))   2.99  1.19  0.00 ! #SUP  1.00
assign  ((resid   25 and name HN   )) ((resid   28 and name HN   ))   5.40  3.60  0.00 ! #SUP  1.00
assign  ((resid   25 and name HN   )) ((resid   25 and name HB   ))   2.95  1.15  0.00 ! #SUP  1.00
assign  ((resid   24 and name HB*  )) ((resid   25 and name HN   ))   3.16  1.36  0.00 ! #SUP  1.00
assign  ((resid   19 and name HN   )) ((resid   19 and name HD2* ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   59 and name HN   )) ((resid   60 and name HN   ))   3.73  1.93  0.00 ! #SUP  1.00
assign  ((resid   21 and name HN   )) ((resid   22 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   24 and name HN   )) ((resid   25 and name HN   ))   3.79  1.99  0.00 ! #SUP  1.00
assign  ((resid   17 and name HG2* )) ((resid   19 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   60 and name HN   )) ((resid   61 and name HN   ))   3.36  1.56  0.00 ! #SUP  1.00
assign  ((resid   60 and name HN   )) ((resid   60 and name HB2  ))   3.54  1.74  0.00 ! #SUP  1.00
assign  ((resid   60 and name HN   )) ((resid   60 and name HB1  ))   3.54  1.74  0.00 ! #SUP  1.00
assign  ((resid   59 and name HB*  )) ((resid   60 and name HN   ))   3.15  1.35  0.00 ! #SUP  1.00
assign  ((resid   19 and name HA   )) ((resid   21 and name HN   ))   4.08  2.28  0.00 ! #SUP  1.00
assign  ((resid   72 and name HN   )) ((resid   72 and name HB*  ))   3.08  1.28  0.00 ! #SUP  1.00
assign  ((resid   71 and name HB*  )) ((resid   72 and name HN   ))   3.41  1.61  0.00 ! #SUP  1.00
assign  ((resid   52 and name HN   )) ((resid   52 and name HB2  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   52 and name HN   )) ((resid   52 and name HG*  ))   4.28  2.48  0.00 ! #SUP  1.00
assign  ((resid   52 and name HN   )) ((resid   53 and name HB*  ))   4.88  3.08  0.00 ! #SUP  1.00
assign  ((resid   82 and name HG11 )) ((resid   83 and name HN   ))   4.62  2.82  0.00 ! #SUP  1.00
assign  ((resid   82 and name HG12 )) ((resid   83 and name HN   ))   4.62  2.82  0.00 ! #SUP  1.00
assign  ((resid   82 and name HG2* )) ((resid   83 and name HN   ))   4.57  2.77  0.00 ! #SUP  1.00
assign  ((resid   80 and name HA   )) ((resid   83 and name HN   ))   4.73  2.93  0.00 ! #SUP  1.00
assign  ((resid   83 and name HN   )) ((resid   84 and name HN   ))   3.05  1.25  0.00 ! #SUP  1.00
assign  ((resid   82 and name HN   )) ((resid   83 and name HN   ))   3.23  1.43  0.00 ! #SUP  1.00
assign  ((resid   82 and name HA   )) ((resid   83 and name HN   ))   3.48  1.68  0.00 ! #SUP  1.00
assign  ((resid   83 and name HN   )) ((resid   83 and name HA   ))   2.61  0.81  0.00 ! #SUP  1.00
assign  ((resid   83 and name HN   )) ((resid   83 and name HB1  ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   37 and name HA   )) ((resid   38 and name HN   ))   2.94  1.14  0.00 ! #SUP  1.00
assign  ((resid   73 and name HA   )) ((resid   76 and name HN   ))   4.06  2.26  0.00 ! #SUP  1.00
assign  ((resid   76 and name HN   )) ((resid   76 and name HB1  ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   75 and name HB*  )) ((resid   76 and name HN   ))   3.24  1.44  0.00 ! #SUP  1.00
assign  ((resid   76 and name HN   )) ((resid   76 and name HG   ))   3.49  1.69  0.00 ! #SUP  1.00
assign  ((resid   76 and name HN   )) ((resid   76 and name HD2* ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   81 and name HA   )) ((resid   83 and name HN   ))   4.43  2.63  0.00 ! #SUP  1.00
assign  ((resid   49 and name HN   )) ((resid   51 and name HN   ))   4.79  2.99  0.00 ! #SUP  1.00
assign  ((resid   48 and name HA2  )) ((resid   49 and name HN   ))   3.34  1.54  0.00 ! #SUP  1.00
assign  ((resid   49 and name HN   )) ((resid   49 and name HB*  ))   3.52  1.72  0.00 ! #SUP  1.00
assign  ((resid   46 and name HB2  )) ((resid   49 and name HN   ))   5.29  3.49  0.00 ! #SUP  1.00
assign  ((resid   46 and name HG2  )) ((resid   49 and name HN   ))   3.52  1.72  0.00 ! #SUP  1.00
assign  ((resid   13 and name HA   )) ((resid   16 and name HN   ))   3.92  2.12  0.00 ! #SUP  1.00
assign  ((resid   15 and name HN   )) ((resid   16 and name HN   ))   3.41  1.61  0.00 ! #SUP  1.00
assign  ((resid   16 and name HN   )) ((resid   17 and name HN   ))   3.75  1.95  0.00 ! #SUP  1.00
assign  ((resid   15 and name HB*  )) ((resid   16 and name HN   ))   3.62  1.82  0.00 ! #SUP  1.00
assign  ((resid   15 and name HG   )) ((resid   16 and name HN   ))   5.26  3.46  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD1* )) ((resid   16 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD2* )) ((resid   16 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   66 and name HN   ))   4.63  2.83  0.00 ! #SUP  1.00
assign  ((resid   65 and name HB1  )) ((resid   66 and name HN   ))   4.20  2.40  0.00 ! #SUP  1.00
assign  ((resid   66 and name HN   )) ((resid   66 and name HB1  ))   3.75  1.95  0.00 ! #SUP  1.00
assign  ((resid   66 and name HN   )) ((resid   66 and name HD*  ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   66 and name HN   )) ((resid   66 and name HB2  ))   3.52  1.72  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   56 and name HN   ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   53 and name HA   )) ((resid   54 and name HN   ))   2.73  0.93  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   55 and name HD1  ))   5.13  3.33  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   57 and name HB2  ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   58 and name HN   ))   4.47  2.67  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   58 and name HG2  ))   4.58  2.78  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   57 and name HB1  ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid   73 and name HA   )) ((resid   77 and name HN   ))   4.73  2.93  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   77 and name HN   ))   4.47  2.67  0.00 ! #SUP  1.00
assign  ((resid   76 and name HN   )) ((resid   77 and name HN   ))   3.36  1.56  0.00 ! #SUP  1.00
assign  ((resid   77 and name HN   )) ((resid   78 and name HN   ))   3.48  1.68  0.00 ! #SUP  1.00
assign  ((resid   77 and name HN   )) ((resid   77 and name HB*  ))   2.91  1.11  0.00 ! #SUP  1.00
assign  ((resid   75 and name HN   )) ((resid   77 and name HN   ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   73 and name HG1  )) ((resid   77 and name HN   ))   5.36  3.56  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   67 and name HN   ))   4.65  2.85  0.00 ! #SUP  1.00
assign  ((resid   66 and name HN   )) ((resid   67 and name HN   ))   3.27  1.47  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   67 and name HN   ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   78 and name HA   )) ((resid   82 and name HN   ))   4.86  3.06  0.00 ! #SUP  1.00
assign  ((resid   81 and name HN   )) ((resid   82 and name HN   ))   3.54  1.74  0.00 ! #SUP  1.00
assign  ((resid   82 and name HN   )) ((resid   82 and name HG12 ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   82 and name HN   )) ((resid   82 and name HG2* ))   3.29  1.49  0.00 ! #SUP  1.00
assign  ((resid   82 and name HN   )) ((resid   82 and name HG11 ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   82 and name HN   )) ((resid   82 and name HD1* ))   3.99  2.19  0.00 ! #SUP  1.00
assign  ((resid   35 and name HN   )) ((resid   36 and name HN   ))   3.29  1.49  0.00 ! #SUP  1.00
assign  ((resid   34 and name HA   )) ((resid   36 and name HN   ))   5.36  3.56  0.00 ! #SUP  1.00
assign  ((resid   36 and name HN   )) ((resid   36 and name HG2* ))   3.26  1.46  0.00 ! #SUP  1.00
assign  ((resid   43 and name HN   )) ((resid   44 and name HN   ))   3.76  1.96  0.00 ! #SUP  1.00
assign  ((resid   43 and name HN   )) ((resid   44 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   43 and name HN   ))   4.47  2.67  0.00 ! #SUP  1.00
assign  ((resid   40 and name HN   )) ((resid   41 and name HN   ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid   40 and name HB1  )) ((resid   41 and name HN   ))   3.93  2.13  0.00 ! #SUP  1.00
assign  ((resid   40 and name HB2  )) ((resid   41 and name HN   ))   3.93  2.13  0.00 ! #SUP  1.00
assign  ((resid   90 and name HN   )) ((resid   91 and name HN   ))   3.32  1.52  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   91 and name HN   ))   4.32  2.52  0.00 ! #SUP  1.00
assign  ((resid   46 and name HG2  )) ((resid   48 and name HN   ))   5.22  3.42  0.00 ! #SUP  1.00
assign  ((resid   47 and name HN   )) ((resid   48 and name HN   ))   3.75  1.95  0.00 ! #SUP  1.00
assign  ((resid   48 and name HN   )) ((resid   49 and name HN   ))   3.70  1.90  0.00 ! #SUP  1.00
assign  ((resid   47 and name HB1  )) ((resid   48 and name HN   ))   4.36  2.56  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   48 and name HN   ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   35 and name HN   ))   4.28  2.48  0.00 ! #SUP  1.00
assign  ((resid   34 and name HB2  )) ((resid   35 and name HN   ))   4.48  2.68  0.00 ! #SUP  1.00
assign  ((resid   34 and name HB1  )) ((resid   35 and name HN   ))   4.35  2.55  0.00 ! #SUP  1.00
assign  ((resid   35 and name HN   )) ((resid   36 and name HG2* ))   4.18  2.38  0.00 ! #SUP  1.00
assign  ((resid   33 and name HA   )) ((resid   37 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   12 and name HN   )) ((resid   14 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   12 and name HN   )) ((resid   63 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   55 and name HA   )) ((resid   59 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   13 and name HN   )) ((resid   14 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   59 and name HN   )) ((resid   61 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   60 and name HG2  )) ((resid   61 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   26 and name HA   )) ((resid   30 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   27 and name HA   )) ((resid   30 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   50 and name HB2  )) ((resid   51 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   51 and name HN   )) ((resid   53 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   50 and name HG2  )) ((resid   51 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   50 and name HB1  )) ((resid   51 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   50 and name HG1  )) ((resid   51 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   26 and name HN   )) ((resid   27 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   26 and name HN   )) ((resid   26 and name HG*  ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB2  )) ((resid   71 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   62 and name HG   )) ((resid   63 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   60 and name HG2  )) ((resid   63 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   26 and name HA   )) ((resid   29 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   28 and name HN   )) ((resid   28 and name HD*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   46 and name HG1  )) ((resid   49 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   32 and name HA   )) ((resid   36 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   42 and name HN   )) ((resid   43 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   32 and name HA   )) ((resid   35 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   33 and name HA   )) ((resid   35 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   46 and name HD2  )) ((resid   48 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   42 and name HB1  )) ((resid   43 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   34 and name HN   )) ((resid   36 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   42 and name HB2  )) ((resid   43 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   25 and name HN   )) ((resid   27 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   46 and name HG2  )) ((resid   50 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   80 and name HN   )) ((resid   81 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   30 and name HD*  )) ((resid   31 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   27 and name HA   )) ((resid   31 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   31 and name HN   )) ((resid   34 and name HG   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   80 and name HN   )) ((resid   88 and name HD1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   79 and name HB1  )) ((resid   80 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   80 and name HN   )) ((resid   82 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   53 and name HA   )) ((resid   58 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   56 and name HA   )) ((resid   58 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   58 and name HN   )) ((resid   58 and name HG2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   89 and name HN   )) ((resid   90 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   13 and name HA   )) ((resid   15 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   15 and name HN   )) ((resid   15 and name HG   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   28 and name HG2  )) ((resid   29 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   44 and name HN   )) ((resid   45 and name HB   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   39 and name HB*  )) ((resid   40 and name HN   ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   18 and name HN   )) ((resid   18 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   26 and name HB2  )) ((resid   27 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   10 and name HA   )) ((resid   12 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   81 and name HB*  )) ((resid   82 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   78 and name HG2* )) ((resid   82 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   53 and name HN   )) ((resid   54 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   66 and name HN   )) ((resid   66 and name HZ   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   64 and name HN   )) ((resid   65 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   29 and name HN   )) ((resid   82 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   78 and name HN   )) ((resid   79 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   63 and name HN   )) ((resid   64 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   60 and name HA   )) ((resid   63 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   46 and name HD1  )) ((resid   65 and name HE1  ))   4.78  2.98  0.00 ! #SUP  1.00
assign  ((resid   85 and name HD*  )) ((resid   88 and name HE3  ))   4.75  2.95  0.00 ! #SUP  1.00
assign  ((resid   88 and name HE3  )) ((resid   89 and name HA   ))   3.62  1.82  0.00 ! #SUP  1.00
assign  ((resid   85 and name HG*  )) ((resid   88 and name HE3  ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   85 and name HA   )) ((resid   88 and name HE3  ))   4.48  2.68  0.00 ! #SUP  1.00
assign  ((resid   47 and name HA   )) ((resid   47 and name HE3  ))   4.44  2.64  0.00 ! #SUP  1.00
assign  ((resid   65 and name HD2  )) ((resid   66 and name HD*  ))   5.40  3.60  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB1  )) ((resid   66 and name HD*  ))   4.57  2.77  0.00 ! #SUP  1.00
assign  ((resid   66 and name HD*  )) ((resid   71 and name HB*  ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   66 and name HD*  ))   3.60  1.80  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   66 and name HD*  ))   4.20  2.40  0.00 ! #SUP  1.00
assign  ((resid   66 and name HD*  )) ((resid   71 and name HA   ))   4.29  2.49  0.00 ! #SUP  1.00
assign  ((resid   18 and name HD*  )) ((resid   87 and name HB2  ))   4.72  2.92  0.00 ! #SUP  1.00
assign  ((resid   14 and name HA   )) ((resid   18 and name HD*  ))   5.30  3.50  0.00 ! #SUP  1.00
assign  ((resid   18 and name HD*  )) ((resid   87 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   18 and name HD*  )) ((resid   87 and name HB1  ))   4.72  2.92  0.00 ! #SUP  1.00
assign  ((resid   15 and name HB*  )) ((resid   72 and name HE3  ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   15 and name HA   )) ((resid   72 and name HE3  ))   4.31  2.51  0.00 ! #SUP  1.00
assign  ((resid   77 and name HA   )) ((resid   88 and name HD1  ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   80 and name HB2  )) ((resid   88 and name HD1  ))   4.65  2.85  0.00 ! #SUP  1.00
assign  ((resid   80 and name HG*  )) ((resid   88 and name HD1  ))   4.36  2.56  0.00 ! #SUP  1.00
assign  ((resid   80 and name HB1  )) ((resid   88 and name HD1  ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid   72 and name HE3  )) ((resid   75 and name HB*  ))   3.75  1.95  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   88 and name HD1  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   66 and name HE*  ))   4.44  2.64  0.00 ! #SUP  1.00
assign  ((resid   72 and name HZ2  )) ((resid   94 and name HG*  ))   3.97  2.17  0.00 ! #SUP  1.00
assign  ((resid   62 and name HG   )) ((resid   66 and name HE*  ))   4.71  2.91  0.00 ! #SUP  1.00
assign  ((resid   72 and name HZ2  )) ((resid   94 and name HB*  ))   4.85  3.05  0.00 ! #SUP  1.00
assign  ((resid   40 and name HD1* )) ((resid   66 and name HE*  ))   4.30  2.50  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG11 )) ((resid   66 and name HE*  ))   4.48  2.68  0.00 ! #SUP  1.00
assign  ((resid   72 and name HZ2  )) ((resid   76 and name HD1* ))   4.88  3.08  0.00 ! #SUP  1.00
assign  ((resid   69 and name HA   )) ((resid   72 and name HD1  ))   4.52  2.72  0.00 ! #SUP  1.00
assign  ((resid   72 and name HD1  )) ((resid   73 and name HA   ))   4.78  2.98  0.00 ! #SUP  1.00
assign  ((resid   72 and name HB*  )) ((resid   72 and name HD1  ))   3.58  1.78  0.00 ! #SUP  1.00
assign  ((resid   40 and name HG   )) ((resid   66 and name HZ   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   72 and name HZ2  )) ((resid   76 and name HG   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   40 and name HD1* )) ((resid   66 and name HZ   ))   4.53  2.73  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   79 and name HD*  ))   3.93  2.13  0.00 ! #SUP  1.00
assign  ((resid   79 and name HD*  )) ((resid   88 and name HA   ))   4.40  2.60  0.00 ! #SUP  1.00
assign  ((resid   79 and name HD*  )) ((resid   82 and name HD1* ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   79 and name HD*  ))   4.55  2.75  0.00 ! #SUP  1.00
assign  ((resid   30 and name HD*  )) ((resid   78 and name HB   ))   3.36  1.56  0.00 ! #SUP  1.00
assign  ((resid   30 and name HD*  )) ((resid   82 and name HD1* ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   30 and name HD*  ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   30 and name HD*  )) ((resid   82 and name HG2* ))   4.75  2.95  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   79 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   76 and name HA   )) ((resid   79 and name HE*  ))   4.63  2.83  0.00 ! #SUP  1.00
assign  ((resid   33 and name HD*  )) ((resid   78 and name HG2* ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   18 and name HB2  )) ((resid   79 and name HE*  ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   33 and name HD*  )) ((resid   81 and name HD*  ))   4.14  2.34  0.00 ! #SUP  1.00
assign  ((resid   33 and name HA   )) ((resid   33 and name HD*  ))   3.40  1.60  0.00 ! #SUP  1.00
assign  ((resid   33 and name HD*  )) ((resid   81 and name HB*  ))   4.40  2.60  0.00 ! #SUP  1.00
assign  ((resid   33 and name HD*  )) ((resid   82 and name HB   ))   5.36  3.56  0.00 ! #SUP  1.00
assign  ((resid   46 and name HG1  )) ((resid   47 and name HZ3  ))   4.89  3.09  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   90 and name HB2  ))   4.38  2.58  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   94 and name HG*  ))   5.01  3.21  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   87 and name HD2* ))   4.95  3.15  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   87 and name HD1* ))   4.95  3.15  0.00 ! #SUP  1.00
assign  ((resid   18 and name HB2  )) ((resid   79 and name HZ   ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD1* )) ((resid   79 and name HZ   ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   79 and name HZ   ))   5.09  3.29  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD2* )) ((resid   79 and name HZ   ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   30 and name HE*  )) ((resid   34 and name HD*  ))   4.49  2.69  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD2* )) ((resid   30 and name HE*  ))   4.69  2.89  0.00 ! #SUP  1.00
assign  ((resid   33 and name HE*  )) ((resid   78 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   33 and name HE*  )) ((resid   81 and name HG*  ))   4.47  2.67  0.00 ! #SUP  1.00
assign  ((resid   33 and name HE*  )) ((resid   36 and name HG2* ))   5.45  3.65  0.00 ! #SUP  1.00
assign  ((resid   65 and name HD2  )) ((resid   66 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   64 and name HB   )) ((resid   65 and name HD2  ))   5.02  3.22  0.00 ! #SUP  1.00
assign  ((resid   61 and name HD1* )) ((resid   65 and name HD2  ))   5.41  3.61  0.00 ! #SUP  1.00
assign  ((resid   64 and name HG2* )) ((resid   65 and name HD2  ))   4.47  2.67  0.00 ! #SUP  1.00
assign  ((resid   61 and name HD2* )) ((resid   65 and name HD2  ))   5.41  3.61  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   65 and name HD2  ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   72 and name HZ3  ))   4.79  2.99  0.00 ! #SUP  1.00
assign  ((resid   15 and name HB*  )) ((resid   72 and name HZ3  ))   4.99  3.19  0.00 ! #SUP  1.00
assign  ((resid   14 and name HG*  )) ((resid   72 and name HZ3  ))   5.24  3.44  0.00 ! #SUP  1.00
assign  ((resid   72 and name HZ3  )) ((resid   75 and name HB*  ))   4.80  3.00  0.00 ! #SUP  1.00
assign  ((resid   72 and name HZ3  )) ((resid   76 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   72 and name HH2  ))   4.26  2.46  0.00 ! #SUP  1.00
assign  ((resid   72 and name HH2  )) ((resid   94 and name HG*  ))   4.72  2.92  0.00 ! #SUP  1.00
assign  ((resid   18 and name HD*  )) ((resid   72 and name HH2  ))   4.49  2.69  0.00 ! #SUP  1.00
assign  ((resid   79 and name HA   )) ((resid   79 and name HD*  ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid   58 and name HA   )) ((resid   61 and name HD2* ))   4.13  2.33  0.00 ! #SUP  1.00
assign  ((resid   36 and name HA   )) ((resid   36 and name HG2* ))   3.35  1.55  0.00 ! #SUP  1.00
assign  ((resid   23 and name HA   )) ((resid   26 and name HB2  ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid  100 and name HA   )) ((resid  100 and name HG2* ))   3.49  1.69  0.00 ! #SUP  1.00
assign  ((resid   22 and name HA   )) ((resid   22 and name HD*  ))   2.95  1.15  0.00 ! #SUP  1.00
assign  ((resid   76 and name HB2  )) ((resid   88 and name HA   ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   47 and name HA   )) ((resid   47 and name HD1  ))   4.80  3.00  0.00 ! #SUP  1.00
assign  ((resid   40 and name HA   )) ((resid   66 and name HZ   ))   5.49  3.69  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   27 and name HA   ))   3.66  1.86  0.00 ! #SUP  1.00
assign  ((resid   39 and name HA   )) ((resid   39 and name HG*  ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   61 and name HA   )) ((resid   61 and name HD2* ))   4.11  2.31  0.00 ! #SUP  1.00
assign  ((resid   94 and name HA   )) ((resid   94 and name HG*  ))   3.88  2.08  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   62 and name HB1  ))   2.90  1.10  0.00 ! #SUP  1.00
assign  ((resid   24 and name HA   )) ((resid   27 and name HB2  ))   3.98  2.18  0.00 ! #SUP  1.00
assign  ((resid   55 and name HB2  )) ((resid   56 and name HA   ))   4.40  2.60  0.00 ! #SUP  1.00
assign  ((resid   87 and name HA   )) ((resid   90 and name HB2  ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   87 and name HA   )) ((resid   90 and name HG2  ))   4.21  2.41  0.00 ! #SUP  1.00
assign  ((resid   87 and name HA   )) ((resid   90 and name HG1  ))   4.21  2.41  0.00 ! #SUP  1.00
assign  ((resid   32 and name HA   )) ((resid   32 and name HG   ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   32 and name HG   )) ((resid   33 and name HA   ))   4.44  2.64  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG1* )) ((resid   26 and name HA   ))   4.75  2.95  0.00 ! #SUP  1.00
assign  ((resid   65 and name HA   )) ((resid   65 and name HD2  ))   4.54  2.74  0.00 ! #SUP  1.00
assign  ((resid   24 and name HB*  )) ((resid   25 and name HA   ))   4.29  2.49  0.00 ! #SUP  1.00
assign  ((resid   20 and name HA   )) ((resid   55 and name HB2  ))   4.20  2.40  0.00 ! #SUP  1.00
assign  ((resid   85 and name HA   )) ((resid   85 and name HG*  ))   3.69  1.89  0.00 ! #SUP  1.00
assign  ((resid   19 and name HA   )) ((resid   22 and name HD*  ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   19 and name HA   )) ((resid   79 and name HZ   ))   4.71  2.91  0.00 ! #SUP  1.00
assign  ((resid   45 and name HA   )) ((resid   65 and name HE1  ))   5.04  3.24  0.00 ! #SUP  1.00
assign  ((resid   60 and name HA   )) ((resid   63 and name HG2* ))   3.97  2.17  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   59 and name HA   ))   3.94  2.14  0.00 ! #SUP  1.00
assign  ((resid   59 and name HA   )) ((resid   62 and name HD*  ))   3.07  1.27  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   92 and name HA   ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   30 and name HB2  )) ((resid   82 and name HG2* ))   4.35  2.55  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   48 and name HA2  ))   4.10  2.30  0.00 ! #SUP  1.00
assign  ((resid   64 and name HA   )) ((resid   64 and name HG2* ))   3.31  1.51  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG2* )) ((resid   64 and name HA   ))   3.40  1.60  0.00 ! #SUP  1.00
assign  ((resid   46 and name HG2  )) ((resid   49 and name HB*  ))   3.98  2.18  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   71 and name HA   ))   4.81  3.01  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   71 and name HA   ))   3.92  2.12  0.00 ! #SUP  1.00
assign  ((resid   71 and name HA   )) ((resid   74 and name HD1* ))   5.02  3.22  0.00 ! #SUP  1.00
assign  ((resid   30 and name HE*  )) ((resid   78 and name HB   ))   4.48  2.68  0.00 ! #SUP  1.00
assign  ((resid   79 and name HB1  )) ((resid   87 and name HG   ))   5.06  3.26  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA2  )) ((resid   40 and name HD1* ))   4.62  2.82  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   91 and name HA1  ))   4.79  2.99  0.00 ! #SUP  1.00
assign  ((resid   73 and name HA   )) ((resid   76 and name HD1* ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   88 and name HZ3  )) ((resid   89 and name HA   ))   4.63  2.83  0.00 ! #SUP  1.00
assign  ((resid   98 and name HB*  )) ((resid   98 and name HD*  ))   4.15  2.35  0.00 ! #SUP  1.00
assign  ((resid   29 and name HE*  )) ((resid   82 and name HG2* ))   4.65  2.85  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   58 and name HG1  ))   4.02  2.22  0.00 ! #SUP  1.00
assign  ((resid   91 and name HA2  )) ((resid   94 and name HG*  ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG2* )) ((resid   26 and name HG*  ))   4.44  2.64  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD2* )) ((resid   58 and name HG2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB2  )) ((resid   66 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB2  )) ((resid   66 and name HD*  ))   4.64  2.84  0.00 ! #SUP  1.00
assign  ((resid   50 and name HG1  )) ((resid   61 and name HD2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   68 and name HB2  ))   4.78  2.98  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   68 and name HG1  ))   4.73  2.93  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   50 and name HG1  ))   3.93  2.13  0.00 ! #SUP  1.00
assign  ((resid   30 and name HE*  )) ((resid   58 and name HB1  ))   4.65  2.85  0.00 ! #SUP  1.00
assign  ((resid   50 and name HG1  )) ((resid   61 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB2  )) ((resid   27 and name HD2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB2  )) ((resid   22 and name HD*  ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD2* )) ((resid   58 and name HB2  ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   79 and name HD*  )) ((resid   84 and name HB2  ))   4.89  3.09  0.00 ! #SUP  1.00
assign  ((resid   19 and name HG   )) ((resid   79 and name HZ   ))   4.68  2.88  0.00 ! #SUP  1.00
assign  ((resid   83 and name HA   )) ((resid   84 and name HB2  ))   4.94  3.14  0.00 ! #SUP  1.00
assign  ((resid   15 and name HB*  )) ((resid   15 and name HD*  ))   3.51  1.71  0.00 ! #SUP  1.00
assign  ((resid   19 and name HG   )) ((resid   79 and name HE*  ))   5.17  3.37  0.00 ! #SUP  1.00
assign  ((resid   25 and name HA   )) ((resid   28 and name HD*  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   56 and name HB*  )) ((resid   56 and name HD1* ))   3.65  1.85  0.00 ! #SUP  1.00
assign  ((resid   30 and name HD*  )) ((resid   34 and name HG   ))   5.14  3.34  0.00 ! #SUP  1.00
assign  ((resid   85 and name HG*  )) ((resid   86 and name HA   ))   4.54  2.74  0.00 ! #SUP  1.00
assign  ((resid   40 and name HG   )) ((resid   66 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB1  )) ((resid   22 and name HD*  ))   3.38  1.58  0.00 ! #SUP  1.00
assign  ((resid   78 and name HA   )) ((resid   81 and name HG*  ))   3.83  2.03  0.00 ! #SUP  1.00
assign  ((resid   34 and name HB1  )) ((resid   74 and name HD1* ))   4.36  2.56  0.00 ! #SUP  1.00
assign  ((resid   75 and name HB*  )) ((resid   79 and name HZ   ))   4.70  2.90  0.00 ! #SUP  1.00
assign  ((resid   26 and name HA   )) ((resid   82 and name HD1* ))   4.47  2.67  0.00 ! #SUP  1.00
assign  ((resid   33 and name HE*  )) ((resid   37 and name HB*  ))   5.16  3.36  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA1  )) ((resid   37 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   37 and name HB*  )) ((resid   38 and name HB   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   37 and name HB*  )) ((resid   40 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   72 and name HZ3  ))   4.77  2.97  0.00 ! #SUP  1.00
assign  ((resid   27 and name HA   )) ((resid   27 and name HD1* ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid  101 and name HA   )) ((resid  101 and name HG*  ))   3.54  1.74  0.00 ! #SUP  1.00
assign  ((resid   56 and name HB*  )) ((resid   56 and name HD2* ))   3.65  1.85  0.00 ! #SUP  1.00
assign  ((resid    4 and name HA   )) ((resid    4 and name HD*  ))   4.44  2.64  0.00 ! #SUP  1.00
assign  ((resid   12 and name HA   )) ((resid   12 and name HD*  ))   3.32  1.52  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD*  )) ((resid   13 and name HA   ))   4.21  2.41  0.00 ! #SUP  1.00
assign  ((resid   56 and name HA   )) ((resid   56 and name HD1* ))   4.58  2.78  0.00 ! #SUP  1.00
assign  ((resid   61 and name HA   )) ((resid   61 and name HD1* ))   4.11  2.31  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   63 and name HG2* ))   3.44  1.64  0.00 ! #SUP  1.00
assign  ((resid   50 and name HG2  )) ((resid   61 and name HD2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   32 and name HB2  )) ((resid   32 and name HD1* ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   61 and name HD2* ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   40 and name HD2* )) ((resid   66 and name HZ   ))   4.53  2.73  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD1* )) ((resid   30 and name HE*  ))   4.69  2.89  0.00 ! #SUP  1.00
assign  ((resid   34 and name HB1  )) ((resid   34 and name HD*  ))   3.34  1.54  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD*  )) ((resid   74 and name HD1* ))   3.66  1.86  0.00 ! #SUP  1.00
assign  ((resid   34 and name HA   )) ((resid   34 and name HD*  ))   3.40  1.60  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA2  )) ((resid   74 and name HD1* ))   4.10  2.30  0.00 ! #SUP  1.00
assign  ((resid   66 and name HE*  )) ((resid   74 and name HD1* ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   74 and name HD1* )) ((resid   75 and name HA   ))   5.24  3.44  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG11 )) ((resid   66 and name HZ   ))   5.21  3.41  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   77 and name HB*  ))   4.96  3.16  0.00 ! #SUP  1.00
assign  ((resid   66 and name HD*  )) ((resid   74 and name HD2* ))   4.44  2.64  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD*  )) ((resid   74 and name HD2* ))   4.47  2.67  0.00 ! #SUP  1.00
assign  ((resid   18 and name HD*  )) ((resid   87 and name HD1* ))   4.23  2.43  0.00 ! #SUP  1.00
assign  ((resid   33 and name HE*  )) ((resid   81 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   79 and name HZ   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   18 and name HD*  )) ((resid   79 and name HD*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   18 and name HD*  )) ((resid   79 and name HZ   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   76 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   19 and name HA   )) ((resid   79 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB1  )) ((resid   79 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   30 and name HA   )) ((resid   33 and name HD*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   30 and name HB2  )) ((resid   79 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB2  )) ((resid   30 and name HD*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   22 and name HG   )) ((resid   30 and name HD*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   66 and name HE*  )) ((resid   74 and name HG   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   72 and name HZ2  )) ((resid   76 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   72 and name HE3  )) ((resid   76 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   72 and name HE3  ))   3.91  2.11  0.00 ! #SUP  1.00
assign  ((resid   88 and name HA   )) ((resid   88 and name HE3  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   88 and name HE3  )) ((resid   89 and name HB1  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   72 and name HE3  )) ((resid   73 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid    4 and name HD*  )) ((resid    5 and name HN   ))   4.42  2.62  0.00 ! #SUP  1.00
assign  ((resid    8 and name HA*  )) ((resid    9 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid    9 and name HN   )) ((resid    9 and name HB*  ))   3.33  1.53  0.00 ! #SUP  1.00
assign  ((resid    9 and name HN   )) ((resid    9 and name HG*  ))   4.18  2.38  0.00 ! #SUP  1.00
assign  ((resid    9 and name HA   )) ((resid    9 and name HG*  ))   3.56  1.76  0.00 ! #SUP  1.00
assign  ((resid    9 and name HA   )) ((resid    9 and name HD*  ))   4.88  3.08  0.00 ! #SUP  1.00
assign  ((resid    9 and name HB*  )) ((resid    9 and name HG*  ))   2.31  0.51  0.00 ! #SUP  1.00
assign  ((resid    9 and name HB*  )) ((resid    9 and name HD*  ))   3.18  1.38  0.00 ! #SUP  1.00
assign  ((resid    9 and name HB*  )) ((resid   10 and name HN   ))   3.95  2.15  0.00 ! #SUP  1.00
assign  ((resid    9 and name HG*  )) ((resid    9 and name HD*  ))   2.36  0.56  0.00 ! #SUP  1.00
assign  ((resid    9 and name HD*  )) ((resid   10 and name HA   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid    9 and name HD*  )) ((resid   11 and name HA*  ))   5.18  3.38  0.00 ! #SUP  1.00
assign  ((resid   10 and name HN   )) ((resid   10 and name HB*  ))   3.57  1.77  0.00 ! #SUP  1.00
assign  ((resid   10 and name HA   )) ((resid   10 and name HB*  ))   2.64  0.84  0.00 ! #SUP  1.00
assign  ((resid   10 and name HB*  )) ((resid   11 and name HN   ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   11 and name HA*  )) ((resid   12 and name HA   ))   4.47  2.67  0.00 ! #SUP  1.00
assign  ((resid   11 and name HA*  )) ((resid   63 and name HD1* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   12 and name HN   )) ((resid   12 and name HB*  ))   2.96  1.16  0.00 ! #SUP  1.00
assign  ((resid   12 and name HN   )) ((resid   12 and name HD*  ))   4.33  2.53  0.00 ! #SUP  1.00
assign  ((resid   12 and name HB*  )) ((resid   12 and name HD*  ))   2.61  0.81  0.00 ! #SUP  1.00
assign  ((resid   12 and name HB*  )) ((resid   13 and name HA   ))   5.00  3.20  0.00 ! #SUP  1.00
assign  ((resid   12 and name HB*  )) ((resid   13 and name HB*  ))   4.28  2.48  0.00 ! #SUP  1.00
assign  ((resid   12 and name HB*  )) ((resid   60 and name HG2  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   12 and name HB*  )) ((resid   60 and name HG1  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   12 and name HB*  )) ((resid   63 and name HG2* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   12 and name HB*  )) ((resid   63 and name HG11 ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD*  )) ((resid   13 and name HN   ))   4.33  2.53  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD*  )) ((resid   13 and name HB*  ))   4.96  3.16  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD*  )) ((resid   59 and name HN   ))   4.76  2.96  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD*  )) ((resid   59 and name HB*  ))   2.96  1.16  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD*  )) ((resid   60 and name HN   ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD*  )) ((resid   60 and name HA   ))   3.06  1.26  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD*  )) ((resid   60 and name HB*  ))   4.01  2.21  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD*  )) ((resid   60 and name HG2  ))   3.25  1.45  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD*  )) ((resid   60 and name HG1  ))   3.32  1.52  0.00 ! #SUP  1.00
assign  ((resid   14 and name HN   )) ((resid   14 and name HB*  ))   3.14  1.34  0.00 ! #SUP  1.00
assign  ((resid   14 and name HB*  )) ((resid   15 and name HN   ))   3.80  2.00  0.00 ! #SUP  1.00
assign  ((resid   15 and name HN   )) ((resid   15 and name HD*  ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   15 and name HA   )) ((resid   15 and name HD*  ))   3.08  1.28  0.00 ! #SUP  1.00
assign  ((resid   15 and name HA   )) ((resid   18 and name HB*  ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   15 and name HG   )) ((resid   19 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   19 and name HG   ))   4.86  3.06  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   19 and name HD*  ))   3.35  1.55  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   59 and name HN   ))   4.82  3.02  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   59 and name HA   ))   3.94  2.14  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   59 and name HB*  ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   71 and name HB*  ))   3.22  1.42  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   72 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   72 and name HA   ))   3.71  1.91  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   72 and name HE3  ))   3.91  2.11  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   75 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   75 and name HA   ))   5.29  3.49  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   75 and name HB*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   15 and name HD*  )) ((resid   76 and name HB1  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   17 and name HA   )) ((resid   20 and name HB*  ))   3.80  2.00  0.00 ! #SUP  1.00
assign  ((resid   17 and name HA   )) ((resid   20 and name HG*  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   17 and name HG2* )) ((resid   18 and name HB*  ))   5.27  3.47  0.00 ! #SUP  1.00
assign  ((resid   17 and name HG2* )) ((resid   20 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   17 and name HG2* )) ((resid   20 and name HG*  ))   4.37  2.57  0.00 ! #SUP  1.00
assign  ((resid   18 and name HN   )) ((resid   18 and name HB*  ))   3.25  1.45  0.00 ! #SUP  1.00
assign  ((resid   18 and name HA   )) ((resid   20 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   18 and name HA   )) ((resid   21 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   18 and name HA   )) ((resid   87 and name HD*  ))   3.95  2.15  0.00 ! #SUP  1.00
assign  ((resid   18 and name HB*  )) ((resid   19 and name HN   ))   3.96  2.16  0.00 ! #SUP  1.00
assign  ((resid   18 and name HB*  )) ((resid   19 and name HA   ))   4.77  2.97  0.00 ! #SUP  1.00
assign  ((resid   18 and name HB*  )) ((resid   72 and name HZ3  ))   4.77  2.97  0.00 ! #SUP  1.00
assign  ((resid   18 and name HB*  )) ((resid   79 and name HE*  ))   3.76  1.96  0.00 ! #SUP  1.00
assign  ((resid   18 and name HB*  )) ((resid   79 and name HZ   ))   3.57  1.77  0.00 ! #SUP  1.00
assign  ((resid   18 and name HB*  )) ((resid   87 and name HD*  ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   18 and name HD*  )) ((resid   87 and name HB*  ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   18 and name HD*  )) ((resid   87 and name HD*  ))   3.46  1.66  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   87 and name HD*  ))   3.98  2.18  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   90 and name HG*  ))   4.71  2.91  0.00 ! #SUP  1.00
assign  ((resid   18 and name HE*  )) ((resid   91 and name HA*  ))   4.11  2.31  0.00 ! #SUP  1.00
assign  ((resid   19 and name HN   )) ((resid   19 and name HB*  ))   3.62  1.82  0.00 ! #SUP  1.00
assign  ((resid   19 and name HN   )) ((resid   19 and name HD*  ))   3.79  1.99  0.00 ! #SUP  1.00
assign  ((resid   19 and name HA   )) ((resid   19 and name HD*  ))   3.00  1.20  0.00 ! #SUP  1.00
assign  ((resid   19 and name HA   )) ((resid   27 and name HD*  ))   5.18  3.38  0.00 ! #SUP  1.00
assign  ((resid   19 and name HB*  )) ((resid   19 and name HD*  ))   2.81  1.01  0.00 ! #SUP  1.00
assign  ((resid   19 and name HB*  )) ((resid   27 and name HD*  ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   19 and name HB*  )) ((resid   55 and name HB2  ))   4.25  2.45  0.00 ! #SUP  1.00
assign  ((resid   19 and name HB*  )) ((resid   55 and name HB1  ))   3.97  2.17  0.00 ! #SUP  1.00
assign  ((resid   19 and name HB*  )) ((resid   75 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   20 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   22 and name HD*  ))   3.12  1.32  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   22 and name HD*  ))   3.12  1.32  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   27 and name HD*  ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   30 and name HE*  ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   34 and name HD2* ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   55 and name HA   ))   4.02  2.22  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   55 and name HB2  ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   58 and name HB2  ))   3.30  1.50  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   58 and name HB1  ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   58 and name HG1  ))   4.77  2.97  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   59 and name HN   ))   4.53  2.73  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   59 and name HA   ))   3.71  1.91  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   59 and name HB*  ))   3.35  1.55  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   62 and name HD*  ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   75 and name HB*  ))   3.77  1.97  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   79 and name HA   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   79 and name HD*  ))   4.81  3.01  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   79 and name HE*  ))   3.46  1.66  0.00 ! #SUP  1.00
assign  ((resid   19 and name HD*  )) ((resid   79 and name HZ   ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   20 and name HN   )) ((resid   20 and name HG*  ))   3.54  1.74  0.00 ! #SUP  1.00
assign  ((resid   20 and name HN   )) ((resid   22 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   20 and name HA   )) ((resid   20 and name HG*  ))   3.37  1.57  0.00 ! #SUP  1.00
assign  ((resid   20 and name HB*  )) ((resid   22 and name HN   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   21 and name HN   )) ((resid   21 and name HB*  ))   2.75  0.95  0.00 ! #SUP  1.00
assign  ((resid   21 and name HN   )) ((resid   87 and name HD*  ))   4.96  3.16  0.00 ! #SUP  1.00
assign  ((resid   21 and name HB*  )) ((resid   22 and name HD*  ))   4.85  3.05  0.00 ! #SUP  1.00
assign  ((resid   21 and name HB*  )) ((resid   87 and name HD*  ))   3.16  1.36  0.00 ! #SUP  1.00
assign  ((resid   21 and name HB*  )) ((resid   87 and name HD*  ))   3.16  1.36  0.00 ! #SUP  1.00
assign  ((resid   22 and name HN   )) ((resid   22 and name HD*  ))   3.83  2.03  0.00 ! #SUP  1.00
assign  ((resid   22 and name HA   )) ((resid   22 and name HD*  ))   2.95  1.15  0.00 ! #SUP  1.00
assign  ((resid   22 and name HA   )) ((resid   23 and name HG*  ))   5.17  3.37  0.00 ! #SUP  1.00
assign  ((resid   22 and name HA   )) ((resid   26 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   22 and name HA   )) ((resid   27 and name HD*  ))   4.81  3.01  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB2  )) ((resid   27 and name HD*  ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB1  )) ((resid   23 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   22 and name HB1  )) ((resid   27 and name HD*  ))   3.37  1.57  0.00 ! #SUP  1.00
assign  ((resid   22 and name HG   )) ((resid   27 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   22 and name HG   )) ((resid   87 and name HD*  ))   4.73  2.93  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   23 and name HN   ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   23 and name HG*  ))   4.76  2.96  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   26 and name HN   ))   5.21  3.41  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   26 and name HB2  ))   3.57  1.77  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   26 and name HB1  ))   3.77  1.97  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   27 and name HN   ))   4.81  3.01  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   27 and name HA   ))   3.66  1.86  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   30 and name HB2  ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   30 and name HB1  ))   3.69  1.89  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   79 and name HA   ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   79 and name HE*  ))   3.31  1.51  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   82 and name HB   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   82 and name HD1* ))   2.93  1.13  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   84 and name HG*  ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   84 and name HD*  ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   22 and name HD*  )) ((resid   87 and name HD*  ))   3.36  1.56  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   23 and name HB*  ))   3.31  1.51  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   23 and name HG*  ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   26 and name HG*  ))   3.37  1.57  0.00 ! #SUP  1.00
assign  ((resid   23 and name HA   )) ((resid   23 and name HG*  ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   23 and name HA   )) ((resid   27 and name HD*  ))   4.49  2.69  0.00 ! #SUP  1.00
assign  ((resid   23 and name HB*  )) ((resid   24 and name HN   ))   3.50  1.70  0.00 ! #SUP  1.00
assign  ((resid   23 and name HB*  )) ((resid   24 and name HA   ))   4.77  2.97  0.00 ! #SUP  1.00
assign  ((resid   23 and name HB*  )) ((resid   24 and name HB*  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   23 and name HB*  )) ((resid   25 and name HN   ))   3.76  1.96  0.00 ! #SUP  1.00
assign  ((resid   23 and name HB*  )) ((resid   25 and name HG1* ))   4.09  2.29  0.00 ! #SUP  1.00
assign  ((resid   23 and name HB*  )) ((resid   26 and name HN   ))   3.94  2.14  0.00 ! #SUP  1.00
assign  ((resid   23 and name HB*  )) ((resid   26 and name HG*  ))   3.51  1.71  0.00 ! #SUP  1.00
assign  ((resid   23 and name HG*  )) ((resid   25 and name HG1* ))   4.47  2.67  0.00 ! #SUP  1.00
assign  ((resid   23 and name HG*  )) ((resid   26 and name HN   ))   4.30  2.50  0.00 ! #SUP  1.00
assign  ((resid   24 and name HA   )) ((resid   27 and name HD*  ))   4.38  2.58  0.00 ! #SUP  1.00
assign  ((resid   25 and name HA   )) ((resid   26 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   25 and name HA   )) ((resid   28 and name HG*  ))   4.52  2.72  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG1* )) ((resid   26 and name HG*  ))   3.99  2.19  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG2* )) ((resid   26 and name HG*  ))   4.44  2.64  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG2* )) ((resid   28 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG2* )) ((resid   29 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG2* )) ((resid   29 and name HG*  ))   4.88  3.08  0.00 ! #SUP  1.00
assign  ((resid   25 and name HG2* )) ((resid   29 and name HD*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   26 and name HN   )) ((resid   26 and name HG*  ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   26 and name HA   )) ((resid   26 and name HG*  ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   26 and name HG*  )) ((resid   27 and name HD*  ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   26 and name HG*  )) ((resid   82 and name HD1* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   27 and name HN   )) ((resid   27 and name HD*  ))   3.75  1.95  0.00 ! #SUP  1.00
assign  ((resid   27 and name HA   )) ((resid   27 and name HD*  ))   2.93  1.13  0.00 ! #SUP  1.00
assign  ((resid   27 and name HB2  )) ((resid   27 and name HD*  ))   3.05  1.25  0.00 ! #SUP  1.00
assign  ((resid   27 and name HD*  )) ((resid   30 and name HN   ))   5.42  3.62  0.00 ! #SUP  1.00
assign  ((resid   27 and name HD*  )) ((resid   30 and name HB2  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   27 and name HD*  )) ((resid   30 and name HB1  ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   27 and name HD*  )) ((resid   30 and name HD*  ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid   27 and name HD*  )) ((resid   31 and name HN   ))   4.98  3.18  0.00 ! #SUP  1.00
assign  ((resid   27 and name HD*  )) ((resid   54 and name HA*  ))   3.78  1.98  0.00 ! #SUP  1.00
assign  ((resid   27 and name HD*  )) ((resid   55 and name HA   ))   4.15  2.35  0.00 ! #SUP  1.00
assign  ((resid   27 and name HD*  )) ((resid   55 and name HG*  ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   27 and name HD*  )) ((resid   55 and name HD*  ))   3.54  1.74  0.00 ! #SUP  1.00
assign  ((resid   27 and name HD*  )) ((resid   58 and name HG2  ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   27 and name HD*  )) ((resid   58 and name HG1  ))   3.58  1.78  0.00 ! #SUP  1.00
assign  ((resid   28 and name HN   )) ((resid   28 and name HB*  ))   3.07  1.27  0.00 ! #SUP  1.00
assign  ((resid   28 and name HN   )) ((resid   28 and name HG*  ))   4.13  2.33  0.00 ! #SUP  1.00
assign  ((resid   28 and name HN   )) ((resid   29 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   28 and name HA   )) ((resid   28 and name HG*  ))   3.52  1.72  0.00 ! #SUP  1.00
assign  ((resid   28 and name HA   )) ((resid   31 and name HB*  ))   3.70  1.90  0.00 ! #SUP  1.00
assign  ((resid   28 and name HB*  )) ((resid   28 and name HD*  ))   3.43  1.63  0.00 ! #SUP  1.00
assign  ((resid   28 and name HG*  )) ((resid   28 and name HE*  ))   3.36  1.56  0.00 ! #SUP  1.00
assign  ((resid   28 and name HG*  )) ((resid   29 and name HN   ))   4.65  2.85  0.00 ! #SUP  1.00
assign  ((resid   29 and name HN   )) ((resid   29 and name HB*  ))   3.43  1.63  0.00 ! #SUP  1.00
assign  ((resid   29 and name HN   )) ((resid   29 and name HG*  ))   3.37  1.57  0.00 ! #SUP  1.00
assign  ((resid   29 and name HN   )) ((resid   32 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   29 and name HA   )) ((resid   29 and name HG*  ))   3.18  1.38  0.00 ! #SUP  1.00
assign  ((resid   29 and name HA   )) ((resid   29 and name HD*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   29 and name HA   )) ((resid   32 and name HD*  ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   29 and name HB*  )) ((resid   29 and name HE*  ))   4.66  2.86  0.00 ! #SUP  1.00
assign  ((resid   29 and name HB*  )) ((resid   30 and name HN   ))   4.36  2.56  0.00 ! #SUP  1.00
assign  ((resid   29 and name HB*  )) ((resid   30 and name HD*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   29 and name HB*  )) ((resid   82 and name HG2* ))   3.50  1.70  0.00 ! #SUP  1.00
assign  ((resid   29 and name HB*  )) ((resid   82 and name HD1* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   29 and name HG*  )) ((resid   29 and name HE*  ))   3.46  1.66  0.00 ! #SUP  1.00
assign  ((resid   29 and name HG*  )) ((resid   30 and name HN   ))   4.61  2.81  0.00 ! #SUP  1.00
assign  ((resid   30 and name HA   )) ((resid   33 and name HB*  ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid   30 and name HD*  )) ((resid   31 and name HB*  ))   5.21  3.41  0.00 ! #SUP  1.00
assign  ((resid   30 and name HD*  )) ((resid   82 and name HG1* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   30 and name HE*  )) ((resid   62 and name HD*  ))   3.60  1.80  0.00 ! #SUP  1.00
assign  ((resid   31 and name HN   )) ((resid   31 and name HB*  ))   3.47  1.67  0.00 ! #SUP  1.00
assign  ((resid   31 and name HN   )) ((resid   32 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   31 and name HA   )) ((resid   62 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   31 and name HB*  )) ((resid   32 and name HN   ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   31 and name HB*  )) ((resid   32 and name HB*  ))   4.85  3.05  0.00 ! #SUP  1.00
assign  ((resid   31 and name HB*  )) ((resid   34 and name HD2* ))   4.75  2.95  0.00 ! #SUP  1.00
assign  ((resid   32 and name HN   )) ((resid   32 and name HB*  ))   3.11  1.31  0.00 ! #SUP  1.00
assign  ((resid   32 and name HA   )) ((resid   32 and name HD*  ))   3.52  1.72  0.00 ! #SUP  1.00
assign  ((resid   32 and name HB*  )) ((resid   32 and name HD*  ))   2.74  0.94  0.00 ! #SUP  1.00
assign  ((resid   32 and name HB*  )) ((resid   33 and name HN   ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   32 and name HB*  )) ((resid   36 and name HG2* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   32 and name HD*  )) ((resid   33 and name HN   ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid   32 and name HD*  )) ((resid   33 and name HA   ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   32 and name HD*  )) ((resid   33 and name HB*  ))   3.79  1.99  0.00 ! #SUP  1.00
assign  ((resid   32 and name HD*  )) ((resid   33 and name HD*  ))   3.97  2.17  0.00 ! #SUP  1.00
assign  ((resid   32 and name HD*  )) ((resid   33 and name HE*  ))   4.98  3.18  0.00 ! #SUP  1.00
assign  ((resid   32 and name HD*  )) ((resid   36 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   32 and name HD*  )) ((resid   36 and name HG2* ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   33 and name HN   )) ((resid   33 and name HB*  ))   2.85  1.05  0.00 ! #SUP  1.00
assign  ((resid   33 and name HB*  )) ((resid   34 and name HN   ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   33 and name HB*  )) ((resid   78 and name HG2* ))   3.21  1.41  0.00 ! #SUP  1.00
assign  ((resid   33 and name HB*  )) ((resid   81 and name HB*  ))   4.77  2.97  0.00 ! #SUP  1.00
assign  ((resid   34 and name HA   )) ((resid   40 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   34 and name HB1  )) ((resid   62 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD1* )) ((resid   62 and name HD*  ))   3.26  1.46  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD2* )) ((resid   62 and name HD*  ))   3.02  1.22  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA2  )) ((resid   40 and name HB*  ))   4.86  3.06  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA2  )) ((resid   40 and name HD*  ))   3.86  2.06  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA1  )) ((resid   40 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   37 and name HB*  )) ((resid   40 and name HD*  ))   4.18  2.38  0.00 ! #SUP  1.00
assign  ((resid   39 and name HN   )) ((resid   40 and name HB*  ))   4.93  3.13  0.00 ! #SUP  1.00
assign  ((resid   39 and name HA   )) ((resid   39 and name HB*  ))   2.60  0.80  0.00 ! #SUP  1.00
assign  ((resid   39 and name HB*  )) ((resid   40 and name HN   ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   40 and name HN   )) ((resid   40 and name HB*  ))   3.21  1.41  0.00 ! #SUP  1.00
assign  ((resid   40 and name HA   )) ((resid   40 and name HD*  ))   3.66  1.86  0.00 ! #SUP  1.00
assign  ((resid   40 and name HA   )) ((resid   41 and name HA*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   40 and name HB*  )) ((resid   40 and name HD*  ))   2.82  1.02  0.00 ! #SUP  1.00
assign  ((resid   40 and name HB*  )) ((resid   41 and name HN   ))   3.41  1.61  0.00 ! #SUP  1.00
assign  ((resid   40 and name HB*  )) ((resid   41 and name HA*  ))   4.82  3.02  0.00 ! #SUP  1.00
assign  ((resid   40 and name HB*  )) ((resid   43 and name HN   ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   40 and name HB*  )) ((resid   66 and name HE*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   40 and name HB*  )) ((resid   66 and name HZ   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   40 and name HD*  )) ((resid   41 and name HN   ))   4.36  2.56  0.00 ! #SUP  1.00
assign  ((resid   40 and name HD*  )) ((resid   43 and name HN   ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   40 and name HD*  )) ((resid   43 and name HA*  ))   4.47  2.67  0.00 ! #SUP  1.00
assign  ((resid   40 and name HD*  )) ((resid   45 and name HG12 ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   40 and name HD*  )) ((resid   66 and name HE*  ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   41 and name HA*  )) ((resid   42 and name HA   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   42 and name HN   )) ((resid   42 and name HB*  ))   3.29  1.49  0.00 ! #SUP  1.00
assign  ((resid   43 and name HA*  )) ((resid   44 and name HN   ))   3.07  1.27  0.00 ! #SUP  1.00
assign  ((resid   44 and name HN   )) ((resid   44 and name HG*  ))   3.95  2.15  0.00 ! #SUP  1.00
assign  ((resid   44 and name HA   )) ((resid   44 and name HD*  ))   3.64  1.84  0.00 ! #SUP  1.00
assign  ((resid   44 and name HG*  )) ((resid   44 and name HD*  ))   2.37  0.57  0.00 ! #SUP  1.00
assign  ((resid   44 and name HG*  )) ((resid   44 and name HE*  ))   3.24  1.44  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   50 and name HG*  ))   3.21  1.41  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   61 and name HD*  ))   3.41  1.61  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG2* )) ((resid   62 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   45 and name HG12 )) ((resid   62 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   50 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   61 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   62 and name HD*  ))   2.70  0.90  0.00 ! #SUP  1.00
assign  ((resid   45 and name HD1* )) ((resid   65 and name HB*  ))   3.69  1.89  0.00 ! #SUP  1.00
assign  ((resid   46 and name HB*  )) ((resid   47 and name HN   ))   3.66  1.86  0.00 ! #SUP  1.00
assign  ((resid   46 and name HB*  )) ((resid   47 and name HE3  ))   4.86  3.06  0.00 ! #SUP  1.00
assign  ((resid   46 and name HB*  )) ((resid   47 and name HH2  ))   4.66  2.86  0.00 ! #SUP  1.00
assign  ((resid   46 and name HB*  )) ((resid   48 and name HN   ))   4.70  2.90  0.00 ! #SUP  1.00
assign  ((resid   46 and name HB*  )) ((resid   49 and name HN   ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   46 and name HD2  )) ((resid   50 and name HG*  ))   4.93  3.13  0.00 ! #SUP  1.00
assign  ((resid   47 and name HE1  )) ((resid   51 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   47 and name HE1  )) ((resid   51 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   48 and name HA2  )) ((resid   51 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   48 and name HA2  )) ((resid   61 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   48 and name HA1  )) ((resid   51 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   49 and name HN   )) ((resid   50 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   49 and name HN   )) ((resid   61 and name HD*  ))   4.66  2.86  0.00 ! #SUP  1.00
assign  ((resid   49 and name HA   )) ((resid   61 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   49 and name HB*  )) ((resid   50 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   49 and name HB*  )) ((resid   61 and name HB*  ))   5.17  3.37  0.00 ! #SUP  1.00
assign  ((resid   49 and name HB*  )) ((resid   61 and name HD*  ))   3.57  1.77  0.00 ! #SUP  1.00
assign  ((resid   50 and name HN   )) ((resid   50 and name HG*  ))   3.93  2.13  0.00 ! #SUP  1.00
assign  ((resid   50 and name HN   )) ((resid   61 and name HD*  ))   4.30  2.50  0.00 ! #SUP  1.00
assign  ((resid   50 and name HA   )) ((resid   61 and name HD*  ))   3.66  1.86  0.00 ! #SUP  1.00
assign  ((resid   50 and name HB*  )) ((resid   53 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   50 and name HB*  )) ((resid   61 and name HB*  ))   5.18  3.38  0.00 ! #SUP  1.00
assign  ((resid   50 and name HB*  )) ((resid   61 and name HD*  ))   3.49  1.69  0.00 ! #SUP  1.00
assign  ((resid   50 and name HG*  )) ((resid   61 and name HD*  ))   3.18  1.38  0.00 ! #SUP  1.00
assign  ((resid   51 and name HN   )) ((resid   51 and name HB*  ))   3.03  1.23  0.00 ! #SUP  1.00
assign  ((resid   51 and name HN   )) ((resid   51 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   51 and name HA   )) ((resid   51 and name HG*  ))   3.40  1.60  0.00 ! #SUP  1.00
assign  ((resid   51 and name HB*  )) ((resid   52 and name HN   ))   3.25  1.45  0.00 ! #SUP  1.00
assign  ((resid   51 and name HB*  )) ((resid   52 and name HA   ))   4.48  2.68  0.00 ! #SUP  1.00
assign  ((resid   51 and name HB*  )) ((resid   53 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   51 and name HG*  )) ((resid   52 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   52 and name HN   )) ((resid   52 and name HB*  ))   3.54  1.74  0.00 ! #SUP  1.00
assign  ((resid   52 and name HB*  )) ((resid   52 and name HE*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   52 and name HB*  )) ((resid   53 and name HA   ))   5.32  3.52  0.00 ! #SUP  1.00
assign  ((resid   53 and name HN   )) ((resid   57 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   53 and name HA   )) ((resid   54 and name HA*  ))   4.51  2.71  0.00 ! #SUP  1.00
assign  ((resid   53 and name HA   )) ((resid   57 and name HB*  ))   3.27  1.47  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   54 and name HA*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   57 and name HG*  ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   55 and name HD*  ))   4.32  2.52  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   57 and name HB*  ))   3.30  1.50  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   57 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   54 and name HA*  )) ((resid   55 and name HD*  ))   2.65  0.85  0.00 ! #SUP  1.00
assign  ((resid   54 and name HA*  )) ((resid   56 and name HN   ))   3.94  2.14  0.00 ! #SUP  1.00
assign  ((resid   54 and name HA*  )) ((resid   56 and name HD*  ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   55 and name HG*  )) ((resid   56 and name HN   ))   5.03  3.23  0.00 ! #SUP  1.00
assign  ((resid   55 and name HD*  )) ((resid   56 and name HN   ))   3.98  2.18  0.00 ! #SUP  1.00
assign  ((resid   56 and name HN   )) ((resid   56 and name HD*  ))   4.30  2.50  0.00 ! #SUP  1.00
assign  ((resid   56 and name HA   )) ((resid   56 and name HD*  ))   3.46  1.66  0.00 ! #SUP  1.00
assign  ((resid   56 and name HD*  )) ((resid   57 and name HN   ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   56 and name HD*  )) ((resid   57 and name HG*  ))   4.52  2.72  0.00 ! #SUP  1.00
assign  ((resid   57 and name HN   )) ((resid   57 and name HB*  ))   3.02  1.22  0.00 ! #SUP  1.00
assign  ((resid   57 and name HN   )) ((resid   57 and name HG*  ))   3.32  1.52  0.00 ! #SUP  1.00
assign  ((resid   57 and name HA   )) ((resid   57 and name HG*  ))   2.99  1.19  0.00 ! #SUP  1.00
assign  ((resid   57 and name HB*  )) ((resid   58 and name HN   ))   2.99  1.19  0.00 ! #SUP  1.00
assign  ((resid   57 and name HB*  )) ((resid   60 and name HN   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   58 and name HN   )) ((resid   61 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   58 and name HA   )) ((resid   61 and name HD*  ))   3.42  1.62  0.00 ! #SUP  1.00
assign  ((resid   58 and name HB2  )) ((resid   62 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   58 and name HG2  )) ((resid   61 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   58 and name HG1  )) ((resid   62 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   59 and name HN   )) ((resid   62 and name HD*  ))   5.01  3.21  0.00 ! #SUP  1.00
assign  ((resid   59 and name HA   )) ((resid   62 and name HD*  ))   3.07  1.27  0.00 ! #SUP  1.00
assign  ((resid   59 and name HB*  )) ((resid   62 and name HD*  ))   4.73  2.93  0.00 ! #SUP  1.00
assign  ((resid   60 and name HN   )) ((resid   60 and name HB*  ))   3.06  1.26  0.00 ! #SUP  1.00
assign  ((resid   60 and name HB*  )) ((resid   61 and name HN   ))   4.39  2.59  0.00 ! #SUP  1.00
assign  ((resid   61 and name HN   )) ((resid   61 and name HB*  ))   3.06  1.26  0.00 ! #SUP  1.00
assign  ((resid   61 and name HN   )) ((resid   61 and name HD*  ))   4.71  2.91  0.00 ! #SUP  1.00
assign  ((resid   61 and name HA   )) ((resid   61 and name HD*  ))   3.53  1.73  0.00 ! #SUP  1.00
assign  ((resid   61 and name HB*  )) ((resid   62 and name HN   ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid   61 and name HD*  )) ((resid   62 and name HN   ))   5.03  3.23  0.00 ! #SUP  1.00
assign  ((resid   61 and name HD*  )) ((resid   65 and name HD2  ))   4.39  2.59  0.00 ! #SUP  1.00
assign  ((resid   62 and name HN   )) ((resid   62 and name HD*  ))   3.37  1.57  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   62 and name HD*  ))   2.88  1.08  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   65 and name HB*  ))   4.45  2.65  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB2  )) ((resid   62 and name HD*  ))   3.03  1.23  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   63 and name HN   ))   3.69  1.89  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   66 and name HB2  ))   4.95  3.15  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   66 and name HD*  ))   3.60  1.80  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   66 and name HE*  ))   3.36  1.56  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   71 and name HA   ))   3.92  2.12  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   71 and name HB*  ))   3.61  1.81  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   74 and name HB1  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   74 and name HD1* ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   74 and name HD2* ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   75 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   62 and name HD*  )) ((resid   75 and name HA   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   67 and name HA*  ))   4.19  2.39  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   67 and name HA*  ))   4.01  2.21  0.00 ! #SUP  1.00
assign  ((resid   63 and name HD1* )) ((resid   68 and name HD*  ))   3.31  1.51  0.00 ! #SUP  1.00
assign  ((resid   65 and name HN   )) ((resid   65 and name HB*  ))   3.06  1.26  0.00 ! #SUP  1.00
assign  ((resid   65 and name HB*  )) ((resid   66 and name HN   ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   65 and name HB*  )) ((resid   66 and name HA   ))   4.91  3.11  0.00 ! #SUP  1.00
assign  ((resid   65 and name HB*  )) ((resid   66 and name HD*  ))   4.44  2.64  0.00 ! #SUP  1.00
assign  ((resid   65 and name HB*  )) ((resid   66 and name HE*  ))   4.55  2.75  0.00 ! #SUP  1.00
assign  ((resid   66 and name HN   )) ((resid   67 and name HA*  ))   5.22  3.42  0.00 ! #SUP  1.00
assign  ((resid   66 and name HA   )) ((resid   67 and name HA*  ))   4.68  2.88  0.00 ! #SUP  1.00
assign  ((resid   66 and name HA   )) ((resid   70 and name HB*  ))   4.39  2.59  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB2  )) ((resid   70 and name HB*  ))   3.99  2.19  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB1  )) ((resid   70 and name HG*  ))   3.65  1.85  0.00 ! #SUP  1.00
assign  ((resid   66 and name HD*  )) ((resid   70 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   66 and name HD*  )) ((resid   70 and name HG*  ))   4.07  2.27  0.00 ! #SUP  1.00
assign  ((resid   67 and name HN   )) ((resid   68 and name HD*  ))   4.86  3.06  0.00 ! #SUP  1.00
assign  ((resid   67 and name HA*  )) ((resid   68 and name HG*  ))   4.67  2.87  0.00 ! #SUP  1.00
assign  ((resid   67 and name HA*  )) ((resid   68 and name HD*  ))   2.59  0.79  0.00 ! #SUP  1.00
assign  ((resid   67 and name HA*  )) ((resid   69 and name HN   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   67 and name HA*  )) ((resid   70 and name HB*  ))   4.72  2.92  0.00 ! #SUP  1.00
assign  ((resid   67 and name HA*  )) ((resid   71 and name HN   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   68 and name HG*  )) ((resid   69 and name HN   ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   68 and name HD*  )) ((resid   69 and name HN   ))   3.46  1.66  0.00 ! #SUP  1.00
assign  ((resid   69 and name HA   )) ((resid   69 and name HG*  ))   3.43  1.63  0.00 ! #SUP  1.00
assign  ((resid   70 and name HN   )) ((resid   70 and name HB*  ))   2.84  1.04  0.00 ! #SUP  1.00
assign  ((resid   70 and name HA   )) ((resid   70 and name HG*  ))   3.48  1.68  0.00 ! #SUP  1.00
assign  ((resid   70 and name HA   )) ((resid   73 and name HB*  ))   3.10  1.30  0.00 ! #SUP  1.00
assign  ((resid   70 and name HA   )) ((resid   73 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   70 and name HA   )) ((resid   73 and name HD*  ))   4.75  2.95  0.00 ! #SUP  1.00
assign  ((resid   70 and name HB*  )) ((resid   70 and name HG*  ))   2.36  0.56  0.00 ! #SUP  1.00
assign  ((resid   70 and name HB*  )) ((resid   71 and name HN   ))   3.29  1.49  0.00 ! #SUP  1.00
assign  ((resid   70 and name HB*  )) ((resid   71 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   70 and name HG*  )) ((resid   71 and name HN   ))   5.11  3.31  0.00 ! #SUP  1.00
assign  ((resid   70 and name HG*  )) ((resid   74 and name HD2* ))   3.78  1.98  0.00 ! #SUP  1.00
assign  ((resid   72 and name HN   )) ((resid   73 and name HB*  ))   5.03  3.23  0.00 ! #SUP  1.00
assign  ((resid   72 and name HB1  )) ((resid   73 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   72 and name HZ2  )) ((resid   91 and name HA*  ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   72 and name HH2  )) ((resid   91 and name HA*  ))   4.57  2.77  0.00 ! #SUP  1.00
assign  ((resid   73 and name HN   )) ((resid   73 and name HB*  ))   2.98  1.18  0.00 ! #SUP  1.00
assign  ((resid   73 and name HN   )) ((resid   73 and name HG*  ))   4.63  2.83  0.00 ! #SUP  1.00
assign  ((resid   73 and name HA   )) ((resid   73 and name HD*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   73 and name HB*  )) ((resid   73 and name HD*  ))   3.25  1.45  0.00 ! #SUP  1.00
assign  ((resid   73 and name HB*  )) ((resid   74 and name HN   ))   3.62  1.82  0.00 ! #SUP  1.00
assign  ((resid   73 and name HB*  )) ((resid   76 and name HG   ))   4.70  2.90  0.00 ! #SUP  1.00
assign  ((resid   73 and name HB*  )) ((resid   77 and name HB*  ))   4.62  2.82  0.00 ! #SUP  1.00
assign  ((resid   73 and name HG*  )) ((resid   77 and name HN   ))   4.58  2.78  0.00 ! #SUP  1.00
assign  ((resid   73 and name HG*  )) ((resid   77 and name HB*  ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   91 and name HA*  ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD1* )) ((resid   92 and name HE2* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   76 and name HD2* )) ((resid   91 and name HA*  ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   78 and name HA   )) ((resid   81 and name HG*  ))   3.83  2.03  0.00 ! #SUP  1.00
assign  ((resid   79 and name HA   )) ((resid   82 and name HG1* ))   3.04  1.24  0.00 ! #SUP  1.00
assign  ((resid   79 and name HB2  )) ((resid   88 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   79 and name HB1  )) ((resid   87 and name HD*  ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   79 and name HD*  )) ((resid   82 and name HG1* ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   79 and name HD*  )) ((resid   87 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   79 and name HD*  )) ((resid   87 and name HD*  ))   4.95  3.15  0.00 ! #SUP  1.00
assign  ((resid   79 and name HE*  )) ((resid   87 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   80 and name HN   )) ((resid   88 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   80 and name HA   )) ((resid   88 and name HB*  ))   4.18  2.38  0.00 ! #SUP  1.00
assign  ((resid   80 and name HB1  )) ((resid   88 and name HB*  ))   4.08  2.28  0.00 ! #SUP  1.00
assign  ((resid   80 and name HG*  )) ((resid   81 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   80 and name HG*  )) ((resid   85 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   80 and name HG*  )) ((resid   88 and name HB*  ))   4.07  2.27  0.00 ! #SUP  1.00
assign  ((resid   81 and name HN   )) ((resid   81 and name HG*  ))   2.99  1.19  0.00 ! #SUP  1.00
assign  ((resid   81 and name HA   )) ((resid   81 and name HG*  ))   3.47  1.67  0.00 ! #SUP  1.00
assign  ((resid   82 and name HN   )) ((resid   82 and name HG1* ))   3.17  1.37  0.00 ! #SUP  1.00
assign  ((resid   82 and name HA   )) ((resid   82 and name HG1* ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid   82 and name HG1* )) ((resid   84 and name HN   ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid   82 and name HD1* )) ((resid   84 and name HD*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   82 and name HD1* )) ((resid   87 and name HD*  ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   83 and name HN   )) ((resid   83 and name HB*  ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid   83 and name HB*  )) ((resid   83 and name HD2* ))   2.95  1.15  0.00 ! #SUP  1.00
assign  ((resid   84 and name HN   )) ((resid   84 and name HD*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   84 and name HN   )) ((resid   85 and name HB*  ))   4.21  2.41  0.00 ! #SUP  1.00
assign  ((resid   84 and name HA   )) ((resid   84 and name HD*  ))   3.03  1.23  0.00 ! #SUP  1.00
assign  ((resid   84 and name HB2  )) ((resid   87 and name HD*  ))   5.13  3.33  0.00 ! #SUP  1.00
assign  ((resid   84 and name HG*  )) ((resid   87 and name HD*  ))   3.91  2.11  0.00 ! #SUP  1.00
assign  ((resid   84 and name HD*  )) ((resid   85 and name HN   ))   4.78  2.98  0.00 ! #SUP  1.00
assign  ((resid   84 and name HD*  )) ((resid   86 and name HN   ))   4.12  2.32  0.00 ! #SUP  1.00
assign  ((resid   85 and name HN   )) ((resid   85 and name HB*  ))   2.82  1.02  0.00 ! #SUP  1.00
assign  ((resid   85 and name HB*  )) ((resid   85 and name HE*  ))   5.18  3.38  0.00 ! #SUP  1.00
assign  ((resid   85 and name HB*  )) ((resid   86 and name HN   ))   3.64  1.84  0.00 ! #SUP  1.00
assign  ((resid   85 and name HB*  )) ((resid   88 and name HB*  ))   4.61  2.81  0.00 ! #SUP  1.00
assign  ((resid   85 and name HB*  )) ((resid   88 and name HE3  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   85 and name HB*  )) ((resid   89 and name HN   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   85 and name HG*  )) ((resid   85 and name HE*  ))   3.44  1.64  0.00 ! #SUP  1.00
assign  ((resid   86 and name HN   )) ((resid   86 and name HB*  ))   3.20  1.40  0.00 ! #SUP  1.00
assign  ((resid   86 and name HN   )) ((resid   87 and name HD*  ))   5.43  3.63  0.00 ! #SUP  1.00
assign  ((resid   86 and name HA   )) ((resid   89 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   86 and name HA   )) ((resid   90 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   87 and name HN   )) ((resid   87 and name HB*  ))   3.54  1.74  0.00 ! #SUP  1.00
assign  ((resid   87 and name HN   )) ((resid   90 and name HG*  ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   87 and name HA   )) ((resid   87 and name HD*  ))   2.92  1.12  0.00 ! #SUP  1.00
assign  ((resid   87 and name HA   )) ((resid   90 and name HG*  ))   3.70  1.90  0.00 ! #SUP  1.00
assign  ((resid   87 and name HA   )) ((resid   90 and name HD*  ))   4.08  2.28  0.00 ! #SUP  1.00
assign  ((resid   87 and name HB*  )) ((resid   88 and name HN   ))   4.27  2.47  0.00 ! #SUP  1.00
assign  ((resid   87 and name HD*  )) ((resid   88 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   87 and name HD*  )) ((resid   90 and name HB2  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   87 and name HD*  )) ((resid   90 and name HG*  ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   87 and name HD*  )) ((resid   90 and name HD*  ))   3.91  2.11  0.00 ! #SUP  1.00
assign  ((resid   88 and name HN   )) ((resid   88 and name HB*  ))   2.95  1.15  0.00 ! #SUP  1.00
assign  ((resid   88 and name HB*  )) ((resid   88 and name HE3  ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   88 and name HB*  )) ((resid   89 and name HN   ))   3.50  1.70  0.00 ! #SUP  1.00
assign  ((resid   88 and name HE3  )) ((resid   89 and name HG*  ))   3.46  1.66  0.00 ! #SUP  1.00
assign  ((resid   88 and name HZ3  )) ((resid   89 and name HG*  ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   89 and name HN   )) ((resid   89 and name HG*  ))   3.58  1.78  0.00 ! #SUP  1.00
assign  ((resid   89 and name HA   )) ((resid   89 and name HG*  ))   3.36  1.56  0.00 ! #SUP  1.00
assign  ((resid   89 and name HA   )) ((resid   92 and name HG*  ))   4.04  2.24  0.00 ! #SUP  1.00
assign  ((resid   89 and name HG*  )) ((resid   90 and name HN   ))   5.04  3.24  0.00 ! #SUP  1.00
assign  ((resid   90 and name HN   )) ((resid   90 and name HG*  ))   4.15  2.35  0.00 ! #SUP  1.00
assign  ((resid   90 and name HA   )) ((resid   90 and name HG*  ))   3.60  1.80  0.00 ! #SUP  1.00
assign  ((resid   90 and name HA   )) ((resid   90 and name HD*  ))   4.29  2.49  0.00 ! #SUP  1.00
assign  ((resid   90 and name HG*  )) ((resid   91 and name HN   ))   5.01  3.21  0.00 ! #SUP  1.00
assign  ((resid   91 and name HA*  )) ((resid   94 and name HB*  ))   4.26  2.46  0.00 ! #SUP  1.00
assign  ((resid   91 and name HA*  )) ((resid   94 and name HG*  ))   3.91  2.11  0.00 ! #SUP  1.00
assign  ((resid   92 and name HN   )) ((resid   92 and name HB*  ))   3.57  1.77  0.00 ! #SUP  1.00
assign  ((resid   92 and name HN   )) ((resid   92 and name HG*  ))   3.23  1.43  0.00 ! #SUP  1.00
assign  ((resid   92 and name HA   )) ((resid   92 and name HG*  ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   93 and name HN   )) ((resid   93 and name HG*  ))   4.54  2.74  0.00 ! #SUP  1.00
assign  ((resid   93 and name HA   )) ((resid   93 and name HG*  ))   3.47  1.67  0.00 ! #SUP  1.00
assign  ((resid   93 and name HB*  )) ((resid   93 and name HD*  ))   3.19  1.39  0.00 ! #SUP  1.00
assign  ((resid   93 and name HG*  )) ((resid   94 and name HA   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   95 and name HN   )) ((resid   95 and name HB*  ))   3.16  1.36  0.00 ! #SUP  1.00
assign  ((resid   95 and name HB*  )) ((resid   96 and name HN   ))   3.65  1.85  0.00 ! #SUP  1.00
assign  ((resid   95 and name HB*  )) ((resid   96 and name HB*  ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   96 and name HN   )) ((resid   96 and name HB*  ))   2.89  1.09  0.00 ! #SUP  1.00
assign  ((resid   96 and name HA   )) ((resid   96 and name HD*  ))   3.37  1.57  0.00 ! #SUP  1.00
assign  ((resid   96 and name HB*  )) ((resid   97 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   96 and name HD*  )) ((resid   97 and name HN   ))   4.49  2.69  0.00 ! #SUP  1.00
assign  ((resid   97 and name HG*  )) ((resid   99 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   98 and name HN   )) ((resid   98 and name HB*  ))   3.50  1.70  0.00 ! #SUP  1.00
assign  ((resid  100 and name HN   )) ((resid  101 and name HG*  ))   4.44  2.64  0.00 ! #SUP  1.00
assign  ((resid  101 and name HN   )) ((resid  101 and name HG*  ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid  101 and name HG*  )) ((resid  102 and name HN   ))   4.24  2.44  0.00 ! #SUP  1.00

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1 -14.312 -14.797  -8.625
    2    H2   GLY   1           HT2      GLY   1 -15.799 -14.930  -7.821
    3    H3   GLY   1           HT3      GLY   1 -14.395 -15.548  -7.121
    4    HA2  GLY   1           HA2      GLY   1 -13.448 -13.358  -6.949
    5    HA3  GLY   1           HA3      GLY   1 -14.931 -12.696  -7.621
    6    H    HIS   2           HN       HIS   2 -16.945 -13.190  -6.402
    7    HA   HIS   2           HA       HIS   2 -16.390 -12.795  -3.602
    8    HB2  HIS   2           HB2      HIS   2 -18.957 -12.651  -5.179
    9    HB3  HIS   2           HB1      HIS   2 -18.898 -12.466  -3.428
   10    HD1  HIS   2           HD1      HIS   2 -18.276 -10.140  -2.543
   11    HD2  HIS   2           HD2      HIS   2 -17.581 -10.594  -6.619
   12    HE1  HIS   2           HE1      HIS   2 -17.688  -7.862  -3.403
   13    H    MET   3           HN       MET   3 -17.599 -13.897  -1.950
   14    HA   MET   3           HA       MET   3 -18.116 -15.690  -0.740
   15    HB2  MET   3           HB2      MET   3 -18.855 -17.018  -3.364
   16    HB3  MET   3           HB1      MET   3 -19.169 -17.707  -1.780
   17    HG2  MET   3           HG2      MET   3 -20.307 -15.136  -2.850
   18    HG3  MET   3           HG1      MET   3 -21.165 -16.668  -2.688
   19    HE1  MET   3           HE1      MET   3 -23.102 -15.353  -1.376
   20    HE2  MET   3           HE2      MET   3 -22.186 -13.856  -1.551
   21    HE3  MET   3           HE3      MET   3 -22.802 -14.334   0.031
   22    H    LEU   4           HN       LEU   4 -15.578 -15.288  -2.308
   23    HA   LEU   4           HA       LEU   4 -14.334 -17.883  -2.345
   24    HB2  LEU   4           HB2      LEU   4 -13.634 -16.067  -3.895
   25    HB3  LEU   4           HB1      LEU   4 -13.101 -15.137  -2.519
   26    HG   LEU   4           HG       LEU   4 -11.373 -16.805  -2.031
   27   HD11  LEU   4          HD11      LEU   4 -12.469 -18.781  -2.921
   28   HD12  LEU   4          HD12      LEU   4 -10.879 -18.562  -3.643
   29   HD13  LEU   4          HD13      LEU   4 -12.327 -18.140  -4.558
   30   HD21  LEU   4          HD21      LEU   4 -10.838 -14.898  -3.445
   31   HD22  LEU   4          HD22      LEU   4 -11.347 -15.796  -4.873
   32   HD23  LEU   4          HD23      LEU   4  -9.937 -16.325  -3.956
   33    H    ARG   5           HN       ARG   5 -14.492 -15.191  -0.371
   34    HA   ARG   5           HA       ARG   5 -13.078 -16.689   1.691
   35    HB2  ARG   5           HB2      ARG   5 -12.489 -14.514   2.818
   36    HB3  ARG   5           HB1      ARG   5 -11.684 -14.795   1.286
   37    HG2  ARG   5           HG2      ARG   5 -13.179 -13.240   0.183
   38    HG3  ARG   5           HG1      ARG   5 -14.091 -13.028   1.681
   39    HD2  ARG   5           HD2      ARG   5 -11.187 -12.308   1.276
   40    HD3  ARG   5           HD1      ARG   5 -12.541 -11.177   1.256
   41    HE   ARG   5           HE       ARG   5 -12.680 -12.549   3.652
   42   HH11  ARG   5          HH11      ARG   5 -10.502 -10.238   2.104
   43   HH12  ARG   5          HH12      ARG   5  -9.875  -9.636   3.577
   44   HH21  ARG   5          HH21      ARG   5 -11.854 -11.714   5.648
   45   HH22  ARG   5          HH22      ARG   5 -10.708 -10.474   5.649
   46    H    THR   6           HN       THR   6 -14.880 -17.754   2.298
   47    HA   THR   6           HA       THR   6 -17.157 -16.469   3.358
   48    HB   THR   6           HB       THR   6 -17.325 -18.870   4.371
   49    HG1  THR   6           HG1      THR   6 -15.783 -20.233   3.736
   50   HG21  THR   6          HG21      THR   6 -18.604 -18.095   2.401
   51   HG22  THR   6          HG22      THR   6 -18.047 -19.753   2.193
   52   HG23  THR   6          HG23      THR   6 -17.211 -18.436   1.371
   53    H    ALA   7           HN       ALA   7 -14.204 -17.859   4.545
   54    HA   ALA   7           HA       ALA   7 -14.280 -16.168   6.889
   55    HB1  ALA   7           HB1      ALA   7 -13.697 -19.139   6.909
   56    HB2  ALA   7           HB2      ALA   7 -15.082 -18.353   7.669
   57    HB3  ALA   7           HB3      ALA   7 -13.453 -18.049   8.275
   58    H    GLY   8           HN       GLY   8 -12.512 -14.958   6.506
   59    HA2  GLY   8           HA3      GLY   8 -10.022 -16.252   5.991
   60    HA3  GLY   8           HA2      GLY   8 -10.622 -15.315   4.630
   61    H    ARG   9           HN       ARG   9  -8.296 -14.638   5.699
   62    HA   ARG   9           HA       ARG   9  -8.832 -12.034   6.840
   63    HB2  ARG   9           HB2      ARG   9  -8.483 -13.603   8.743
   64    HB3  ARG   9           HB1      ARG   9  -6.957 -14.096   8.055
   65    HG2  ARG   9           HG2      ARG   9  -7.528 -11.287   8.983
   66    HG3  ARG   9           HG1      ARG   9  -6.888 -12.546  10.030
   67    HD2  ARG   9           HD2      ARG   9  -5.012 -12.793   8.344
   68    HD3  ARG   9           HD1      ARG   9  -5.615 -11.312   7.600
   69    HE   ARG   9           HE       ARG   9  -5.263 -10.941  10.349
   70   HH11  ARG   9          HH11      ARG   9  -3.459 -11.090   7.301
   71   HH12  ARG   9          HH12      ARG   9  -2.025 -10.476   7.934
   72   HH21  ARG   9          HH21      ARG   9  -3.277 -10.055  11.233
   73   HH22  ARG   9          HH22      ARG   9  -1.905  -9.838  10.253
   74    H    ASP  10           HN       ASP  10  -7.702 -10.654   5.614
   75    HA   ASP  10           HA       ASP  10  -5.760 -11.837   3.831
   76    HB2  ASP  10           HB2      ASP  10  -6.014  -9.765   2.437
   77    HB3  ASP  10           HB1      ASP  10  -7.508 -10.670   2.658
   78    H    GLY  11           HN       GLY  11  -5.370  -8.433   4.187
   79    HA2  GLY  11           HA3      GLY  11  -3.750  -7.240   5.308
   80    HA3  GLY  11           HA2      GLY  11  -3.010  -8.755   5.846
   81    H    LEU  12           HN       LEU  12  -1.761  -9.861   4.533
   82    HA   LEU  12           HA       LEU  12  -0.052  -8.441   2.747
   83    HB2  LEU  12           HB2      LEU  12   0.257 -10.639   4.214
   84    HB3  LEU  12           HB1      LEU  12  -0.285 -11.415   2.757
   85    HG   LEU  12           HG       LEU  12   2.197  -9.683   2.900
   86   HD11  LEU  12          HD11      LEU  12   3.445 -11.784   2.848
   87   HD12  LEU  12          HD12      LEU  12   1.929 -12.681   2.977
   88   HD13  LEU  12          HD13      LEU  12   2.455 -11.642   4.301
   89   HD21  LEU  12          HD21      LEU  12   1.277 -11.644   0.803
   90   HD22  LEU  12          HD22      LEU  12   2.781 -10.724   0.777
   91   HD23  LEU  12          HD23      LEU  12   1.230  -9.889   0.645
   92    H    CYS  13           HN       CYS  13  -2.627 -10.773   2.368
   93    HA   CYS  13           HA       CYS  13  -2.530 -11.288  -0.335
   94    HB2  CYS  13           HB2      CYS  13  -4.921 -11.122   1.466
   95    HB3  CYS  13           HB1      CYS  13  -4.854 -12.021  -0.064
   96    HG   CYS  13           HG       CYS  13  -2.433 -13.289   1.462
   97    H    ARG  14           HN       ARG  14  -4.273  -8.654   1.350
   98    HA   ARG  14           HA       ARG  14  -5.382  -7.657  -1.093
   99    HB2  ARG  14           HB2      ARG  14  -6.710  -7.287   0.851
  100    HB3  ARG  14           HB1      ARG  14  -5.355  -6.606   1.733
  101    HG2  ARG  14           HG2      ARG  14  -5.449  -4.586   0.467
  102    HG3  ARG  14           HG1      ARG  14  -6.602  -5.294  -0.666
  103    HD2  ARG  14           HD2      ARG  14  -7.257  -5.077   2.251
  104    HD3  ARG  14           HD1      ARG  14  -7.468  -3.694   1.182
  105    HE   ARG  14           HE       ARG  14  -8.973  -5.128  -0.153
  106   HH11  ARG  14          HH11      ARG  14  -8.447  -6.179   3.199
  107   HH12  ARG  14          HH12      ARG  14 -10.034  -6.743   3.404
  108   HH21  ARG  14          HH21      ARG  14 -11.131  -5.913   0.155
  109   HH22  ARG  14          HH22      ARG  14 -11.591  -6.602   1.644
  110    H    LEU  15           HN       LEU  15  -2.636  -6.880   0.936
  111    HA   LEU  15           HA       LEU  15  -1.759  -4.515  -0.175
  112    HB2  LEU  15           HB2      LEU  15  -0.892  -5.468   1.825
  113    HB3  LEU  15           HB1      LEU  15  -0.303  -6.883   0.974
  114    HG   LEU  15           HG       LEU  15   1.305  -5.372  -0.215
  115   HD11  LEU  15          HD11      LEU  15   0.394  -3.396   1.857
  116   HD12  LEU  15          HD12      LEU  15   0.109  -3.268   0.120
  117   HD13  LEU  15          HD13      LEU  15   1.752  -3.195   0.756
  118   HD21  LEU  15          HD21      LEU  15   1.438  -5.523   2.782
  119   HD22  LEU  15          HD22      LEU  15   2.799  -5.183   1.714
  120   HD23  LEU  15          HD23      LEU  15   1.988  -6.750   1.642
  121    H    SER  16           HN       SER  16  -0.749  -7.867  -1.013
  122    HA   SER  16           HA       SER  16   0.856  -7.311  -3.179
  123    HB2  SER  16           HB2      SER  16  -0.958  -9.694  -2.827
  124    HB3  SER  16           HB1      SER  16   0.494  -9.617  -3.825
  125    HG   SER  16           HG       SER  16   1.548 -10.140  -2.145
  126    H    THR  17           HN       THR  17  -2.612  -8.045  -3.128
  127    HA   THR  17           HA       THR  17  -3.123  -8.135  -5.825
  128    HB   THR  17           HB       THR  17  -4.918  -7.219  -3.572
  129    HG1  THR  17           HG1      THR  17  -4.484  -9.279  -3.104
  130   HG21  THR  17          HG21      THR  17  -6.792  -7.894  -5.027
  131   HG22  THR  17          HG22      THR  17  -5.649  -8.263  -6.318
  132   HG23  THR  17          HG23      THR  17  -5.857  -6.598  -5.779
  133    H    TYR  18           HN       TYR  18  -2.836  -5.285  -3.794
  134    HA   TYR  18           HA       TYR  18  -3.625  -3.612  -6.008
  135    HB2  TYR  18           HB2      TYR  18  -3.025  -3.031  -3.134
  136    HB3  TYR  18           HB1      TYR  18  -3.161  -1.736  -4.323
  137    HD1  TYR  18           HD1      TYR  18  -5.240  -1.521  -5.615
  138    HD2  TYR  18           HD2      TYR  18  -5.010  -4.032  -2.226
  139    HE1  TYR  18           HE1      TYR  18  -7.676  -1.504  -5.469
  140    HE2  TYR  18           HE2      TYR  18  -7.468  -4.028  -2.056
  141    HH   TYR  18           HH       TYR  18  -9.361  -2.402  -2.823
  142    H    LEU  19           HN       LEU  19  -0.672  -4.492  -4.334
  143    HA   LEU  19           HA       LEU  19   0.872  -2.499  -5.661
  144    HB2  LEU  19           HB2      LEU  19   1.718  -4.999  -4.214
  145    HB3  LEU  19           HB1      LEU  19   2.846  -3.828  -4.870
  146    HG   LEU  19           HG       LEU  19   0.817  -3.286  -2.695
  147   HD11  LEU  19          HD11      LEU  19   2.599  -4.698  -1.921
  148   HD12  LEU  19          HD12      LEU  19   2.758  -3.078  -1.248
  149   HD13  LEU  19          HD13      LEU  19   3.809  -3.589  -2.576
  150   HD21  LEU  19          HD21      LEU  19   1.208  -1.289  -4.043
  151   HD22  LEU  19          HD22      LEU  19   2.947  -1.499  -3.895
  152   HD23  LEU  19          HD23      LEU  19   1.984  -1.114  -2.477
  153    H    GLU  20           HN       GLU  20  -0.187  -5.651  -6.541
  154    HA   GLU  20           HA       GLU  20   1.619  -6.127  -8.684
  155    HB2  GLU  20           HB3      GLU  20  -1.224  -7.064  -8.286
  156    HB3  GLU  20           HB2      GLU  20  -0.147  -7.689  -9.526
  157    HG2  GLU  20           HG3      GLU  20   1.304  -8.621  -7.833
  158    HG3  GLU  20           HG2      GLU  20   0.343  -7.876  -6.557
  159    H    GLU  21           HN       GLU  21  -0.930  -3.904  -8.287
  160    HA   GLU  21           HA       GLU  21  -1.551  -3.615 -11.095
  161    HB2  GLU  21           HB3      GLU  21  -2.414  -2.089  -8.647
  162    HB3  GLU  21           HB2      GLU  21  -2.953  -1.709 -10.276
  163    HG2  GLU  21           HG3      GLU  21  -3.381  -4.341  -8.894
  164    HG3  GLU  21           HG2      GLU  21  -4.572  -3.042  -8.997
  165    H    LEU  22           HN       LEU  22   0.882  -2.577  -9.070
  166    HA   LEU  22           HA       LEU  22   1.217  -0.033 -10.447
  167    HB2  LEU  22           HB2      LEU  22   2.797  -1.233  -8.181
  168    HB3  LEU  22           HB1      LEU  22   3.033   0.363  -8.846
  169    HG   LEU  22           HG       LEU  22   0.698  -0.633  -7.237
  170   HD11  LEU  22          HD11      LEU  22   1.395   1.213  -5.743
  171   HD12  LEU  22          HD12      LEU  22   2.824   1.437  -6.756
  172   HD13  LEU  22          HD13      LEU  22   2.578  -0.083  -5.895
  173   HD21  LEU  22          HD21      LEU  22   1.023   2.069  -8.551
  174   HD22  LEU  22          HD22      LEU  22  -0.253   1.583  -7.431
  175   HD23  LEU  22          HD23      LEU  22  -0.139   0.823  -9.016
  176    H    GLU  23           HN       GLU  23   2.796   0.313 -11.882
  177    HA   GLU  23           HA       GLU  23   4.279  -1.995 -12.785
  178    HB2  GLU  23           HB3      GLU  23   4.940  -0.597 -14.688
  179    HB3  GLU  23           HB2      GLU  23   3.208  -0.464 -14.407
  180    HG2  GLU  23           HG3      GLU  23   3.441   1.666 -13.451
  181    HG3  GLU  23           HG2      GLU  23   5.205   1.543 -13.447
  182    H    ALA  24           HN       ALA  24   6.694  -1.167 -13.556
  183    HA   ALA  24           HA       ALA  24   8.233  -1.267 -11.274
  184    HB1  ALA  24           HB1      ALA  24   9.098  -0.131 -13.928
  185    HB2  ALA  24           HB2      ALA  24   9.031  -1.847 -13.526
  186    HB3  ALA  24           HB3      ALA  24  10.149  -0.784 -12.672
  187    H    VAL  25           HN       VAL  25   7.586   1.651 -13.218
  188    HA   VAL  25           HA       VAL  25   9.032   3.332 -11.450
  189    HB   VAL  25           HB       VAL  25   8.759   4.004 -13.760
  190   HG11  VAL  25          HG11      VAL  25   6.632   4.768 -14.638
  191   HG12  VAL  25          HG12      VAL  25   5.868   4.230 -13.122
  192   HG13  VAL  25          HG13      VAL  25   6.651   3.051 -14.189
  193   HG21  VAL  25          HG21      VAL  25   7.315   5.901 -11.937
  194   HG22  VAL  25          HG22      VAL  25   8.028   6.334 -13.492
  195   HG23  VAL  25          HG23      VAL  25   9.067   5.820 -12.151
  196    H    GLU  26           HN       GLU  26   5.750   2.297 -11.491
  197    HA   GLU  26           HA       GLU  26   4.784   4.287  -9.697
  198    HB2  GLU  26           HB3      GLU  26   3.732   1.554 -10.404
  199    HB3  GLU  26           HB2      GLU  26   2.866   2.713  -9.394
  200    HG2  GLU  26           HG3      GLU  26   3.786   3.261 -12.179
  201    HG3  GLU  26           HG2      GLU  26   2.160   2.675 -11.798
  202    H    LEU  27           HN       LEU  27   5.960   0.995  -9.337
  203    HA   LEU  27           HA       LEU  27   5.838   0.926  -6.515
  204    HB2  LEU  27           HB2      LEU  27   7.620  -0.562  -8.445
  205    HB3  LEU  27           HB1      LEU  27   7.532  -0.908  -6.733
  206    HG   LEU  27           HG       LEU  27   5.179  -1.167  -8.615
  207   HD11  LEU  27          HD11      LEU  27   7.052  -3.280  -7.556
  208   HD12  LEU  27          HD12      LEU  27   6.953  -2.730  -9.230
  209   HD13  LEU  27          HD13      LEU  27   5.588  -3.569  -8.495
  210   HD21  LEU  27          HD21      LEU  27   4.215  -2.465  -6.779
  211   HD22  LEU  27          HD22      LEU  27   4.588  -0.821  -6.265
  212   HD23  LEU  27          HD23      LEU  27   5.646  -2.152  -5.797
  213    H    LYS  28           HN       LYS  28   8.203   1.981  -8.812
  214    HA   LYS  28           HA       LYS  28  10.466   2.478  -7.297
  215    HB2  LYS  28           HB2      LYS  28  10.098   2.754  -9.787
  216    HB3  LYS  28           HB1      LYS  28   9.374   4.311  -9.428
  217    HG2  LYS  28           HG2      LYS  28  11.529   4.851 -10.024
  218    HG3  LYS  28           HG1      LYS  28  11.631   4.788  -8.258
  219    HD2  LYS  28           HD2      LYS  28  12.383   2.432  -8.448
  220    HD3  LYS  28           HD1      LYS  28  12.334   2.650 -10.203
  221    HE2  LYS  28           HE2      LYS  28  14.016   4.401 -10.081
  222    HE3  LYS  28           HE1      LYS  28  14.042   4.282  -8.324
  223    HZ1  LYS  28           HZ1      LYS  28  15.878   3.151  -9.442
  224    HZ2  LYS  28           HZ2      LYS  28  14.815   2.059 -10.144
  225    HZ3  LYS  28           HZ3      LYS  28  15.007   2.109  -8.460
  226    H    LYS  29           HN       LYS  29   7.738   4.617  -7.934
  227    HA   LYS  29           HA       LYS  29   8.600   6.861  -6.436
  228    HB2  LYS  29           HB2      LYS  29   5.803   5.915  -6.992
  229    HB3  LYS  29           HB1      LYS  29   6.251   7.520  -6.466
  230    HG2  LYS  29           HG2      LYS  29   7.321   7.974  -8.585
  231    HG3  LYS  29           HG1      LYS  29   7.038   6.307  -9.104
  232    HD2  LYS  29           HD2      LYS  29   4.640   6.625  -8.912
  233    HD3  LYS  29           HD1      LYS  29   4.895   8.270  -8.339
  234    HE2  LYS  29           HE2      LYS  29   5.806   8.905 -10.470
  235    HE3  LYS  29           HE1      LYS  29   5.711   7.236 -11.038
  236    HZ1  LYS  29           HZ1      LYS  29   3.388   7.264 -10.876
  237    HZ2  LYS  29           HZ2      LYS  29   3.815   8.603 -11.795
  238    HZ3  LYS  29           HZ3      LYS  29   3.333   8.794 -10.167
  239    H    PHE  30           HN       PHE  30   6.325   4.305  -5.799
  240    HA   PHE  30           HA       PHE  30   5.478   4.840  -3.258
  241    HB2  PHE  30           HB2      PHE  30   4.291   3.249  -4.454
  242    HB3  PHE  30           HB1      PHE  30   5.736   2.406  -4.960
  243    HD1  PHE  30           HD1      PHE  30   3.891   3.160  -1.804
  244    HD2  PHE  30           HD2      PHE  30   6.052   0.348  -4.119
  245    HE1  PHE  30           HE1      PHE  30   3.479   1.431  -0.101
  246    HE2  PHE  30           HE2      PHE  30   5.633  -1.383  -2.431
  247    HZ   PHE  30           HZ       PHE  30   4.336  -0.837  -0.419
  248    H    LYS  31           HN       LYS  31   8.182   2.749  -4.172
  249    HA   LYS  31           HA       LYS  31   8.820   2.223  -1.424
  250    HB2  LYS  31           HB2      LYS  31  10.609   0.843  -2.265
  251    HB3  LYS  31           HB1      LYS  31   9.136   0.538  -3.173
  252    HG2  LYS  31           HG2      LYS  31  10.049   2.078  -4.931
  253    HG3  LYS  31           HG1      LYS  31  11.585   1.996  -4.053
  254    HD2  LYS  31           HD2      LYS  31  11.441  -0.493  -4.201
  255    HD3  LYS  31           HD1      LYS  31  10.055  -0.292  -5.276
  256    HE2  LYS  31           HE2      LYS  31  12.127  -0.654  -6.513
  257    HE3  LYS  31           HE1      LYS  31  11.468   0.942  -6.857
  258    HZ1  LYS  31           HZ1      LYS  31  13.584   0.365  -4.873
  259    HZ2  LYS  31           HZ2      LYS  31  13.020   1.889  -5.294
  260    HZ3  LYS  31           HZ3      LYS  31  13.904   1.005  -6.395
  261    H    LEU  32           HN       LEU  32   9.920   4.674  -3.633
  262    HA   LEU  32           HA       LEU  32  12.087   5.180  -1.828
  263    HB2  LEU  32           HB2      LEU  32  12.694   7.072  -3.182
  264    HB3  LEU  32           HB1      LEU  32  12.390   5.707  -4.214
  265    HG   LEU  32           HG       LEU  32  10.070   6.855  -4.630
  266   HD11  LEU  32          HD11      LEU  32  11.673   9.208  -3.654
  267   HD12  LEU  32          HD12      LEU  32  10.211   8.555  -2.913
  268   HD13  LEU  32          HD13      LEU  32  10.137   9.288  -4.516
  269   HD21  LEU  32          HD21      LEU  32  11.784   6.549  -6.309
  270   HD22  LEU  32          HD22      LEU  32  12.660   7.943  -5.685
  271   HD23  LEU  32          HD23      LEU  32  11.081   8.166  -6.450
  272    H    TYR  33           HN       TYR  33   8.873   6.367  -2.390
  273    HA   TYR  33           HA       TYR  33   8.936   8.668  -0.842
  274    HB2  TYR  33           HB2      TYR  33   7.047   8.111  -2.314
  275    HB3  TYR  33           HB1      TYR  33   6.607   6.776  -1.253
  276    HD1  TYR  33           HD1      TYR  33   5.559   7.195   0.919
  277    HD2  TYR  33           HD2      TYR  33   6.633  10.394  -1.658
  278    HE1  TYR  33           HE1      TYR  33   4.234   8.711   2.290
  279    HE2  TYR  33           HE2      TYR  33   5.293  11.948  -0.278
  280    HH   TYR  33           HH       TYR  33   4.296  11.163   2.774
  281    H    LEU  34           HN       LEU  34   8.062   5.396   0.146
  282    HA   LEU  34           HA       LEU  34   8.043   6.350   2.879
  283    HB2  LEU  34           HB2      LEU  34   7.189   4.043   3.424
  284    HB3  LEU  34           HB1      LEU  34   6.151   5.070   2.469
  285    HG   LEU  34           HG       LEU  34   6.949   3.770   0.427
  286   HD11  LEU  34          HD11      LEU  34   7.804   1.527   0.777
  287   HD12  LEU  34          HD12      LEU  34   7.949   1.836   2.505
  288   HD13  LEU  34          HD13      LEU  34   8.945   2.738   1.363
  289   HD21  LEU  34          HD21      LEU  34   4.776   3.485   1.458
  290   HD22  LEU  34          HD22      LEU  34   5.463   2.269   2.549
  291   HD23  LEU  34          HD23      LEU  34   5.413   1.975   0.814
  292    H    GLY  35           HN       GLY  35  10.101   4.557   0.812
  293    HA2  GLY  35           HA3      GLY  35  11.329   3.182   2.952
  294    HA3  GLY  35           HA2      GLY  35  11.891   3.179   1.279
  295    H    THR  36           HN       THR  36  12.083   6.011   1.062
  296    HA   THR  36           HA       THR  36  14.530   6.397   2.678
  297    HB   THR  36           HB       THR  36  15.295   8.000   0.968
  298    HG1  THR  36           HG1      THR  36  12.688   7.589  -0.107
  299   HG21  THR  36          HG21      THR  36  15.475   6.515  -0.985
  300   HG22  THR  36          HG22      THR  36  14.217   5.489  -0.316
  301   HG23  THR  36          HG23      THR  36  15.766   5.634   0.520
  302    H    ALA  37           HN       ALA  37  11.692   6.919   3.390
  303    HA   ALA  37           HA       ALA  37  11.183   9.709   3.344
  304    HB1  ALA  37           HB1      ALA  37   9.317   9.191   4.770
  305    HB2  ALA  37           HB2      ALA  37   9.889   7.525   4.914
  306    HB3  ALA  37           HB3      ALA  37   9.380   8.165   3.336
  307    H    THR  38           HN       THR  38  11.947  11.206   4.672
  308    HA   THR  38           HA       THR  38  12.911  10.402   7.257
  309    HB   THR  38           HB       THR  38  13.444  12.892   7.431
  310    HG1  THR  38           HG1      THR  38  13.049  14.129   5.794
  311   HG21  THR  38          HG21      THR  38  15.167  11.220   6.967
  312   HG22  THR  38          HG22      THR  38  15.470  12.679   6.027
  313   HG23  THR  38          HG23      THR  38  14.763  11.263   5.250
  314    H    GLU  39           HN       GLU  39  10.082  11.464   5.813
  315    HA   GLU  39           HA       GLU  39   8.841  12.754   8.066
  316    HB2  GLU  39           HB3      GLU  39   6.748  12.534   6.791
  317    HB3  GLU  39           HB2      GLU  39   8.024  13.151   5.760
  318    HG2  GLU  39           HG3      GLU  39   8.335  10.874   4.860
  319    HG3  GLU  39           HG2      GLU  39   6.973  10.311   5.815
  320    H    LEU  40           HN       LEU  40   9.692   9.653   7.330
  321    HA   LEU  40           HA       LEU  40   7.637   8.352   8.968
  322    HB2  LEU  40           HB2      LEU  40   8.309   7.722   6.595
  323    HB3  LEU  40           HB1      LEU  40   9.777   7.099   7.293
  324    HG   LEU  40           HG       LEU  40   8.375   5.643   8.755
  325   HD11  LEU  40          HD11      LEU  40   6.249   6.765   8.582
  326   HD12  LEU  40          HD12      LEU  40   6.092   5.113   7.988
  327   HD13  LEU  40          HD13      LEU  40   6.195   6.453   6.847
  328   HD21  LEU  40          HD21      LEU  40   8.001   3.953   6.994
  329   HD22  LEU  40          HD22      LEU  40   9.567   4.745   6.858
  330   HD23  LEU  40          HD23      LEU  40   8.254   5.203   5.778
  331    H    GLY  41           HN       GLY  41  10.403   9.836   9.301
  332    HA2  GLY  41           HA3      GLY  41  11.554   9.977  11.370
  333    HA3  GLY  41           HA2      GLY  41  11.225   8.266  11.632
  334    H    GLU  42           HN       GLU  42  12.427   6.801  10.696
  335    HA   GLU  42           HA       GLU  42  14.976   7.745   9.663
  336    HB2  GLU  42           HB3      GLU  42  15.489   5.130  10.283
  337    HB3  GLU  42           HB2      GLU  42  15.835   6.504  11.312
  338    HG2  GLU  42           HG3      GLU  42  14.743   4.740  12.570
  339    HG3  GLU  42           HG2      GLU  42  13.775   6.216  12.443
  340    H    GLY  43           HN       GLY  43  12.414   5.471   9.172
  341    HA2  GLY  43           HA3      GLY  43  11.735   4.873   6.936
  342    HA3  GLY  43           HA2      GLY  43  13.434   4.966   6.458
  343    H    LYS  44           HN       LYS  44  11.025   2.895   7.280
  344    HA   LYS  44           HA       LYS  44  12.571   1.018   8.819
  345    HB2  LYS  44           HB2      LYS  44   9.774   0.940   7.716
  346    HB3  LYS  44           HB1      LYS  44  10.514  -0.474   8.435
  347    HG2  LYS  44           HG2      LYS  44   9.092   0.626  10.041
  348    HG3  LYS  44           HG1      LYS  44  10.773   0.756  10.550
  349    HD2  LYS  44           HD2      LYS  44  10.818   3.071   9.713
  350    HD3  LYS  44           HD1      LYS  44   9.126   2.919   9.229
  351    HE2  LYS  44           HE2      LYS  44   8.474   2.525  11.531
  352    HE3  LYS  44           HE1      LYS  44  10.162   2.583  12.037
  353    HZ1  LYS  44           HZ1      LYS  44   9.033   4.676  12.481
  354    HZ2  LYS  44           HZ2      LYS  44   8.642   4.877  10.872
  355    HZ3  LYS  44           HZ3      LYS  44  10.259   4.890  11.349
  356    H    ILE  45           HN       ILE  45  12.617   1.745   5.692
  357    HA   ILE  45           HA       ILE  45  12.898  -0.995   4.745
  358    HB   ILE  45           HB       ILE  45  12.851   1.632   3.234
  359   HG12  ILE  45          HG12      ILE  45  10.658   0.984   4.129
  360   HG13  ILE  45          HG11      ILE  45  10.678   0.883   2.373
  361   HG21  ILE  45          HG21      ILE  45  12.781   0.298   1.169
  362   HG22  ILE  45          HG22      ILE  45  13.017  -1.168   2.122
  363   HG23  ILE  45          HG23      ILE  45  14.282   0.047   2.064
  364   HD11  ILE  45          HD11      ILE  45  10.884  -1.425   4.301
  365   HD12  ILE  45          HD12      ILE  45  10.994  -1.529   2.542
  366   HD13  ILE  45          HD13      ILE  45   9.491  -0.995   3.297
  367    HA   PRO  46           HA       PRO  46  17.310  -0.671   5.266
  368    HB2  PRO  46           HB2      PRO  46  17.884  -2.546   3.246
  369    HB3  PRO  46           HB1      PRO  46  17.736  -2.871   4.975
  370    HG2  PRO  46           HG2      PRO  46  15.794  -3.287   2.787
  371    HG3  PRO  46           HG1      PRO  46  15.983  -4.152   4.335
  372    HD2  PRO  46           HD2      PRO  46  13.983  -2.402   3.787
  373    HD3  PRO  46           HD1      PRO  46  14.601  -2.680   5.424
  374    H    TRP  47           HN       TRP  47  19.241  -0.610   3.672
  375    HA   TRP  47           HA       TRP  47  18.780   1.863   2.347
  376    HB2  TRP  47           HB2      TRP  47  21.340   0.392   2.993
  377    HB3  TRP  47           HB1      TRP  47  21.234   2.038   2.377
  378    HD1  TRP  47           HD1      TRP  47  20.781   3.954   4.113
  379    HE1  TRP  47           HE1      TRP  47  20.452   4.045   6.644
  380    HE3  TRP  47           HE3      TRP  47  20.324  -1.064   5.088
  381    HZ2  TRP  47           HZ2      TRP  47  20.046   2.257   8.785
  382    HZ3  TRP  47           HZ3      TRP  47  19.952  -1.783   7.387
  383    HH2  TRP  47           HH2      TRP  47  19.821  -0.158   9.215
  384    H    GLY  48           HN       GLY  48  17.657   1.090   0.630
  385    HA2  GLY  48           HA3      GLY  48  17.643   1.073  -1.722
  386    HA3  GLY  48           HA2      GLY  48  19.364   0.729  -1.692
  387    H    SER  49           HN       SER  49  17.329  -1.333   0.222
  388    HA   SER  49           HA       SER  49  18.106  -3.553  -1.454
  389    HB2  SER  49           HB2      SER  49  16.682  -3.458   1.174
  390    HB3  SER  49           HB1      SER  49  17.512  -4.856   0.482
  391    HG   SER  49           HG       SER  49  19.429  -3.766   0.635
  392    H    MET  50           HN       MET  50  15.955  -1.647  -2.217
  393    HA   MET  50           HA       MET  50  13.950  -3.687  -2.731
  394    HB2  MET  50           HB2      MET  50  12.162  -1.832  -2.606
  395    HB3  MET  50           HB1      MET  50  12.758  -2.521  -1.113
  396    HG2  MET  50           HG2      MET  50  12.431  -0.101  -1.012
  397    HG3  MET  50           HG1      MET  50  14.080  -0.574  -0.667
  398    HE1  MET  50           HE1      MET  50  13.173   2.426  -1.293
  399    HE2  MET  50           HE2      MET  50  14.478   2.944  -2.362
  400    HE3  MET  50           HE3      MET  50  14.839   1.954  -0.948
  401    H    GLU  51           HN       GLU  51  16.183  -2.194  -4.140
  402    HA   GLU  51           HA       GLU  51  14.924  -0.732  -6.250
  403    HB2  GLU  51           HB3      GLU  51  17.645  -1.699  -5.675
  404    HB3  GLU  51           HB2      GLU  51  17.290  -1.213  -7.334
  405    HG2  GLU  51           HG3      GLU  51  16.805   0.545  -4.932
  406    HG3  GLU  51           HG2      GLU  51  18.286   0.588  -5.891
  407    H    LYS  52           HN       LYS  52  16.044  -3.997  -5.903
  408    HA   LYS  52           HA       LYS  52  15.144  -4.639  -8.616
  409    HB2  LYS  52           HB2      LYS  52  16.866  -6.171  -6.661
  410    HB3  LYS  52           HB1      LYS  52  16.423  -6.756  -8.257
  411    HG2  LYS  52           HG2      LYS  52  17.590  -4.844  -9.272
  412    HG3  LYS  52           HG1      LYS  52  18.048  -4.285  -7.665
  413    HD2  LYS  52           HD2      LYS  52  18.826  -6.944  -8.860
  414    HD3  LYS  52           HD1      LYS  52  19.850  -5.513  -8.838
  415    HE2  LYS  52           HE2      LYS  52  19.763  -5.526  -6.364
  416    HE3  LYS  52           HE1      LYS  52  18.799  -7.003  -6.421
  417    HZ1  LYS  52           HZ1      LYS  52  20.681  -8.104  -7.525
  418    HZ2  LYS  52           HZ2      LYS  52  21.111  -7.524  -6.023
  419    HZ3  LYS  52           HZ3      LYS  52  21.590  -6.697  -7.402
  420    H    ALA  53           HN       ALA  53  13.458  -4.154  -6.256
  421    HA   ALA  53           HA       ALA  53  12.278  -6.779  -5.777
  422    HB1  ALA  53           HB1      ALA  53  12.824  -5.469  -3.812
  423    HB2  ALA  53           HB2      ALA  53  11.065  -5.609  -3.953
  424    HB3  ALA  53           HB3      ALA  53  11.888  -4.118  -4.424
  425    H    GLY  54           HN       GLY  54  10.115  -7.182  -6.290
  426    HA2  GLY  54           HA3      GLY  54   8.837  -5.221  -8.050
  427    HA3  GLY  54           HA2      GLY  54   8.737  -6.976  -8.240
  428    HA   PRO  55           HA       PRO  55   5.028  -5.441  -5.830
  429    HB2  PRO  55           HB2      PRO  55   3.338  -7.365  -6.886
  430    HB3  PRO  55           HB1      PRO  55   3.527  -5.730  -7.526
  431    HG2  PRO  55           HG2      PRO  55   4.745  -8.285  -8.459
  432    HG3  PRO  55           HG1      PRO  55   4.148  -6.919  -9.413
  433    HD2  PRO  55           HD2      PRO  55   6.776  -7.329  -8.999
  434    HD3  PRO  55           HD1      PRO  55   6.091  -5.694  -9.107
  435    H    LEU  56           HN       LEU  56   6.126  -8.701  -6.491
  436    HA   LEU  56           HA       LEU  56   4.879  -9.981  -4.273
  437    HB2  LEU  56           HB2      LEU  56   5.633 -11.151  -6.306
  438    HB3  LEU  56           HB1      LEU  56   7.288 -10.761  -5.903
  439    HG   LEU  56           HG       LEU  56   7.058 -12.146  -3.845
  440   HD11  LEU  56          HD11      LEU  56   5.204 -13.731  -3.713
  441   HD12  LEU  56          HD12      LEU  56   4.434 -12.950  -5.091
  442   HD13  LEU  56          HD13      LEU  56   4.656 -12.061  -3.579
  443   HD21  LEU  56          HD21      LEU  56   6.529 -13.533  -6.466
  444   HD22  LEU  56          HD22      LEU  56   7.227 -14.273  -5.021
  445   HD23  LEU  56          HD23      LEU  56   8.098 -12.998  -5.870
  446    H    GLU  57           HN       GLU  57   8.244  -8.905  -4.855
  447    HA   GLU  57           HA       GLU  57   9.122  -9.600  -2.289
  448    HB2  GLU  57           HB3      GLU  57  10.308  -7.565  -4.178
  449    HB3  GLU  57           HB2      GLU  57  11.119  -8.243  -2.777
  450    HG2  GLU  57           HG3      GLU  57  12.041  -9.486  -4.449
  451    HG3  GLU  57           HG2      GLU  57  10.680 -10.513  -4.023
  452    H    MET  58           HN       MET  58   7.872  -6.593  -3.625
  453    HA   MET  58           HA       MET  58   8.413  -5.019  -1.361
  454    HB2  MET  58           HB2      MET  58   6.437  -4.694  -3.581
  455    HB3  MET  58           HB1      MET  58   6.559  -3.484  -2.317
  456    HG2  MET  58           HG2      MET  58   8.798  -4.446  -4.079
  457    HG3  MET  58           HG1      MET  58   7.928  -2.939  -4.393
  458    HE1  MET  58           HE1      MET  58   7.958  -1.006  -2.372
  459    HE2  MET  58           HE2      MET  58   9.115  -1.040  -1.041
  460    HE3  MET  58           HE3      MET  58   7.777  -2.186  -1.070
  461    H    ALA  59           HN       ALA  59   5.497  -6.837  -2.253
  462    HA   ALA  59           HA       ALA  59   3.930  -6.003  -0.113
  463    HB1  ALA  59           HB1      ALA  59   2.650  -8.067  -0.452
  464    HB2  ALA  59           HB2      ALA  59   3.965  -8.727  -1.419
  465    HB3  ALA  59           HB3      ALA  59   3.064  -7.326  -1.998
  466    H    GLN  60           HN       GLN  60   6.338  -8.521  -0.330
  467    HA   GLN  60           HA       GLN  60   5.870  -9.408   2.364
  468    HB2  GLN  60           HB2      GLN  60   8.052 -10.183   0.437
  469    HB3  GLN  60           HB1      GLN  60   7.615 -11.028   1.924
  470    HG2  GLN  60           HG2      GLN  60   5.417 -11.518   1.011
  471    HG3  GLN  60           HG1      GLN  60   5.820 -10.622  -0.434
  472   HE21  GLN  60          HE21      GLN  60   7.227 -11.476  -1.901
  473   HE22  GLN  60          HE22      GLN  60   7.698 -13.141  -1.905
  474    H    LEU  61           HN       LEU  61   7.473  -6.832   1.069
  475    HA   LEU  61           HA       LEU  61   9.725  -6.783   2.894
  476    HB2  LEU  61           HB2      LEU  61   9.606  -5.804   0.457
  477    HB3  LEU  61           HB1      LEU  61   8.711  -4.504   1.225
  478    HG   LEU  61           HG       LEU  61  10.695  -4.102   2.683
  479   HD11  LEU  61          HD11      LEU  61  12.856  -4.962   1.897
  480   HD12  LEU  61          HD12      LEU  61  12.001  -5.923   0.690
  481   HD13  LEU  61          HD13      LEU  61  11.791  -6.284   2.407
  482   HD21  LEU  61          HD21      LEU  61  11.951  -2.920   0.940
  483   HD22  LEU  61          HD22      LEU  61  10.211  -2.695   0.761
  484   HD23  LEU  61          HD23      LEU  61  11.070  -3.822  -0.291
  485    H    LEU  62           HN       LEU  62   6.905  -4.698   2.116
  486    HA   LEU  62           HA       LEU  62   7.051  -3.140   4.408
  487    HB2  LEU  62           HB2      LEU  62   4.630  -3.756   2.704
  488    HB3  LEU  62           HB1      LEU  62   4.629  -2.590   3.997
  489    HG   LEU  62           HG       LEU  62   4.738  -1.345   2.044
  490   HD11  LEU  62          HD11      LEU  62   7.542  -1.547   2.991
  491   HD12  LEU  62          HD12      LEU  62   6.266  -0.512   3.637
  492   HD13  LEU  62          HD13      LEU  62   6.877  -0.250   2.001
  493   HD21  LEU  62          HD21      LEU  62   6.267  -1.698   0.220
  494   HD22  LEU  62          HD22      LEU  62   5.238  -3.111   0.508
  495   HD23  LEU  62          HD23      LEU  62   6.915  -3.120   1.042
  496    H    ILE  63           HN       ILE  63   5.396  -6.207   3.810
  497    HA   ILE  63           HA       ILE  63   3.818  -6.166   6.135
  498    HB   ILE  63           HB       ILE  63   3.767  -7.641   3.923
  499   HG12  ILE  63          HG12      ILE  63   2.052  -7.538   5.667
  500   HG13  ILE  63          HG11      ILE  63   2.147  -9.111   4.904
  501   HG21  ILE  63          HG21      ILE  63   5.836  -8.836   4.299
  502   HG22  ILE  63          HG22      ILE  63   4.470  -9.951   4.234
  503   HG23  ILE  63          HG23      ILE  63   5.184  -9.522   5.789
  504   HD11  ILE  63          HD11      ILE  63   3.214  -8.351   7.612
  505   HD12  ILE  63          HD12      ILE  63   3.391  -9.947   6.872
  506   HD13  ILE  63          HD13      ILE  63   1.788  -9.334   7.293
  507    H    THR  64           HN       THR  64   7.126  -7.059   5.610
  508    HA   THR  64           HA       THR  64   7.317  -8.483   8.106
  509    HB   THR  64           HB       THR  64   9.486  -7.734   6.125
  510    HG1  THR  64           HG1      THR  64   8.485  -9.212   4.995
  511   HG21  THR  64          HG21      THR  64  10.350  -8.289   8.381
  512   HG22  THR  64          HG22      THR  64  10.771  -9.538   7.208
  513   HG23  THR  64          HG23      THR  64   9.446  -9.802   8.342
  514    H    HIS  65           HN       HIS  65   8.412  -5.409   6.758
  515    HA   HIS  65           HA       HIS  65   9.788  -4.689   9.166
  516    HB2  HIS  65           HB2      HIS  65   9.111  -3.026   6.734
  517    HB3  HIS  65           HB1      HIS  65  10.077  -2.457   8.089
  518    HD1  HIS  65           HD1      HIS  65  12.487  -3.584   8.360
  519    HD2  HIS  65           HD2      HIS  65  10.421  -4.582   4.902
  520    HE1  HIS  65           HE1      HIS  65  14.158  -4.671   6.836
  521    H    PHE  66           HN       PHE  66   6.896  -3.357   7.590
  522    HA   PHE  66           HA       PHE  66   6.164  -1.855   9.923
  523    HB2  PHE  66           HB2      PHE  66   4.705  -2.395   7.348
  524    HB3  PHE  66           HB1      PHE  66   4.204  -1.229   8.570
  525    HD1  PHE  66           HD2      PHE  66   6.626  -2.039   6.007
  526    HD2  PHE  66           HD1      PHE  66   5.410   0.822   8.873
  527    HE1  PHE  66           HE2      PHE  66   8.140  -0.427   4.988
  528    HE2  PHE  66           HE1      PHE  66   6.935   2.471   7.873
  529    HZ   PHE  66           HZ       PHE  66   8.317   1.815   5.909
  530    H    GLY  67           HN       GLY  67   4.361  -4.333   8.143
  531    HA2  GLY  67           HA3      GLY  67   3.812  -6.189   9.916
  532    HA3  GLY  67           HA2      GLY  67   2.824  -4.876  10.553
  533    HA   PRO  68           HA       PRO  68   0.704  -7.435   7.155
  534    HB2  PRO  68           HB2      PRO  68  -1.647  -7.689   8.617
  535    HB3  PRO  68           HB1      PRO  68  -0.385  -8.914   8.471
  536    HG2  PRO  68           HG2      PRO  68  -0.892  -6.971  10.672
  537    HG3  PRO  68           HG1      PRO  68  -0.299  -8.641  10.746
  538    HD2  PRO  68           HD2      PRO  68   1.338  -6.525  11.061
  539    HD3  PRO  68           HD1      PRO  68   1.876  -8.018  10.281
  540    H    GLU  69           HN       GLU  69  -1.221  -5.354   9.268
  541    HA   GLU  69           HA       GLU  69  -2.459  -4.278   6.878
  542    HB2  GLU  69           HB3      GLU  69  -4.044  -3.155   8.387
  543    HB3  GLU  69           HB2      GLU  69  -3.992  -4.907   8.590
  544    HG2  GLU  69           HG3      GLU  69  -2.461  -4.631  10.362
  545    HG3  GLU  69           HG2      GLU  69  -2.614  -2.875  10.166
  546    H    GLU  70           HN       GLU  70  -0.080  -3.405   9.128
  547    HA   GLU  70           HA       GLU  70  -0.121  -0.596   8.729
  548    HB2  GLU  70           HB3      GLU  70   1.157  -1.915  10.517
  549    HB3  GLU  70           HB2      GLU  70   2.330  -2.285   9.261
  550    HG2  GLU  70           HG3      GLU  70   3.118  -0.430  10.575
  551    HG3  GLU  70           HG2      GLU  70   2.705   0.139   8.956
  552    H    ALA  71           HN       ALA  71   1.574  -3.284   7.118
  553    HA   ALA  71           HA       ALA  71   2.884  -1.942   5.075
  554    HB1  ALA  71           HB1      ALA  71   2.678  -4.026   3.809
  555    HB2  ALA  71           HB2      ALA  71   1.468  -4.607   4.955
  556    HB3  ALA  71           HB3      ALA  71   3.120  -4.333   5.483
  557    H    TRP  72           HN       TRP  72  -0.447  -3.118   5.203
  558    HA   TRP  72           HA       TRP  72  -1.162  -2.359   2.612
  559    HB2  TRP  72           HB2      TRP  72  -2.574  -3.925   3.768
  560    HB3  TRP  72           HB1      TRP  72  -2.857  -2.793   5.083
  561    HD1  TRP  72           HD1      TRP  72  -5.370  -2.291   4.964
  562    HE1  TRP  72           HE1      TRP  72  -6.998  -1.463   3.141
  563    HE3  TRP  72           HE3      TRP  72  -2.243  -2.428   0.946
  564    HZ2  TRP  72           HZ2      TRP  72  -6.941  -0.909   0.401
  565    HZ3  TRP  72           HZ3      TRP  72  -3.091  -1.746  -1.242
  566    HH2  TRP  72           HH2      TRP  72  -5.404  -0.993  -1.516
  567    H    ARG  73           HN       ARG  73  -1.442  -0.643   5.648
  568    HA   ARG  73           HA       ARG  73  -2.642   1.650   4.686
  569    HB2  ARG  73           HB2      ARG  73  -2.462   1.288   7.040
  570    HB3  ARG  73           HB1      ARG  73  -0.710   1.236   6.954
  571    HG2  ARG  73           HG2      ARG  73  -0.639   3.597   6.386
  572    HG3  ARG  73           HG1      ARG  73  -2.404   3.664   6.428
  573    HD2  ARG  73           HD2      ARG  73  -0.638   2.907   8.742
  574    HD3  ARG  73           HD1      ARG  73  -1.372   4.493   8.499
  575    HE   ARG  73           HE       ARG  73  -3.539   3.273   8.528
  576   HH11  ARG  73          HH11      ARG  73  -0.747   1.926  10.279
  577   HH12  ARG  73          HH12      ARG  73  -1.695   1.272  11.526
  578   HH21  ARG  73          HH21      ARG  73  -4.813   2.337  10.204
  579   HH22  ARG  73          HH22      ARG  73  -4.064   1.461  11.468
  580    H    LEU  74           HN       LEU  74   0.786   0.872   5.104
  581    HA   LEU  74           HA       LEU  74   1.875   3.220   4.108
  582    HB2  LEU  74           HB2      LEU  74   2.859   0.475   4.559
  583    HB3  LEU  74           HB1      LEU  74   3.780   1.429   3.425
  584    HG   LEU  74           HG       LEU  74   4.704   1.452   5.731
  585   HD11  LEU  74          HD11      LEU  74   3.778   4.130   4.699
  586   HD12  LEU  74          HD12      LEU  74   5.281   3.283   4.299
  587   HD13  LEU  74          HD13      LEU  74   5.022   3.880   5.921
  588   HD21  LEU  74          HD21      LEU  74   2.188   2.969   6.428
  589   HD22  LEU  74          HD22      LEU  74   3.591   2.757   7.478
  590   HD23  LEU  74          HD23      LEU  74   2.624   1.358   7.002
  591    H    ALA  75           HN       ALA  75   0.597   0.481   2.360
  592    HA   ALA  75           HA       ALA  75   1.643   1.524  -0.120
  593    HB1  ALA  75           HB1      ALA  75  -0.310  -0.738   0.310
  594    HB2  ALA  75           HB2      ALA  75   1.444  -0.888   0.014
  595    HB3  ALA  75           HB3      ALA  75   0.390  -0.245  -1.226
  596    H    LEU  76           HN       LEU  76  -1.663   1.268   1.234
  597    HA   LEU  76           HA       LEU  76  -2.801   2.545  -1.024
  598    HB2  LEU  76           HB2      LEU  76  -4.873   2.605   0.118
  599    HB3  LEU  76           HB1      LEU  76  -4.089   1.143   0.655
  600    HG   LEU  76           HG       LEU  76  -3.381   2.687   2.700
  601   HD11  LEU  76          HD11      LEU  76  -4.336   4.735   1.844
  602   HD12  LEU  76          HD12      LEU  76  -5.191   4.245   3.310
  603   HD13  LEU  76          HD13      LEU  76  -5.920   3.979   1.721
  604   HD21  LEU  76          HD21      LEU  76  -5.357   1.919   3.916
  605   HD22  LEU  76          HD22      LEU  76  -4.686   0.647   2.891
  606   HD23  LEU  76          HD23      LEU  76  -6.134   1.515   2.386
  607    H    SER  77           HN       SER  77  -1.703   3.858   2.060
  608    HA   SER  77           HA       SER  77  -2.549   6.488   1.479
  609    HB2  SER  77           HB2      SER  77  -0.842   5.206   3.553
  610    HB3  SER  77           HB1      SER  77  -1.113   6.973   3.573
  611    HG   SER  77           HG       SER  77  -3.328   6.472   3.733
  612    H    THR  78           HN       THR  78  -0.024   4.708   0.220
  613    HA   THR  78           HA       THR  78   1.453   7.163  -0.345
  614    HB   THR  78           HB       THR  78   2.339   4.269  -0.670
  615    HG1  THR  78           HG1      THR  78   2.824   4.498   1.300
  616   HG21  THR  78          HG21      THR  78   3.907   6.836  -1.057
  617   HG22  THR  78          HG22      THR  78   3.426   5.729  -2.343
  618   HG23  THR  78          HG23      THR  78   4.581   5.208  -1.113
  619    H    PHE  79           HN       PHE  79  -0.671   4.805  -1.690
  620    HA   PHE  79           HA       PHE  79  -0.104   5.045  -4.388
  621    HB2  PHE  79           HB2      PHE  79  -2.757   4.700  -2.989
  622    HB3  PHE  79           HB1      PHE  79  -2.626   4.654  -4.750
  623    HD1  PHE  79           HD2      PHE  79   0.188   3.053  -4.319
  624    HD2  PHE  79           HD1      PHE  79  -3.848   2.575  -3.049
  625    HE1  PHE  79           HE2      PHE  79   0.537   0.636  -4.080
  626    HE2  PHE  79           HE1      PHE  79  -3.491   0.158  -2.816
  627    HZ   PHE  79           HZ       PHE  79  -1.293  -0.810  -3.335
  628    H    GLU  80           HN       GLU  80  -2.188   7.000  -2.299
  629    HA   GLU  80           HA       GLU  80  -3.028   8.962  -4.129
  630    HB2  GLU  80           HB3      GLU  80  -3.287  10.402  -2.048
  631    HB3  GLU  80           HB2      GLU  80  -4.124   8.852  -2.019
  632    HG2  GLU  80           HG3      GLU  80  -2.532   7.888  -0.644
  633    HG3  GLU  80           HG2      GLU  80  -1.401   9.214  -0.914
  634    H    ARG  81           HN       ARG  81   0.023   8.532  -2.550
  635    HA   ARG  81           HA       ARG  81   0.863  11.297  -2.798
  636    HB2  ARG  81           HB2      ARG  81   2.366   8.867  -1.844
  637    HB3  ARG  81           HB1      ARG  81   2.925  10.530  -1.717
  638    HG2  ARG  81           HG2      ARG  81   0.468   9.394  -0.375
  639    HG3  ARG  81           HG1      ARG  81   2.029   9.698   0.377
  640    HD2  ARG  81           HD2      ARG  81   1.846  12.020   0.064
  641    HD3  ARG  81           HD1      ARG  81   0.428  11.841  -0.972
  642    HE   ARG  81           HE       ARG  81  -0.836  11.200   0.952
  643   HH11  ARG  81          HH11      ARG  81   2.395  12.365   1.823
  644   HH12  ARG  81          HH12      ARG  81   1.885  13.128   3.244
  645   HH21  ARG  81          HH21      ARG  81  -1.514  12.252   2.942
  646   HH22  ARG  81          HH22      ARG  81  -0.350  13.103   3.873
  647    H    ILE  82           HN       ILE  82   1.134   8.384  -4.590
  648    HA   ILE  82           HA       ILE  82   3.362   9.475  -6.165
  649    HB   ILE  82           HB       ILE  82   3.693   7.212  -7.025
  650   HG12  ILE  82          HG12      ILE  82   1.321   6.432  -5.303
  651   HG13  ILE  82          HG11      ILE  82   1.310   6.520  -7.058
  652   HG21  ILE  82          HG21      ILE  82   3.335   7.257  -4.030
  653   HG22  ILE  82          HG22      ILE  82   4.756   7.813  -4.909
  654   HG23  ILE  82          HG23      ILE  82   4.326   6.101  -4.924
  655   HD11  ILE  82          HD11      ILE  82   2.973   4.714  -7.143
  656   HD12  ILE  82          HD12      ILE  82   1.496   4.226  -6.314
  657   HD13  ILE  82          HD13      ILE  82   2.938   4.626  -5.380
  658    H    ASN  83           HN       ASN  83   0.373   9.968  -6.181
  659    HA   ASN  83           HA       ASN  83  -1.337  10.402  -7.529
  660    HB2  ASN  83           HB3      ASN  83   0.359  11.763  -8.794
  661    HB3  ASN  83           HB2      ASN  83   0.636  10.373  -9.837
  662   HD21  ASN  83          HD21      ASN  83  -2.513  11.466  -8.574
  663   HD22  ASN  83          HD22      ASN  83  -3.175  11.848 -10.103
  664    H    ARG  84           HN       ARG  84  -1.538   8.161  -6.779
  665    HA   ARG  84           HA       ARG  84  -2.556   6.588  -9.001
  666    HB2  ARG  84           HB2      ARG  84  -0.438   5.562  -8.220
  667    HB3  ARG  84           HB1      ARG  84  -1.011   5.604  -6.565
  668    HG2  ARG  84           HG2      ARG  84  -1.066   3.372  -7.590
  669    HG3  ARG  84           HG1      ARG  84  -2.651   3.917  -7.042
  670    HD2  ARG  84           HD2      ARG  84  -2.833   2.859  -9.182
  671    HD3  ARG  84           HD1      ARG  84  -3.206   4.581  -9.273
  672    HE   ARG  84           HE       ARG  84  -0.539   4.449  -9.940
  673   HH11  ARG  84          HH11      ARG  84  -3.381   2.823 -11.284
  674   HH12  ARG  84          HH12      ARG  84  -2.727   2.746 -12.861
  675   HH21  ARG  84          HH21      ARG  84   0.299   4.320 -11.986
  676   HH22  ARG  84          HH22      ARG  84  -0.555   3.610 -13.304
  677    H    LYS  85           HN       LYS  85  -3.999   8.378  -7.955
  678    HA   LYS  85           HA       LYS  85  -5.124   7.982  -5.409
  679    HB2  LYS  85           HB2      LYS  85  -5.044  10.127  -6.067
  680    HB3  LYS  85           HB1      LYS  85  -5.540   9.826  -7.733
  681    HG2  LYS  85           HG2      LYS  85  -7.855   9.375  -6.806
  682    HG3  LYS  85           HG1      LYS  85  -7.243   9.912  -5.241
  683    HD2  LYS  85           HD2      LYS  85  -6.730  12.086  -6.123
  684    HD3  LYS  85           HD1      LYS  85  -7.191  11.571  -7.746
  685    HE2  LYS  85           HE2      LYS  85  -9.055  11.651  -5.375
  686    HE3  LYS  85           HE1      LYS  85  -8.946  12.907  -6.602
  687    HZ1  LYS  85           HZ1      LYS  85 -10.762  11.432  -7.070
  688    HZ2  LYS  85           HZ2      LYS  85  -9.797  10.073  -7.056
  689    HZ3  LYS  85           HZ3      LYS  85  -9.600  11.236  -8.267
  690    H    ASP  86           HN       ASP  86  -5.737   6.958  -8.633
  691    HA   ASP  86           HA       ASP  86  -8.377   6.381  -8.533
  692    HB2  ASP  86           HB2      ASP  86  -6.209   4.885 -10.014
  693    HB3  ASP  86           HB1      ASP  86  -7.925   4.606 -10.259
  694    H    LEU  87           HN       LEU  87  -5.645   4.276  -7.888
  695    HA   LEU  87           HA       LEU  87  -7.123   1.953  -7.018
  696    HB2  LEU  87           HB2      LEU  87  -4.707   2.244  -8.049
  697    HB3  LEU  87           HB1      LEU  87  -4.277   2.560  -6.383
  698    HG   LEU  87           HG       LEU  87  -5.092   0.382  -5.744
  699   HD11  LEU  87          HD11      LEU  87  -5.447   0.033  -8.727
  700   HD12  LEU  87          HD12      LEU  87  -6.727  -0.018  -7.514
  701   HD13  LEU  87          HD13      LEU  87  -5.506  -1.287  -7.570
  702   HD21  LEU  87          HD21      LEU  87  -3.037   0.432  -7.941
  703   HD22  LEU  87          HD22      LEU  87  -3.221  -0.857  -6.749
  704   HD23  LEU  87          HD23      LEU  87  -2.750   0.765  -6.236
  705    H    TRP  88           HN       TRP  88  -5.677   4.737  -5.573
  706    HA   TRP  88           HA       TRP  88  -5.579   3.972  -2.870
  707    HB2  TRP  88           HB2      TRP  88  -4.393   5.872  -3.633
  708    HB3  TRP  88           HB1      TRP  88  -5.824   6.536  -4.363
  709    HD1  TRP  88           HD1      TRP  88  -4.596   5.780  -0.769
  710    HE1  TRP  88           HE1      TRP  88  -5.563   7.589   0.775
  711    HE3  TRP  88           HE3      TRP  88  -7.370   8.299  -4.162
  712    HZ2  TRP  88           HZ2      TRP  88  -7.304   9.808   0.564
  713    HZ3  TRP  88           HZ3      TRP  88  -8.667  10.267  -3.432
  714    HH2  TRP  88           HH2      TRP  88  -8.624  10.996  -1.109
  715    H    GLU  89           HN       GLU  89  -8.146   5.497  -4.794
  716    HA   GLU  89           HA       GLU  89 -10.028   5.691  -2.693
  717    HB2  GLU  89           HB3      GLU  89 -10.432   5.522  -5.684
  718    HB3  GLU  89           HB2      GLU  89 -11.702   5.921  -4.532
  719    HG2  GLU  89           HG3      GLU  89 -10.478   7.901  -3.844
  720    HG3  GLU  89           HG2      GLU  89  -9.168   7.485  -4.945
  721    H    ARG  90           HN       ARG  90  -9.003   3.131  -4.684
  722    HA   ARG  90           HA       ARG  90 -11.176   1.303  -4.172
  723    HB2  ARG  90           HB2      ARG  90  -8.427   1.035  -5.372
  724    HB3  ARG  90           HB1      ARG  90  -9.311  -0.400  -4.896
  725    HG2  ARG  90           HG2      ARG  90  -9.430   0.235  -7.312
  726    HG3  ARG  90           HG1      ARG  90 -10.975  -0.037  -6.529
  727    HD2  ARG  90           HD2      ARG  90 -11.134   2.448  -6.256
  728    HD3  ARG  90           HD1      ARG  90  -9.676   2.582  -7.232
  729    HE   ARG  90           HE       ARG  90 -11.804   1.070  -8.422
  730   HH11  ARG  90          HH11      ARG  90 -10.242   4.220  -8.137
  731   HH12  ARG  90          HH12      ARG  90 -11.049   4.970  -9.424
  732   HH21  ARG  90          HH21      ARG  90 -12.976   2.050 -10.258
  733   HH22  ARG  90          HH22      ARG  90 -12.653   3.654 -10.687
  734    H    GLY  91           HN       GLY  91  -8.533   2.460  -2.452
  735    HA2  GLY  91           HA3      GLY  91  -8.449   0.170  -0.670
  736    HA3  GLY  91           HA2      GLY  91  -7.307   1.510  -0.686
  737    H    GLN  92           HN       GLN  92  -8.632   3.758  -0.308
  738    HA   GLN  92           HA       GLN  92 -10.226   3.090   2.026
  739    HB2  GLN  92           HB2      GLN  92  -9.536   5.098   3.177
  740    HB3  GLN  92           HB1      GLN  92  -8.163   4.084   2.786
  741    HG2  GLN  92           HG2      GLN  92  -7.531   5.587   0.989
  742    HG3  GLN  92           HG1      GLN  92  -8.975   6.561   1.279
  743   HE21  GLN  92          HE21      GLN  92  -8.785   6.338   4.184
  744   HE22  GLN  92          HE22      GLN  92  -7.458   7.331   4.647
  745    H    ARG  93           HN       ARG  93 -12.057   3.676   2.235
  746    HA   ARG  93           HA       ARG  93 -13.111   6.021   0.840
  747    HB2  ARG  93           HB2      ARG  93 -15.312   4.867   0.501
  748    HB3  ARG  93           HB1      ARG  93 -14.012   4.144  -0.420
  749    HG2  ARG  93           HG2      ARG  93 -14.992   3.017   2.195
  750    HG3  ARG  93           HG1      ARG  93 -15.686   2.568   0.640
  751    HD2  ARG  93           HD2      ARG  93 -13.512   1.719  -0.091
  752    HD3  ARG  93           HD1      ARG  93 -12.782   2.205   1.437
  753    HE   ARG  93           HE       ARG  93 -15.052   0.447   1.616
  754   HH11  ARG  93          HH11      ARG  93 -11.451   0.537   1.522
  755   HH12  ARG  93          HH12      ARG  93 -11.301  -1.001   2.182
  756   HH21  ARG  93          HH21      ARG  93 -14.770  -1.657   2.511
  757   HH22  ARG  93          HH22      ARG  93 -13.204  -2.278   2.764
  758    H    GLU  94           HN       GLU  94 -12.997   3.945   3.512
  759    HA   GLU  94           HA       GLU  94 -13.367   4.056   5.613
  760    HB2  GLU  94           HB3      GLU  94 -13.160   7.022   5.206
  761    HB3  GLU  94           HB2      GLU  94 -13.070   6.212   6.764
  762    HG2  GLU  94           HG3      GLU  94 -11.114   4.938   5.943
  763    HG3  GLU  94           HG2      GLU  94 -11.179   5.875   4.451
  764    H    ASP  95           HN       ASP  95 -15.230   7.002   5.121
  765    HA   ASP  95           HA       ASP  95 -17.737   5.752   5.607
  766    HB2  ASP  95           HB2      ASP  95 -16.907   5.379   7.817
  767    HB3  ASP  95           HB1      ASP  95 -16.262   7.007   7.921
  768    H    LEU  96           HN       LEU  96 -19.364   7.140   5.142
  769    HA   LEU  96           HA       LEU  96 -20.545   8.856   4.603
  770    HB2  LEU  96           HB2      LEU  96 -19.933   9.740   6.763
  771    HB3  LEU  96           HB1      LEU  96 -18.529  10.525   6.059
  772    HG   LEU  96           HG       LEU  96 -20.154  11.740   4.537
  773   HD11  LEU  96          HD11      LEU  96 -22.440  12.025   5.363
  774   HD12  LEU  96          HD12      LEU  96 -22.146  10.772   6.568
  775   HD13  LEU  96          HD13      LEU  96 -22.093  10.376   4.849
  776   HD21  LEU  96          HD21      LEU  96 -20.665  13.457   6.237
  777   HD22  LEU  96          HD22      LEU  96 -19.005  12.876   6.344
  778   HD23  LEU  96          HD23      LEU  96 -20.214  12.312   7.501
  779    H    VAL  97           HN       VAL  97 -20.895  10.153   2.971
  780    HA   VAL  97           HA       VAL  97 -18.561  10.930   1.400
  781    HB   VAL  97           HB       VAL  97 -20.056   9.374   0.296
  782   HG11  VAL  97          HG11      VAL  97 -22.208   9.947   1.179
  783   HG12  VAL  97          HG12      VAL  97 -22.275  10.051  -0.581
  784   HG13  VAL  97          HG13      VAL  97 -22.165  11.520   0.386
  785   HG21  VAL  97          HG21      VAL  97 -18.724  10.800  -1.100
  786   HG22  VAL  97          HG22      VAL  97 -19.939  12.074  -1.031
  787   HG23  VAL  97          HG23      VAL  97 -20.292  10.567  -1.874
  788    H    ARG  98           HN       ARG  98 -21.783  12.130   2.328
  789    HA   ARG  98           HA       ARG  98 -20.713  14.801   2.538
  790    HB2  ARG  98           HB2      ARG  98 -22.873  14.105   0.533
  791    HB3  ARG  98           HB1      ARG  98 -22.700  15.732   1.168
  792    HG2  ARG  98           HG2      ARG  98 -20.467  15.896   0.254
  793    HG3  ARG  98           HG1      ARG  98 -20.529  14.220  -0.271
  794    HD2  ARG  98           HD2      ARG  98 -20.883  15.759  -2.123
  795    HD3  ARG  98           HD1      ARG  98 -22.292  14.759  -1.846
  796    HE   ARG  98           HE       ARG  98 -23.309  16.709  -0.749
  797   HH11  ARG  98          HH11      ARG  98 -20.537  17.315  -2.864
  798   HH12  ARG  98          HH12      ARG  98 -20.994  18.835  -3.381
  799   HH21  ARG  98          HH21      ARG  98 -24.066  18.840  -1.469
  800   HH22  ARG  98          HH22      ARG  98 -23.129  19.743  -2.552
  801    H    ASP  99           HN       ASP  99 -24.049  13.530   2.330
  802    HA   ASP  99           HA       ASP  99 -24.350  14.137   5.180
  803    HB2  ASP  99           HB2      ASP  99 -25.186  16.127   4.087
  804    HB3  ASP  99           HB1      ASP  99 -26.149  15.169   2.973
  805    H    THR 100           HN       THR 100 -25.196  12.487   6.177
  806    HA   THR 100           HA       THR 100 -26.578  10.854   6.822
  807    HB   THR 100           HB       THR 100 -28.154  11.376   4.291
  808    HG1  THR 100           HG1      THR 100 -28.298  13.236   5.397
  809   HG21  THR 100          HG21      THR 100 -30.033  10.353   5.524
  810   HG22  THR 100          HG22      THR 100 -28.963  10.025   6.884
  811   HG23  THR 100          HG23      THR 100 -28.701   9.211   5.343
  812    H    VAL 101           HN       VAL 101 -25.995  10.528   3.343
  813    HA   VAL 101           HA       VAL 101 -26.090   7.647   3.531
  814    HB   VAL 101           HB       VAL 101 -25.778   7.698   1.062
  815   HG11  VAL 101          HG11      VAL 101 -27.964   9.481   2.141
  816   HG12  VAL 101          HG12      VAL 101 -28.022   7.722   2.036
  817   HG13  VAL 101          HG13      VAL 101 -27.976   8.693   0.563
  818   HG21  VAL 101          HG21      VAL 101 -24.462   9.743   0.877
  819   HG22  VAL 101          HG22      VAL 101 -25.824  10.690   1.467
  820   HG23  VAL 101          HG23      VAL 101 -25.930   9.873  -0.097
  821    H    GLU 102           HN       GLU 102 -24.494   6.335   2.424
  822    HA   GLU 102           HA       GLU 102 -22.524   5.429   2.094
  823    HB2  GLU 102           HB3      GLU 102 -21.888   7.686   1.037
  824    HB3  GLU 102           HB2      GLU 102 -21.143   8.081   2.576
  825    HG2  GLU 102           HG3      GLU 102 -19.440   7.317   1.091
  826    HG3  GLU 102           HG2      GLU 102 -19.703   6.061   2.304
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1  -7.812 -19.982  23.946
    2    H2   GLY   1           HT2      GLY   1  -7.060 -18.518  24.324
    3    H3   GLY   1           HT3      GLY   1  -6.737 -19.269  22.858
    4    HA2  GLY   1           HA2      GLY   1  -9.046 -18.972  22.187
    5    HA3  GLY   1           HA3      GLY   1  -9.323 -18.129  23.707
    6    H    HIS   2           HN       HIS   2 -10.016 -16.406  22.259
    7    HA   HIS   2           HA       HIS   2  -9.862 -14.429  21.286
    8    HB2  HIS   2           HB2      HIS   2  -7.045 -14.407  22.407
    9    HB3  HIS   2           HB1      HIS   2  -7.744 -13.044  21.551
   10    HD1  HIS   2           HD1      HIS   2  -9.270 -11.485  22.921
   11    HD2  HIS   2           HD2      HIS   2  -8.208 -14.964  24.931
   12    HE1  HIS   2           HE1      HIS   2  -9.975 -11.152  25.306
   13    H    MET   3           HN       MET   3  -6.493 -15.208  20.578
   14    HA   MET   3           HA       MET   3  -7.141 -15.494  17.739
   15    HB2  MET   3           HB2      MET   3  -5.038 -13.618  18.864
   16    HB3  MET   3           HB1      MET   3  -5.187 -14.054  17.176
   17    HG2  MET   3           HG2      MET   3  -7.358 -12.930  17.087
   18    HG3  MET   3           HG1      MET   3  -7.206 -12.517  18.797
   19    HE1  MET   3           HE1      MET   3  -7.765 -10.347  16.518
   20    HE2  MET   3           HE2      MET   3  -6.668  -9.051  16.992
   21    HE3  MET   3           HE3      MET   3  -7.594  -9.916  18.220
   22    H    LEU   4           HN       LEU   4  -5.605 -16.731  16.676
   23    HA   LEU   4           HA       LEU   4  -3.543 -17.994  18.356
   24    HB2  LEU   4           HB2      LEU   4  -4.794 -18.939  15.759
   25    HB3  LEU   4           HB1      LEU   4  -3.576 -19.805  16.664
   26    HG   LEU   4           HG       LEU   4  -6.413 -19.280  17.553
   27   HD11  LEU   4          HD11      LEU   4  -6.241 -20.948  15.795
   28   HD12  LEU   4          HD12      LEU   4  -6.677 -21.690  17.334
   29   HD13  LEU   4          HD13      LEU   4  -5.027 -21.824  16.726
   30   HD21  LEU   4          HD21      LEU   4  -4.203 -20.818  18.922
   31   HD22  LEU   4          HD22      LEU   4  -5.884 -20.724  19.455
   32   HD23  LEU   4          HD23      LEU   4  -4.879 -19.279  19.460
   33    H    ARG   5           HN       ARG   5  -1.874 -18.868  16.288
   34    HA   ARG   5           HA       ARG   5  -0.646 -16.441  15.424
   35    HB2  ARG   5           HB2      ARG   5   0.946 -17.815  14.204
   36    HB3  ARG   5           HB1      ARG   5   0.671 -18.541  15.775
   37    HG2  ARG   5           HG2      ARG   5  -0.842 -20.172  14.729
   38    HG3  ARG   5           HG1      ARG   5  -0.501 -19.446  13.157
   39    HD2  ARG   5           HD2      ARG   5   1.915 -19.935  13.541
   40    HD3  ARG   5           HD1      ARG   5   1.445 -20.805  15.002
   41    HE   ARG   5           HE       ARG   5   0.149 -21.618  12.560
   42   HH11  ARG   5          HH11      ARG   5   2.788 -22.255  14.827
   43   HH12  ARG   5          HH12      ARG   5   3.036 -23.850  14.270
   44   HH21  ARG   5          HH21      ARG   5   0.526 -23.796  11.807
   45   HH22  ARG   5          HH22      ARG   5   1.752 -24.731  12.525
   46    H    THR   6           HN       THR   6  -3.114 -18.425  14.205
   47    HA   THR   6           HA       THR   6  -3.081 -17.169  11.614
   48    HB   THR   6           HB       THR   6  -4.994 -18.866  11.299
   49    HG1  THR   6           HG1      THR   6  -4.438 -20.748  12.799
   50   HG21  THR   6          HG21      THR   6  -2.792 -19.128  10.267
   51   HG22  THR   6          HG22      THR   6  -3.409 -20.685  10.819
   52   HG23  THR   6          HG23      THR   6  -2.176 -19.843  11.756
   53    H    ALA   7           HN       ALA   7  -4.523 -15.522  11.265
   54    HA   ALA   7           HA       ALA   7  -6.972 -15.344  12.752
   55    HB1  ALA   7           HB1      ALA   7  -6.496 -13.118  13.684
   56    HB2  ALA   7           HB2      ALA   7  -4.838 -13.227  13.087
   57    HB3  ALA   7           HB3      ALA   7  -5.397 -14.334  14.338
   58    H    GLY   8           HN       GLY   8  -8.227 -13.449  12.007
   59    HA2  GLY   8           HA3      GLY   8  -7.980 -13.068   9.164
   60    HA3  GLY   8           HA2      GLY   8  -9.199 -12.362  10.224
   61    H    ARG   9           HN       ARG   9  -6.034 -11.985   8.879
   62    HA   ARG   9           HA       ARG   9  -6.030  -9.188   9.714
   63    HB2  ARG   9           HB2      ARG   9  -4.851 -10.618  11.425
   64    HB3  ARG   9           HB1      ARG   9  -3.698 -11.047  10.182
   65    HG2  ARG   9           HG2      ARG   9  -2.971  -8.767  10.010
   66    HG3  ARG   9           HG1      ARG   9  -4.208  -8.255  11.164
   67    HD2  ARG   9           HD2      ARG   9  -3.199  -9.811  12.824
   68    HD3  ARG   9           HD1      ARG   9  -1.898 -10.108  11.671
   69    HE   ARG   9           HE       ARG   9  -2.024  -7.384  11.964
   70   HH11  ARG   9          HH11      ARG   9  -1.413 -10.120  14.112
   71   HH12  ARG   9          HH12      ARG   9  -0.516  -9.194  15.234
   72   HH21  ARG   9          HH21      ARG   9  -0.845  -6.161  13.443
   73   HH22  ARG   9          HH22      ARG   9  -0.183  -6.874  14.856
   74    H    ASP  10           HN       ASP  10  -3.853 -11.595   8.311
   75    HA   ASP  10           HA       ASP  10  -2.793 -11.843   6.400
   76    HB2  ASP  10           HB2      ASP  10  -5.189 -10.423   5.239
   77    HB3  ASP  10           HB1      ASP  10  -3.991 -11.302   4.297
   78    H    GLY  11           HN       GLY  11  -4.098  -8.817   5.194
   79    HA2  GLY  11           HA3      GLY  11  -3.062  -6.808   4.767
   80    HA3  GLY  11           HA2      GLY  11  -1.652  -7.372   5.657
   81    H    LEU  12           HN       LEU  12  -0.637  -9.294   4.565
   82    HA   LEU  12           HA       LEU  12   0.839  -8.573   2.359
   83    HB2  LEU  12           HB2      LEU  12   1.472 -10.333   3.901
   84    HB3  LEU  12           HB1      LEU  12   0.126 -11.313   3.385
   85    HG   LEU  12           HG       LEU  12   1.186 -11.538   1.158
   86   HD11  LEU  12          HD11      LEU  12   2.483  -9.508   1.141
   87   HD12  LEU  12          HD12      LEU  12   3.511 -10.913   0.874
   88   HD13  LEU  12          HD13      LEU  12   3.495 -10.113   2.452
   89   HD21  LEU  12          HD21      LEU  12   1.490 -13.250   2.842
   90   HD22  LEU  12          HD22      LEU  12   2.879 -12.382   3.501
   91   HD23  LEU  12          HD23      LEU  12   2.954 -13.063   1.874
   92    H    CYS  13           HN       CYS  13  -2.112 -10.461   2.436
   93    HA   CYS  13           HA       CYS  13  -2.108 -11.339  -0.221
   94    HB2  CYS  13           HB2      CYS  13  -3.442 -12.392   1.545
   95    HB3  CYS  13           HB1      CYS  13  -4.421 -10.937   1.677
   96    HG   CYS  13           HG       CYS  13  -5.469 -11.214  -0.935
   97    H    ARG  14           HN       ARG  14  -4.058  -8.714   1.273
   98    HA   ARG  14           HA       ARG  14  -5.074  -7.801  -1.201
   99    HB2  ARG  14           HB2      ARG  14  -6.223  -7.384   0.895
  100    HB3  ARG  14           HB1      ARG  14  -4.862  -6.446   1.488
  101    HG2  ARG  14           HG2      ARG  14  -5.275  -4.744  -0.176
  102    HG3  ARG  14           HG1      ARG  14  -6.575  -5.717  -0.864
  103    HD2  ARG  14           HD2      ARG  14  -6.524  -4.677   1.959
  104    HD3  ARG  14           HD1      ARG  14  -7.369  -3.896   0.623
  105    HE   ARG  14           HE       ARG  14  -8.402  -6.308   0.507
  106   HH11  ARG  14          HH11      ARG  14  -7.831  -4.291   3.381
  107   HH12  ARG  14          HH12      ARG  14  -9.212  -4.862   4.197
  108   HH21  ARG  14          HH21      ARG  14 -10.301  -7.052   1.684
  109   HH22  ARG  14          HH22      ARG  14 -10.620  -6.416   3.241
  110    H    LEU  15           HN       LEU  15  -2.299  -6.956   0.720
  111    HA   LEU  15           HA       LEU  15  -1.503  -4.583  -0.413
  112    HB2  LEU  15           HB2      LEU  15  -0.625  -5.572   1.622
  113    HB3  LEU  15           HB1      LEU  15   0.114  -6.853   0.699
  114    HG   LEU  15           HG       LEU  15   1.678  -5.252  -0.291
  115   HD11  LEU  15          HD11      LEU  15   0.214  -3.283  -0.252
  116   HD12  LEU  15          HD12      LEU  15   1.762  -2.983   0.533
  117   HD13  LEU  15          HD13      LEU  15   0.325  -3.260   1.510
  118   HD21  LEU  15          HD21      LEU  15   2.254  -6.383   1.771
  119   HD22  LEU  15          HD22      LEU  15   1.464  -5.110   2.698
  120   HD23  LEU  15          HD23      LEU  15   2.906  -4.743   1.750
  121    H    SER  16           HN       SER  16  -0.539  -7.910  -1.359
  122    HA   SER  16           HA       SER  16   1.145  -7.001  -3.442
  123    HB2  SER  16           HB2      SER  16   1.024  -9.478  -4.138
  124    HB3  SER  16           HB1      SER  16   1.703  -9.110  -2.551
  125    HG   SER  16           HG       SER  16  -0.034  -9.923  -1.594
  126    H    THR  17           HN       THR  17  -2.200  -8.006  -3.342
  127    HA   THR  17           HA       THR  17  -2.720  -8.194  -6.070
  128    HB   THR  17           HB       THR  17  -4.531  -7.407  -3.777
  129    HG1  THR  17           HG1      THR  17  -3.896  -9.899  -4.976
  130   HG21  THR  17          HG21      THR  17  -6.361  -8.276  -5.160
  131   HG22  THR  17          HG22      THR  17  -5.222  -8.594  -6.469
  132   HG23  THR  17          HG23      THR  17  -5.558  -6.932  -5.976
  133    H    TYR  18           HN       TYR  18  -2.701  -5.376  -3.931
  134    HA   TYR  18           HA       TYR  18  -3.642  -3.679  -6.076
  135    HB2  TYR  18           HB2      TYR  18  -2.924  -3.158  -3.221
  136    HB3  TYR  18           HB1      TYR  18  -3.177  -1.828  -4.348
  137    HD1  TYR  18           HD2      TYR  18  -4.841  -4.847  -2.930
  138    HD2  TYR  18           HD1      TYR  18  -5.315  -1.075  -4.809
  139    HE1  TYR  18           HE2      TYR  18  -7.277  -4.964  -2.561
  140    HE2  TYR  18           HE1      TYR  18  -7.719  -1.200  -4.443
  141    HH   TYR  18           HH       TYR  18  -9.105  -3.357  -2.321
  142    H    LEU  19           HN       LEU  19  -0.596  -4.342  -4.496
  143    HA   LEU  19           HA       LEU  19   0.805  -2.209  -5.681
  144    HB2  LEU  19           HB2      LEU  19   1.779  -4.821  -4.560
  145    HB3  LEU  19           HB1      LEU  19   2.858  -3.592  -5.177
  146    HG   LEU  19           HG       LEU  19   0.978  -3.239  -2.827
  147   HD11  LEU  19          HD11      LEU  19   3.014  -3.208  -1.502
  148   HD12  LEU  19          HD12      LEU  19   3.969  -3.568  -2.941
  149   HD13  LEU  19          HD13      LEU  19   2.804  -4.748  -2.330
  150   HD21  LEU  19          HD21      LEU  19   1.322  -1.150  -4.020
  151   HD22  LEU  19          HD22      LEU  19   3.065  -1.401  -4.003
  152   HD23  LEU  19          HD23      LEU  19   2.198  -1.135  -2.495
  153    H    GLU  20           HN       GLU  20  -0.300  -5.137  -7.054
  154    HA   GLU  20           HA       GLU  20   1.724  -5.282  -9.059
  155    HB2  GLU  20           HB3      GLU  20   0.464  -7.000 -10.090
  156    HB3  GLU  20           HB2      GLU  20   0.329  -7.234  -8.353
  157    HG2  GLU  20           HG3      GLU  20  -1.869  -6.288  -8.360
  158    HG3  GLU  20           HG2      GLU  20  -1.725  -5.919 -10.081
  159    H    GLU  21           HN       GLU  21  -0.865  -3.180  -8.643
  160    HA   GLU  21           HA       GLU  21  -1.026  -2.691 -11.492
  161    HB2  GLU  21           HB3      GLU  21  -2.684  -1.654  -9.209
  162    HB3  GLU  21           HB2      GLU  21  -2.823  -0.997 -10.840
  163    HG2  GLU  21           HG3      GLU  21  -3.303  -3.347 -11.614
  164    HG3  GLU  21           HG2      GLU  21  -3.397  -3.789  -9.911
  165    H    LEU  22           HN       LEU  22   1.174  -1.987  -9.462
  166    HA   LEU  22           HA       LEU  22   1.545   0.747 -10.429
  167    HB2  LEU  22           HB2      LEU  22   3.108  -0.800  -8.352
  168    HB3  LEU  22           HB1      LEU  22   3.493   0.811  -8.888
  169    HG   LEU  22           HG       LEU  22   1.061  -0.020  -7.317
  170   HD11  LEU  22          HD11      LEU  22   3.048   0.033  -5.972
  171   HD12  LEU  22          HD12      LEU  22   2.099   1.485  -5.611
  172   HD13  LEU  22          HD13      LEU  22   3.513   1.589  -6.648
  173   HD21  LEU  22          HD21      LEU  22   0.543   2.374  -7.226
  174   HD22  LEU  22          HD22      LEU  22   0.487   1.763  -8.876
  175   HD23  LEU  22          HD23      LEU  22   1.877   2.706  -8.328
  176    H    GLU  23           HN       GLU  23   3.161   1.188 -11.790
  177    HA   GLU  23           HA       GLU  23   4.332  -0.970 -13.293
  178    HB2  GLU  23           HB3      GLU  23   4.835   2.002 -13.442
  179    HB3  GLU  23           HB2      GLU  23   5.306   0.801 -14.620
  180    HG2  GLU  23           HG3      GLU  23   2.491   1.512 -13.902
  181    HG3  GLU  23           HG2      GLU  23   3.383   2.031 -15.336
  182    H    ALA  24           HN       ALA  24   6.765  -0.736 -13.793
  183    HA   ALA  24           HA       ALA  24   8.281  -1.091 -11.471
  184    HB1  ALA  24           HB1      ALA  24  10.238  -1.019 -12.955
  185    HB2  ALA  24           HB2      ALA  24   9.246  -0.338 -14.241
  186    HB3  ALA  24           HB3      ALA  24   8.944  -1.980 -13.669
  187    H    VAL  25           HN       VAL  25   7.824   1.695 -13.548
  188    HA   VAL  25           HA       VAL  25   9.536   3.436 -12.141
  189    HB   VAL  25           HB       VAL  25   8.858   3.979 -14.427
  190   HG11  VAL  25          HG11      VAL  25   6.607   4.711 -14.998
  191   HG12  VAL  25          HG12      VAL  25   6.088   4.391 -13.347
  192   HG13  VAL  25          HG13      VAL  25   6.587   3.051 -14.385
  193   HG21  VAL  25          HG21      VAL  25   7.798   5.979 -12.465
  194   HG22  VAL  25          HG22      VAL  25   8.162   6.322 -14.152
  195   HG23  VAL  25          HG23      VAL  25   9.468   5.877 -13.035
  196    H    GLU  26           HN       GLU  26   6.128   2.665 -11.744
  197    HA   GLU  26           HA       GLU  26   5.590   4.769  -9.891
  198    HB2  GLU  26           HB3      GLU  26   4.047   2.220 -10.370
  199    HB3  GLU  26           HB2      GLU  26   3.442   3.610  -9.489
  200    HG2  GLU  26           HG3      GLU  26   4.146   3.483 -12.418
  201    HG3  GLU  26           HG2      GLU  26   2.519   3.543 -11.738
  202    H    LEU  27           HN       LEU  27   6.404   1.359  -9.614
  203    HA   LEU  27           HA       LEU  27   6.252   1.089  -6.837
  204    HB2  LEU  27           HB2      LEU  27   8.078  -0.238  -8.844
  205    HB3  LEU  27           HB1      LEU  27   8.008  -0.707  -7.161
  206    HG   LEU  27           HG       LEU  27   5.651  -0.864  -9.051
  207   HD11  LEU  27          HD11      LEU  27   7.423  -2.374  -9.771
  208   HD12  LEU  27          HD12      LEU  27   6.073  -3.269  -9.083
  209   HD13  LEU  27          HD13      LEU  27   7.546  -3.031  -8.141
  210   HD21  LEU  27          HD21      LEU  27   6.121  -2.017  -6.302
  211   HD22  LEU  27          HD22      LEU  27   4.702  -2.301  -7.310
  212   HD23  LEU  27          HD23      LEU  27   5.033  -0.683  -6.692
  213    H    LYS  28           HN       LYS  28   8.876   2.140  -8.922
  214    HA   LYS  28           HA       LYS  28  10.882   2.531  -7.030
  215    HB2  LYS  28           HB2      LYS  28  11.191   2.628  -9.468
  216    HB3  LYS  28           HB1      LYS  28  10.298   4.137  -9.512
  217    HG2  LYS  28           HG2      LYS  28  12.028   5.202  -8.162
  218    HG3  LYS  28           HG1      LYS  28  12.923   3.681  -8.119
  219    HD2  LYS  28           HD2      LYS  28  13.122   3.704 -10.536
  220    HD3  LYS  28           HD1      LYS  28  12.177   5.190 -10.612
  221    HE2  LYS  28           HE2      LYS  28  13.906   6.329  -9.294
  222    HE3  LYS  28           HE1      LYS  28  14.843   4.839  -9.268
  223    HZ1  LYS  28           HZ1      LYS  28  15.037   4.936 -11.647
  224    HZ2  LYS  28           HZ2      LYS  28  15.556   6.415 -11.005
  225    HZ3  LYS  28           HZ3      LYS  28  14.054   6.292 -11.721
  226    H    LYS  29           HN       LYS  29   8.322   4.721  -8.044
  227    HA   LYS  29           HA       LYS  29   9.069   6.955  -6.466
  228    HB2  LYS  29           HB2      LYS  29   6.308   6.106  -7.278
  229    HB3  LYS  29           HB1      LYS  29   6.782   7.732  -6.820
  230    HG2  LYS  29           HG2      LYS  29   8.283   7.765  -8.855
  231    HG3  LYS  29           HG1      LYS  29   7.555   6.232  -9.310
  232    HD2  LYS  29           HD2      LYS  29   5.337   7.283  -9.303
  233    HD3  LYS  29           HD1      LYS  29   6.083   8.827  -8.901
  234    HE2  LYS  29           HE2      LYS  29   6.580   7.209 -11.397
  235    HE3  LYS  29           HE1      LYS  29   5.595   8.659 -11.280
  236    HZ1  LYS  29           HZ1      LYS  29   8.523   8.555 -10.749
  237    HZ2  LYS  29           HZ2      LYS  29   7.559   9.936 -10.718
  238    HZ3  LYS  29           HZ3      LYS  29   7.803   9.121 -12.160
  239    H    PHE  30           HN       PHE  30   6.696   4.421  -6.007
  240    HA   PHE  30           HA       PHE  30   5.722   5.014  -3.508
  241    HB2  PHE  30           HB2      PHE  30   4.439   3.441  -4.525
  242    HB3  PHE  30           HB1      PHE  30   5.800   2.715  -5.337
  243    HD1  PHE  30           HD2      PHE  30   3.765   2.675  -2.214
  244    HD2  PHE  30           HD1      PHE  30   6.824   0.809  -4.495
  245    HE1  PHE  30           HE2      PHE  30   3.581   0.682  -0.822
  246    HE2  PHE  30           HE1      PHE  30   6.634  -1.210  -3.092
  247    HZ   PHE  30           HZ       PHE  30   5.004  -1.264  -1.253
  248    H    LYS  31           HN       LYS  31   8.535   3.027  -4.300
  249    HA   LYS  31           HA       LYS  31   9.075   2.278  -1.585
  250    HB2  LYS  31           HB2      LYS  31  11.037   2.383  -3.840
  251    HB3  LYS  31           HB1      LYS  31  11.149   1.458  -2.344
  252    HG2  LYS  31           HG2      LYS  31   9.299   0.054  -3.050
  253    HG3  LYS  31           HG1      LYS  31   9.140   1.001  -4.530
  254    HD2  LYS  31           HD2      LYS  31  11.541  -0.629  -3.712
  255    HD3  LYS  31           HD1      LYS  31  10.361  -1.080  -4.942
  256    HE2  LYS  31           HE2      LYS  31  11.011   0.823  -6.275
  257    HE3  LYS  31           HE1      LYS  31  12.181   1.349  -5.050
  258    HZ1  LYS  31           HZ1      LYS  31  12.996  -1.103  -5.462
  259    HZ2  LYS  31           HZ2      LYS  31  13.565   0.176  -6.350
  260    HZ3  LYS  31           HZ3      LYS  31  12.335  -0.816  -6.993
  261    H    LEU  32           HN       LEU  32  10.277   4.936  -3.633
  262    HA   LEU  32           HA       LEU  32  12.147   5.650  -1.581
  263    HB2  LEU  32           HB2      LEU  32  12.675   7.613  -2.883
  264    HB3  LEU  32           HB1      LEU  32  12.597   6.235  -3.943
  265    HG   LEU  32           HG       LEU  32  10.196   7.122  -4.515
  266   HD11  LEU  32          HD11      LEU  32  10.026   8.799  -2.776
  267   HD12  LEU  32          HD12      LEU  32   9.945   9.536  -4.379
  268   HD13  LEU  32          HD13      LEU  32  11.429   9.643  -3.433
  269   HD21  LEU  32          HD21      LEU  32  12.688   8.544  -5.374
  270   HD22  LEU  32          HD22      LEU  32  11.152   8.558  -6.250
  271   HD23  LEU  32          HD23      LEU  32  12.058   7.050  -6.065
  272    H    TYR  33           HN       TYR  33   8.885   6.397  -2.306
  273    HA   TYR  33           HA       TYR  33   8.701   8.622  -0.626
  274    HB2  TYR  33           HB2      TYR  33   6.952   8.102  -2.303
  275    HB3  TYR  33           HB1      TYR  33   6.494   6.681  -1.364
  276    HD1  TYR  33           HD1      TYR  33   5.298   6.901   0.721
  277    HD2  TYR  33           HD2      TYR  33   6.480  10.321  -1.482
  278    HE1  TYR  33           HE1      TYR  33   3.894   8.268   2.167
  279    HE2  TYR  33           HE2      TYR  33   5.064  11.742  -0.044
  280    HH   TYR  33           HH       TYR  33   4.062  10.796   2.847
  281    H    LEU  34           HN       LEU  34   7.780   5.246   0.019
  282    HA   LEU  34           HA       LEU  34   7.512   5.966   2.825
  283    HB2  LEU  34           HB2      LEU  34   6.682   3.621   3.101
  284    HB3  LEU  34           HB1      LEU  34   5.719   4.692   2.112
  285    HG   LEU  34           HG       LEU  34   6.671   3.557   0.088
  286   HD11  LEU  34          HD11      LEU  34   8.677   2.579   1.027
  287   HD12  LEU  34          HD12      LEU  34   7.630   1.324   0.354
  288   HD13  LEU  34          HD13      LEU  34   7.705   1.572   2.098
  289   HD21  LEU  34          HD21      LEU  34   4.484   3.070   0.945
  290   HD22  LEU  34          HD22      LEU  34   5.177   1.854   2.040
  291   HD23  LEU  34          HD23      LEU  34   5.275   1.635   0.287
  292    H    GLY  35           HN       GLY  35   9.840   4.313   0.900
  293    HA2  GLY  35           HA3      GLY  35  10.824   2.656   2.950
  294    HA3  GLY  35           HA2      GLY  35  11.663   3.056   1.455
  295    H    THR  36           HN       THR  36  11.936   5.706   1.700
  296    HA   THR  36           HA       THR  36  13.717   5.907   4.021
  297    HB   THR  36           HB       THR  36  14.920   5.865   1.862
  298    HG1  THR  36           HG1      THR  36  15.232   7.723   3.693
  299   HG21  THR  36          HG21      THR  36  13.192   6.807   0.389
  300   HG22  THR  36          HG22      THR  36  14.703   7.677   0.208
  301   HG23  THR  36          HG23      THR  36  13.393   8.383   1.150
  302    H    ALA  37           HN       ALA  37  10.862   6.518   3.760
  303    HA   ALA  37           HA       ALA  37  10.278   9.270   3.685
  304    HB1  ALA  37           HB1      ALA  37   8.875   7.070   5.158
  305    HB2  ALA  37           HB2      ALA  37   8.533   7.657   3.520
  306    HB3  ALA  37           HB3      ALA  37   8.244   8.699   4.913
  307    H    THR  38           HN       THR  38  10.815  10.835   4.996
  308    HA   THR  38           HA       THR  38  11.875  10.413   7.579
  309    HB   THR  38           HB       THR  38  11.526  12.974   7.674
  310    HG1  THR  38           HG1      THR  38  11.391  12.838   4.884
  311   HG21  THR  38          HG21      THR  38  13.278  11.726   5.543
  312   HG22  THR  38          HG22      THR  38  13.699  11.919   7.244
  313   HG23  THR  38          HG23      THR  38  13.483  13.340   6.223
  314    H    GLU  39           HN       GLU  39   8.758  10.631   6.352
  315    HA   GLU  39           HA       GLU  39   7.282  11.697   8.541
  316    HB2  GLU  39           HB3      GLU  39   6.420   9.679   6.481
  317    HB3  GLU  39           HB2      GLU  39   5.348  10.579   7.542
  318    HG2  GLU  39           HG3      GLU  39   6.065  12.651   6.496
  319    HG3  GLU  39           HG2      GLU  39   7.148  11.723   5.449
  320    H    LEU  40           HN       LEU  40   8.802   8.716   8.012
  321    HA   LEU  40           HA       LEU  40   7.270   7.213  10.001
  322    HB2  LEU  40           HB2      LEU  40   9.763   6.511   8.505
  323    HB3  LEU  40           HB1      LEU  40   8.813   5.428   9.484
  324    HG   LEU  40           HG       LEU  40   8.000   6.709   6.883
  325   HD11  LEU  40          HD11      LEU  40   8.657   3.862   7.592
  326   HD12  LEU  40          HD12      LEU  40   9.631   4.963   6.615
  327   HD13  LEU  40          HD13      LEU  40   8.059   4.420   6.032
  328   HD21  LEU  40          HD21      LEU  40   6.045   6.429   8.332
  329   HD22  LEU  40          HD22      LEU  40   6.455   4.724   8.562
  330   HD23  LEU  40          HD23      LEU  40   6.022   5.329   6.957
  331    H    GLY  41           HN       GLY  41   9.767   9.308   9.849
  332    HA2  GLY  41           HA3      GLY  41  10.774  10.074  11.923
  333    HA3  GLY  41           HA2      GLY  41  10.965   8.369  12.360
  334    H    GLU  42           HN       GLU  42  12.128   7.069  10.691
  335    HA   GLU  42           HA       GLU  42  14.269   8.655   9.582
  336    HB2  GLU  42           HB3      GLU  42  15.515   6.266  10.017
  337    HB3  GLU  42           HB2      GLU  42  15.616   7.667  11.068
  338    HG2  GLU  42           HG3      GLU  42  15.162   5.770  12.431
  339    HG3  GLU  42           HG2      GLU  42  13.725   6.793  12.326
  340    H    GLY  43           HN       GLY  43  12.705   5.498   9.283
  341    HA2  GLY  43           HA3      GLY  43  11.795   5.233   6.895
  342    HA3  GLY  43           HA2      GLY  43  13.486   5.474   6.446
  343    H    LYS  44           HN       LYS  44  11.218   3.208   7.092
  344    HA   LYS  44           HA       LYS  44  12.804   1.382   8.608
  345    HB2  LYS  44           HB2      LYS  44  10.066   1.260   7.438
  346    HB3  LYS  44           HB1      LYS  44  10.851  -0.234   7.917
  347    HG2  LYS  44           HG2      LYS  44   9.377   0.637   9.673
  348    HG3  LYS  44           HG1      LYS  44  11.053   0.568  10.201
  349    HD2  LYS  44           HD2      LYS  44  11.245   2.999   9.736
  350    HD3  LYS  44           HD1      LYS  44   9.532   3.020   9.321
  351    HE2  LYS  44           HE2      LYS  44   8.926   2.346  11.543
  352    HE3  LYS  44           HE1      LYS  44  10.610   2.121  11.994
  353    HZ1  LYS  44           HZ1      LYS  44  10.942   4.521  11.592
  354    HZ2  LYS  44           HZ2      LYS  44   9.837   4.199  12.827
  355    HZ3  LYS  44           HZ3      LYS  44   9.276   4.691  11.335
  356    H    ILE  45           HN       ILE  45  12.520   1.966   5.241
  357    HA   ILE  45           HA       ILE  45  13.367  -0.745   4.653
  358    HB   ILE  45           HB       ILE  45  12.674   1.528   2.779
  359   HG12  ILE  45          HG12      ILE  45  10.721   0.569   3.924
  360   HG13  ILE  45          HG11      ILE  45  10.694   0.180   2.210
  361   HG21  ILE  45          HG21      ILE  45  12.818  -0.100   0.949
  362   HG22  ILE  45          HG22      ILE  45  13.436  -1.306   2.083
  363   HG23  ILE  45          HG23      ILE  45  14.375   0.138   1.742
  364   HD11  ILE  45          HD11      ILE  45   9.989  -1.715   3.542
  365   HD12  ILE  45          HD12      ILE  45  11.489  -1.667   4.458
  366   HD13  ILE  45          HD13      ILE  45  11.520  -2.076   2.741
  367    HA   PRO  46           HA       PRO  46  17.615   0.525   4.646
  368    HB2  PRO  46           HB2      PRO  46  18.650  -1.843   3.860
  369    HB3  PRO  46           HB1      PRO  46  18.041  -1.572   5.495
  370    HG2  PRO  46           HG2      PRO  46  16.688  -2.888   3.173
  371    HG3  PRO  46           HG1      PRO  46  16.750  -3.421   4.869
  372    HD2  PRO  46           HD2      PRO  46  14.641  -2.158   3.776
  373    HD3  PRO  46           HD1      PRO  46  15.084  -1.966   5.483
  374    H    TRP  47           HN       TRP  47  18.740   1.532   3.192
  375    HA   TRP  47           HA       TRP  47  19.053   2.620   1.267
  376    HB2  TRP  47           HB2      TRP  47  20.955   1.481   0.113
  377    HB3  TRP  47           HB1      TRP  47  21.110   1.704   1.841
  378    HD1  TRP  47           HD1      TRP  47  20.846  -1.037  -0.823
  379    HE1  TRP  47           HE1      TRP  47  21.428  -3.301   0.230
  380    HE3  TRP  47           HE3      TRP  47  21.087   0.401   4.074
  381    HZ2  TRP  47           HZ2      TRP  47  21.939  -4.345   2.812
  382    HZ3  TRP  47           HZ3      TRP  47  21.638  -1.291   5.771
  383    HH2  TRP  47           HH2      TRP  47  22.054  -3.606   5.153
  384    H    GLY  48           HN       GLY  48  18.774  -0.576  -0.010
  385    HA2  GLY  48           HA3      GLY  48  16.826   0.215  -1.965
  386    HA3  GLY  48           HA2      GLY  48  18.431  -0.009  -2.654
  387    H    SER  49           HN       SER  49  17.136  -1.838   0.063
  388    HA   SER  49           HA       SER  49  17.788  -4.311  -1.164
  389    HB2  SER  49           HB2      SER  49  16.055  -3.789   1.251
  390    HB3  SER  49           HB1      SER  49  16.981  -5.249   0.891
  391    HG   SER  49           HG       SER  49  18.815  -4.258   1.364
  392    H    MET  50           HN       MET  50  15.431  -2.322  -1.949
  393    HA   MET  50           HA       MET  50  13.452  -4.388  -2.552
  394    HB2  MET  50           HB2      MET  50  11.847  -2.377  -2.658
  395    HB3  MET  50           HB1      MET  50  12.313  -3.012  -1.098
  396    HG2  MET  50           HG2      MET  50  12.247  -0.543  -1.185
  397    HG3  MET  50           HG1      MET  50  13.809  -1.189  -0.707
  398    HE1  MET  50           HE1      MET  50  14.684   2.151  -2.583
  399    HE2  MET  50           HE2      MET  50  14.847   1.244  -1.078
  400    HE3  MET  50           HE3      MET  50  13.267   1.849  -1.579
  401    H    GLU  51           HN       GLU  51  15.852  -2.978  -4.009
  402    HA   GLU  51           HA       GLU  51  14.674  -1.689  -6.229
  403    HB2  GLU  51           HB3      GLU  51  17.349  -2.837  -5.713
  404    HB3  GLU  51           HB2      GLU  51  16.959  -2.165  -7.294
  405    HG2  GLU  51           HG3      GLU  51  16.770  -0.678  -4.668
  406    HG3  GLU  51           HG2      GLU  51  18.110  -0.546  -5.807
  407    H    LYS  52           HN       LYS  52  15.704  -4.988  -5.756
  408    HA   LYS  52           HA       LYS  52  14.741  -5.671  -8.441
  409    HB2  LYS  52           HB2      LYS  52  16.126  -7.392  -6.373
  410    HB3  LYS  52           HB1      LYS  52  15.752  -7.877  -8.021
  411    HG2  LYS  52           HG2      LYS  52  17.599  -5.631  -7.243
  412    HG3  LYS  52           HG1      LYS  52  18.113  -7.247  -7.726
  413    HD2  LYS  52           HD2      LYS  52  17.169  -6.917  -9.940
  414    HD3  LYS  52           HD1      LYS  52  16.508  -5.356  -9.459
  415    HE2  LYS  52           HE2      LYS  52  18.568  -5.115 -10.777
  416    HE3  LYS  52           HE1      LYS  52  18.744  -4.463  -9.153
  417    HZ1  LYS  52           HZ1      LYS  52  19.707  -7.142 -10.007
  418    HZ2  LYS  52           HZ2      LYS  52  20.000  -6.407  -8.515
  419    HZ3  LYS  52           HZ3      LYS  52  20.658  -5.771  -9.914
  420    H    ALA  53           HN       ALA  53  13.090  -4.948  -6.052
  421    HA   ALA  53           HA       ALA  53  11.595  -7.420  -5.642
  422    HB1  ALA  53           HB1      ALA  53  12.366  -6.314  -3.623
  423    HB2  ALA  53           HB2      ALA  53  10.602  -6.236  -3.712
  424    HB3  ALA  53           HB3      ALA  53  11.582  -4.823  -4.120
  425    H    GLY  54           HN       GLY  54   9.707  -7.645  -6.618
  426    HA2  GLY  54           HA3      GLY  54   8.462  -5.313  -7.878
  427    HA3  GLY  54           HA2      GLY  54   8.175  -6.996  -8.294
  428    HA   PRO  55           HA       PRO  55   4.516  -5.310  -5.901
  429    HB2  PRO  55           HB2      PRO  55   3.413  -7.644  -7.393
  430    HB3  PRO  55           HB1      PRO  55   2.712  -6.043  -7.127
  431    HG2  PRO  55           HG2      PRO  55   3.782  -6.651  -9.472
  432    HG3  PRO  55           HG1      PRO  55   4.034  -5.049  -8.757
  433    HD2  PRO  55           HD2      PRO  55   5.951  -7.347  -8.933
  434    HD3  PRO  55           HD1      PRO  55   6.254  -5.613  -9.030
  435    H    LEU  56           HN       LEU  56   5.461  -8.676  -6.370
  436    HA   LEU  56           HA       LEU  56   4.017  -9.595  -4.012
  437    HB2  LEU  56           HB2      LEU  56   6.121 -11.040  -5.624
  438    HB3  LEU  56           HB1      LEU  56   5.104 -11.758  -4.397
  439    HG   LEU  56           HG       LEU  56   4.220 -10.703  -7.081
  440   HD11  LEU  56          HD11      LEU  56   5.391 -12.826  -7.183
  441   HD12  LEU  56          HD12      LEU  56   3.676 -13.042  -7.530
  442   HD13  LEU  56          HD13      LEU  56   4.322 -13.492  -5.954
  443   HD21  LEU  56          HD21      LEU  56   2.000 -11.602  -6.485
  444   HD22  LEU  56          HD22      LEU  56   2.487 -10.268  -5.445
  445   HD23  LEU  56          HD23      LEU  56   2.583 -11.928  -4.852
  446    H    GLU  57           HN       GLU  57   7.430  -9.384  -4.835
  447    HA   GLU  57           HA       GLU  57   8.450  -9.999  -2.340
  448    HB2  GLU  57           HB3      GLU  57   9.670  -8.101  -4.340
  449    HB3  GLU  57           HB2      GLU  57  10.548  -8.938  -3.084
  450    HG2  GLU  57           HG3      GLU  57  11.057 -10.231  -4.899
  451    HG3  GLU  57           HG2      GLU  57   9.608 -11.066  -4.333
  452    H    MET  58           HN       MET  58   7.495  -6.873  -3.661
  453    HA   MET  58           HA       MET  58   8.344  -5.275  -1.527
  454    HB2  MET  58           HB2      MET  58   6.255  -4.921  -3.629
  455    HB3  MET  58           HB1      MET  58   6.362  -3.743  -2.332
  456    HG2  MET  58           HG2      MET  58   8.812  -4.496  -3.851
  457    HG3  MET  58           HG1      MET  58   7.653  -3.416  -4.603
  458    HE1  MET  58           HE1      MET  58   9.823  -2.339  -0.619
  459    HE2  MET  58           HE2      MET  58  10.008  -3.908  -1.401
  460    HE3  MET  58           HE3      MET  58   8.469  -3.460  -0.655
  461    H    ALA  59           HN       ALA  59   5.250  -6.833  -2.092
  462    HA   ALA  59           HA       ALA  59   3.914  -5.873   0.120
  463    HB1  ALA  59           HB1      ALA  59   2.870  -7.167  -1.692
  464    HB2  ALA  59           HB2      ALA  59   2.459  -7.798  -0.103
  465    HB3  ALA  59           HB3      ALA  59   3.667  -8.625  -1.098
  466    H    GLN  60           HN       GLN  60   6.155  -8.519  -0.171
  467    HA   GLN  60           HA       GLN  60   5.818  -9.477   2.487
  468    HB2  GLN  60           HB2      GLN  60   8.134  -9.895   0.602
  469    HB3  GLN  60           HB1      GLN  60   7.726 -10.883   2.003
  470    HG2  GLN  60           HG2      GLN  60   5.625 -11.527   0.923
  471    HG3  GLN  60           HG1      GLN  60   6.036 -10.514  -0.440
  472   HE21  GLN  60          HE21      GLN  60   5.549 -13.360  -0.312
  473   HE22  GLN  60          HE22      GLN  60   6.939 -14.128  -0.973
  474    H    LEU  61           HN       LEU  61   8.020  -7.246   0.914
  475    HA   LEU  61           HA       LEU  61   9.692  -6.939   3.152
  476    HB2  LEU  61           HB2      LEU  61   9.413  -5.578   0.575
  477    HB3  LEU  61           HB1      LEU  61  10.099  -4.580   1.828
  478    HG   LEU  61           HG       LEU  61  11.862  -6.323   2.179
  479   HD11  LEU  61          HD11      LEU  61  10.701  -7.602  -0.280
  480   HD12  LEU  61          HD12      LEU  61  10.697  -8.274   1.348
  481   HD13  LEU  61          HD13      LEU  61  12.224  -8.036   0.497
  482   HD21  LEU  61          HD21      LEU  61  13.129  -5.805   0.158
  483   HD22  LEU  61          HD22      LEU  61  12.306  -4.385   0.797
  484   HD23  LEU  61          HD23      LEU  61  11.658  -5.222  -0.612
  485    H    LEU  62           HN       LEU  62   6.915  -4.863   2.088
  486    HA   LEU  62           HA       LEU  62   7.223  -3.203   4.330
  487    HB2  LEU  62           HB2      LEU  62   4.725  -3.710   2.691
  488    HB3  LEU  62           HB1      LEU  62   4.838  -2.499   3.943
  489    HG   LEU  62           HG       LEU  62   5.049  -1.273   1.994
  490   HD11  LEU  62          HD11      LEU  62   6.784  -0.631   3.445
  491   HD12  LEU  62          HD12      LEU  62   7.332  -0.519   1.766
  492   HD13  LEU  62          HD13      LEU  62   7.857  -1.862   2.779
  493   HD21  LEU  62          HD21      LEU  62   5.131  -3.017   0.445
  494   HD22  LEU  62          HD22      LEU  62   6.775  -3.434   0.915
  495   HD23  LEU  62          HD23      LEU  62   6.452  -1.893   0.091
  496    H    ILE  63           HN       ILE  63   5.571  -6.279   3.894
  497    HA   ILE  63           HA       ILE  63   4.126  -6.117   6.322
  498    HB   ILE  63           HB       ILE  63   3.888  -7.723   4.162
  499   HG12  ILE  63          HG12      ILE  63   2.278  -7.374   5.986
  500   HG13  ILE  63          HG11      ILE  63   2.210  -8.995   5.326
  501   HG21  ILE  63          HG21      ILE  63   5.275  -9.531   6.128
  502   HG22  ILE  63          HG22      ILE  63   5.900  -9.027   4.566
  503   HG23  ILE  63          HG23      ILE  63   4.461 -10.049   4.652
  504   HD11  ILE  63          HD11      ILE  63   1.982  -9.064   7.726
  505   HD12  ILE  63          HD12      ILE  63   3.469  -8.134   7.921
  506   HD13  ILE  63          HD13      ILE  63   3.535  -9.779   7.276
  507    H    THR  64           HN       THR  64   7.363  -7.130   5.546
  508    HA   THR  64           HA       THR  64   7.851  -8.478   8.008
  509    HB   THR  64           HB       THR  64   9.806  -7.430   5.932
  510    HG1  THR  64           HG1      THR  64   8.528  -9.011   5.029
  511   HG21  THR  64          HG21      THR  64  10.226  -9.457   8.146
  512   HG22  THR  64          HG22      THR  64  10.902  -7.831   8.109
  513   HG23  THR  64          HG23      THR  64  11.402  -9.023   6.907
  514    H    HIS  65           HN       HIS  65   8.295  -5.175   6.907
  515    HA   HIS  65           HA       HIS  65   9.766  -4.528   9.344
  516    HB2  HIS  65           HB2      HIS  65   9.150  -2.851   6.906
  517    HB3  HIS  65           HB1      HIS  65   9.962  -2.221   8.332
  518    HD1  HIS  65           HD1      HIS  65  12.476  -2.630   8.482
  519    HD2  HIS  65           HD2      HIS  65  10.649  -4.800   5.454
  520    HE1  HIS  65           HE1      HIS  65  14.348  -3.662   7.144
  521    H    PHE  66           HN       PHE  66   6.904  -3.244   7.681
  522    HA   PHE  66           HA       PHE  66   6.122  -1.704   9.949
  523    HB2  PHE  66           HB2      PHE  66   4.671  -2.312   7.374
  524    HB3  PHE  66           HB1      PHE  66   4.209  -1.089   8.556
  525    HD1  PHE  66           HD1      PHE  66   6.705  -2.045   6.046
  526    HD2  PHE  66           HD2      PHE  66   5.375   0.981   8.718
  527    HE1  PHE  66           HE1      PHE  66   8.215  -0.449   4.980
  528    HE2  PHE  66           HE2      PHE  66   6.887   2.585   7.638
  529    HZ   PHE  66           HZ       PHE  66   8.322   1.832   5.763
  530    H    GLY  67           HN       GLY  67   4.432  -4.327   8.237
  531    HA2  GLY  67           HA3      GLY  67   3.744  -6.092  10.051
  532    HA3  GLY  67           HA2      GLY  67   2.801  -4.695  10.603
  533    HA   PRO  68           HA       PRO  68   0.631  -7.054   7.091
  534    HB2  PRO  68           HB2      PRO  68  -1.565  -7.362   9.004
  535    HB3  PRO  68           HB1      PRO  68  -0.813  -8.566   7.966
  536    HG2  PRO  68           HG2      PRO  68  -0.477  -8.457  10.647
  537    HG3  PRO  68           HG1      PRO  68   0.745  -9.151   9.554
  538    HD2  PRO  68           HD2      PRO  68   0.692  -6.564  11.012
  539    HD3  PRO  68           HD1      PRO  68   2.080  -7.551  10.520
  540    H    GLU  69           HN       GLU  69  -1.253  -5.349   9.568
  541    HA   GLU  69           HA       GLU  69  -2.927  -4.055   7.702
  542    HB2  GLU  69           HB3      GLU  69  -2.384  -3.114  10.511
  543    HB3  GLU  69           HB2      GLU  69  -3.798  -2.774   9.528
  544    HG2  GLU  69           HG3      GLU  69  -4.686  -4.404  10.773
  545    HG3  GLU  69           HG2      GLU  69  -3.938  -5.423   9.557
  546    H    GLU  70           HN       GLU  70   0.003  -3.118   9.361
  547    HA   GLU  70           HA       GLU  70  -0.106  -0.393   8.692
  548    HB2  GLU  70           HB3      GLU  70   1.253  -1.458  10.529
  549    HB3  GLU  70           HB2      GLU  70   2.391  -1.966   9.293
  550    HG2  GLU  70           HG3      GLU  70   3.199   0.037  10.330
  551    HG3  GLU  70           HG2      GLU  70   2.722   0.401   8.676
  552    H    ALA  71           HN       ALA  71   1.576  -3.150   7.170
  553    HA   ALA  71           HA       ALA  71   2.899  -1.824   5.063
  554    HB1  ALA  71           HB1      ALA  71   1.610  -4.556   5.010
  555    HB2  ALA  71           HB2      ALA  71   3.217  -4.206   5.622
  556    HB3  ALA  71           HB3      ALA  71   2.861  -3.971   3.918
  557    H    TRP  72           HN       TRP  72  -0.372  -3.149   5.217
  558    HA   TRP  72           HA       TRP  72  -1.077  -2.449   2.598
  559    HB2  TRP  72           HB2      TRP  72  -2.458  -4.072   3.668
  560    HB3  TRP  72           HB1      TRP  72  -2.762  -3.019   5.045
  561    HD1  TRP  72           HD1      TRP  72  -5.240  -2.385   4.995
  562    HE1  TRP  72           HE1      TRP  72  -6.891  -1.516   3.224
  563    HE3  TRP  72           HE3      TRP  72  -2.247  -2.686   0.862
  564    HZ2  TRP  72           HZ2      TRP  72  -6.906  -1.015   0.476
  565    HZ3  TRP  72           HZ3      TRP  72  -3.167  -1.995  -1.314
  566    HH2  TRP  72           HH2      TRP  72  -5.452  -1.180  -1.505
  567    H    ARG  73           HN       ARG  73  -1.469  -0.687   5.633
  568    HA   ARG  73           HA       ARG  73  -2.836   1.449   4.462
  569    HB2  ARG  73           HB2      ARG  73  -2.832   1.084   6.890
  570    HB3  ARG  73           HB1      ARG  73  -1.124   1.508   6.952
  571    HG2  ARG  73           HG2      ARG  73  -1.577   3.748   6.268
  572    HG3  ARG  73           HG1      ARG  73  -3.270   3.365   5.961
  573    HD2  ARG  73           HD2      ARG  73  -3.048   4.558   8.022
  574    HD3  ARG  73           HD1      ARG  73  -3.579   2.913   8.355
  575    HE   ARG  73           HE       ARG  73  -0.928   2.727   8.726
  576   HH11  ARG  73          HH11      ARG  73  -3.238   5.204   9.815
  577   HH12  ARG  73          HH12      ARG  73  -2.393   5.530  11.257
  578   HH21  ARG  73          HH21      ARG  73   0.165   3.131  10.636
  579   HH22  ARG  73          HH22      ARG  73  -0.350   4.279  11.784
  580    H    LEU  74           HN       LEU  74   0.587   0.918   5.059
  581    HA   LEU  74           HA       LEU  74   1.571   3.347   4.164
  582    HB2  LEU  74           HB2      LEU  74   2.669   0.637   4.496
  583    HB3  LEU  74           HB1      LEU  74   3.519   1.635   3.345
  584    HG   LEU  74           HG       LEU  74   4.540   1.686   5.593
  585   HD11  LEU  74          HD11      LEU  74   4.758   4.095   5.786
  586   HD12  LEU  74          HD12      LEU  74   3.366   4.319   4.728
  587   HD13  LEU  74          HD13      LEU  74   4.837   3.564   4.108
  588   HD21  LEU  74          HD21      LEU  74   1.995   3.066   6.444
  589   HD22  LEU  74          HD22      LEU  74   3.440   2.826   7.433
  590   HD23  LEU  74          HD23      LEU  74   2.481   1.440   6.907
  591    H    ALA  75           HN       ALA  75   0.831   0.437   2.280
  592    HA   ALA  75           HA       ALA  75   1.756   1.545  -0.152
  593    HB1  ALA  75           HB1      ALA  75  -0.241  -0.667   0.255
  594    HB2  ALA  75           HB2      ALA  75   1.514  -0.849   0.065
  595    HB3  ALA  75           HB3      ALA  75   0.539  -0.236  -1.263
  596    H    LEU  76           HN       LEU  76  -1.545   1.319   1.219
  597    HA   LEU  76           HA       LEU  76  -2.718   2.508  -1.037
  598    HB2  LEU  76           HB2      LEU  76  -4.780   2.723   0.214
  599    HB3  LEU  76           HB1      LEU  76  -4.053   1.180   0.573
  600    HG   LEU  76           HG       LEU  76  -3.160   2.457   2.693
  601   HD11  LEU  76          HD11      LEU  76  -5.640   4.040   2.022
  602   HD12  LEU  76          HD12      LEU  76  -3.987   4.657   2.097
  603   HD13  LEU  76          HD13      LEU  76  -4.782   4.081   3.562
  604   HD21  LEU  76          HD21      LEU  76  -6.008   1.524   2.413
  605   HD22  LEU  76          HD22      LEU  76  -5.145   1.738   3.937
  606   HD23  LEU  76          HD23      LEU  76  -4.604   0.520   2.778
  607    H    SER  77           HN       SER  77  -1.564   3.906   1.954
  608    HA   SER  77           HA       SER  77  -2.317   6.517   1.187
  609    HB2  SER  77           HB2      SER  77  -0.953   5.259   3.471
  610    HB3  SER  77           HB1      SER  77  -0.819   7.039   3.320
  611    HG   SER  77           HG       SER  77  -3.206   6.814   3.058
  612    H    THR  78           HN       THR  78   0.107   4.649   0.016
  613    HA   THR  78           HA       THR  78   1.716   7.010  -0.557
  614    HB   THR  78           HB       THR  78   2.389   4.076  -1.022
  615    HG1  THR  78           HG1      THR  78   2.645   4.526   1.089
  616   HG21  THR  78          HG21      THR  78   4.638   4.893  -1.611
  617   HG22  THR  78          HG22      THR  78   4.057   6.557  -1.473
  618   HG23  THR  78          HG23      THR  78   3.423   5.507  -2.738
  619    H    PHE  79           HN       PHE  79  -0.409   4.629  -1.988
  620    HA   PHE  79           HA       PHE  79   0.015   5.024  -4.694
  621    HB2  PHE  79           HB2      PHE  79  -2.604   4.613  -3.249
  622    HB3  PHE  79           HB1      PHE  79  -2.454   4.527  -5.004
  623    HD1  PHE  79           HD1      PHE  79   0.205   2.947  -4.940
  624    HD2  PHE  79           HD2      PHE  79  -3.477   2.529  -2.865
  625    HE1  PHE  79           HE1      PHE  79   0.605   0.546  -4.705
  626    HE2  PHE  79           HE2      PHE  79  -3.068   0.125  -2.604
  627    HZ   PHE  79           HZ       PHE  79  -1.021  -0.874  -3.529
  628    H    GLU  80           HN       GLU  80  -1.887   6.867  -2.405
  629    HA   GLU  80           HA       GLU  80  -2.988   8.731  -4.207
  630    HB2  GLU  80           HB3      GLU  80  -3.490  10.048  -2.181
  631    HB3  GLU  80           HB2      GLU  80  -3.975   8.368  -2.044
  632    HG2  GLU  80           HG3      GLU  80  -2.077   7.858  -0.678
  633    HG3  GLU  80           HG2      GLU  80  -1.423   9.475  -0.913
  634    H    ARG  81           HN       ARG  81   0.089   8.599  -2.584
  635    HA   ARG  81           HA       ARG  81   0.620  11.419  -2.708
  636    HB2  ARG  81           HB2      ARG  81   2.615   9.219  -2.283
  637    HB3  ARG  81           HB1      ARG  81   2.771  10.911  -1.827
  638    HG2  ARG  81           HG2      ARG  81   0.773   8.979  -0.697
  639    HG3  ARG  81           HG1      ARG  81   2.295   9.468   0.044
  640    HD2  ARG  81           HD2      ARG  81   1.525  11.655   0.412
  641    HD3  ARG  81           HD1      ARG  81   0.141  11.433  -0.672
  642    HE   ARG  81           HE       ARG  81  -0.250   9.524   1.141
  643   HH11  ARG  81          HH11      ARG  81   0.482  12.951   1.768
  644   HH12  ARG  81          HH12      ARG  81  -0.621  13.094   3.046
  645   HH21  ARG  81          HH21      ARG  81  -1.816   9.765   2.851
  646   HH22  ARG  81          HH22      ARG  81  -1.958  11.226   3.704
  647    H    ILE  82           HN       ILE  82   1.439   8.579  -4.549
  648    HA   ILE  82           HA       ILE  82   3.184  10.079  -6.324
  649    HB   ILE  82           HB       ILE  82   3.735   7.908  -7.326
  650   HG12  ILE  82          HG12      ILE  82   1.760   6.728  -5.338
  651   HG13  ILE  82          HG11      ILE  82   1.481   6.863  -7.068
  652   HG21  ILE  82          HG21      ILE  82   4.972   8.631  -5.358
  653   HG22  ILE  82          HG22      ILE  82   4.784   6.874  -5.340
  654   HG23  ILE  82          HG23      ILE  82   3.770   7.883  -4.307
  655   HD11  ILE  82          HD11      ILE  82   3.628   5.216  -5.743
  656   HD12  ILE  82          HD12      ILE  82   3.347   5.343  -7.482
  657   HD13  ILE  82          HD13      ILE  82   2.127   4.605  -6.442
  658    H    ASN  83           HN       ASN  83   0.139  10.143  -6.111
  659    HA   ASN  83           HA       ASN  83  -1.692  10.227  -7.324
  660    HB2  ASN  83           HB3      ASN  83   0.280  11.384  -9.239
  661    HB3  ASN  83           HB2      ASN  83  -1.416  11.225  -9.689
  662   HD21  ASN  83          HD21      ASN  83   0.719  12.486  -7.339
  663   HD22  ASN  83          HD22      ASN  83  -0.220  13.855  -6.839
  664    H    ARG  84           HN       ARG  84  -1.704   8.185  -7.015
  665    HA   ARG  84           HA       ARG  84  -2.559   6.740  -9.441
  666    HB2  ARG  84           HB2      ARG  84  -0.232   6.063  -8.148
  667    HB3  ARG  84           HB1      ARG  84  -1.392   5.174  -7.189
  668    HG2  ARG  84           HG2      ARG  84  -0.908   4.871 -10.149
  669    HG3  ARG  84           HG1      ARG  84  -0.420   3.761  -8.886
  670    HD2  ARG  84           HD2      ARG  84  -2.810   3.413  -8.360
  671    HD3  ARG  84           HD1      ARG  84  -3.234   4.435  -9.714
  672    HE   ARG  84           HE       ARG  84  -1.427   2.237 -10.331
  673   HH11  ARG  84          HH11      ARG  84  -4.800   3.351 -10.556
  674   HH12  ARG  84          HH12      ARG  84  -5.248   2.118 -11.642
  675   HH21  ARG  84          HH21      ARG  84  -2.058   0.630 -11.858
  676   HH22  ARG  84          HH22      ARG  84  -3.680   0.565 -12.401
  677    H    LYS  85           HN       LYS  85  -4.282   8.231  -8.056
  678    HA   LYS  85           HA       LYS  85  -4.884   7.451  -5.463
  679    HB2  LYS  85           HB2      LYS  85  -6.709   9.045  -5.741
  680    HB3  LYS  85           HB1      LYS  85  -5.143   9.731  -6.153
  681    HG2  LYS  85           HG2      LYS  85  -5.699   9.480  -8.531
  682    HG3  LYS  85           HG1      LYS  85  -7.243   8.764  -8.092
  683    HD2  LYS  85           HD2      LYS  85  -7.501  11.104  -8.722
  684    HD3  LYS  85           HD1      LYS  85  -7.927  10.860  -7.034
  685    HE2  LYS  85           HE2      LYS  85  -6.645  12.915  -7.369
  686    HE3  LYS  85           HE1      LYS  85  -5.779  11.786  -6.337
  687    HZ1  LYS  85           HZ1      LYS  85  -4.271  12.790  -7.942
  688    HZ2  LYS  85           HZ2      LYS  85  -5.248  12.311  -9.231
  689    HZ3  LYS  85           HZ3      LYS  85  -4.440  11.168  -8.326
  690    H    ASP  86           HN       ASP  86  -5.795   6.397  -8.574
  691    HA   ASP  86           HA       ASP  86  -8.338   5.601  -8.034
  692    HB2  ASP  86           HB2      ASP  86  -7.529   5.647 -10.315
  693    HB3  ASP  86           HB1      ASP  86  -6.432   4.308  -9.980
  694    H    LEU  87           HN       LEU  87  -5.296   3.985  -7.327
  695    HA   LEU  87           HA       LEU  87  -6.532   1.479  -6.497
  696    HB2  LEU  87           HB2      LEU  87  -3.759   2.588  -6.070
  697    HB3  LEU  87           HB1      LEU  87  -4.276   1.063  -5.400
  698    HG   LEU  87           HG       LEU  87  -4.102   1.681  -8.354
  699   HD11  LEU  87          HD11      LEU  87  -1.909   1.611  -7.226
  700   HD12  LEU  87          HD12      LEU  87  -2.145   0.228  -8.295
  701   HD13  LEU  87          HD13      LEU  87  -2.323   0.035  -6.550
  702   HD21  LEU  87          HD21      LEU  87  -4.562  -0.904  -6.875
  703   HD22  LEU  87          HD22      LEU  87  -4.429  -0.705  -8.623
  704   HD23  LEU  87          HD23      LEU  87  -5.790  -0.003  -7.760
  705    H    TRP  88           HN       TRP  88  -5.533   4.420  -5.123
  706    HA   TRP  88           HA       TRP  88  -5.582   3.750  -2.398
  707    HB2  TRP  88           HB2      TRP  88  -4.349   5.606  -3.195
  708    HB3  TRP  88           HB1      TRP  88  -5.745   6.291  -3.962
  709    HD1  TRP  88           HD1      TRP  88  -4.773   5.422  -0.291
  710    HE1  TRP  88           HE1      TRP  88  -5.605   7.343   1.201
  711    HE3  TRP  88           HE3      TRP  88  -7.036   8.278  -3.848
  712    HZ2  TRP  88           HZ2      TRP  88  -7.012   9.749   0.905
  713    HZ3  TRP  88           HZ3      TRP  88  -8.096  10.396  -3.167
  714    HH2  TRP  88           HH2      TRP  88  -8.084  11.107  -0.832
  715    H    GLU  89           HN       GLU  89  -7.990   5.180  -4.575
  716    HA   GLU  89           HA       GLU  89 -10.014   5.684  -2.724
  717    HB2  GLU  89           HB3      GLU  89 -10.229   4.931  -5.619
  718    HB3  GLU  89           HB2      GLU  89 -11.554   5.535  -4.644
  719    HG2  GLU  89           HG3      GLU  89 -10.338   7.640  -4.342
  720    HG3  GLU  89           HG2      GLU  89  -9.042   7.010  -5.365
  721    H    ARG  90           HN       ARG  90  -8.953   2.763  -4.127
  722    HA   ARG  90           HA       ARG  90 -11.386   1.264  -3.672
  723    HB2  ARG  90           HB2      ARG  90  -8.608   0.379  -4.193
  724    HB3  ARG  90           HB1      ARG  90 -10.032  -0.653  -4.357
  725    HG2  ARG  90           HG2      ARG  90 -10.728   0.840  -6.255
  726    HG3  ARG  90           HG1      ARG  90  -9.195   1.694  -6.060
  727    HD2  ARG  90           HD2      ARG  90  -8.094  -0.586  -6.286
  728    HD3  ARG  90           HD1      ARG  90  -9.658  -1.153  -6.867
  729    HE   ARG  90           HE       ARG  90  -8.946   1.091  -8.334
  730   HH11  ARG  90          HH11      ARG  90  -8.006  -2.283  -7.900
  731   HH12  ARG  90          HH12      ARG  90  -7.024  -2.352  -9.288
  732   HH21  ARG  90          HH21      ARG  90  -7.650   0.989 -10.297
  733   HH22  ARG  90          HH22      ARG  90  -6.822  -0.490 -10.683
  734    H    GLY  91           HN       GLY  91  -8.533   2.136  -1.981
  735    HA2  GLY  91           HA3      GLY  91  -8.521  -0.126  -0.212
  736    HA3  GLY  91           HA2      GLY  91  -7.440   1.264  -0.130
  737    H    GLN  92           HN       GLN  92  -8.515   3.304   0.647
  738    HA   GLN  92           HA       GLN  92  -9.956   2.556   3.013
  739    HB2  GLN  92           HB2      GLN  92  -9.692   4.973   3.680
  740    HB3  GLN  92           HB1      GLN  92  -8.199   4.083   3.466
  741    HG2  GLN  92           HG2      GLN  92  -7.898   5.132   1.278
  742    HG3  GLN  92           HG1      GLN  92  -9.404   6.021   1.505
  743   HE21  GLN  92          HE21      GLN  92  -9.474   7.628   3.043
  744   HE22  GLN  92          HE22      GLN  92  -8.050   8.390   3.662
  745    H    ARG  93           HN       ARG  93 -11.915   3.080   3.578
  746    HA   ARG  93           HA       ARG  93 -13.662   4.197   1.476
  747    HB2  ARG  93           HB2      ARG  93 -15.312   2.420   2.018
  748    HB3  ARG  93           HB1      ARG  93 -13.850   1.850   1.229
  749    HG2  ARG  93           HG2      ARG  93 -12.982   1.139   3.428
  750    HG3  ARG  93           HG1      ARG  93 -14.507   1.640   4.162
  751    HD2  ARG  93           HD2      ARG  93 -14.488  -0.750   3.736
  752    HD3  ARG  93           HD1      ARG  93 -15.702   0.095   2.759
  753    HE   ARG  93           HE       ARG  93 -13.637   0.020   1.092
  754   HH11  ARG  93          HH11      ARG  93 -15.044  -2.600   3.012
  755   HH12  ARG  93          HH12      ARG  93 -14.751  -3.799   1.836
  756   HH21  ARG  93          HH21      ARG  93 -13.248  -1.632  -0.507
  757   HH22  ARG  93          HH22      ARG  93 -13.668  -3.247  -0.155
  758    H    GLU  94           HN       GLU  94 -12.913   3.854   4.783
  759    HA   GLU  94           HA       GLU  94 -15.380   4.904   5.756
  760    HB2  GLU  94           HB3      GLU  94 -14.070   5.128   7.935
  761    HB3  GLU  94           HB2      GLU  94 -14.285   3.506   7.303
  762    HG2  GLU  94           HG3      GLU  94 -11.775   5.083   6.787
  763    HG3  GLU  94           HG2      GLU  94 -11.983   4.156   8.267
  764    H    ASP  95           HN       ASP  95 -12.434   6.191   4.631
  765    HA   ASP  95           HA       ASP  95 -13.429   8.905   4.762
  766    HB2  ASP  95           HB2      ASP  95 -12.087   8.498   6.918
  767    HB3  ASP  95           HB1      ASP  95 -10.746   8.120   5.822
  768    H    LEU  96           HN       LEU  96 -12.160  10.132   3.161
  769    HA   LEU  96           HA       LEU  96 -10.210   8.581   1.742
  770    HB2  LEU  96           HB2      LEU  96 -12.287   7.847   0.858
  771    HB3  LEU  96           HB1      LEU  96 -12.746   9.479   0.422
  772    HG   LEU  96           HG       LEU  96 -10.764   9.528  -1.142
  773   HD11  LEU  96          HD11      LEU  96 -10.680   6.569  -0.570
  774   HD12  LEU  96          HD12      LEU  96  -9.470   7.756  -0.080
  775   HD13  LEU  96          HD13      LEU  96  -9.738   7.434  -1.789
  776   HD21  LEU  96          HD21      LEU  96 -13.020   9.114  -1.965
  777   HD22  LEU  96          HD22      LEU  96 -12.817   7.386  -1.670
  778   HD23  LEU  96          HD23      LEU  96 -11.829   8.196  -2.883
  779    H    VAL  97           HN       VAL  97 -12.065  11.350   0.684
  780    HA   VAL  97           HA       VAL  97  -9.524  12.798   0.731
  781    HB   VAL  97           HB       VAL  97  -9.788  12.024  -1.544
  782   HG11  VAL  97          HG11      VAL  97 -12.434  13.438  -1.613
  783   HG12  VAL  97          HG12      VAL  97 -12.164  11.694  -1.666
  784   HG13  VAL  97          HG13      VAL  97 -11.623  12.711  -3.001
  785   HG21  VAL  97          HG21      VAL  97  -8.741  14.204  -1.279
  786   HG22  VAL  97          HG22      VAL  97 -10.315  14.990  -1.349
  787   HG23  VAL  97          HG23      VAL  97  -9.681  14.163  -2.772
  788    H    ARG  98           HN       ARG  98  -9.642  14.380   2.014
  789    HA   ARG  98           HA       ARG  98 -10.073  16.364   2.924
  790    HB2  ARG  98           HB2      ARG  98 -10.290  17.182   0.633
  791    HB3  ARG  98           HB1      ARG  98 -11.991  16.755   0.617
  792    HG2  ARG  98           HG2      ARG  98 -12.453  18.435   2.301
  793    HG3  ARG  98           HG1      ARG  98 -10.732  18.807   2.428
  794    HD2  ARG  98           HD2      ARG  98 -10.711  19.482   0.074
  795    HD3  ARG  98           HD1      ARG  98 -12.431  19.130  -0.035
  796    HE   ARG  98           HE       ARG  98 -12.322  20.893   1.983
  797   HH11  ARG  98          HH11      ARG  98 -10.982  20.966  -1.274
  798   HH12  ARG  98          HH12      ARG  98 -11.068  22.648  -1.468
  799   HH21  ARG  98          HH21      ARG  98 -12.483  23.203   1.754
  800   HH22  ARG  98          HH22      ARG  98 -11.982  23.971   0.318
  801    H    ASP  99           HN       ASP  99 -10.882  16.330   4.802
  802    HA   ASP  99           HA       ASP  99 -13.660  16.508   5.344
  803    HB2  ASP  99           HB2      ASP  99 -13.556  14.072   4.996
  804    HB3  ASP  99           HB1      ASP  99 -12.274  13.940   6.196
  805    H    THR 100           HN       THR 100 -10.937  15.055   7.155
  806    HA   THR 100           HA       THR 100 -11.266  16.864   9.323
  807    HB   THR 100           HB       THR 100  -8.720  15.343   8.701
  808    HG1  THR 100           HG1      THR 100 -11.153  14.330   9.857
  809   HG21  THR 100          HG21      THR 100  -8.690  16.882  10.609
  810   HG22  THR 100          HG22      THR 100  -8.591  15.206  11.153
  811   HG23  THR 100          HG23      THR 100 -10.114  16.083  11.278
  812    H    VAL 101           HN       VAL 101  -8.981  16.525   6.654
  813    HA   VAL 101           HA       VAL 101  -7.979  19.201   7.139
  814    HB   VAL 101           HB       VAL 101  -6.332  18.710   5.326
  815   HG11  VAL 101          HG11      VAL 101  -5.008  17.061   6.565
  816   HG12  VAL 101          HG12      VAL 101  -6.431  16.644   7.515
  817   HG13  VAL 101          HG13      VAL 101  -5.731  18.262   7.635
  818   HG21  VAL 101          HG21      VAL 101  -6.101  16.412   4.470
  819   HG22  VAL 101          HG22      VAL 101  -7.656  17.110   4.016
  820   HG23  VAL 101          HG23      VAL 101  -7.565  15.945   5.336
  821    H    GLU 102           HN       GLU 102  -8.354  20.863   5.796
  822    HA   GLU 102           HA       GLU 102 -10.350  20.433   3.693
  823    HB2  GLU 102           HB3      GLU 102  -9.794  22.931   5.305
  824    HB3  GLU 102           HB2      GLU 102 -11.076  22.729   4.116
  825    HG2  GLU 102           HG3      GLU 102 -12.092  21.003   5.539
  826    HG3  GLU 102           HG2      GLU 102 -10.828  21.265   6.736
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1  11.000 -22.517  11.041
    2    H2   GLY   1           HT2      GLY   1  10.881 -22.811   9.391
    3    H3   GLY   1           HT3      GLY   1  11.536 -23.989  10.398
    4    HA2  GLY   1           HA2      GLY   1   9.295 -24.561   9.744
    5    HA3  GLY   1           HA3      GLY   1   9.376 -24.252  11.477
    6    H    HIS   2           HN       HIS   2   7.032 -23.942  11.185
    7    HA   HIS   2           HA       HIS   2   5.173 -22.645  11.175
    8    HB2  HIS   2           HB2      HIS   2   7.163 -20.365  11.178
    9    HB3  HIS   2           HB1      HIS   2   5.434 -20.164  11.413
   10    HD1  HIS   2           HD1      HIS   2   7.697 -19.400  13.520
   11    HD2  HIS   2           HD2      HIS   2   5.305 -22.790  13.574
   12    HE1  HIS   2           HE1      HIS   2   7.611 -20.155  15.916
   13    H    MET   3           HN       MET   3   6.256 -23.574   8.731
   14    HA   MET   3           HA       MET   3   6.224 -21.544   6.744
   15    HB2  MET   3           HB2      MET   3   5.989 -24.544   6.474
   16    HB3  MET   3           HB1      MET   3   6.118 -23.445   5.115
   17    HG2  MET   3           HG2      MET   3   8.171 -23.838   7.281
   18    HG3  MET   3           HG1      MET   3   8.257 -24.477   5.644
   19    HE1  MET   3           HE1      MET   3   7.132 -21.970   3.918
   20    HE2  MET   3           HE2      MET   3   8.523 -22.954   3.468
   21    HE3  MET   3           HE3      MET   3   8.665 -21.197   3.508
   22    H    LEU   4           HN       LEU   4   4.586 -20.451   6.168
   23    HA   LEU   4           HA       LEU   4   2.557 -19.756   5.606
   24    HB2  LEU   4           HB2      LEU   4   2.147 -22.646   4.828
   25    HB3  LEU   4           HB1      LEU   4   0.916 -21.431   4.586
   26    HG   LEU   4           HG       LEU   4   1.988 -21.807   2.508
   27   HD11  LEU   4          HD11      LEU   4   2.859 -19.631   1.917
   28   HD12  LEU   4          HD12      LEU   4   3.005 -19.221   3.624
   29   HD13  LEU   4          HD13      LEU   4   1.412 -19.520   2.923
   30   HD21  LEU   4          HD21      LEU   4   4.636 -21.259   3.856
   31   HD22  LEU   4          HD22      LEU   4   4.402 -21.498   2.126
   32   HD23  LEU   4          HD23      LEU   4   4.083 -22.819   3.251
   33    H    ARG   5           HN       ARG   5   2.095 -19.092   7.601
   34    HA   ARG   5           HA       ARG   5   0.485 -20.775   9.349
   35    HB2  ARG   5           HB2      ARG   5   2.166 -19.322  10.384
   36    HB3  ARG   5           HB1      ARG   5   1.452 -17.912   9.619
   37    HG2  ARG   5           HG2      ARG   5   0.828 -17.975  11.952
   38    HG3  ARG   5           HG1      ARG   5  -0.595 -18.243  10.948
   39    HD2  ARG   5           HD2      ARG   5  -0.621 -19.765  12.829
   40    HD3  ARG   5           HD1      ARG   5  -0.361 -20.678  11.344
   41    HE   ARG   5           HE       ARG   5   2.048 -19.898  12.670
   42   HH11  ARG   5          HH11      ARG   5  -0.468 -22.401  12.593
   43   HH12  ARG   5          HH12      ARG   5   0.523 -23.616  13.242
   44   HH21  ARG   5          HH21      ARG   5   3.361 -21.520  13.624
   45   HH22  ARG   5          HH22      ARG   5   2.772 -23.108  13.841
   46    H    THR   6           HN       THR   6   0.258 -18.193   7.090
   47    HA   THR   6           HA       THR   6  -1.381 -17.203   5.997
   48    HB   THR   6           HB       THR   6  -3.349 -18.887   7.599
   49    HG1  THR   6           HG1      THR   6  -3.251 -19.609   5.042
   50   HG21  THR   6          HG21      THR   6  -4.965 -18.313   5.825
   51   HG22  THR   6          HG22      THR   6  -3.752 -17.298   5.047
   52   HG23  THR   6          HG23      THR   6  -4.380 -16.858   6.632
   53    H    ALA   7           HN       ALA   7  -1.770 -15.163   6.336
   54    HA   ALA   7           HA       ALA   7  -1.778 -14.081   8.960
   55    HB1  ALA   7           HB1      ALA   7  -0.732 -12.916   7.074
   56    HB2  ALA   7           HB2      ALA   7  -1.975 -11.918   7.831
   57    HB3  ALA   7           HB3      ALA   7  -2.311 -12.740   6.309
   58    H    GLY   8           HN       GLY   8  -3.425 -13.214  10.107
   59    HA2  GLY   8           HA3      GLY   8  -6.123 -14.029   9.384
   60    HA3  GLY   8           HA2      GLY   8  -5.621 -13.266  10.894
   61    H    ARG   9           HN       ARG   9  -4.342 -11.096  10.033
   62    HA   ARG   9           HA       ARG   9  -6.520  -9.445   9.138
   63    HB2  ARG   9           HB2      ARG   9  -3.738  -8.850  10.141
   64    HB3  ARG   9           HB1      ARG   9  -4.774  -7.595   9.475
   65    HG2  ARG   9           HG2      ARG   9  -5.550  -9.348  11.794
   66    HG3  ARG   9           HG1      ARG   9  -4.809  -7.750  11.955
   67    HD2  ARG   9           HD2      ARG   9  -6.622  -6.731  10.780
   68    HD3  ARG   9           HD1      ARG   9  -7.335  -8.290  10.423
   69    HE   ARG   9           HE       ARG   9  -7.614  -8.522  12.889
   70   HH11  ARG   9          HH11      ARG   9  -7.230  -5.209  11.672
   71   HH12  ARG   9          HH12      ARG   9  -8.435  -4.556  12.677
   72   HH21  ARG   9          HH21      ARG   9  -9.253  -7.586  14.333
   73   HH22  ARG   9          HH22      ARG   9  -9.575  -5.919  14.246
   74    H    ASP  10           HN       ASP  10  -6.880  -8.960   7.121
   75    HA   ASP  10           HA       ASP  10  -4.922  -9.807   5.299
   76    HB2  ASP  10           HB2      ASP  10  -7.094 -10.391   4.559
   77    HB3  ASP  10           HB1      ASP  10  -7.670  -8.738   4.728
   78    H    GLY  11           HN       GLY  11  -3.343  -8.629   5.485
   79    HA2  GLY  11           HA3      GLY  11  -3.525  -5.943   4.334
   80    HA3  GLY  11           HA2      GLY  11  -2.216  -6.474   5.402
   81    H    LEU  12           HN       LEU  12  -1.443  -8.766   4.581
   82    HA   LEU  12           HA       LEU  12   0.284  -8.227   2.478
   83    HB2  LEU  12           HB2      LEU  12   0.731  -9.832   4.260
   84    HB3  LEU  12           HB1      LEU  12  -0.513 -10.883   3.635
   85    HG   LEU  12           HG       LEU  12   0.834 -11.189   1.560
   86   HD11  LEU  12          HD11      LEU  12   3.198 -10.539   1.576
   87   HD12  LEU  12          HD12      LEU  12   2.933  -9.640   3.067
   88   HD13  LEU  12          HD13      LEU  12   2.118  -9.147   1.583
   89   HD21  LEU  12          HD21      LEU  12   0.939 -12.826   3.343
   90   HD22  LEU  12          HD22      LEU  12   2.207 -11.899   4.150
   91   HD23  LEU  12          HD23      LEU  12   2.521 -12.652   2.584
   92    H    CYS  13           HN       CYS  13  -2.779 -10.077   2.386
   93    HA   CYS  13           HA       CYS  13  -2.269 -11.137  -0.183
   94    HB2  CYS  13           HB2      CYS  13  -3.787 -12.253   1.393
   95    HB3  CYS  13           HB1      CYS  13  -4.883 -10.878   1.320
   96    HG   CYS  13           HG       CYS  13  -5.673 -11.282  -1.277
   97    H    ARG  14           HN       ARG  14  -4.478  -8.576   0.931
   98    HA   ARG  14           HA       ARG  14  -5.114  -7.780  -1.700
   99    HB2  ARG  14           HB2      ARG  14  -6.097  -5.760  -0.755
  100    HB3  ARG  14           HB1      ARG  14  -6.561  -7.168   0.180
  101    HG2  ARG  14           HG2      ARG  14  -4.895  -6.567   1.877
  102    HG3  ARG  14           HG1      ARG  14  -4.477  -5.134   0.937
  103    HD2  ARG  14           HD2      ARG  14  -6.035  -4.550   2.705
  104    HD3  ARG  14           HD1      ARG  14  -6.802  -4.349   1.128
  105    HE   ARG  14           HE       ARG  14  -7.224  -6.926   2.285
  106   HH11  ARG  14          HH11      ARG  14  -8.606  -3.666   1.974
  107   HH12  ARG  14          HH12      ARG  14 -10.091  -4.160   2.682
  108   HH21  ARG  14          HH21      ARG  14  -9.232  -7.509   3.141
  109   HH22  ARG  14          HH22      ARG  14 -10.465  -6.319   3.326
  110    H    LEU  15           HN       LEU  15  -2.522  -6.870   0.435
  111    HA   LEU  15           HA       LEU  15  -1.521  -4.597  -0.757
  112    HB2  LEU  15           HB2      LEU  15  -0.808  -5.533   1.370
  113    HB3  LEU  15           HB1      LEU  15  -0.110  -6.901   0.551
  114    HG   LEU  15           HG       LEU  15   1.636  -5.494  -0.374
  115   HD11  LEU  15          HD11      LEU  15   0.308  -3.446  -0.624
  116   HD12  LEU  15          HD12      LEU  15   1.803  -3.175   0.276
  117   HD13  LEU  15          HD13      LEU  15   0.269  -3.282   1.132
  118   HD21  LEU  15          HD21      LEU  15   1.167  -5.100   2.563
  119   HD22  LEU  15          HD22      LEU  15   2.702  -4.871   1.733
  120   HD23  LEU  15          HD23      LEU  15   1.970  -6.475   1.805
  121    H    SER  16           HN       SER  16  -0.591  -7.988  -1.367
  122    HA   SER  16           HA       SER  16   1.173  -7.355  -3.474
  123    HB2  SER  16           HB2      SER  16   1.286  -9.454  -2.133
  124    HB3  SER  16           HB1      SER  16  -0.212  -9.989  -2.883
  125    HG   SER  16           HG       SER  16   1.206  -9.472  -4.917
  126    H    THR  17           HN       THR  17  -2.244  -7.859  -3.308
  127    HA   THR  17           HA       THR  17  -2.683  -8.377  -6.058
  128    HB   THR  17           HB       THR  17  -4.562  -7.446  -3.872
  129    HG1  THR  17           HG1      THR  17  -3.908  -9.452  -3.310
  130   HG21  THR  17          HG21      THR  17  -5.548  -6.971  -6.032
  131   HG22  THR  17          HG22      THR  17  -6.341  -8.396  -5.349
  132   HG23  THR  17          HG23      THR  17  -5.131  -8.576  -6.615
  133    H    TYR  18           HN       TYR  18  -3.001  -5.398  -4.064
  134    HA   TYR  18           HA       TYR  18  -3.782  -3.814  -6.308
  135    HB2  TYR  18           HB2      TYR  18  -2.897  -3.053  -3.528
  136    HB3  TYR  18           HB1      TYR  18  -3.246  -1.847  -4.753
  137    HD1  TYR  18           HD2      TYR  18  -4.762  -4.641  -2.824
  138    HD2  TYR  18           HD1      TYR  18  -5.483  -1.156  -5.140
  139    HE1  TYR  18           HE2      TYR  18  -7.121  -4.700  -2.163
  140    HE2  TYR  18           HE1      TYR  18  -7.850  -1.206  -4.477
  141    HH   TYR  18           HH       TYR  18  -9.498  -2.768  -3.651
  142    H    LEU  19           HN       LEU  19  -0.694  -4.539  -4.809
  143    HA   LEU  19           HA       LEU  19   0.730  -2.502  -6.151
  144    HB2  LEU  19           HB2      LEU  19   1.672  -5.051  -4.857
  145    HB3  LEU  19           HB1      LEU  19   2.773  -3.893  -5.571
  146    HG   LEU  19           HG       LEU  19   0.914  -3.281  -3.237
  147   HD11  LEU  19          HD11      LEU  19   2.927  -3.273  -1.899
  148   HD12  LEU  19          HD12      LEU  19   3.873  -3.818  -3.288
  149   HD13  LEU  19          HD13      LEU  19   2.622  -4.861  -2.596
  150   HD21  LEU  19          HD21      LEU  19   1.443  -1.316  -4.619
  151   HD22  LEU  19          HD22      LEU  19   3.161  -1.673  -4.464
  152   HD23  LEU  19          HD23      LEU  19   2.219  -1.236  -3.045
  153    H    GLU  20           HN       GLU  20  -0.389  -5.568  -7.242
  154    HA   GLU  20           HA       GLU  20   1.327  -5.982  -9.437
  155    HB2  GLU  20           HB3      GLU  20  -1.534  -6.743  -8.899
  156    HB3  GLU  20           HB2      GLU  20  -0.750  -7.136 -10.421
  157    HG2  GLU  20           HG3      GLU  20   0.307  -7.998  -7.741
  158    HG3  GLU  20           HG2      GLU  20  -0.793  -8.967  -8.723
  159    H    GLU  21           HN       GLU  21  -1.288  -3.761  -8.917
  160    HA   GLU  21           HA       GLU  21  -1.742  -3.243 -11.716
  161    HB2  GLU  21           HB3      GLU  21  -2.892  -2.071  -9.209
  162    HB3  GLU  21           HB2      GLU  21  -3.302  -1.473 -10.811
  163    HG2  GLU  21           HG3      GLU  21  -3.726  -4.284  -9.823
  164    HG3  GLU  21           HG2      GLU  21  -4.969  -3.037  -9.958
  165    H    LEU  22           HN       LEU  22   0.712  -2.328  -9.814
  166    HA   LEU  22           HA       LEU  22   0.793   0.421 -10.817
  167    HB2  LEU  22           HB2      LEU  22   2.537  -1.012  -8.823
  168    HB3  LEU  22           HB1      LEU  22   2.823   0.622  -9.362
  169    HG   LEU  22           HG       LEU  22   0.455  -0.355  -7.771
  170   HD11  LEU  22          HD11      LEU  22   1.405   1.102  -6.043
  171   HD12  LEU  22          HD12      LEU  22   2.806   1.399  -7.072
  172   HD13  LEU  22          HD13      LEU  22   2.474  -0.229  -6.468
  173   HD21  LEU  22          HD21      LEU  22  -0.144   2.018  -7.608
  174   HD22  LEU  22          HD22      LEU  22  -0.249   1.427  -9.262
  175   HD23  LEU  22          HD23      LEU  22   1.125   2.421  -8.764
  176    H    GLU  23           HN       GLU  23   2.367   1.141 -12.163
  177    HA   GLU  23           HA       GLU  23   3.824  -0.725 -13.815
  178    HB2  GLU  23           HB3      GLU  23   4.240   2.251 -13.450
  179    HB3  GLU  23           HB2      GLU  23   4.919   1.270 -14.730
  180    HG2  GLU  23           HG3      GLU  23   2.014   1.814 -14.292
  181    HG3  GLU  23           HG2      GLU  23   3.058   2.625 -15.460
  182    H    ALA  24           HN       ALA  24   6.222  -0.596 -14.014
  183    HA   ALA  24           HA       ALA  24   7.547  -1.029 -11.596
  184    HB1  ALA  24           HB1      ALA  24   8.745  -0.189 -14.236
  185    HB2  ALA  24           HB2      ALA  24   8.389  -1.845 -13.744
  186    HB3  ALA  24           HB3      ALA  24   9.620  -0.918 -12.889
  187    H    VAL  25           HN       VAL  25   7.228   1.871 -13.562
  188    HA   VAL  25           HA       VAL  25   8.943   3.491 -12.013
  189    HB   VAL  25           HB       VAL  25   8.300   4.114 -14.317
  190   HG11  VAL  25          HG11      VAL  25   6.134   5.111 -14.813
  191   HG12  VAL  25          HG12      VAL  25   5.597   4.736 -13.176
  192   HG13  VAL  25          HG13      VAL  25   5.972   3.426 -14.300
  193   HG21  VAL  25          HG21      VAL  25   7.914   6.510 -13.967
  194   HG22  VAL  25          HG22      VAL  25   9.135   5.873 -12.856
  195   HG23  VAL  25          HG23      VAL  25   7.491   6.185 -12.289
  196    H    GLU  26           HN       GLU  26   5.542   2.687 -11.648
  197    HA   GLU  26           HA       GLU  26   5.030   4.698  -9.671
  198    HB2  GLU  26           HB3      GLU  26   3.531   2.176 -10.370
  199    HB3  GLU  26           HB2      GLU  26   2.946   3.400  -9.242
  200    HG2  GLU  26           HG3      GLU  26   2.909   5.020 -11.069
  201    HG3  GLU  26           HG2      GLU  26   3.478   3.779 -12.181
  202    H    LEU  27           HN       LEU  27   5.829   1.289  -9.696
  203    HA   LEU  27           HA       LEU  27   5.832   0.856  -6.950
  204    HB2  LEU  27           HB2      LEU  27   7.482  -0.407  -9.136
  205    HB3  LEU  27           HB1      LEU  27   7.466  -0.989  -7.486
  206    HG   LEU  27           HG       LEU  27   4.996  -0.862  -9.221
  207   HD11  LEU  27          HD11      LEU  27   5.288  -3.293  -9.442
  208   HD12  LEU  27          HD12      LEU  27   6.898  -3.149  -8.714
  209   HD13  LEU  27          HD13      LEU  27   6.533  -2.360 -10.253
  210   HD21  LEU  27          HD21      LEU  27   5.595  -2.300  -6.633
  211   HD22  LEU  27          HD22      LEU  27   4.096  -2.408  -7.551
  212   HD23  LEU  27          HD23      LEU  27   4.567  -0.877  -6.814
  213    H    LYS  28           HN       LYS  28   8.335   1.880  -9.168
  214    HA   LYS  28           HA       LYS  28  10.525   2.224  -7.541
  215    HB2  LYS  28           HB2      LYS  28  10.506   2.439  -9.989
  216    HB3  LYS  28           HB1      LYS  28   9.579   3.919  -9.850
  217    HG2  LYS  28           HG2      LYS  28  11.456   5.003  -8.761
  218    HG3  LYS  28           HG1      LYS  28  12.382   3.501  -8.868
  219    HD2  LYS  28           HD2      LYS  28  12.126   3.579 -11.335
  220    HD3  LYS  28           HD1      LYS  28  11.326   5.142 -11.173
  221    HE2  LYS  28           HE2      LYS  28  14.155   4.482 -10.357
  222    HE3  LYS  28           HE1      LYS  28  13.678   5.409 -11.771
  223    HZ1  LYS  28           HZ1      LYS  28  12.710   7.060 -10.296
  224    HZ2  LYS  28           HZ2      LYS  28  14.354   6.874 -10.006
  225    HZ3  LYS  28           HZ3      LYS  28  13.246   6.203  -8.937
  226    H    LYS  29           HN       LYS  29   7.883   4.488  -8.212
  227    HA   LYS  29           HA       LYS  29   8.915   6.608  -6.664
  228    HB2  LYS  29           HB2      LYS  29   6.067   6.042  -7.462
  229    HB3  LYS  29           HB1      LYS  29   6.594   7.508  -6.672
  230    HG2  LYS  29           HG2      LYS  29   8.061   7.946  -8.684
  231    HG3  LYS  29           HG1      LYS  29   7.278   6.559  -9.438
  232    HD2  LYS  29           HD2      LYS  29   5.110   7.564  -9.218
  233    HD3  LYS  29           HD1      LYS  29   5.784   8.923  -8.326
  234    HE2  LYS  29           HE2      LYS  29   7.082   9.548 -10.319
  235    HE3  LYS  29           HE1      LYS  29   6.332   8.221 -11.210
  236    HZ1  LYS  29           HZ1      LYS  29   4.893  10.522  -9.993
  237    HZ2  LYS  29           HZ2      LYS  29   4.173   9.244 -10.810
  238    HZ3  LYS  29           HZ3      LYS  29   5.159  10.294 -11.645
  239    H    PHE  30           HN       PHE  30   6.533   4.092  -5.903
  240    HA   PHE  30           HA       PHE  30   5.981   5.161  -3.343
  241    HB2  PHE  30           HB2      PHE  30   4.222   3.751  -3.403
  242    HB3  PHE  30           HB1      PHE  30   4.797   3.226  -4.968
  243    HD1  PHE  30           HD2      PHE  30   6.126   1.167  -5.123
  244    HD2  PHE  30           HD1      PHE  30   4.253   2.292  -1.481
  245    HE1  PHE  30           HE2      PHE  30   6.314  -1.151  -4.305
  246    HE2  PHE  30           HE1      PHE  30   4.423   0.016  -0.683
  247    HZ   PHE  30           HZ       PHE  30   5.448  -1.722  -2.072
  248    H    LYS  31           HN       LYS  31   8.260   2.732  -4.417
  249    HA   LYS  31           HA       LYS  31   8.977   1.922  -1.741
  250    HB2  LYS  31           HB2      LYS  31  10.742   0.643  -2.760
  251    HB3  LYS  31           HB1      LYS  31   9.280   0.428  -3.713
  252    HG2  LYS  31           HG2      LYS  31  10.104   2.031  -5.354
  253    HG3  LYS  31           HG1      LYS  31  11.556   2.282  -4.392
  254    HD2  LYS  31           HD2      LYS  31  12.064   0.800  -6.197
  255    HD3  LYS  31           HD1      LYS  31  12.106  -0.106  -4.688
  256    HE2  LYS  31           HE2      LYS  31   9.875  -0.991  -5.149
  257    HE3  LYS  31           HE1      LYS  31   9.817  -0.071  -6.658
  258    HZ1  LYS  31           HZ1      LYS  31  11.745  -1.315  -7.406
  259    HZ2  LYS  31           HZ2      LYS  31  10.460  -2.337  -7.078
  260    HZ3  LYS  31           HZ3      LYS  31  11.739  -2.210  -5.972
  261    H    LEU  32           HN       LEU  32  10.267   4.326  -3.973
  262    HA   LEU  32           HA       LEU  32  12.383   4.792  -2.108
  263    HB2  LEU  32           HB2      LEU  32  13.076   6.635  -3.462
  264    HB3  LEU  32           HB1      LEU  32  12.683   5.307  -4.517
  265    HG   LEU  32           HG       LEU  32  10.412   6.586  -4.854
  266   HD11  LEU  32          HD11      LEU  32  12.153   8.842  -3.889
  267   HD12  LEU  32          HD12      LEU  32  10.707   8.225  -3.092
  268   HD13  LEU  32          HD13      LEU  32  10.580   8.994  -4.675
  269   HD21  LEU  32          HD21      LEU  32  13.025   7.579  -5.918
  270   HD22  LEU  32          HD22      LEU  32  11.437   7.867  -6.650
  271   HD23  LEU  32          HD23      LEU  32  12.092   6.223  -6.556
  272    H    TYR  33           HN       TYR  33   9.188   5.988  -2.636
  273    HA   TYR  33           HA       TYR  33   9.433   8.189  -0.959
  274    HB2  TYR  33           HB2      TYR  33   7.453   7.942  -2.419
  275    HB3  TYR  33           HB1      TYR  33   6.913   6.568  -1.452
  276    HD1  TYR  33           HD1      TYR  33   7.327  10.188  -1.536
  277    HD2  TYR  33           HD2      TYR  33   6.008   6.892   0.777
  278    HE1  TYR  33           HE1      TYR  33   6.267  11.740   0.072
  279    HE2  TYR  33           HE2      TYR  33   4.950   8.376   2.373
  280    HH   TYR  33           HH       TYR  33   5.473  10.884   3.086
  281    H    LEU  34           HN       LEU  34   7.853   5.085  -0.128
  282    HA   LEU  34           HA       LEU  34   8.018   5.823   2.637
  283    HB2  LEU  34           HB2      LEU  34   7.010   3.599   3.092
  284    HB3  LEU  34           HB1      LEU  34   6.073   4.655   2.070
  285    HG   LEU  34           HG       LEU  34   6.867   3.284   0.099
  286   HD11  LEU  34          HD11      LEU  34   8.809   2.214   1.099
  287   HD12  LEU  34          HD12      LEU  34   7.647   1.013   0.524
  288   HD13  LEU  34          HD13      LEU  34   7.768   1.372   2.248
  289   HD21  LEU  34          HD21      LEU  34   4.670   3.098   1.083
  290   HD22  LEU  34          HD22      LEU  34   5.279   1.898   2.228
  291   HD23  LEU  34          HD23      LEU  34   5.256   1.537   0.500
  292    H    GLY  35           HN       GLY  35  10.103   4.200   0.547
  293    HA2  GLY  35           HA3      GLY  35  11.312   2.741   2.615
  294    HA3  GLY  35           HA2      GLY  35  11.996   2.951   0.991
  295    H    THR  36           HN       THR  36  11.944   5.787   1.047
  296    HA   THR  36           HA       THR  36  14.202   6.185   2.892
  297    HB   THR  36           HB       THR  36  14.878   8.141   1.597
  298    HG1  THR  36           HG1      THR  36  12.601   7.702  -0.056
  299   HG21  THR  36          HG21      THR  36  15.301   7.141  -0.613
  300   HG22  THR  36          HG22      THR  36  14.107   5.902  -0.285
  301   HG23  THR  36          HG23      THR  36  15.588   5.971   0.678
  302    H    ALA  37           HN       ALA  37  11.016   6.631   2.934
  303    HA   ALA  37           HA       ALA  37  10.505   9.221   3.810
  304    HB1  ALA  37           HB1      ALA  37   8.435   8.368   4.747
  305    HB2  ALA  37           HB2      ALA  37   9.035   6.710   4.583
  306    HB3  ALA  37           HB3      ALA  37   8.748   7.698   3.149
  307    H    THR  38           HN       THR  38  11.141  10.261   5.449
  308    HA   THR  38           HA       THR  38  12.244   8.836   7.690
  309    HB   THR  38           HB       THR  38  12.334  11.805   7.066
  310    HG1  THR  38           HG1      THR  38  13.442  10.696   5.470
  311   HG21  THR  38          HG21      THR  38  12.793  11.284   9.448
  312   HG22  THR  38          HG22      THR  38  14.255  11.831   8.626
  313   HG23  THR  38          HG23      THR  38  14.015  10.113   8.951
  314    H    GLU  39           HN       GLU  39   9.262  10.230   6.897
  315    HA   GLU  39           HA       GLU  39   8.519  11.053   9.545
  316    HB2  GLU  39           HB3      GLU  39   6.189  11.118   8.735
  317    HB3  GLU  39           HB2      GLU  39   7.262  11.974   7.649
  318    HG2  GLU  39           HG3      GLU  39   6.597   9.130   7.051
  319    HG3  GLU  39           HG2      GLU  39   5.374  10.360   6.762
  320    H    LEU  40           HN       LEU  40   9.071   8.143   8.175
  321    HA   LEU  40           HA       LEU  40   7.219   6.552   9.776
  322    HB2  LEU  40           HB2      LEU  40   9.499   5.759   8.018
  323    HB3  LEU  40           HB1      LEU  40   8.294   4.719   8.745
  324    HG   LEU  40           HG       LEU  40   7.824   6.805   6.595
  325   HD11  LEU  40          HD11      LEU  40   8.999   4.871   5.776
  326   HD12  LEU  40          HD12      LEU  40   7.360   4.947   5.135
  327   HD13  LEU  40          HD13      LEU  40   7.747   3.814   6.425
  328   HD21  LEU  40          HD21      LEU  40   5.844   6.600   8.006
  329   HD22  LEU  40          HD22      LEU  40   5.873   4.844   7.789
  330   HD23  LEU  40          HD23      LEU  40   5.588   5.904   6.404
  331    H    GLY  41           HN       GLY  41   9.753   8.183  10.391
  332    HA2  GLY  41           HA3      GLY  41  10.681   8.008  12.692
  333    HA3  GLY  41           HA2      GLY  41  10.930   6.296  12.333
  334    H    GLU  42           HN       GLU  42  12.424   5.724  10.741
  335    HA   GLU  42           HA       GLU  42  14.404   7.810  10.023
  336    HB2  GLU  42           HB3      GLU  42  14.971   4.955  10.819
  337    HB3  GLU  42           HB2      GLU  42  16.161   6.169  10.384
  338    HG2  GLU  42           HG3      GLU  42  15.708   7.417  12.361
  339    HG3  GLU  42           HG2      GLU  42  14.325   6.391  12.747
  340    H    GLY  43           HN       GLY  43  12.194   5.632   8.958
  341    HA2  GLY  43           HA3      GLY  43  11.890   4.985   6.697
  342    HA3  GLY  43           HA2      GLY  43  13.647   5.042   6.483
  343    H    LYS  44           HN       LYS  44  11.045   3.040   7.073
  344    HA   LYS  44           HA       LYS  44  12.436   1.165   8.763
  345    HB2  LYS  44           HB2      LYS  44   9.730   0.988   7.428
  346    HB3  LYS  44           HB1      LYS  44  10.369  -0.188   8.567
  347    HG2  LYS  44           HG2      LYS  44   9.911   2.722   9.209
  348    HG3  LYS  44           HG1      LYS  44   8.785   1.417   9.592
  349    HD2  LYS  44           HD2      LYS  44  10.415   0.366  11.028
  350    HD3  LYS  44           HD1      LYS  44  11.643   1.544  10.573
  351    HE2  LYS  44           HE2      LYS  44  10.665   1.992  12.770
  352    HE3  LYS  44           HE1      LYS  44  10.371   3.306  11.635
  353    HZ1  LYS  44           HZ1      LYS  44   8.438   2.769  12.973
  354    HZ2  LYS  44           HZ2      LYS  44   8.394   1.201  12.356
  355    HZ3  LYS  44           HZ3      LYS  44   8.126   2.519  11.346
  356    H    ILE  45           HN       ILE  45  12.364   1.719   5.495
  357    HA   ILE  45           HA       ILE  45  12.911  -1.049   4.769
  358    HB   ILE  45           HB       ILE  45  12.786   1.455   3.067
  359   HG12  ILE  45          HG12      ILE  45  10.575   0.778   4.023
  360   HG13  ILE  45          HG11      ILE  45  10.630   0.684   2.269
  361   HG21  ILE  45          HG21      ILE  45  13.016  -1.428   2.244
  362   HG22  ILE  45          HG22      ILE  45  14.241  -0.172   2.055
  363   HG23  ILE  45          HG23      ILE  45  12.719  -0.076   1.160
  364   HD11  ILE  45          HD11      ILE  45  10.946  -1.717   2.413
  365   HD12  ILE  45          HD12      ILE  45   9.447  -1.207   3.196
  366   HD13  ILE  45          HD13      ILE  45  10.859  -1.632   4.177
  367    HA   PRO  46           HA       PRO  46  17.280  -0.165   5.289
  368    HB2  PRO  46           HB2      PRO  46  18.247  -2.363   3.965
  369    HB3  PRO  46           HB1      PRO  46  17.690  -2.398   5.637
  370    HG2  PRO  46           HG2      PRO  46  16.294  -3.259   3.152
  371    HG3  PRO  46           HG1      PRO  46  16.264  -3.985   4.769
  372    HD2  PRO  46           HD2      PRO  46  14.257  -2.436   3.777
  373    HD3  PRO  46           HD1      PRO  46  14.629  -2.550   5.511
  374    H    TRP  47           HN       TRP  47  18.318   1.269   4.183
  375    HA   TRP  47           HA       TRP  47  18.707   2.735   2.618
  376    HB2  TRP  47           HB2      TRP  47  20.654   1.923   1.245
  377    HB3  TRP  47           HB1      TRP  47  20.799   1.819   2.986
  378    HD1  TRP  47           HD1      TRP  47  20.734  -0.322  -0.145
  379    HE1  TRP  47           HE1      TRP  47  21.310  -2.735   0.464
  380    HE3  TRP  47           HE3      TRP  47  20.645   0.088   4.946
  381    HZ2  TRP  47           HZ2      TRP  47  21.691  -4.280   2.792
  382    HZ3  TRP  47           HZ3      TRP  47  21.134  -1.908   6.289
  383    HH2  TRP  47           HH2      TRP  47  21.643  -4.047   5.229
  384    H    GLY  48           HN       GLY  48  18.708   0.012   0.540
  385    HA2  GLY  48           HA3      GLY  48  16.698   1.174  -1.200
  386    HA3  GLY  48           HA2      GLY  48  18.316   1.137  -1.890
  387    H    SER  49           HN       SER  49  17.197  -1.360   0.321
  388    HA   SER  49           HA       SER  49  17.849  -3.381  -1.542
  389    HB2  SER  49           HB2      SER  49  16.231  -3.611   0.993
  390    HB3  SER  49           HB1      SER  49  17.191  -4.867   0.206
  391    HG   SER  49           HG       SER  49  19.032  -3.843   0.750
  392    H    MET  50           HN       MET  50  15.150  -1.469  -1.108
  393    HA   MET  50           HA       MET  50  13.161  -3.324  -1.992
  394    HB2  MET  50           HB2      MET  50  11.719  -1.206  -2.191
  395    HB3  MET  50           HB1      MET  50  12.216  -1.744  -0.602
  396    HG2  MET  50           HG2      MET  50  12.326   0.668  -0.821
  397    HG3  MET  50           HG1      MET  50  13.896  -0.048  -0.496
  398    HE1  MET  50           HE1      MET  50  14.708   3.144  -2.695
  399    HE2  MET  50           HE2      MET  50  14.982   2.350  -1.144
  400    HE3  MET  50           HE3      MET  50  13.390   2.985  -1.535
  401    H    GLU  51           HN       GLU  51  15.484  -1.522  -3.598
  402    HA   GLU  51           HA       GLU  51  14.204  -0.860  -5.992
  403    HB2  GLU  51           HB3      GLU  51  16.977  -1.650  -5.318
  404    HB3  GLU  51           HB2      GLU  51  16.540  -1.111  -6.938
  405    HG2  GLU  51           HG3      GLU  51  15.823   1.059  -5.991
  406    HG3  GLU  51           HG2      GLU  51  16.272   0.491  -4.384
  407    H    LYS  52           HN       LYS  52  15.759  -3.775  -4.911
  408    HA   LYS  52           HA       LYS  52  15.341  -5.225  -7.410
  409    HB2  LYS  52           HB2      LYS  52  16.381  -6.142  -4.739
  410    HB3  LYS  52           HB1      LYS  52  16.415  -7.067  -6.228
  411    HG2  LYS  52           HG2      LYS  52  17.958  -5.469  -7.205
  412    HG3  LYS  52           HG1      LYS  52  17.885  -4.491  -5.731
  413    HD2  LYS  52           HD2      LYS  52  18.731  -6.359  -4.435
  414    HD3  LYS  52           HD1      LYS  52  18.786  -7.353  -5.886
  415    HE2  LYS  52           HE2      LYS  52  20.439  -5.831  -6.855
  416    HE3  LYS  52           HE1      LYS  52  20.386  -4.846  -5.389
  417    HZ1  LYS  52           HZ1      LYS  52  22.260  -6.388  -5.372
  418    HZ2  LYS  52           HZ2      LYS  52  21.218  -7.698  -5.503
  419    HZ3  LYS  52           HZ3      LYS  52  21.184  -6.723  -4.133
  420    H    ALA  53           HN       ALA  53  13.120  -4.303  -5.500
  421    HA   ALA  53           HA       ALA  53  11.955  -6.933  -4.964
  422    HB1  ALA  53           HB1      ALA  53  10.684  -5.832  -3.165
  423    HB2  ALA  53           HB2      ALA  53  11.499  -4.310  -3.569
  424    HB3  ALA  53           HB3      ALA  53  12.435  -5.657  -2.951
  425    H    GLY  54           HN       GLY  54  10.231  -7.439  -6.170
  426    HA2  GLY  54           HA3      GLY  54   8.939  -5.361  -7.727
  427    HA3  GLY  54           HA2      GLY  54   8.732  -7.106  -7.897
  428    HA   PRO  55           HA       PRO  55   5.101  -5.117  -5.640
  429    HB2  PRO  55           HB2      PRO  55   3.295  -6.929  -6.800
  430    HB3  PRO  55           HB1      PRO  55   3.556  -5.253  -7.285
  431    HG2  PRO  55           HG2      PRO  55   4.569  -7.753  -8.494
  432    HG3  PRO  55           HG1      PRO  55   4.222  -6.197  -9.255
  433    HD2  PRO  55           HD2      PRO  55   6.740  -7.101  -8.767
  434    HD3  PRO  55           HD1      PRO  55   6.328  -5.381  -8.806
  435    H    LEU  56           HN       LEU  56   5.763  -8.516  -6.208
  436    HA   LEU  56           HA       LEU  56   4.321  -9.469  -3.908
  437    HB2  LEU  56           HB2      LEU  56   6.539 -10.810  -5.461
  438    HB3  LEU  56           HB1      LEU  56   5.662 -11.574  -4.163
  439    HG   LEU  56           HG       LEU  56   3.575 -11.273  -5.597
  440   HD11  LEU  56          HD11      LEU  56   4.427  -9.624  -7.156
  441   HD12  LEU  56          HD12      LEU  56   3.925 -11.089  -8.007
  442   HD13  LEU  56          HD13      LEU  56   5.639 -10.771  -7.727
  443   HD21  LEU  56          HD21      LEU  56   4.096 -13.287  -6.908
  444   HD22  LEU  56          HD22      LEU  56   4.650 -13.403  -5.237
  445   HD23  LEU  56          HD23      LEU  56   5.808 -13.070  -6.520
  446    H    GLU  57           HN       GLU  57   7.752  -9.050  -4.564
  447    HA   GLU  57           HA       GLU  57   8.639  -9.715  -2.002
  448    HB2  GLU  57           HB3      GLU  57   9.969  -7.924  -4.045
  449    HB3  GLU  57           HB2      GLU  57  10.753  -8.550  -2.608
  450    HG2  GLU  57           HG3      GLU  57  11.479  -9.881  -4.452
  451    HG3  GLU  57           HG2      GLU  57  10.353 -10.861  -3.522
  452    H    MET  58           HN       MET  58   7.675  -6.647  -3.398
  453    HA   MET  58           HA       MET  58   8.376  -4.978  -1.255
  454    HB2  MET  58           HB2      MET  58   6.287  -4.737  -3.396
  455    HB3  MET  58           HB1      MET  58   6.441  -3.502  -2.160
  456    HG2  MET  58           HG2      MET  58   8.859  -4.323  -3.697
  457    HG3  MET  58           HG1      MET  58   7.674  -3.328  -4.514
  458    HE1  MET  58           HE1      MET  58   8.560  -3.071  -0.607
  459    HE2  MET  58           HE2      MET  58   9.909  -1.945  -0.666
  460    HE3  MET  58           HE3      MET  58  10.081  -3.564  -1.355
  461    H    ALA  59           HN       ALA  59   5.377  -6.705  -1.932
  462    HA   ALA  59           HA       ALA  59   3.905  -5.800   0.239
  463    HB1  ALA  59           HB1      ALA  59   2.550  -7.815  -0.067
  464    HB2  ALA  59           HB2      ALA  59   3.827  -8.534  -1.048
  465    HB3  ALA  59           HB3      ALA  59   2.969  -7.109  -1.629
  466    H    GLN  60           HN       GLN  60   6.150  -8.450  -0.043
  467    HA   GLN  60           HA       GLN  60   5.813  -9.476   2.576
  468    HB2  GLN  60           HB2      GLN  60   8.154  -9.796   0.711
  469    HB3  GLN  60           HB1      GLN  60   7.719 -10.828   2.075
  470    HG2  GLN  60           HG2      GLN  60   5.758 -11.595   0.980
  471    HG3  GLN  60           HG1      GLN  60   5.936 -10.385  -0.278
  472   HE21  GLN  60          HE21      GLN  60   5.781 -13.283  -0.516
  473   HE22  GLN  60          HE22      GLN  60   7.204 -13.758  -1.364
  474    H    LEU  61           HN       LEU  61   8.101  -7.189   1.121
  475    HA   LEU  61           HA       LEU  61   9.688  -6.845   3.421
  476    HB2  LEU  61           HB2      LEU  61   9.343  -5.377   0.892
  477    HB3  LEU  61           HB1      LEU  61   9.853  -4.366   2.224
  478    HG   LEU  61           HG       LEU  61  11.811  -5.893   2.551
  479   HD11  LEU  61          HD11      LEU  61  10.904  -7.137  -0.027
  480   HD12  LEU  61          HD12      LEU  61  10.947  -7.907   1.558
  481   HD13  LEU  61          HD13      LEU  61  12.450  -7.423   0.772
  482   HD21  LEU  61          HD21      LEU  61  12.060  -3.799   1.305
  483   HD22  LEU  61          HD22      LEU  61  11.595  -4.614  -0.183
  484   HD23  LEU  61          HD23      LEU  61  13.093  -5.049   0.628
  485    H    LEU  62           HN       LEU  62   6.931  -4.905   2.252
  486    HA   LEU  62           HA       LEU  62   6.867  -3.148   4.370
  487    HB2  LEU  62           HB2      LEU  62   4.681  -4.149   2.582
  488    HB3  LEU  62           HB1      LEU  62   4.323  -3.084   3.898
  489    HG   LEU  62           HG       LEU  62   5.529  -1.222   2.843
  490   HD11  LEU  62          HD11      LEU  62   6.324  -3.158   0.733
  491   HD12  LEU  62          HD12      LEU  62   7.388  -2.500   1.972
  492   HD13  LEU  62          HD13      LEU  62   6.663  -1.419   0.765
  493   HD21  LEU  62          HD21      LEU  62   3.251  -1.787   2.138
  494   HD22  LEU  62          HD22      LEU  62   3.935  -2.699   0.792
  495   HD23  LEU  62          HD23      LEU  62   4.204  -0.951   0.921
  496    H    ILE  63           HN       ILE  63   5.285  -6.291   4.035
  497    HA   ILE  63           HA       ILE  63   3.862  -6.181   6.471
  498    HB   ILE  63           HB       ILE  63   3.718  -7.824   4.369
  499   HG12  ILE  63          HG12      ILE  63   2.086  -7.604   6.162
  500   HG13  ILE  63          HG11      ILE  63   2.197  -9.247   5.557
  501   HG21  ILE  63          HG21      ILE  63   5.274  -9.524   6.301
  502   HG22  ILE  63          HG22      ILE  63   5.814  -8.985   4.714
  503   HG23  ILE  63          HG23      ILE  63   4.456 -10.106   4.849
  504   HD11  ILE  63          HD11      ILE  63   1.950  -9.265   7.975
  505   HD12  ILE  63          HD12      ILE  63   3.331  -8.180   8.137
  506   HD13  ILE  63          HD13      ILE  63   3.571  -9.824   7.549
  507    H    THR  64           HN       THR  64   7.144  -7.031   5.789
  508    HA   THR  64           HA       THR  64   7.601  -8.241   8.354
  509    HB   THR  64           HB       THR  64   9.484  -7.520   6.103
  510    HG1  THR  64           HG1      THR  64   8.266  -9.123   5.384
  511   HG21  THR  64          HG21      THR  64  11.110  -9.010   7.187
  512   HG22  THR  64          HG22      THR  64   9.987  -9.288   8.514
  513   HG23  THR  64          HG23      THR  64  10.682  -7.687   8.273
  514    H    HIS  65           HN       HIS  65   8.421  -5.197   6.755
  515    HA   HIS  65           HA       HIS  65   9.920  -4.273   9.036
  516    HB2  HIS  65           HB2      HIS  65   9.101  -2.781   6.529
  517    HB3  HIS  65           HB1      HIS  65  10.180  -2.155   7.766
  518    HD1  HIS  65           HD1      HIS  65  12.493  -3.687   8.050
  519    HD2  HIS  65           HD2      HIS  65  10.328  -4.051   4.542
  520    HE1  HIS  65           HE1      HIS  65  14.029  -4.789   6.407
  521    H    PHE  66           HN       PHE  66   6.872  -3.307   7.492
  522    HA   PHE  66           HA       PHE  66   6.244  -1.581   9.697
  523    HB2  PHE  66           HB2      PHE  66   4.636  -2.336   7.240
  524    HB3  PHE  66           HB1      PHE  66   4.222  -1.061   8.408
  525    HD1  PHE  66           HD2      PHE  66   5.843   0.768   8.746
  526    HD2  PHE  66           HD1      PHE  66   6.038  -1.938   5.524
  527    HE1  PHE  66           HE2      PHE  66   7.335   2.314   7.569
  528    HE2  PHE  66           HE1      PHE  66   7.542  -0.422   4.300
  529    HZ   PHE  66           HZ       PHE  66   8.201   1.691   5.313
  530    H    GLY  67           HN       GLY  67   4.159  -4.058   8.253
  531    HA2  GLY  67           HA3      GLY  67   3.892  -5.811  10.275
  532    HA3  GLY  67           HA2      GLY  67   2.863  -4.480  10.782
  533    HA   PRO  68           HA       PRO  68   0.742  -7.385   7.716
  534    HB2  PRO  68           HB2      PRO  68  -1.509  -7.769   9.277
  535    HB3  PRO  68           HB1      PRO  68  -0.135  -8.876   9.207
  536    HG2  PRO  68           HG2      PRO  68  -0.798  -6.787  11.227
  537    HG3  PRO  68           HG1      PRO  68  -0.081  -8.390  11.463
  538    HD2  PRO  68           HD2      PRO  68   1.389  -6.124  11.536
  539    HD3  PRO  68           HD1      PRO  68   2.049  -7.650  10.918
  540    H    GLU  69           HN       GLU  69  -0.659  -4.898   9.780
  541    HA   GLU  69           HA       GLU  69  -2.542  -4.224   7.639
  542    HB2  GLU  69           HB3      GLU  69  -2.397  -3.208  10.466
  543    HB3  GLU  69           HB2      GLU  69  -3.703  -2.934   9.321
  544    HG2  GLU  69           HG3      GLU  69  -4.176  -5.320   9.285
  545    HG3  GLU  69           HG2      GLU  69  -2.874  -5.593  10.443
  546    H    GLU  70           HN       GLU  70   0.165  -3.070   9.424
  547    HA   GLU  70           HA       GLU  70   0.100  -0.345   8.676
  548    HB2  GLU  70           HB3      GLU  70   1.509  -1.609  10.468
  549    HB3  GLU  70           HB2      GLU  70   2.623  -1.895   9.148
  550    HG2  GLU  70           HG3      GLU  70   3.387   0.033  10.304
  551    HG3  GLU  70           HG2      GLU  70   2.666   0.611   8.803
  552    H    ALA  71           HN       ALA  71   1.542  -3.238   7.238
  553    HA   ALA  71           HA       ALA  71   2.885  -2.162   5.070
  554    HB1  ALA  71           HB1      ALA  71   2.560  -4.326   4.002
  555    HB2  ALA  71           HB2      ALA  71   1.290  -4.717   5.163
  556    HB3  ALA  71           HB3      ALA  71   2.952  -4.514   5.709
  557    H    TRP  72           HN       TRP  72  -0.514  -3.218   5.225
  558    HA   TRP  72           HA       TRP  72  -1.120  -2.511   2.584
  559    HB2  TRP  72           HB2      TRP  72  -2.608  -4.028   3.685
  560    HB3  TRP  72           HB1      TRP  72  -2.906  -2.890   4.995
  561    HD1  TRP  72           HD1      TRP  72  -5.389  -2.266   4.798
  562    HE1  TRP  72           HE1      TRP  72  -6.930  -1.395   2.920
  563    HE3  TRP  72           HE3      TRP  72  -2.167  -2.590   0.873
  564    HZ2  TRP  72           HZ2      TRP  72  -6.788  -0.921   0.179
  565    HZ3  TRP  72           HZ3      TRP  72  -2.943  -1.913  -1.365
  566    HH2  TRP  72           HH2      TRP  72  -5.212  -1.091  -1.700
  567    H    ARG  73           HN       ARG  73  -1.484  -0.778   5.583
  568    HA   ARG  73           HA       ARG  73  -2.669   1.518   4.613
  569    HB2  ARG  73           HB2      ARG  73  -2.517   1.116   6.970
  570    HB3  ARG  73           HB1      ARG  73  -0.765   1.076   6.902
  571    HG2  ARG  73           HG2      ARG  73  -0.728   3.447   6.375
  572    HG3  ARG  73           HG1      ARG  73  -2.490   3.507   6.452
  573    HD2  ARG  73           HD2      ARG  73  -2.401   2.754   8.765
  574    HD3  ARG  73           HD1      ARG  73  -0.640   2.700   8.678
  575    HE   ARG  73           HE       ARG  73  -1.992   5.198   8.109
  576   HH11  ARG  73          HH11      ARG  73   0.153   3.305  10.219
  577   HH12  ARG  73          HH12      ARG  73   0.476   4.611  11.270
  578   HH21  ARG  73          HH21      ARG  73  -1.518   6.981   9.546
  579   HH22  ARG  73          HH22      ARG  73  -0.498   6.770  10.876
  580    H    LEU  74           HN       LEU  74   0.763   0.767   5.070
  581    HA   LEU  74           HA       LEU  74   1.881   3.110   4.110
  582    HB2  LEU  74           HB2      LEU  74   2.792   0.366   4.564
  583    HB3  LEU  74           HB1      LEU  74   3.717   1.237   3.366
  584    HG   LEU  74           HG       LEU  74   4.690   1.314   5.661
  585   HD11  LEU  74          HD11      LEU  74   5.149   3.712   5.668
  586   HD12  LEU  74          HD12      LEU  74   3.862   3.957   4.481
  587   HD13  LEU  74          HD13      LEU  74   5.284   2.989   4.073
  588   HD21  LEU  74          HD21      LEU  74   3.683   2.735   7.356
  589   HD22  LEU  74          HD22      LEU  74   2.573   1.429   6.918
  590   HD23  LEU  74          HD23      LEU  74   2.311   3.056   6.299
  591    H    ALA  75           HN       ALA  75   0.779   0.303   2.313
  592    HA   ALA  75           HA       ALA  75   1.825   1.251  -0.157
  593    HB1  ALA  75           HB1      ALA  75   1.316  -1.086   0.159
  594    HB2  ALA  75           HB2      ALA  75   0.437  -0.425  -1.210
  595    HB3  ALA  75           HB3      ALA  75  -0.401  -0.709   0.321
  596    H    LEU  76           HN       LEU  76  -1.528   1.222   1.120
  597    HA   LEU  76           HA       LEU  76  -2.550   2.552  -1.149
  598    HB2  LEU  76           HB2      LEU  76  -4.652   2.715  -0.044
  599    HB3  LEU  76           HB1      LEU  76  -3.945   1.185   0.400
  600    HG   LEU  76           HG       LEU  76  -3.198   2.585   2.546
  601   HD11  LEU  76          HD11      LEU  76  -4.144   4.705   1.804
  602   HD12  LEU  76          HD12      LEU  76  -4.965   4.123   3.251
  603   HD13  LEU  76          HD13      LEU  76  -5.741   3.961   1.676
  604   HD21  LEU  76          HD21      LEU  76  -4.474   0.565   2.632
  605   HD22  LEU  76          HD22      LEU  76  -5.891   1.376   2.006
  606   HD23  LEU  76          HD23      LEU  76  -5.296   1.768   3.633
  607    H    SER  77           HN       SER  77  -1.498   3.810   1.954
  608    HA   SER  77           HA       SER  77  -2.287   6.451   1.380
  609    HB2  SER  77           HB2      SER  77  -0.627   5.100   3.426
  610    HB3  SER  77           HB1      SER  77  -0.863   6.878   3.491
  611    HG   SER  77           HG       SER  77  -3.158   6.256   3.457
  612    H    THR  78           HN       THR  78   0.344   4.587   0.297
  613    HA   THR  78           HA       THR  78   1.811   7.010  -0.295
  614    HB   THR  78           HB       THR  78   2.662   4.114  -0.638
  615    HG1  THR  78           HG1      THR  78   2.961   4.366   1.376
  616   HG21  THR  78          HG21      THR  78   4.276   6.663  -0.916
  617   HG22  THR  78          HG22      THR  78   3.774   5.633  -2.255
  618   HG23  THR  78          HG23      THR  78   4.908   5.020  -1.048
  619    H    PHE  79           HN       PHE  79  -0.281   4.656  -1.712
  620    HA   PHE  79           HA       PHE  79   0.262   5.018  -4.418
  621    HB2  PHE  79           HB2      PHE  79  -2.435   4.630  -3.083
  622    HB3  PHE  79           HB1      PHE  79  -2.186   4.565  -4.821
  623    HD1  PHE  79           HD1      PHE  79   0.593   3.019  -4.294
  624    HD2  PHE  79           HD2      PHE  79  -3.471   2.459  -3.171
  625    HE1  PHE  79           HE1      PHE  79   0.980   0.624  -4.108
  626    HE2  PHE  79           HE2      PHE  79  -3.087   0.041  -2.976
  627    HZ   PHE  79           HZ       PHE  79  -0.860  -0.886  -3.444
  628    H    GLU  80           HN       GLU  80  -1.901   6.800  -2.253
  629    HA   GLU  80           HA       GLU  80  -2.715   8.757  -4.082
  630    HB2  GLU  80           HB3      GLU  80  -3.277  10.150  -2.082
  631    HB3  GLU  80           HB2      GLU  80  -3.932   8.519  -2.024
  632    HG2  GLU  80           HG3      GLU  80  -2.389   7.831  -0.443
  633    HG3  GLU  80           HG2      GLU  80  -1.354   9.237  -0.693
  634    H    ARG  81           HN       ARG  81   0.168   8.515  -2.141
  635    HA   ARG  81           HA       ARG  81   1.074  11.199  -2.348
  636    HB2  ARG  81           HB2      ARG  81   2.696   8.680  -2.059
  637    HB3  ARG  81           HB1      ARG  81   3.316  10.301  -1.857
  638    HG2  ARG  81           HG2      ARG  81   1.247   8.966  -0.128
  639    HG3  ARG  81           HG1      ARG  81   2.956   9.202   0.243
  640    HD2  ARG  81           HD2      ARG  81   2.000  10.929   1.403
  641    HD3  ARG  81           HD1      ARG  81   2.376  11.710  -0.136
  642    HE   ARG  81           HE       ARG  81  -0.259  10.603  -0.037
  643   HH11  ARG  81          HH11      ARG  81   1.672  13.459   0.799
  644   HH12  ARG  81          HH12      ARG  81   0.333  14.494   0.950
  645   HH21  ARG  81          HH21      ARG  81  -2.123  12.018   0.295
  646   HH22  ARG  81          HH22      ARG  81  -1.853  13.658   0.640
  647    H    ILE  82           HN       ILE  82   1.569   8.289  -4.269
  648    HA   ILE  82           HA       ILE  82   3.268   9.683  -6.131
  649    HB   ILE  82           HB       ILE  82   3.634   7.501  -7.200
  650   HG12  ILE  82          HG12      ILE  82   1.830   6.327  -5.069
  651   HG13  ILE  82          HG11      ILE  82   1.299   6.581  -6.738
  652   HG21  ILE  82          HG21      ILE  82   5.000   8.141  -5.290
  653   HG22  ILE  82          HG22      ILE  82   4.736   6.396  -5.288
  654   HG23  ILE  82          HG23      ILE  82   3.824   7.432  -4.189
  655   HD11  ILE  82          HD11      ILE  82   3.504   4.780  -5.764
  656   HD12  ILE  82          HD12      ILE  82   3.047   5.003  -7.454
  657   HD13  ILE  82          HD13      ILE  82   1.906   4.279  -6.316
  658    H    ASN  83           HN       ASN  83   0.346  10.160  -5.784
  659    HA   ASN  83           HA       ASN  83  -1.351  10.917  -6.965
  660    HB2  ASN  83           HB3      ASN  83   0.533  10.777  -9.303
  661    HB3  ASN  83           HB2      ASN  83  -1.067  11.529  -9.338
  662   HD21  ASN  83          HD21      ASN  83  -1.430  13.054  -7.728
  663   HD22  ASN  83          HD22      ASN  83  -0.220  14.232  -7.302
  664    H    ARG  84           HN       ARG  84  -0.805   8.220  -6.731
  665    HA   ARG  84           HA       ARG  84  -2.624   7.195  -8.766
  666    HB2  ARG  84           HB2      ARG  84  -0.581   5.951  -8.603
  667    HB3  ARG  84           HB1      ARG  84  -0.795   5.697  -6.886
  668    HG2  ARG  84           HG2      ARG  84  -1.371   3.664  -8.192
  669    HG3  ARG  84           HG1      ARG  84  -2.726   4.279  -7.242
  670    HD2  ARG  84           HD2      ARG  84  -3.574   3.691  -9.345
  671    HD3  ARG  84           HD1      ARG  84  -3.511   5.439  -9.277
  672    HE   ARG  84           HE       ARG  84  -1.116   4.391 -10.419
  673   HH11  ARG  84          HH11      ARG  84  -4.407   5.398 -11.367
  674   HH12  ARG  84          HH12      ARG  84  -4.089   5.145 -13.024
  675   HH21  ARG  84          HH21      ARG  84  -0.743   4.145 -12.552
  676   HH22  ARG  84          HH22      ARG  84  -1.943   4.437 -13.753
  677    H    LYS  85           HN       LYS  85  -4.236   8.430  -7.674
  678    HA   LYS  85           HA       LYS  85  -4.976   7.835  -5.026
  679    HB2  LYS  85           HB2      LYS  85  -6.756   9.357  -5.504
  680    HB3  LYS  85           HB1      LYS  85  -5.215  10.038  -6.007
  681    HG2  LYS  85           HG2      LYS  85  -5.685   9.706  -8.290
  682    HG3  LYS  85           HG1      LYS  85  -6.998   8.591  -7.938
  683    HD2  LYS  85           HD2      LYS  85  -8.236  10.513  -6.932
  684    HD3  LYS  85           HD1      LYS  85  -6.959  11.572  -7.547
  685    HE2  LYS  85           HE2      LYS  85  -8.919  11.420  -9.060
  686    HE3  LYS  85           HE1      LYS  85  -7.406  10.902  -9.806
  687    HZ1  LYS  85           HZ1      LYS  85  -8.072   8.621  -9.683
  688    HZ2  LYS  85           HZ2      LYS  85  -9.462   9.431 -10.167
  689    HZ3  LYS  85           HZ3      LYS  85  -9.280   8.957  -8.568
  690    H    ASP  86           HN       ASP  86  -5.505   6.608  -8.133
  691    HA   ASP  86           HA       ASP  86  -8.195   5.870  -8.053
  692    HB2  ASP  86           HB2      ASP  86  -6.056   4.424  -9.593
  693    HB3  ASP  86           HB1      ASP  86  -7.751   4.645 -10.026
  694    H    LEU  87           HN       LEU  87  -5.253   4.058  -7.390
  695    HA   LEU  87           HA       LEU  87  -6.755   1.708  -6.582
  696    HB2  LEU  87           HB2      LEU  87  -3.821   2.336  -6.222
  697    HB3  LEU  87           HB1      LEU  87  -4.559   0.809  -5.805
  698    HG   LEU  87           HG       LEU  87  -4.297   1.959  -8.578
  699   HD11  LEU  87          HD11      LEU  87  -2.946  -0.373  -7.235
  700   HD12  LEU  87          HD12      LEU  87  -2.202   1.175  -7.633
  701   HD13  LEU  87          HD13      LEU  87  -2.752   0.101  -8.921
  702   HD21  LEU  87          HD21      LEU  87  -6.342   0.663  -8.402
  703   HD22  LEU  87          HD22      LEU  87  -5.470  -0.668  -7.647
  704   HD23  LEU  87          HD23      LEU  87  -5.139  -0.234  -9.328
  705    H    TRP  88           HN       TRP  88  -5.614   4.522  -5.177
  706    HA   TRP  88           HA       TRP  88  -5.597   3.775  -2.453
  707    HB2  TRP  88           HB2      TRP  88  -4.414   5.708  -3.236
  708    HB3  TRP  88           HB1      TRP  88  -5.848   6.361  -3.964
  709    HD1  TRP  88           HD1      TRP  88  -4.415   5.693  -0.476
  710    HE1  TRP  88           HE1      TRP  88  -5.363   7.454   1.150
  711    HE3  TRP  88           HE3      TRP  88  -7.678   7.979  -3.622
  712    HZ2  TRP  88           HZ2      TRP  88  -7.288   9.519   1.095
  713    HZ3  TRP  88           HZ3      TRP  88  -9.044   9.832  -2.781
  714    HH2  TRP  88           HH2      TRP  88  -8.855  10.593  -0.468
  715    H    GLU  89           HN       GLU  89  -7.951   5.392  -4.553
  716    HA   GLU  89           HA       GLU  89 -10.145   5.551  -2.826
  717    HB2  GLU  89           HB3      GLU  89 -10.093   5.257  -5.842
  718    HB3  GLU  89           HB2      GLU  89 -11.519   5.675  -4.910
  719    HG2  GLU  89           HG3      GLU  89 -10.435   7.756  -4.197
  720    HG3  GLU  89           HG2      GLU  89  -8.993   7.301  -5.106
  721    H    ARG  90           HN       ARG  90  -9.072   2.992  -4.959
  722    HA   ARG  90           HA       ARG  90 -11.339   1.277  -4.520
  723    HB2  ARG  90           HB2      ARG  90  -8.574   0.525  -5.478
  724    HB3  ARG  90           HB1      ARG  90 -10.017  -0.469  -5.592
  725    HG2  ARG  90           HG2      ARG  90 -10.991   1.214  -7.106
  726    HG3  ARG  90           HG1      ARG  90  -9.479   2.114  -7.029
  727    HD2  ARG  90           HD2      ARG  90  -8.303   0.090  -7.860
  728    HD3  ARG  90           HD1      ARG  90  -9.875  -0.680  -8.046
  729    HE   ARG  90           HE       ARG  90  -9.804   1.781  -9.419
  730   HH11  ARG  90          HH11      ARG  90  -8.740  -1.580  -9.635
  731   HH12  ARG  90          HH12      ARG  90  -8.593  -1.610 -11.324
  732   HH21  ARG  90          HH21      ARG  90  -9.637   1.785 -11.742
  733   HH22  ARG  90          HH22      ARG  90  -9.122   0.395 -12.577
  734    H    GLY  91           HN       GLY  91  -8.173   1.657  -3.143
  735    HA2  GLY  91           HA3      GLY  91  -8.065  -0.652  -1.489
  736    HA3  GLY  91           HA2      GLY  91  -7.119   0.799  -1.383
  737    H    GLN  92           HN       GLN  92  -7.785   2.497  -0.196
  738    HA   GLN  92           HA       GLN  92  -8.376   3.409   1.776
  739    HB2  GLN  92           HB2      GLN  92 -11.002   1.950   1.425
  740    HB3  GLN  92           HB1      GLN  92 -10.734   3.398   2.372
  741    HG2  GLN  92           HG2      GLN  92 -10.195   4.592   0.237
  742    HG3  GLN  92           HG1      GLN  92 -10.684   3.137  -0.631
  743   HE21  GLN  92          HE21      GLN  92 -12.408   4.020  -1.633
  744   HE22  GLN  92          HE22      GLN  92 -13.839   4.557  -0.811
  745    H    ARG  93           HN       ARG  93  -9.507   2.744   4.009
  746    HA   ARG  93           HA       ARG  93  -8.353   0.118   4.617
  747    HB2  ARG  93           HB2      ARG  93  -7.999   0.872   6.885
  748    HB3  ARG  93           HB1      ARG  93  -7.209   1.957   5.752
  749    HG2  ARG  93           HG2      ARG  93  -8.983   3.568   6.013
  750    HG3  ARG  93           HG1      ARG  93  -9.863   2.463   7.065
  751    HD2  ARG  93           HD2      ARG  93  -7.125   3.542   7.602
  752    HD3  ARG  93           HD1      ARG  93  -8.645   4.193   8.253
  753    HE   ARG  93           HE       ARG  93  -8.925   2.261   9.528
  754   HH11  ARG  93          HH11      ARG  93  -5.744   2.257   7.911
  755   HH12  ARG  93          HH12      ARG  93  -5.068   1.133   8.995
  756   HH21  ARG  93          HH21      ARG  93  -7.964   0.754  11.003
  757   HH22  ARG  93          HH22      ARG  93  -6.354   0.259  10.799
  758    H    GLU  94           HN       GLU  94  -9.477  -1.169   6.069
  759    HA   GLU  94           HA       GLU  94 -12.242  -0.372   6.440
  760    HB2  GLU  94           HB3      GLU  94 -11.109  -3.165   6.062
  761    HB3  GLU  94           HB2      GLU  94 -12.799  -2.805   6.382
  762    HG2  GLU  94           HG3      GLU  94 -12.972  -1.616   4.274
  763    HG3  GLU  94           HG2      GLU  94 -11.265  -1.914   3.947
  764    H    ASP  95           HN       ASP  95 -12.509   0.126   8.498
  765    HA   ASP  95           HA       ASP  95 -10.656  -1.086  10.422
  766    HB2  ASP  95           HB2      ASP  95 -10.502   1.416   9.885
  767    HB3  ASP  95           HB1      ASP  95 -12.047   1.580  10.708
  768    H    LEU  96           HN       LEU  96 -12.240   0.155  12.631
  769    HA   LEU  96           HA       LEU  96 -13.873  -2.010  13.281
  770    HB2  LEU  96           HB2      LEU  96 -12.757  -0.469  14.874
  771    HB3  LEU  96           HB1      LEU  96 -13.856   0.797  14.392
  772    HG   LEU  96           HG       LEU  96 -15.733  -0.448  15.363
  773   HD11  LEU  96          HD11      LEU  96 -13.620  -2.438  16.203
  774   HD12  LEU  96          HD12      LEU  96 -14.916  -2.724  15.042
  775   HD13  LEU  96          HD13      LEU  96 -15.299  -2.430  16.736
  776   HD21  LEU  96          HD21      LEU  96 -13.392  -0.128  17.226
  777   HD22  LEU  96          HD22      LEU  96 -15.094  -0.167  17.690
  778   HD23  LEU  96          HD23      LEU  96 -14.474   1.156  16.704
  779    H    VAL  97           HN       VAL  97 -16.223  -1.894  13.714
  780    HA   VAL  97           HA       VAL  97 -18.275  -1.863  12.981
  781    HB   VAL  97           HB       VAL  97 -17.566   0.744  11.619
  782   HG11  VAL  97          HG11      VAL  97 -20.039   1.143  11.481
  783   HG12  VAL  97          HG12      VAL  97 -20.306  -0.481  12.122
  784   HG13  VAL  97          HG13      VAL  97 -19.544  -0.272  10.548
  785   HG21  VAL  97          HG21      VAL  97 -18.796   1.819  13.484
  786   HG22  VAL  97          HG22      VAL  97 -17.387   0.905  14.028
  787   HG23  VAL  97          HG23      VAL  97 -19.002   0.230  14.223
  788    H    ARG  98           HN       ARG  98 -17.755  -3.663  12.018
  789    HA   ARG  98           HA       ARG  98 -17.196  -3.658   9.140
  790    HB2  ARG  98           HB2      ARG  98 -16.827  -5.745  11.288
  791    HB3  ARG  98           HB1      ARG  98 -16.590  -6.050   9.570
  792    HG2  ARG  98           HG2      ARG  98 -15.139  -3.922  11.069
  793    HG3  ARG  98           HG1      ARG  98 -14.504  -5.570  10.900
  794    HD2  ARG  98           HD2      ARG  98 -15.187  -3.672   8.634
  795    HD3  ARG  98           HD1      ARG  98 -13.561  -4.063   9.203
  796    HE   ARG  98           HE       ARG  98 -14.559  -6.468   8.672
  797   HH11  ARG  98          HH11      ARG  98 -14.639  -3.582   6.656
  798   HH12  ARG  98          HH12      ARG  98 -14.378  -4.402   5.197
  799   HH21  ARG  98          HH21      ARG  98 -14.321  -7.619   6.706
  800   HH22  ARG  98          HH22      ARG  98 -14.237  -6.790   5.210
  801    H    ASP  99           HN       ASP  99 -19.663  -3.275  10.726
  802    HA   ASP  99           HA       ASP  99 -21.349  -5.533  10.149
  803    HB2  ASP  99           HB2      ASP  99 -22.190  -2.713  10.880
  804    HB3  ASP  99           HB1      ASP  99 -23.206  -4.146  10.920
  805    H    THR 100           HN       THR 100 -20.488  -5.457   7.906
  806    HA   THR 100           HA       THR 100 -21.824  -3.580   6.146
  807    HB   THR 100           HB       THR 100 -20.181  -6.031   5.403
  808    HG1  THR 100           HG1      THR 100 -19.478  -3.676   6.607
  809   HG21  THR 100          HG21      THR 100 -20.671  -3.398   3.966
  810   HG22  THR 100          HG22      THR 100 -21.450  -4.929   3.566
  811   HG23  THR 100          HG23      THR 100 -19.710  -4.745   3.352
  812    H    VAL 101           HN       VAL 101 -22.215  -6.664   7.521
  813    HA   VAL 101           HA       VAL 101 -23.987  -7.896   5.700
  814    HB   VAL 101           HB       VAL 101 -23.781  -8.308   8.699
  815   HG11  VAL 101          HG11      VAL 101 -24.642 -10.558   8.247
  816   HG12  VAL 101          HG12      VAL 101 -24.795 -10.142   6.541
  817   HG13  VAL 101          HG13      VAL 101 -25.778  -9.306   7.742
  818   HG21  VAL 101          HG21      VAL 101 -22.262  -9.695   6.487
  819   HG22  VAL 101          HG22      VAL 101 -22.212 -10.122   8.199
  820   HG23  VAL 101          HG23      VAL 101 -21.592  -8.563   7.661
  821    H    GLU 102           HN       GLU 102 -25.805  -6.904   5.132
  822    HA   GLU 102           HA       GLU 102 -27.828  -6.285   7.047
  823    HB2  GLU 102           HB3      GLU 102 -26.213  -4.203   6.806
  824    HB3  GLU 102           HB2      GLU 102 -26.935  -4.039   5.223
  825    HG2  GLU 102           HG3      GLU 102 -28.530  -3.986   7.784
  826    HG3  GLU 102           HG2      GLU 102 -27.868  -2.551   7.026
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1  -9.388 -11.637  14.099
    2    H2   GLY   1           HT2      GLY   1  -9.425 -11.431  12.414
    3    H3   GLY   1           HT3      GLY   1  -8.362 -10.531  13.384
    4    HA2  GLY   1           HA2      GLY   1  -8.219 -13.450  13.116
    5    HA3  GLY   1           HA3      GLY   1  -7.206 -12.307  12.241
    6    H    HIS   2           HN       HIS   2  -8.220 -13.126  15.573
    7    HA   HIS   2           HA       HIS   2  -5.692 -12.085  16.473
    8    HB2  HIS   2           HB2      HIS   2  -6.482 -12.643  18.816
    9    HB3  HIS   2           HB1      HIS   2  -7.486 -11.491  17.963
   10    HD1  HIS   2           HD1      HIS   2  -7.613 -14.684  19.792
   11    HD2  HIS   2           HD2      HIS   2 -10.018 -12.608  17.122
   12    HE1  HIS   2           HE1      HIS   2  -9.911 -15.673  20.013
   13    H    MET   3           HN       MET   3  -4.035 -13.160  16.143
   14    HA   MET   3           HA       MET   3  -2.505 -14.746  15.878
   15    HB2  MET   3           HB2      MET   3  -4.238 -16.391  17.758
   16    HB3  MET   3           HB1      MET   3  -2.673 -16.930  17.180
   17    HG2  MET   3           HG2      MET   3  -1.766 -14.768  18.207
   18    HG3  MET   3           HG1      MET   3  -3.309 -14.687  19.057
   19    HE1  MET   3           HE1      MET   3  -4.144 -16.669  20.782
   20    HE2  MET   3           HE2      MET   3  -3.201 -18.137  21.058
   21    HE3  MET   3           HE3      MET   3  -3.901 -17.828  19.474
   22    H    LEU   4           HN       LEU   4  -2.780 -17.576  15.583
   23    HA   LEU   4           HA       LEU   4  -3.396 -19.199  14.262
   24    HB2  LEU   4           HB2      LEU   4  -5.759 -18.547  14.589
   25    HB3  LEU   4           HB1      LEU   4  -5.622 -17.432  13.249
   26    HG   LEU   4           HG       LEU   4  -5.325 -19.302  11.697
   27   HD11  LEU   4          HD11      LEU   4  -5.664 -21.035  14.144
   28   HD12  LEU   4          HD12      LEU   4  -4.194 -20.877  13.176
   29   HD13  LEU   4          HD13      LEU   4  -5.635 -21.605  12.476
   30   HD21  LEU   4          HD21      LEU   4  -7.566 -20.205  11.864
   31   HD22  LEU   4          HD22      LEU   4  -7.575 -18.481  12.250
   32   HD23  LEU   4          HD23      LEU   4  -7.666 -19.678  13.539
   33    H    ARG   5           HN       ARG   5  -2.118 -19.737  12.805
   34    HA   ARG   5           HA       ARG   5  -0.870 -17.833  11.065
   35    HB2  ARG   5           HB2      ARG   5   0.193 -19.797  12.259
   36    HB3  ARG   5           HB1      ARG   5  -0.594 -20.818  11.084
   37    HG2  ARG   5           HG2      ARG   5   0.657 -19.794   9.294
   38    HG3  ARG   5           HG1      ARG   5   1.427 -18.690  10.443
   39    HD2  ARG   5           HD2      ARG   5   1.646 -21.693  10.368
   40    HD3  ARG   5           HD1      ARG   5   2.930 -20.522  10.051
   41    HE   ARG   5           HE       ARG   5   2.144 -19.893  12.550
   42   HH11  ARG   5          HH11      ARG   5   3.236 -22.938  11.103
   43   HH12  ARG   5          HH12      ARG   5   3.765 -23.581  12.594
   44   HH21  ARG   5          HH21      ARG   5   2.890 -20.799  14.558
   45   HH22  ARG   5          HH22      ARG   5   3.613 -22.340  14.570
   46    H    THR   6           HN       THR   6  -2.820 -20.770  10.569
   47    HA   THR   6           HA       THR   6  -3.112 -20.011   7.783
   48    HB   THR   6           HB       THR   6  -4.046 -22.535   9.152
   49    HG1  THR   6           HG1      THR   6  -1.846 -22.383   9.364
   50   HG21  THR   6          HG21      THR   6  -3.488 -21.892   6.239
   51   HG22  THR   6          HG22      THR   6  -5.089 -22.041   6.960
   52   HG23  THR   6          HG23      THR   6  -4.031 -23.449   6.868
   53    H    ALA   7           HN       ALA   7  -4.554 -18.395   7.830
   54    HA   ALA   7           HA       ALA   7  -7.320 -19.115   8.401
   55    HB1  ALA   7           HB1      ALA   7  -6.047 -16.623   9.534
   56    HB2  ALA   7           HB2      ALA   7  -6.525 -18.040  10.465
   57    HB3  ALA   7           HB3      ALA   7  -7.751 -17.065   9.653
   58    H    GLY   8           HN       GLY   8  -5.315 -16.330   7.514
   59    HA2  GLY   8           HA3      GLY   8  -5.390 -15.556   5.182
   60    HA3  GLY   8           HA2      GLY   8  -7.129 -15.867   5.235
   61    H    ARG   9           HN       ARG   9  -4.915 -13.452   5.439
   62    HA   ARG   9           HA       ARG   9  -6.685 -11.825   7.113
   63    HB2  ARG   9           HB2      ARG   9  -4.744 -12.713   8.429
   64    HB3  ARG   9           HB1      ARG   9  -3.676 -11.892   7.305
   65    HG2  ARG   9           HG2      ARG   9  -4.877  -9.757   7.940
   66    HG3  ARG   9           HG1      ARG   9  -5.601 -10.690   9.251
   67    HD2  ARG   9           HD2      ARG   9  -3.337 -11.271  10.021
   68    HD3  ARG   9           HD1      ARG   9  -2.718 -10.234   8.717
   69    HE   ARG   9           HE       ARG   9  -4.058  -8.416   9.811
   70   HH11  ARG   9          HH11      ARG   9  -2.535 -11.023  11.714
   71   HH12  ARG   9          HH12      ARG   9  -2.498 -10.092  13.134
   72   HH21  ARG   9          HH21      ARG   9  -3.977  -7.234  11.668
   73   HH22  ARG   9          HH22      ARG   9  -3.325  -7.832  13.136
   74    H    ASP  10           HN       ASP  10  -6.303  -9.526   6.751
   75    HA   ASP  10           HA       ASP  10  -5.686  -8.856   4.067
   76    HB2  ASP  10           HB2      ASP  10  -6.087  -7.005   6.436
   77    HB3  ASP  10           HB1      ASP  10  -6.063  -6.524   4.746
   78    H    GLY  11           HN       GLY  11  -4.057  -7.293   3.511
   79    HA2  GLY  11           HA3      GLY  11  -2.013  -6.170   4.307
   80    HA3  GLY  11           HA2      GLY  11  -1.663  -7.682   5.150
   81    H    LEU  12           HN       LEU  12  -0.870  -9.356   4.101
   82    HA   LEU  12           HA       LEU  12   0.846  -8.925   1.935
   83    HB2  LEU  12           HB2      LEU  12   0.770 -10.783   3.765
   84    HB3  LEU  12           HB1      LEU  12  -0.294 -11.604   2.667
   85    HG   LEU  12           HG       LEU  12   1.980 -12.506   2.570
   86   HD11  LEU  12          HD11      LEU  12   1.212 -11.152   0.002
   87   HD12  LEU  12          HD12      LEU  12   0.662 -12.731   0.566
   88   HD13  LEU  12          HD13      LEU  12   2.362 -12.478   0.167
   89   HD21  LEU  12          HD21      LEU  12   3.807 -11.209   1.605
   90   HD22  LEU  12          HD22      LEU  12   3.241 -10.529   3.130
   91   HD23  LEU  12          HD23      LEU  12   2.786  -9.774   1.603
   92    H    CYS  13           HN       CYS  13  -2.205 -10.657   2.068
   93    HA   CYS  13           HA       CYS  13  -2.586 -11.484  -0.512
   94    HB2  CYS  13           HB2      CYS  13  -4.564 -10.342   1.380
   95    HB3  CYS  13           HB1      CYS  13  -4.949 -11.486   0.073
   96    HG   CYS  13           HG       CYS  13  -4.192 -12.060   3.176
   97    H    ARG  14           HN       ARG  14  -3.596  -8.388   0.921
   98    HA   ARG  14           HA       ARG  14  -4.791  -7.385  -1.471
   99    HB2  ARG  14           HB2      ARG  14  -3.970  -5.972   1.059
  100    HB3  ARG  14           HB1      ARG  14  -4.802  -5.186  -0.268
  101    HG2  ARG  14           HG2      ARG  14  -6.670  -6.654   0.012
  102    HG3  ARG  14           HG1      ARG  14  -5.872  -7.465   1.384
  103    HD2  ARG  14           HD2      ARG  14  -5.775  -5.234   2.505
  104    HD3  ARG  14           HD1      ARG  14  -6.694  -4.569   1.164
  105    HE   ARG  14           HE       ARG  14  -7.838  -6.735   2.806
  106   HH11  ARG  14          HH11      ARG  14  -8.029  -3.374   1.635
  107   HH12  ARG  14          HH12      ARG  14  -9.496  -3.057   2.393
  108   HH21  ARG  14          HH21      ARG  14  -9.754  -6.334   3.811
  109   HH22  ARG  14          HH22      ARG  14 -10.600  -4.854   3.674
  110    H    LEU  15           HN       LEU  15  -1.690  -6.999   0.081
  111    HA   LEU  15           HA       LEU  15  -0.658  -4.981  -1.574
  112    HB2  LEU  15           HB2      LEU  15   0.616  -7.213  -0.087
  113    HB3  LEU  15           HB1      LEU  15   1.550  -5.894  -0.816
  114    HG   LEU  15           HG       LEU  15  -0.416  -5.763   1.458
  115   HD11  LEU  15          HD11      LEU  15   2.529  -5.216   1.469
  116   HD12  LEU  15          HD12      LEU  15   1.771  -6.722   1.986
  117   HD13  LEU  15          HD13      LEU  15   1.416  -5.222   2.840
  118   HD21  LEU  15          HD21      LEU  15   0.248  -3.403   1.650
  119   HD22  LEU  15          HD22      LEU  15  -0.607  -3.746   0.146
  120   HD23  LEU  15          HD23      LEU  15   1.146  -3.557   0.145
  121    H    SER  16           HN       SER  16  -0.488  -8.516  -1.749
  122    HA   SER  16           HA       SER  16   1.015  -8.614  -4.145
  123    HB2  SER  16           HB2      SER  16   0.933 -10.448  -2.450
  124    HB3  SER  16           HB1      SER  16  -0.751 -10.736  -2.866
  125    HG   SER  16           HG       SER  16  -0.152 -11.808  -4.534
  126    H    THR  17           HN       THR  17  -1.992  -7.497  -3.696
  127    HA   THR  17           HA       THR  17  -2.912  -8.351  -6.328
  128    HB   THR  17           HB       THR  17  -4.449  -6.995  -4.091
  129    HG1  THR  17           HG1      THR  17  -3.913  -9.184  -3.590
  130   HG21  THR  17          HG21      THR  17  -5.373  -6.491  -6.311
  131   HG22  THR  17          HG22      THR  17  -6.447  -7.576  -5.425
  132   HG23  THR  17          HG23      THR  17  -5.397  -8.211  -6.694
  133    H    TYR  18           HN       TYR  18  -2.867  -5.462  -4.240
  134    HA   TYR  18           HA       TYR  18  -3.355  -3.706  -6.399
  135    HB2  TYR  18           HB2      TYR  18  -2.729  -3.222  -3.505
  136    HB3  TYR  18           HB1      TYR  18  -2.940  -1.898  -4.652
  137    HD1  TYR  18           HD2      TYR  18  -4.626  -4.765  -3.048
  138    HD2  TYR  18           HD1      TYR  18  -5.085  -1.291  -5.447
  139    HE1  TYR  18           HE2      TYR  18  -7.082  -4.952  -2.844
  140    HE2  TYR  18           HE1      TYR  18  -7.511  -1.466  -5.258
  141    HH   TYR  18           HH       TYR  18  -9.092  -3.449  -3.049
  142    H    LEU  19           HN       LEU  19  -0.379  -4.744  -4.883
  143    HA   LEU  19           HA       LEU  19   1.030  -2.586  -6.114
  144    HB2  LEU  19           HB2      LEU  19   2.037  -5.053  -4.705
  145    HB3  LEU  19           HB1      LEU  19   3.095  -3.819  -5.360
  146    HG   LEU  19           HG       LEU  19   1.056  -3.365  -3.152
  147   HD11  LEU  19          HD11      LEU  19   2.980  -3.155  -1.694
  148   HD12  LEU  19          HD12      LEU  19   4.049  -3.575  -3.032
  149   HD13  LEU  19          HD13      LEU  19   2.900  -4.763  -2.417
  150   HD21  LEU  19          HD21      LEU  19   3.176  -1.531  -4.300
  151   HD22  LEU  19          HD22      LEU  19   2.164  -1.180  -2.903
  152   HD23  LEU  19          HD23      LEU  19   1.438  -1.336  -4.487
  153    H    GLU  20           HN       GLU  20  -0.152  -5.562  -7.212
  154    HA   GLU  20           HA       GLU  20   1.784  -5.718  -9.379
  155    HB2  GLU  20           HB3      GLU  20  -0.739  -7.336  -8.989
  156    HB3  GLU  20           HB2      GLU  20   0.507  -7.650 -10.187
  157    HG2  GLU  20           HG3      GLU  20   2.063  -7.901  -8.191
  158    HG3  GLU  20           HG2      GLU  20   0.590  -8.009  -7.225
  159    H    GLU  21           HN       GLU  21  -0.912  -3.987  -8.647
  160    HA   GLU  21           HA       GLU  21  -1.971  -3.747 -11.325
  161    HB2  GLU  21           HB3      GLU  21  -2.506  -2.139  -8.809
  162    HB3  GLU  21           HB2      GLU  21  -3.392  -1.985 -10.312
  163    HG2  GLU  21           HG3      GLU  21  -3.294  -4.495  -8.645
  164    HG3  GLU  21           HG2      GLU  21  -4.574  -3.287  -8.562
  165    H    LEU  22           HN       LEU  22   0.575  -2.561  -9.480
  166    HA   LEU  22           HA       LEU  22   0.685   0.056 -10.735
  167    HB2  LEU  22           HB2      LEU  22   2.591  -1.181  -8.741
  168    HB3  LEU  22           HB1      LEU  22   2.673   0.410  -9.456
  169    HG   LEU  22           HG       LEU  22   0.502  -0.567  -7.611
  170   HD11  LEU  22          HD11      LEU  22   1.488   1.077  -6.064
  171   HD12  LEU  22          HD12      LEU  22   2.814   1.323  -7.203
  172   HD13  LEU  22          HD13      LEU  22   2.580  -0.253  -6.445
  173   HD21  LEU  22          HD21      LEU  22   0.979   2.150  -8.841
  174   HD22  LEU  22          HD22      LEU  22  -0.204   1.770  -7.593
  175   HD23  LEU  22          HD23      LEU  22  -0.365   1.060  -9.194
  176    H    GLU  23           HN       GLU  23   2.675   0.824 -11.360
  177    HA   GLU  23           HA       GLU  23   3.751  -0.810 -13.526
  178    HB2  GLU  23           HB3      GLU  23   2.569   1.651 -13.396
  179    HB3  GLU  23           HB2      GLU  23   4.272   2.059 -13.271
  180    HG2  GLU  23           HG3      GLU  23   2.957   0.475 -15.370
  181    HG3  GLU  23           HG2      GLU  23   3.447   2.178 -15.508
  182    H    ALA  24           HN       ALA  24   6.121  -0.412 -13.891
  183    HA   ALA  24           HA       ALA  24   7.752  -0.755 -11.657
  184    HB1  ALA  24           HB1      ALA  24   9.630  -0.288 -13.177
  185    HB2  ALA  24           HB2      ALA  24   8.499   0.316 -14.386
  186    HB3  ALA  24           HB3      ALA  24   8.465  -1.384 -13.908
  187    H    VAL  25           HN       VAL  25   6.954   2.162 -13.500
  188    HA   VAL  25           HA       VAL  25   8.629   3.891 -12.019
  189    HB   VAL  25           HB       VAL  25   7.720   4.509 -14.251
  190   HG11  VAL  25          HG11      VAL  25   5.455   5.366 -14.484
  191   HG12  VAL  25          HG12      VAL  25   5.136   4.915 -12.808
  192   HG13  VAL  25          HG13      VAL  25   5.452   3.655 -14.016
  193   HG21  VAL  25          HG21      VAL  25   8.559   6.276 -12.793
  194   HG22  VAL  25          HG22      VAL  25   6.931   6.414 -12.097
  195   HG23  VAL  25          HG23      VAL  25   7.200   6.843 -13.783
  196    H    GLU  26           HN       GLU  26   5.347   2.837 -11.544
  197    HA   GLU  26           HA       GLU  26   4.642   4.618  -9.455
  198    HB2  GLU  26           HB3      GLU  26   3.657   1.901 -10.220
  199    HB3  GLU  26           HB2      GLU  26   2.885   2.911  -8.996
  200    HG2  GLU  26           HG3      GLU  26   3.324   3.766 -11.822
  201    HG3  GLU  26           HG2      GLU  26   1.835   2.943 -11.304
  202    H    LEU  27           HN       LEU  27   5.856   1.300  -9.548
  203    HA   LEU  27           HA       LEU  27   5.950   0.853  -6.829
  204    HB2  LEU  27           HB2      LEU  27   7.673  -0.301  -9.025
  205    HB3  LEU  27           HB1      LEU  27   7.651  -0.894  -7.376
  206    HG   LEU  27           HG       LEU  27   5.224  -0.870  -9.175
  207   HD11  LEU  27          HD11      LEU  27   7.114  -3.135  -8.546
  208   HD12  LEU  27          HD12      LEU  27   6.902  -2.337 -10.111
  209   HD13  LEU  27          HD13      LEU  27   5.582  -3.270  -9.414
  210   HD21  LEU  27          HD21      LEU  27   5.783  -2.245  -6.544
  211   HD22  LEU  27          HD22      LEU  27   4.322  -2.424  -7.512
  212   HD23  LEU  27          HD23      LEU  27   4.709  -0.865  -6.787
  213    H    LYS  28           HN       LYS  28   8.358   2.113  -9.050
  214    HA   LYS  28           HA       LYS  28  10.504   2.516  -7.355
  215    HB2  LYS  28           HB2      LYS  28  10.688   2.776  -9.752
  216    HB3  LYS  28           HB1      LYS  28   9.575   4.132  -9.728
  217    HG2  LYS  28           HG2      LYS  28  11.216   5.439  -8.450
  218    HG3  LYS  28           HG1      LYS  28  12.334   4.078  -8.519
  219    HD2  LYS  28           HD2      LYS  28  12.357   4.217 -10.963
  220    HD3  LYS  28           HD1      LYS  28  11.206   5.552 -10.904
  221    HE2  LYS  28           HE2      LYS  28  13.431   6.427 -11.230
  222    HE3  LYS  28           HE1      LYS  28  12.857   6.869  -9.626
  223    HZ1  LYS  28           HZ1      LYS  28  14.730   4.649 -10.243
  224    HZ2  LYS  28           HZ2      LYS  28  14.178   5.043  -8.706
  225    HZ3  LYS  28           HZ3      LYS  28  15.143   6.121  -9.543
  226    H    LYS  29           HN       LYS  29   7.782   4.616  -8.036
  227    HA   LYS  29           HA       LYS  29   8.776   6.752  -6.453
  228    HB2  LYS  29           HB2      LYS  29   6.032   6.284  -7.584
  229    HB3  LYS  29           HB1      LYS  29   6.535   7.793  -6.825
  230    HG2  LYS  29           HG2      LYS  29   8.388   7.922  -8.584
  231    HG3  LYS  29           HG1      LYS  29   7.626   6.546  -9.329
  232    HD2  LYS  29           HD2      LYS  29   6.145   9.119  -8.869
  233    HD3  LYS  29           HD1      LYS  29   7.121   8.833 -10.305
  234    HE2  LYS  29           HE2      LYS  29   4.943   8.297 -10.957
  235    HE3  LYS  29           HE1      LYS  29   5.691   6.739 -10.625
  236    HZ1  LYS  29           HZ1      LYS  29   3.825   8.216  -8.871
  237    HZ2  LYS  29           HZ2      LYS  29   4.553   6.716  -8.482
  238    HZ3  LYS  29           HZ3      LYS  29   3.519   6.851  -9.810
  239    H    PHE  30           HN       PHE  30   6.515   4.131  -5.826
  240    HA   PHE  30           HA       PHE  30   5.710   5.250  -3.343
  241    HB2  PHE  30           HB2      PHE  30   4.050   3.725  -3.469
  242    HB3  PHE  30           HB1      PHE  30   4.748   3.186  -4.978
  243    HD1  PHE  30           HD1      PHE  30   6.121   1.175  -5.033
  244    HD2  PHE  30           HD2      PHE  30   4.167   2.400  -1.474
  245    HE1  PHE  30           HE1      PHE  30   6.422  -1.085  -4.093
  246    HE2  PHE  30           HE2      PHE  30   4.472   0.169  -0.523
  247    HZ   PHE  30           HZ       PHE  30   5.599  -1.582  -1.827
  248    H    LYS  31           HN       LYS  31   8.179   2.919  -4.268
  249    HA   LYS  31           HA       LYS  31   8.828   2.217  -1.554
  250    HB2  LYS  31           HB2      LYS  31  10.710   1.024  -2.441
  251    HB3  LYS  31           HB1      LYS  31   9.360   0.745  -3.528
  252    HG2  LYS  31           HG2      LYS  31  10.244   2.340  -5.110
  253    HG3  LYS  31           HG1      LYS  31  11.537   2.774  -3.996
  254    HD2  LYS  31           HD2      LYS  31  12.325   0.412  -4.113
  255    HD3  LYS  31           HD1      LYS  31  11.113   0.134  -5.369
  256    HE2  LYS  31           HE2      LYS  31  12.158   1.760  -6.800
  257    HE3  LYS  31           HE1      LYS  31  13.278   2.216  -5.518
  258    HZ1  LYS  31           HZ1      LYS  31  13.118  -0.438  -6.811
  259    HZ2  LYS  31           HZ2      LYS  31  14.231   0.034  -5.625
  260    HZ3  LYS  31           HZ3      LYS  31  14.261   0.752  -7.150
  261    H    LEU  32           HN       LEU  32   9.915   4.770  -3.703
  262    HA   LEU  32           HA       LEU  32  12.042   5.323  -1.915
  263    HB2  LEU  32           HB2      LEU  32  12.502   7.327  -3.206
  264    HB3  LEU  32           HB1      LEU  32  12.302   5.960  -4.262
  265    HG   LEU  32           HG       LEU  32   9.884   6.935  -4.625
  266   HD11  LEU  32          HD11      LEU  32  11.314   9.393  -3.649
  267   HD12  LEU  32          HD12      LEU  32   9.937   8.614  -2.874
  268   HD13  LEU  32          HD13      LEU  32   9.749   9.357  -4.461
  269   HD21  LEU  32          HD21      LEU  32  11.590   6.787  -6.333
  270   HD22  LEU  32          HD22      LEU  32  12.364   8.234  -5.699
  271   HD23  LEU  32          HD23      LEU  32  10.760   8.346  -6.442
  272    H    TYR  33           HN       TYR  33   8.784   6.426  -2.353
  273    HA   TYR  33           HA       TYR  33   8.871   8.622  -0.676
  274    HB2  TYR  33           HB2      TYR  33   6.979   8.198  -2.176
  275    HB3  TYR  33           HB1      TYR  33   6.516   6.801  -1.206
  276    HD1  TYR  33           HD2      TYR  33   6.723  10.437  -1.293
  277    HD2  TYR  33           HD1      TYR  33   5.405   7.074   0.916
  278    HE1  TYR  33           HE2      TYR  33   5.446  11.928   0.212
  279    HE2  TYR  33           HE1      TYR  33   4.138   8.513   2.413
  280    HH   TYR  33           HH       TYR  33   4.245  10.873   3.151
  281    H    LEU  34           HN       LEU  34   7.723   5.349   0.149
  282    HA   LEU  34           HA       LEU  34   7.731   6.148   2.935
  283    HB2  LEU  34           HB2      LEU  34   6.782   3.904   3.378
  284    HB3  LEU  34           HB1      LEU  34   5.852   4.887   2.275
  285    HG   LEU  34           HG       LEU  34   6.858   3.505   0.391
  286   HD11  LEU  34          HD11      LEU  34   8.716   2.484   1.580
  287   HD12  LEU  34          HD12      LEU  34   7.625   1.260   0.931
  288   HD13  LEU  34          HD13      LEU  34   7.589   1.651   2.651
  289   HD21  LEU  34          HD21      LEU  34   5.235   1.729   0.692
  290   HD22  LEU  34          HD22      LEU  34   4.571   3.298   1.168
  291   HD23  LEU  34          HD23      LEU  34   5.085   2.145   2.399
  292    H    GLY  35           HN       GLY  35   9.904   4.586   0.842
  293    HA2  GLY  35           HA3      GLY  35  11.044   3.113   2.984
  294    HA3  GLY  35           HA2      GLY  35  11.629   3.092   1.320
  295    H    THR  36           HN       THR  36  11.900   6.001   1.165
  296    HA   THR  36           HA       THR  36  14.397   6.206   2.735
  297    HB   THR  36           HB       THR  36  15.120   7.980   1.212
  298    HG1  THR  36           HG1      THR  36  12.516   7.735   0.028
  299   HG21  THR  36          HG21      THR  36  15.483   5.686   0.415
  300   HG22  THR  36          HG22      THR  36  15.137   6.763  -0.946
  301   HG23  THR  36          HG23      THR  36  13.888   5.693  -0.337
  302    H    ALA  37           HN       ALA  37  11.368   6.934   3.207
  303    HA   ALA  37           HA       ALA  37  11.097   9.659   3.613
  304    HB1  ALA  37           HB1      ALA  37   9.154   9.116   4.937
  305    HB2  ALA  37           HB2      ALA  37   9.684   7.435   5.031
  306    HB3  ALA  37           HB3      ALA  37   9.229   8.130   3.477
  307    H    THR  38           HN       THR  38  12.358  10.837   4.831
  308    HA   THR  38           HA       THR  38  13.285   9.883   7.390
  309    HB   THR  38           HB       THR  38  13.638  12.633   6.154
  310    HG1  THR  38           HG1      THR  38  14.360  10.363   5.107
  311   HG21  THR  38          HG21      THR  38  15.704  12.655   7.497
  312   HG22  THR  38          HG22      THR  38  15.349  11.028   8.079
  313   HG23  THR  38          HG23      THR  38  14.305  12.371   8.536
  314    H    GLU  39           HN       GLU  39  10.668  11.466   6.035
  315    HA   GLU  39           HA       GLU  39   9.655  12.868   8.299
  316    HB2  GLU  39           HB3      GLU  39   7.500  12.824   7.059
  317    HB3  GLU  39           HB2      GLU  39   8.826  13.375   6.050
  318    HG2  GLU  39           HG3      GLU  39   8.946  11.229   4.959
  319    HG3  GLU  39           HG2      GLU  39   7.741  10.562   6.046
  320    H    LEU  40           HN       LEU  40   9.671   9.630   7.175
  321    HA   LEU  40           HA       LEU  40   7.581   8.665   8.918
  322    HB2  LEU  40           HB2      LEU  40   8.059   7.795   6.615
  323    HB3  LEU  40           HB1      LEU  40   9.576   7.176   7.221
  324    HG   LEU  40           HG       LEU  40   8.261   5.761   8.792
  325   HD11  LEU  40          HD11      LEU  40   6.149   7.011   8.716
  326   HD12  LEU  40          HD12      LEU  40   5.914   5.335   8.210
  327   HD13  LEU  40          HD13      LEU  40   5.999   6.617   7.000
  328   HD21  LEU  40          HD21      LEU  40   9.270   4.885   6.784
  329   HD22  LEU  40          HD22      LEU  40   7.867   5.384   5.838
  330   HD23  LEU  40          HD23      LEU  40   7.704   4.125   7.057
  331    H    GLY  41           HN       GLY  41  11.099   8.554   8.581
  332    HA2  GLY  41           HA3      GLY  41  11.639   8.640  11.270
  333    HA3  GLY  41           HA2      GLY  41  11.621   6.945  10.791
  334    H    GLU  42           HN       GLU  42  13.552   6.296  10.512
  335    HA   GLU  42           HA       GLU  42  15.748   7.879   9.519
  336    HB2  GLU  42           HB3      GLU  42  15.778   4.886   9.297
  337    HB3  GLU  42           HB2      GLU  42  17.049   5.953   9.838
  338    HG2  GLU  42           HG3      GLU  42  16.516   4.692  11.726
  339    HG3  GLU  42           HG2      GLU  42  15.644   6.194  12.001
  340    H    GLY  43           HN       GLY  43  13.743   5.261   8.528
  341    HA2  GLY  43           HA3      GLY  43  12.901   5.757   6.175
  342    HA3  GLY  43           HA2      GLY  43  14.471   4.924   5.941
  343    H    LYS  44           HN       LYS  44  13.290   3.092   5.535
  344    HA   LYS  44           HA       LYS  44  12.985   1.506   7.977
  345    HB2  LYS  44           HB2      LYS  44  10.758   1.683   5.943
  346    HB3  LYS  44           HB1      LYS  44  10.881   0.376   7.100
  347    HG2  LYS  44           HG2      LYS  44  10.855   3.175   8.109
  348    HG3  LYS  44           HG1      LYS  44   9.358   2.501   7.491
  349    HD2  LYS  44           HD2      LYS  44   9.367   2.138   9.882
  350    HD3  LYS  44           HD1      LYS  44   9.691   0.584   9.142
  351    HE2  LYS  44           HE2      LYS  44  11.119   0.868  11.065
  352    HE3  LYS  44           HE1      LYS  44  12.121   0.910   9.627
  353    HZ1  LYS  44           HZ1      LYS  44  11.200   3.280  11.172
  354    HZ2  LYS  44           HZ2      LYS  44  12.175   3.338   9.803
  355    HZ3  LYS  44           HZ3      LYS  44  12.767   2.679  11.200
  356    H    ILE  45           HN       ILE  45  12.944   1.556   4.517
  357    HA   ILE  45           HA       ILE  45  13.319  -1.252   4.197
  358    HB   ILE  45           HB       ILE  45  13.670   0.964   2.174
  359   HG12  ILE  45          HG12      ILE  45  11.434   1.021   3.233
  360   HG13  ILE  45          HG11      ILE  45  11.347   0.566   1.535
  361   HG21  ILE  45          HG21      ILE  45  13.123  -0.825   0.558
  362   HG22  ILE  45          HG22      ILE  45  13.186  -1.996   1.873
  363   HG23  ILE  45          HG23      ILE  45  14.644  -1.110   1.411
  364   HD11  ILE  45          HD11      ILE  45  11.142  -1.296   3.901
  365   HD12  ILE  45          HD12      ILE  45  11.196  -1.726   2.185
  366   HD13  ILE  45          HD13      ILE  45   9.835  -0.783   2.803
  367    HA   PRO  46           HA       PRO  46  17.762  -1.155   4.618
  368    HB2  PRO  46           HB2      PRO  46  18.254  -3.674   3.670
  369    HB3  PRO  46           HB1      PRO  46  17.711  -3.336   5.313
  370    HG2  PRO  46           HG2      PRO  46  16.161  -4.272   2.954
  371    HG3  PRO  46           HG1      PRO  46  15.989  -4.724   4.660
  372    HD2  PRO  46           HD2      PRO  46  14.347  -2.972   3.373
  373    HD3  PRO  46           HD1      PRO  46  14.661  -2.914   5.118
  374    H    TRP  47           HN       TRP  47  18.950  -0.078   3.339
  375    HA   TRP  47           HA       TRP  47  19.452   1.079   1.478
  376    HB2  TRP  47           HB2      TRP  47  21.552   0.021   0.624
  377    HB3  TRP  47           HB1      TRP  47  21.420   0.175   2.361
  378    HD1  TRP  47           HD1      TRP  47  21.827  -2.394  -0.379
  379    HE1  TRP  47           HE1      TRP  47  22.204  -4.715   0.657
  380    HE3  TRP  47           HE3      TRP  47  20.794  -1.284   4.506
  381    HZ2  TRP  47           HZ2      TRP  47  22.086  -5.921   3.205
  382    HZ3  TRP  47           HZ3      TRP  47  20.957  -3.084   6.181
  383    HH2  TRP  47           HH2      TRP  47  21.589  -5.350   5.540
  384    H    GLY  48           HN       GLY  48  19.451  -2.118   0.100
  385    HA2  GLY  48           HA3      GLY  48  18.145  -0.932  -2.263
  386    HA3  GLY  48           HA2      GLY  48  19.642  -1.821  -2.476
  387    H    SER  49           HN       SER  49  17.402  -2.985  -0.096
  388    HA   SER  49           HA       SER  49  17.133  -5.435  -1.446
  389    HB2  SER  49           HB2      SER  49  15.481  -4.282   0.795
  390    HB3  SER  49           HB1      SER  49  15.597  -5.988   0.345
  391    HG   SER  49           HG       SER  49  17.054  -5.851   1.860
  392    H    MET  50           HN       MET  50  15.368  -2.485  -1.547
  393    HA   MET  50           HA       MET  50  13.106  -3.742  -2.800
  394    HB2  MET  50           HB2      MET  50  12.180  -1.368  -2.983
  395    HB3  MET  50           HB1      MET  50  12.346  -2.064  -1.388
  396    HG2  MET  50           HG2      MET  50  12.974   0.245  -1.370
  397    HG3  MET  50           HG1      MET  50  14.338  -0.773  -1.002
  398    HE1  MET  50           HE1      MET  50  15.945   1.359  -1.395
  399    HE2  MET  50           HE2      MET  50  14.542   2.342  -1.825
  400    HE3  MET  50           HE3      MET  50  15.958   2.310  -2.881
  401    H    GLU  51           HN       GLU  51  15.952  -3.198  -3.966
  402    HA   GLU  51           HA       GLU  51  15.244  -1.959  -6.465
  403    HB2  GLU  51           HB3      GLU  51  17.718  -3.313  -5.462
  404    HB3  GLU  51           HB2      GLU  51  17.573  -2.728  -7.116
  405    HG2  GLU  51           HG3      GLU  51  17.241  -0.470  -6.309
  406    HG3  GLU  51           HG2      GLU  51  17.250  -1.041  -4.642
  407    H    LYS  52           HN       LYS  52  15.938  -5.191  -5.330
  408    HA   LYS  52           HA       LYS  52  15.240  -6.324  -7.893
  409    HB2  LYS  52           HB2      LYS  52  15.647  -8.544  -6.774
  410    HB3  LYS  52           HB1      LYS  52  17.019  -7.464  -6.767
  411    HG2  LYS  52           HG2      LYS  52  16.948  -8.564  -4.646
  412    HG3  LYS  52           HG1      LYS  52  16.463  -6.881  -4.417
  413    HD2  LYS  52           HD2      LYS  52  14.130  -7.528  -4.277
  414    HD3  LYS  52           HD1      LYS  52  14.529  -9.193  -4.658
  415    HE2  LYS  52           HE2      LYS  52  15.471  -7.721  -2.194
  416    HE3  LYS  52           HE1      LYS  52  14.048  -8.753  -2.242
  417    HZ1  LYS  52           HZ1      LYS  52  16.863  -9.615  -2.706
  418    HZ2  LYS  52           HZ2      LYS  52  15.506 -10.596  -2.886
  419    HZ3  LYS  52           HZ3      LYS  52  15.885  -9.979  -1.375
  420    H    ALA  53           HN       ALA  53  13.577  -5.133  -5.417
  421    HA   ALA  53           HA       ALA  53  11.656  -7.182  -4.983
  422    HB1  ALA  53           HB1      ALA  53  10.595  -5.633  -3.465
  423    HB2  ALA  53           HB2      ALA  53  11.619  -4.329  -4.060
  424    HB3  ALA  53           HB3      ALA  53  12.337  -5.689  -3.188
  425    H    GLY  54           HN       GLY  54   9.897  -7.544  -6.036
  426    HA2  GLY  54           HA3      GLY  54   8.751  -5.445  -7.708
  427    HA3  GLY  54           HA2      GLY  54   8.589  -7.197  -7.945
  428    HA   PRO  55           HA       PRO  55   4.816  -5.581  -5.679
  429    HB2  PRO  55           HB2      PRO  55   3.823  -7.993  -7.093
  430    HB3  PRO  55           HB1      PRO  55   3.054  -6.414  -6.897
  431    HG2  PRO  55           HG2      PRO  55   4.153  -7.107  -9.222
  432    HG3  PRO  55           HG1      PRO  55   4.297  -5.451  -8.606
  433    HD2  PRO  55           HD2      PRO  55   6.350  -7.626  -8.670
  434    HD3  PRO  55           HD1      PRO  55   6.544  -5.873  -8.851
  435    H    LEU  56           HN       LEU  56   5.977  -8.879  -6.141
  436    HA   LEU  56           HA       LEU  56   4.696 -10.035  -3.858
  437    HB2  LEU  56           HB2      LEU  56   5.449 -11.365  -5.762
  438    HB3  LEU  56           HB1      LEU  56   7.102 -10.895  -5.444
  439    HG   LEU  56           HG       LEU  56   7.022 -12.122  -3.311
  440   HD11  LEU  56          HD11      LEU  56   4.644 -11.998  -2.860
  441   HD12  LEU  56          HD12      LEU  56   5.170 -13.683  -2.901
  442   HD13  LEU  56          HD13      LEU  56   4.302 -12.993  -4.273
  443   HD21  LEU  56          HD21      LEU  56   6.286 -13.709  -5.762
  444   HD22  LEU  56          HD22      LEU  56   7.079 -14.354  -4.322
  445   HD23  LEU  56          HD23      LEU  56   7.898 -13.150  -5.324
  446    H    GLU  57           HN       GLU  57   8.049  -9.031  -4.438
  447    HA   GLU  57           HA       GLU  57   8.908  -9.607  -1.827
  448    HB2  GLU  57           HB3      GLU  57  10.066  -7.739  -3.872
  449    HB3  GLU  57           HB2      GLU  57  10.877  -8.133  -2.374
  450    HG2  GLU  57           HG3      GLU  57  11.864  -9.414  -4.122
  451    HG3  GLU  57           HG2      GLU  57  10.909 -10.518  -3.137
  452    H    MET  58           HN       MET  58   7.667  -6.711  -3.345
  453    HA   MET  58           HA       MET  58   8.140  -4.892  -1.256
  454    HB2  MET  58           HB2      MET  58   5.968  -4.948  -3.341
  455    HB3  MET  58           HB1      MET  58   6.218  -3.600  -2.245
  456    HG2  MET  58           HG2      MET  58   8.353  -4.647  -4.034
  457    HG3  MET  58           HG1      MET  58   7.231  -3.406  -4.606
  458    HE1  MET  58           HE1      MET  58  10.174  -2.935  -4.939
  459    HE2  MET  58           HE2      MET  58  10.442  -1.361  -4.192
  460    HE3  MET  58           HE3      MET  58   9.000  -1.636  -5.168
  461    H    ALA  59           HN       ALA  59   5.375  -7.014  -1.893
  462    HA   ALA  59           HA       ALA  59   3.760  -6.144   0.230
  463    HB1  ALA  59           HB1      ALA  59   2.595  -8.254  -0.014
  464    HB2  ALA  59           HB2      ALA  59   3.948  -8.938  -0.921
  465    HB3  ALA  59           HB3      ALA  59   2.996  -7.620  -1.608
  466    H    GLN  60           HN       GLN  60   6.258  -8.621   0.078
  467    HA   GLN  60           HA       GLN  60   5.927  -9.410   2.801
  468    HB2  GLN  60           HB2      GLN  60   8.319  -9.856   1.011
  469    HB3  GLN  60           HB1      GLN  60   7.963 -10.709   2.504
  470    HG2  GLN  60           HG2      GLN  60   5.815 -11.469   1.378
  471    HG3  GLN  60           HG1      GLN  60   6.500 -10.834  -0.100
  472   HE21  GLN  60          HE21      GLN  60   8.390 -12.429   2.392
  473   HE22  GLN  60          HE22      GLN  60   8.795 -13.820   1.474
  474    H    LEU  61           HN       LEU  61   7.931  -7.175   1.099
  475    HA   LEU  61           HA       LEU  61   9.835  -6.435   2.986
  476    HB2  LEU  61           HB2      LEU  61   9.559  -5.851   0.510
  477    HB3  LEU  61           HB1      LEU  61   8.430  -4.630   1.033
  478    HG   LEU  61           HG       LEU  61  10.314  -3.585   2.326
  479   HD11  LEU  61          HD11      LEU  61  11.773  -5.575   2.421
  480   HD12  LEU  61          HD12      LEU  61  12.580  -4.206   1.647
  481   HD13  LEU  61          HD13      LEU  61  11.911  -5.508   0.661
  482   HD21  LEU  61          HD21      LEU  61  10.581  -3.869  -0.663
  483   HD22  LEU  61          HD22      LEU  61  11.293  -2.587   0.315
  484   HD23  LEU  61          HD23      LEU  61   9.540  -2.728   0.191
  485    H    LEU  62           HN       LEU  62   6.764  -4.819   2.153
  486    HA   LEU  62           HA       LEU  62   6.686  -2.968   4.205
  487    HB2  LEU  62           HB2      LEU  62   4.491  -4.260   2.607
  488    HB3  LEU  62           HB1      LEU  62   4.161  -3.143   3.880
  489    HG   LEU  62           HG       LEU  62   5.017  -1.291   2.704
  490   HD11  LEU  62          HD11      LEU  62   6.160  -3.183   0.703
  491   HD12  LEU  62          HD12      LEU  62   7.061  -2.258   1.908
  492   HD13  LEU  62          HD13      LEU  62   6.191  -1.410   0.610
  493   HD21  LEU  62          HD21      LEU  62   3.770  -1.339   0.620
  494   HD22  LEU  62          HD22      LEU  62   2.864  -2.068   1.953
  495   HD23  LEU  62          HD23      LEU  62   3.645  -3.094   0.754
  496    H    ILE  63           HN       ILE  63   5.322  -6.236   4.037
  497    HA   ILE  63           HA       ILE  63   3.957  -6.092   6.500
  498    HB   ILE  63           HB       ILE  63   3.899  -7.865   4.459
  499   HG12  ILE  63          HG12      ILE  63   2.199  -7.545   6.222
  500   HG13  ILE  63          HG11      ILE  63   2.348  -9.218   5.719
  501   HG21  ILE  63          HG21      ILE  63   6.014  -8.924   4.960
  502   HG22  ILE  63          HG22      ILE  63   4.689 -10.080   5.142
  503   HG23  ILE  63          HG23      ILE  63   5.440  -9.356   6.567
  504   HD11  ILE  63          HD11      ILE  63   3.664  -9.662   7.751
  505   HD12  ILE  63          HD12      ILE  63   2.045  -9.060   8.113
  506   HD13  ILE  63          HD13      ILE  63   3.439  -7.983   8.241
  507    H    THR  64           HN       THR  64   7.278  -6.794   5.792
  508    HA   THR  64           HA       THR  64   7.876  -7.914   8.348
  509    HB   THR  64           HB       THR  64   9.730  -6.803   6.229
  510    HG1  THR  64           HG1      THR  64   8.555  -8.485   5.416
  511   HG21  THR  64          HG21      THR  64  10.824  -7.021   8.434
  512   HG22  THR  64          HG22      THR  64  11.449  -8.210   7.292
  513   HG23  THR  64          HG23      THR  64  10.292  -8.701   8.528
  514    H    HIS  65           HN       HIS  65   8.299  -4.735   6.856
  515    HA   HIS  65           HA       HIS  65   9.631  -3.730   9.218
  516    HB2  HIS  65           HB2      HIS  65   8.822  -2.253   6.712
  517    HB3  HIS  65           HB1      HIS  65   9.745  -1.554   8.038
  518    HD1  HIS  65           HD1      HIS  65  12.208  -2.660   8.432
  519    HD2  HIS  65           HD2      HIS  65  10.235  -3.640   4.912
  520    HE1  HIS  65           HE1      HIS  65  13.921  -3.734   6.955
  521    H    PHE  66           HN       PHE  66   6.559  -3.140   7.616
  522    HA   PHE  66           HA       PHE  66   5.749  -1.315   9.683
  523    HB2  PHE  66           HB2      PHE  66   4.326  -2.286   7.200
  524    HB3  PHE  66           HB1      PHE  66   3.768  -0.976   8.263
  525    HD1  PHE  66           HD2      PHE  66   5.389   0.893   8.683
  526    HD2  PHE  66           HD1      PHE  66   5.733  -1.841   5.481
  527    HE1  PHE  66           HE2      PHE  66   6.906   2.443   7.545
  528    HE2  PHE  66           HE1      PHE  66   7.260  -0.316   4.307
  529    HZ   PHE  66           HZ       PHE  66   7.857   1.821   5.338
  530    H    GLY  67           HN       GLY  67   4.263  -4.256   8.359
  531    HA2  GLY  67           HA3      GLY  67   3.739  -5.866  10.322
  532    HA3  GLY  67           HA2      GLY  67   2.744  -4.501  10.845
  533    HA   PRO  68           HA       PRO  68   0.535  -7.206   7.680
  534    HB2  PRO  68           HB2      PRO  68  -1.666  -7.764   9.213
  535    HB3  PRO  68           HB1      PRO  68  -0.238  -8.800   9.119
  536    HG2  PRO  68           HG2      PRO  68  -0.978  -6.787  11.205
  537    HG3  PRO  68           HG1      PRO  68  -0.276  -8.397  11.410
  538    HD2  PRO  68           HD2      PRO  68   1.209  -6.155  11.565
  539    HD3  PRO  68           HD1      PRO  68   1.863  -7.660  10.896
  540    H    GLU  69           HN       GLU  69  -1.224  -5.186  10.047
  541    HA   GLU  69           HA       GLU  69  -3.140  -4.306   8.178
  542    HB2  GLU  69           HB3      GLU  69  -2.383  -3.033  10.778
  543    HB3  GLU  69           HB2      GLU  69  -3.871  -2.826   9.886
  544    HG2  GLU  69           HG3      GLU  69  -2.951  -5.389  11.154
  545    HG3  GLU  69           HG2      GLU  69  -4.123  -4.216  11.752
  546    H    GLU  70           HN       GLU  70  -0.177  -3.111   9.575
  547    HA   GLU  70           HA       GLU  70  -0.303  -0.423   8.697
  548    HB2  GLU  70           HB3      GLU  70   1.041  -1.533  10.618
  549    HB3  GLU  70           HB2      GLU  70   2.250  -1.818   9.380
  550    HG2  GLU  70           HG3      GLU  70   2.756   0.208  10.583
  551    HG3  GLU  70           HG2      GLU  70   2.310   0.605   8.923
  552    H    ALA  71           HN       ALA  71   1.214  -3.327   7.304
  553    HA   ALA  71           HA       ALA  71   2.672  -2.096   5.205
  554    HB1  ALA  71           HB1      ALA  71   1.268  -4.764   5.234
  555    HB2  ALA  71           HB2      ALA  71   2.889  -4.452   5.848
  556    HB3  ALA  71           HB3      ALA  71   2.553  -4.272   4.130
  557    H    TRP  72           HN       TRP  72  -0.620  -3.340   5.373
  558    HA   TRP  72           HA       TRP  72  -1.358  -2.792   2.750
  559    HB2  TRP  72           HB2      TRP  72  -2.768  -4.219   4.084
  560    HB3  TRP  72           HB1      TRP  72  -3.028  -2.943   5.271
  561    HD1  TRP  72           HD1      TRP  72  -5.488  -2.206   5.064
  562    HE1  TRP  72           HE1      TRP  72  -7.073  -1.607   3.114
  563    HE3  TRP  72           HE3      TRP  72  -2.418  -3.282   1.231
  564    HZ2  TRP  72           HZ2      TRP  72  -6.982  -1.622   0.315
  565    HZ3  TRP  72           HZ3      TRP  72  -3.214  -3.041  -1.092
  566    HH2  TRP  72           HH2      TRP  72  -5.465  -2.188  -1.541
  567    H    ARG  73           HN       ARG  73  -1.706  -0.947   5.660
  568    HA   ARG  73           HA       ARG  73  -3.002   1.206   4.576
  569    HB2  ARG  73           HB2      ARG  73  -2.900   0.795   6.958
  570    HB3  ARG  73           HB1      ARG  73  -1.166   1.041   6.957
  571    HG2  ARG  73           HG2      ARG  73  -1.545   3.413   6.360
  572    HG3  ARG  73           HG1      ARG  73  -3.286   3.127   6.490
  573    HD2  ARG  73           HD2      ARG  73  -3.010   2.412   8.792
  574    HD3  ARG  73           HD1      ARG  73  -1.273   2.658   8.672
  575    HE   ARG  73           HE       ARG  73  -3.066   4.909   8.217
  576   HH11  ARG  73          HH11      ARG  73  -0.439   3.419  10.104
  577   HH12  ARG  73          HH12      ARG  73  -0.313   4.713  11.198
  578   HH21  ARG  73          HH21      ARG  73  -2.896   6.681   9.745
  579   HH22  ARG  73          HH22      ARG  73  -1.752   6.605  11.004
  580    H    LEU  74           HN       LEU  74   0.456   0.683   5.191
  581    HA   LEU  74           HA       LEU  74   1.476   3.086   4.256
  582    HB2  LEU  74           HB2      LEU  74   2.533   0.427   4.833
  583    HB3  LEU  74           HB1      LEU  74   3.441   1.291   3.614
  584    HG   LEU  74           HG       LEU  74   4.325   1.509   5.936
  585   HD11  LEU  74          HD11      LEU  74   3.475   4.049   4.561
  586   HD12  LEU  74          HD12      LEU  74   4.951   3.109   4.285
  587   HD13  LEU  74          HD13      LEU  74   4.710   3.924   5.818
  588   HD21  LEU  74          HD21      LEU  74   3.217   2.990   7.505
  589   HD22  LEU  74          HD22      LEU  74   2.164   1.621   7.116
  590   HD23  LEU  74          HD23      LEU  74   1.864   3.197   6.392
  591    H    ALA  75           HN       ALA  75   0.612   0.207   2.427
  592    HA   ALA  75           HA       ALA  75   1.782   1.113   0.007
  593    HB1  ALA  75           HB1      ALA  75  -0.510  -0.793   0.395
  594    HB2  ALA  75           HB2      ALA  75   1.208  -1.228   0.314
  595    HB3  ALA  75           HB3      ALA  75   0.396  -0.544  -1.095
  596    H    LEU  76           HN       LEU  76  -1.620   1.063   1.070
  597    HA   LEU  76           HA       LEU  76  -2.503   2.425  -1.220
  598    HB2  LEU  76           HB2      LEU  76  -4.687   2.570  -0.212
  599    HB3  LEU  76           HB1      LEU  76  -4.003   0.999   0.110
  600    HG   LEU  76           HG       LEU  76  -3.385   2.059   2.431
  601   HD11  LEU  76          HD11      LEU  76  -5.067   3.681   3.207
  602   HD12  LEU  76          HD12      LEU  76  -5.695   3.775   1.557
  603   HD13  LEU  76          HD13      LEU  76  -4.063   4.342   1.909
  604   HD21  LEU  76          HD21      LEU  76  -5.526   1.322   3.324
  605   HD22  LEU  76          HD22      LEU  76  -4.880   0.206   2.126
  606   HD23  LEU  76          HD23      LEU  76  -6.192   1.304   1.690
  607    H    SER  77           HN       SER  77  -1.515   3.643   1.895
  608    HA   SER  77           HA       SER  77  -2.489   6.275   1.459
  609    HB2  SER  77           HB2      SER  77  -1.259   6.801   3.526
  610    HB3  SER  77           HB1      SER  77  -2.124   5.248   3.629
  611    HG   SER  77           HG       SER  77  -0.364   4.171   3.653
  612    H    THR  78           HN       THR  78   0.281   4.578   0.376
  613    HA   THR  78           HA       THR  78   1.685   7.029  -0.208
  614    HB   THR  78           HB       THR  78   2.459   4.134  -0.658
  615    HG1  THR  78           HG1      THR  78   2.727   4.325   1.385
  616   HG21  THR  78          HG21      THR  78   4.735   5.012  -1.024
  617   HG22  THR  78          HG22      THR  78   4.123   6.658  -0.883
  618   HG23  THR  78          HG23      THR  78   3.617   5.645  -2.231
  619    H    PHE  79           HN       PHE  79  -0.440   4.741  -1.664
  620    HA   PHE  79           HA       PHE  79   0.179   5.080  -4.346
  621    HB2  PHE  79           HB2      PHE  79  -2.486   4.575  -3.023
  622    HB3  PHE  79           HB1      PHE  79  -2.297   4.589  -4.776
  623    HD1  PHE  79           HD2      PHE  79   0.595   3.144  -4.269
  624    HD2  PHE  79           HD1      PHE  79  -3.466   2.381  -3.240
  625    HE1  PHE  79           HE2      PHE  79   1.082   0.768  -4.110
  626    HE2  PHE  79           HE1      PHE  79  -2.979  -0.016  -3.081
  627    HZ   PHE  79           HZ       PHE  79  -0.699  -0.834  -3.522
  628    H    GLU  80           HN       GLU  80  -2.120   6.865  -2.297
  629    HA   GLU  80           HA       GLU  80  -2.957   8.735  -4.218
  630    HB2  GLU  80           HB3      GLU  80  -3.686  10.136  -2.307
  631    HB3  GLU  80           HB2      GLU  80  -4.168   8.458  -2.119
  632    HG2  GLU  80           HG3      GLU  80  -2.533   8.061  -0.503
  633    HG3  GLU  80           HG2      GLU  80  -1.678   9.553  -0.892
  634    H    ARG  81           HN       ARG  81  -0.221   8.722  -2.076
  635    HA   ARG  81           HA       ARG  81   0.654  11.382  -2.318
  636    HB2  ARG  81           HB2      ARG  81   2.184   8.869  -1.719
  637    HB3  ARG  81           HB1      ARG  81   2.833  10.489  -1.546
  638    HG2  ARG  81           HG2      ARG  81   0.354   9.612  -0.097
  639    HG3  ARG  81           HG1      ARG  81   1.971   9.306   0.518
  640    HD2  ARG  81           HD2      ARG  81   1.072  11.301   1.531
  641    HD3  ARG  81           HD1      ARG  81   2.439  11.687   0.496
  642    HE   ARG  81           HE       ARG  81  -0.236  12.026  -0.622
  643   HH11  ARG  81          HH11      ARG  81   2.597  13.523   0.875
  644   HH12  ARG  81          HH12      ARG  81   2.245  15.099   0.390
  645   HH21  ARG  81          HH21      ARG  81  -0.784  14.140  -1.282
  646   HH22  ARG  81          HH22      ARG  81   0.200  15.477  -0.939
  647    H    ILE  82           HN       ILE  82   1.383   8.453  -4.121
  648    HA   ILE  82           HA       ILE  82   3.223   9.903  -5.821
  649    HB   ILE  82           HB       ILE  82   3.743   7.741  -6.861
  650   HG12  ILE  82          HG12      ILE  82   1.802   6.518  -4.880
  651   HG13  ILE  82          HG11      ILE  82   1.426   6.755  -6.588
  652   HG21  ILE  82          HG21      ILE  82   4.963   8.429  -4.878
  653   HG22  ILE  82          HG22      ILE  82   4.745   6.675  -4.867
  654   HG23  ILE  82          HG23      ILE  82   3.734   7.700  -3.845
  655   HD11  ILE  82          HD11      ILE  82   3.249   5.223  -7.151
  656   HD12  ILE  82          HD12      ILE  82   2.053   4.474  -6.090
  657   HD13  ILE  82          HD13      ILE  82   3.594   5.027  -5.432
  658    H    ASN  83           HN       ASN  83   0.228  10.263  -5.800
  659    HA   ASN  83           HA       ASN  83  -1.347  10.974  -7.267
  660    HB2  ASN  83           HB3      ASN  83   0.660  12.010  -8.427
  661    HB3  ASN  83           HB2      ASN  83   0.720  10.591  -9.453
  662   HD21  ASN  83          HD21      ASN  83  -2.246  12.250  -8.408
  663   HD22  ASN  83          HD22      ASN  83  -2.701  12.779  -9.974
  664    H    ARG  84           HN       ARG  84  -0.965   8.221  -6.620
  665    HA   ARG  84           HA       ARG  84  -2.401   7.005  -8.847
  666    HB2  ARG  84           HB2      ARG  84  -0.252   5.953  -8.283
  667    HB3  ARG  84           HB1      ARG  84  -0.746   5.795  -6.615
  668    HG2  ARG  84           HG2      ARG  84  -0.809   3.693  -7.987
  669    HG3  ARG  84           HG1      ARG  84  -2.292   4.083  -7.118
  670    HD2  ARG  84           HD2      ARG  84  -2.702   3.305  -9.406
  671    HD3  ARG  84           HD1      ARG  84  -3.285   4.940  -9.087
  672    HE   ARG  84           HE       ARG  84  -0.645   4.929 -10.201
  673   HH11  ARG  84          HH11      ARG  84  -4.011   4.434 -11.172
  674   HH12  ARG  84          HH12      ARG  84  -3.891   5.200 -12.676
  675   HH21  ARG  84          HH21      ARG  84  -0.426   5.991 -12.307
  676   HH22  ARG  84          HH22      ARG  84  -1.767   6.089 -13.356
  677    H    LYS  85           HN       LYS  85  -4.025   8.501  -7.785
  678    HA   LYS  85           HA       LYS  85  -4.982   7.834  -5.170
  679    HB2  LYS  85           HB2      LYS  85  -4.933  10.161  -6.051
  680    HB3  LYS  85           HB1      LYS  85  -6.131   9.708  -7.255
  681    HG2  LYS  85           HG2      LYS  85  -7.730   9.221  -5.465
  682    HG3  LYS  85           HG1      LYS  85  -6.517   9.669  -4.266
  683    HD2  LYS  85           HD2      LYS  85  -7.965  11.542  -4.525
  684    HD3  LYS  85           HD1      LYS  85  -6.454  11.947  -5.335
  685    HE2  LYS  85           HE2      LYS  85  -8.279  12.656  -6.713
  686    HE3  LYS  85           HE1      LYS  85  -7.505  11.285  -7.497
  687    HZ1  LYS  85           HZ1      LYS  85 -10.006  11.199  -5.898
  688    HZ2  LYS  85           HZ2      LYS  85  -9.345   9.850  -6.667
  689    HZ3  LYS  85           HZ3      LYS  85  -9.916  11.140  -7.563
  690    H    ASP  86           HN       ASP  86  -5.565   6.994  -8.420
  691    HA   ASP  86           HA       ASP  86  -8.213   6.253  -8.362
  692    HB2  ASP  86           HB2      ASP  86  -6.983   6.457 -10.445
  693    HB3  ASP  86           HB1      ASP  86  -5.934   5.127 -10.000
  694    H    LEU  87           HN       LEU  87  -5.293   4.339  -7.905
  695    HA   LEU  87           HA       LEU  87  -6.612   1.897  -7.238
  696    HB2  LEU  87           HB2      LEU  87  -4.266   2.236  -8.214
  697    HB3  LEU  87           HB1      LEU  87  -3.798   2.673  -6.579
  698    HG   LEU  87           HG       LEU  87  -4.458   0.482  -5.817
  699   HD11  LEU  87          HD11      LEU  87  -4.846  -0.016  -8.774
  700   HD12  LEU  87          HD12      LEU  87  -6.096  -0.103  -7.529
  701   HD13  LEU  87          HD13      LEU  87  -4.790  -1.285  -7.555
  702   HD21  LEU  87          HD21      LEU  87  -2.544  -0.675  -6.819
  703   HD22  LEU  87          HD22      LEU  87  -2.185   0.998  -6.374
  704   HD23  LEU  87          HD23      LEU  87  -2.477   0.583  -8.060
  705    H    TRP  88           HN       TRP  88  -5.488   4.663  -5.532
  706    HA   TRP  88           HA       TRP  88  -5.410   3.644  -2.917
  707    HB2  TRP  88           HB2      TRP  88  -4.374   5.724  -3.426
  708    HB3  TRP  88           HB1      TRP  88  -5.847   6.373  -4.088
  709    HD1  TRP  88           HD1      TRP  88  -4.454   5.346  -0.628
  710    HE1  TRP  88           HE1      TRP  88  -5.577   6.859   1.159
  711    HE3  TRP  88           HE3      TRP  88  -7.683   7.852  -3.613
  712    HZ2  TRP  88           HZ2      TRP  88  -7.572   8.823   1.252
  713    HZ3  TRP  88           HZ3      TRP  88  -9.170   9.532  -2.616
  714    HH2  TRP  88           HH2      TRP  88  -9.111  10.006  -0.246
  715    H    GLU  89           HN       GLU  89  -7.968   5.331  -4.717
  716    HA   GLU  89           HA       GLU  89 -10.034   5.160  -2.835
  717    HB2  GLU  89           HB3      GLU  89 -10.145   5.192  -5.852
  718    HB3  GLU  89           HB2      GLU  89 -11.551   5.360  -4.817
  719    HG2  GLU  89           HG3      GLU  89 -10.637   7.429  -3.901
  720    HG3  GLU  89           HG2      GLU  89  -9.192   7.227  -4.894
  721    H    ARG  90           HN       ARG  90  -8.872   2.895  -5.177
  722    HA   ARG  90           HA       ARG  90 -10.943   0.946  -4.903
  723    HB2  ARG  90           HB2      ARG  90  -8.123   0.732  -5.953
  724    HB3  ARG  90           HB1      ARG  90  -9.284  -0.583  -5.991
  725    HG2  ARG  90           HG2      ARG  90 -10.718   0.670  -7.463
  726    HG3  ARG  90           HG1      ARG  90  -9.662   2.075  -7.344
  727    HD2  ARG  90           HD2      ARG  90  -9.368   0.739  -9.423
  728    HD3  ARG  90           HD1      ARG  90  -7.894   0.924  -8.477
  729    HE   ARG  90           HE       ARG  90  -9.203  -1.469  -7.770
  730   HH11  ARG  90          HH11      ARG  90  -7.492  -0.130 -10.583
  731   HH12  ARG  90          HH12      ARG  90  -6.793  -1.602 -11.025
  732   HH21  ARG  90          HH21      ARG  90  -8.233  -3.481  -8.381
  733   HH22  ARG  90          HH22      ARG  90  -7.144  -3.538  -9.727
  734    H    GLY  91           HN       GLY  91  -7.912   1.585  -3.337
  735    HA2  GLY  91           HA3      GLY  91  -7.533  -0.934  -2.082
  736    HA3  GLY  91           HA2      GLY  91  -6.681   0.560  -1.737
  737    H    GLN  92           HN       GLN  92  -8.347   2.229  -0.673
  738    HA   GLN  92           HA       GLN  92  -8.742   1.055   1.886
  739    HB2  GLN  92           HB2      GLN  92  -9.650   3.279   2.573
  740    HB3  GLN  92           HB1      GLN  92  -8.047   3.339   1.861
  741    HG2  GLN  92           HG2      GLN  92  -8.970   4.157  -0.222
  742    HG3  GLN  92           HG1      GLN  92 -10.604   3.990   0.413
  743   HE21  GLN  92          HE21      GLN  92  -7.950   5.141   2.349
  744   HE22  GLN  92          HE22      GLN  92  -8.499   6.757   2.485
  745    H    ARG  93           HN       ARG  93 -10.066  -0.334   2.165
  746    HA   ARG  93           HA       ARG  93 -12.898   0.230   1.649
  747    HB2  ARG  93           HB2      ARG  93 -11.947  -1.060  -0.256
  748    HB3  ARG  93           HB1      ARG  93 -11.542  -2.352   0.861
  749    HG2  ARG  93           HG2      ARG  93 -13.560  -2.842  -0.372
  750    HG3  ARG  93           HG1      ARG  93 -13.904  -2.667   1.353
  751    HD2  ARG  93           HD2      ARG  93 -14.631  -0.366   0.957
  752    HD3  ARG  93           HD1      ARG  93 -14.327  -0.570  -0.766
  753    HE   ARG  93           HE       ARG  93 -15.972  -2.631   0.090
  754   HH11  ARG  93          HH11      ARG  93 -16.194   0.889  -0.335
  755   HH12  ARG  93          HH12      ARG  93 -17.862   0.902  -0.620
  756   HH21  ARG  93          HH21      ARG  93 -18.267  -2.624  -0.279
  757   HH22  ARG  93          HH22      ARG  93 -19.114  -1.181  -0.591
  758    H    GLU  94           HN       GLU  94 -10.426  -1.132   3.524
  759    HA   GLU  94           HA       GLU  94 -11.922  -2.988   5.072
  760    HB2  GLU  94           HB3      GLU  94  -9.899  -3.175   6.425
  761    HB3  GLU  94           HB2      GLU  94  -9.513  -3.272   4.716
  762    HG2  GLU  94           HG3      GLU  94  -9.008  -0.979   6.612
  763    HG3  GLU  94           HG2      GLU  94  -7.814  -2.014   5.843
  764    H    ASP  95           HN       ASP  95 -11.829   0.315   5.049
  765    HA   ASP  95           HA       ASP  95 -12.282   0.811   7.835
  766    HB2  ASP  95           HB2      ASP  95 -11.454   2.615   6.392
  767    HB3  ASP  95           HB1      ASP  95 -12.892   2.488   5.396
  768    H    LEU  96           HN       LEU  96 -13.991  -0.086   5.238
  769    HA   LEU  96           HA       LEU  96 -16.575   0.523   6.411
  770    HB2  LEU  96           HB2      LEU  96 -16.169   1.196   4.070
  771    HB3  LEU  96           HB1      LEU  96 -15.965  -0.485   3.633
  772    HG   LEU  96           HG       LEU  96 -18.551   0.357   4.869
  773   HD11  LEU  96          HD11      LEU  96 -19.385   0.914   2.606
  774   HD12  LEU  96          HD12      LEU  96 -17.753   0.715   1.961
  775   HD13  LEU  96          HD13      LEU  96 -18.102   2.017   3.100
  776   HD21  LEU  96          HD21      LEU  96 -17.788  -1.620   2.731
  777   HD22  LEU  96          HD22      LEU  96 -19.414  -1.350   3.347
  778   HD23  LEU  96          HD23      LEU  96 -18.164  -1.989   4.417
  779    H    VAL  97           HN       VAL  97 -17.561  -0.829   7.496
  780    HA   VAL  97           HA       VAL  97 -16.700  -3.565   7.780
  781    HB   VAL  97           HB       VAL  97 -18.839  -1.919   9.126
  782   HG11  VAL  97          HG11      VAL  97 -18.826  -3.652  10.913
  783   HG12  VAL  97          HG12      VAL  97 -17.662  -4.589   9.978
  784   HG13  VAL  97          HG13      VAL  97 -19.295  -4.344   9.359
  785   HG21  VAL  97          HG21      VAL  97 -16.054  -2.629  10.038
  786   HG22  VAL  97          HG22      VAL  97 -17.245  -1.759  11.004
  787   HG23  VAL  97          HG23      VAL  97 -16.621  -1.046   9.518
  788    H    ARG  98           HN       ARG  98 -18.120  -5.380   7.506
  789    HA   ARG  98           HA       ARG  98 -19.639  -6.692   6.515
  790    HB2  ARG  98           HB2      ARG  98 -21.337  -5.216   7.627
  791    HB3  ARG  98           HB1      ARG  98 -21.339  -4.179   6.211
  792    HG2  ARG  98           HG2      ARG  98 -22.187  -6.088   4.875
  793    HG3  ARG  98           HG1      ARG  98 -22.286  -7.042   6.359
  794    HD2  ARG  98           HD2      ARG  98 -23.854  -5.452   7.299
  795    HD3  ARG  98           HD1      ARG  98 -23.695  -4.427   5.872
  796    HE   ARG  98           HE       ARG  98 -24.685  -7.166   5.619
  797   HH11  ARG  98          HH11      ARG  98 -25.310  -3.673   5.356
  798   HH12  ARG  98          HH12      ARG  98 -26.782  -3.874   4.519
  799   HH21  ARG  98          HH21      ARG  98 -26.704  -7.402   4.440
  800   HH22  ARG  98          HH22      ARG  98 -27.569  -6.010   3.968
  801    H    ASP  99           HN       ASP  99 -17.560  -5.949   5.121
  802    HA   ASP  99           HA       ASP  99 -18.361  -6.434   2.445
  803    HB2  ASP  99           HB2      ASP  99 -18.597  -3.956   2.468
  804    HB3  ASP  99           HB1      ASP  99 -16.948  -3.808   3.047
  805    H    THR 100           HN       THR 100 -15.531  -4.724   3.707
  806    HA   THR 100           HA       THR 100 -13.512  -5.279   4.242
  807    HB   THR 100           HB       THR 100 -14.526  -8.138   4.396
  808    HG1  THR 100           HG1      THR 100 -14.166  -6.767   6.736
  809   HG21  THR 100          HG21      THR 100 -12.666  -8.445   5.999
  810   HG22  THR 100          HG22      THR 100 -12.151  -6.786   5.692
  811   HG23  THR 100          HG23      THR 100 -12.066  -7.991   4.406
  812    H    VAL 101           HN       VAL 101 -14.149  -8.289   2.575
  813    HA   VAL 101           HA       VAL 101 -13.492  -8.009   0.007
  814    HB   VAL 101           HB       VAL 101 -11.144  -9.165   0.041
  815   HG11  VAL 101          HG11      VAL 101 -11.265  -6.255   0.756
  816   HG12  VAL 101          HG12      VAL 101 -11.367  -6.927  -0.867
  817   HG13  VAL 101          HG13      VAL 101  -9.857  -7.054   0.051
  818   HG21  VAL 101          HG21      VAL 101 -11.036  -9.567   2.447
  819   HG22  VAL 101          HG22      VAL 101 -11.024  -7.822   2.719
  820   HG23  VAL 101          HG23      VAL 101  -9.658  -8.593   1.913
  821    H    GLU 102           HN       GLU 102 -12.722 -10.385  -0.729
  822    HA   GLU 102           HA       GLU 102 -14.103 -12.197   1.088
  823    HB2  GLU 102           HB3      GLU 102 -13.372 -12.474  -1.833
  824    HB3  GLU 102           HB2      GLU 102 -13.880 -13.846  -0.874
  825    HG2  GLU 102           HG3      GLU 102 -15.743 -13.069  -2.143
  826    HG3  GLU 102           HG2      GLU 102 -16.035 -12.696  -0.453
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1   4.715 -11.048  11.230
    2    H2   GLY   1           HT2      GLY   1   6.111 -10.379  10.621
    3    H3   GLY   1           HT3      GLY   1   4.708 -10.366   9.689
    4    HA2  GLY   1           HA2      GLY   1   5.140  -8.171  10.664
    5    HA3  GLY   1           HA3      GLY   1   3.661  -8.885  11.312
    6    H    HIS   2           HN       HIS   2   4.643  -7.017  12.946
    7    HA   HIS   2           HA       HIS   2   6.652  -8.142  14.671
    8    HB2  HIS   2           HB2      HIS   2   4.934  -5.668  15.044
    9    HB3  HIS   2           HB1      HIS   2   6.244  -6.161  16.098
   10    HD1  HIS   2           HD1      HIS   2   5.609  -3.927  13.382
   11    HD2  HIS   2           HD2      HIS   2   8.777  -6.367  14.511
   12    HE1  HIS   2           HE1      HIS   2   7.633  -3.014  12.246
   13    H    MET   3           HN       MET   3   3.382  -7.013  15.250
   14    HA   MET   3           HA       MET   3   3.181  -8.842  17.492
   15    HB2  MET   3           HB2      MET   3   2.613  -6.475  17.826
   16    HB3  MET   3           HB1      MET   3   1.392  -6.584  16.574
   17    HG2  MET   3           HG2      MET   3   0.131  -8.165  17.938
   18    HG3  MET   3           HG1      MET   3   1.366  -8.067  19.191
   19    HE1  MET   3           HE1      MET   3   1.040  -4.349  20.399
   20    HE2  MET   3           HE2      MET   3   2.123  -4.938  19.144
   21    HE3  MET   3           HE3      MET   3   1.877  -5.886  20.615
   22    H    LEU   4           HN       LEU   4   2.675 -10.791  16.730
   23    HA   LEU   4           HA       LEU   4   0.797 -11.044  14.518
   24    HB2  LEU   4           HB2      LEU   4   2.919 -12.289  14.447
   25    HB3  LEU   4           HB1      LEU   4   2.470 -13.128  15.918
   26    HG   LEU   4           HG       LEU   4   0.529 -14.109  14.699
   27   HD11  LEU   4          HD11      LEU   4   1.848 -12.875  12.290
   28   HD12  LEU   4          HD12      LEU   4   0.260 -12.469  12.951
   29   HD13  LEU   4          HD13      LEU   4   0.548 -14.063  12.256
   30   HD21  LEU   4          HD21      LEU   4   3.262 -14.649  13.560
   31   HD22  LEU   4          HD22      LEU   4   1.875 -15.723  13.424
   32   HD23  LEU   4          HD23      LEU   4   2.572 -15.378  15.010
   33    H    ARG   5           HN       ARG   5  -1.245 -11.108  15.052
   34    HA   ARG   5           HA       ARG   5  -2.309 -13.086  16.780
   35    HB2  ARG   5           HB2      ARG   5  -3.398 -11.577  18.395
   36    HB3  ARG   5           HB1      ARG   5  -1.666 -11.362  18.473
   37    HG2  ARG   5           HG2      ARG   5  -1.892  -9.295  17.139
   38    HG3  ARG   5           HG1      ARG   5  -3.640  -9.547  17.125
   39    HD2  ARG   5           HD2      ARG   5  -3.527  -9.581  19.650
   40    HD3  ARG   5           HD1      ARG   5  -1.871  -9.010  19.472
   41    HE   ARG   5           HE       ARG   5  -3.789  -7.429  18.071
   42   HH11  ARG   5          HH11      ARG   5  -2.156  -7.942  21.166
   43   HH12  ARG   5          HH12      ARG   5  -2.514  -6.387  21.770
   44   HH21  ARG   5          HH21      ARG   5  -4.299  -5.275  18.917
   45   HH22  ARG   5          HH22      ARG   5  -3.735  -4.856  20.481
   46    H    THR   6           HN       THR   6  -4.922 -11.482  16.984
   47    HA   THR   6           HA       THR   6  -6.136 -11.910  14.571
   48    HB   THR   6           HB       THR   6  -6.696  -9.508  16.337
   49    HG1  THR   6           HG1      THR   6  -7.746 -12.109  16.695
   50   HG21  THR   6          HG21      THR   6  -9.031  -9.940  15.700
   51   HG22  THR   6          HG22      THR   6  -8.506 -11.299  14.705
   52   HG23  THR   6          HG23      THR   6  -8.031  -9.656  14.276
   53    H    ALA   7           HN       ALA   7  -4.281  -9.119  15.640
   54    HA   ALA   7           HA       ALA   7  -4.286  -7.598  13.274
   55    HB1  ALA   7           HB1      ALA   7  -2.273  -6.550  14.179
   56    HB2  ALA   7           HB2      ALA   7  -2.113  -7.846  15.360
   57    HB3  ALA   7           HB3      ALA   7  -3.477  -6.738  15.456
   58    H    GLY   8           HN       GLY   8  -4.070  -9.004  11.634
   59    HA2  GLY   8           HA3      GLY   8  -1.715  -9.458  10.423
   60    HA3  GLY   8           HA2      GLY   8  -1.983 -10.901  11.417
   61    H    ARG   9           HN       ARG   9  -2.360 -12.225   9.624
   62    HA   ARG   9           HA       ARG   9  -3.502 -13.258   8.074
   63    HB2  ARG   9           HB2      ARG   9  -5.862 -11.844   9.324
   64    HB3  ARG   9           HB1      ARG   9  -5.941 -13.113   8.104
   65    HG2  ARG   9           HG2      ARG   9  -4.704 -13.438  10.818
   66    HG3  ARG   9           HG1      ARG   9  -6.327 -13.977  10.361
   67    HD2  ARG   9           HD2      ARG   9  -5.387 -15.369   8.621
   68    HD3  ARG   9           HD1      ARG   9  -3.780 -14.820   9.024
   69    HE   ARG   9           HE       ARG   9  -5.066 -15.943  11.276
   70   HH11  ARG   9          HH11      ARG   9  -3.257 -16.693   8.326
   71   HH12  ARG   9          HH12      ARG   9  -2.723 -18.213   8.842
   72   HH21  ARG   9          HH21      ARG   9  -4.321 -18.047  12.022
   73   HH22  ARG   9          HH22      ARG   9  -3.319 -18.988  11.004
   74    H    ASP  10           HN       ASP  10  -5.119 -10.142   8.047
   75    HA   ASP  10           HA       ASP  10  -4.931 -10.263   5.183
   76    HB2  ASP  10           HB2      ASP  10  -7.065  -9.581   6.491
   77    HB3  ASP  10           HB1      ASP  10  -6.259  -8.041   6.753
   78    H    GLY  11           HN       GLY  11  -4.278  -8.029   4.189
   79    HA2  GLY  11           HA3      GLY  11  -2.908  -6.082   4.298
   80    HA3  GLY  11           HA2      GLY  11  -2.177  -6.713   5.770
   81    H    LEU  12           HN       LEU  12  -2.477  -9.180   3.590
   82    HA   LEU  12           HA       LEU  12   0.262  -8.736   2.608
   83    HB2  LEU  12           HB2      LEU  12   0.229 -10.518   4.286
   84    HB3  LEU  12           HB1      LEU  12  -1.020 -11.359   3.393
   85    HG   LEU  12           HG       LEU  12   0.590 -11.696   1.529
   86   HD11  LEU  12          HD11      LEU  12   2.070  -9.828   1.912
   87   HD12  LEU  12          HD12      LEU  12   2.971 -11.342   1.926
   88   HD13  LEU  12          HD13      LEU  12   2.596 -10.527   3.444
   89   HD21  LEU  12          HD21      LEU  12   0.234 -13.446   3.180
   90   HD22  LEU  12          HD22      LEU  12   1.475 -12.741   4.216
   91   HD23  LEU  12          HD23      LEU  12   1.915 -13.425   2.650
   92    H    CYS  13           HN       CYS  13  -2.527 -10.833   1.906
   93    HA   CYS  13           HA       CYS  13  -1.895 -11.106  -0.832
   94    HB2  CYS  13           HB2      CYS  13  -3.245 -12.747   0.412
   95    HB3  CYS  13           HB1      CYS  13  -4.509 -11.548   0.630
   96    HG   CYS  13           HG       CYS  13  -3.646 -13.237  -2.198
   97    H    ARG  14           HN       ARG  14  -4.048  -8.998   0.928
   98    HA   ARG  14           HA       ARG  14  -5.335  -7.676  -1.202
   99    HB2  ARG  14           HB2      ARG  14  -5.950  -7.571   1.253
  100    HB3  ARG  14           HB1      ARG  14  -4.571  -6.517   1.495
  101    HG2  ARG  14           HG2      ARG  14  -5.610  -4.951  -0.181
  102    HG3  ARG  14           HG1      ARG  14  -7.054  -5.958  -0.104
  103    HD2  ARG  14           HD2      ARG  14  -5.768  -4.456   2.179
  104    HD3  ARG  14           HD1      ARG  14  -7.266  -4.037   1.368
  105    HE   ARG  14           HE       ARG  14  -7.012  -6.577   2.841
  106   HH11  ARG  14          HH11      ARG  14  -8.670  -3.479   2.374
  107   HH12  ARG  14          HH12      ARG  14  -9.846  -3.749   3.567
  108   HH21  ARG  14          HH21      ARG  14  -8.626  -6.965   4.441
  109   HH22  ARG  14          HH22      ARG  14  -9.823  -5.805   4.807
  110    H    LEU  15           HN       LEU  15  -2.453  -7.004   0.671
  111    HA   LEU  15           HA       LEU  15  -1.659  -4.580  -0.415
  112    HB2  LEU  15           HB2      LEU  15  -0.857  -5.589   1.673
  113    HB3  LEU  15           HB1      LEU  15  -0.044  -6.833   0.757
  114    HG   LEU  15           HG       LEU  15   1.480  -5.144  -0.171
  115   HD11  LEU  15          HD11      LEU  15   1.485  -2.915   0.785
  116   HD12  LEU  15          HD12      LEU  15   0.008  -3.288   1.672
  117   HD13  LEU  15          HD13      LEU  15  -0.009  -3.225  -0.095
  118   HD21  LEU  15          HD21      LEU  15   2.679  -4.677   1.898
  119   HD22  LEU  15          HD22      LEU  15   2.084  -6.338   1.851
  120   HD23  LEU  15          HD23      LEU  15   1.249  -5.127   2.825
  121    H    SER  16           HN       SER  16  -0.608  -7.875  -1.151
  122    HA   SER  16           HA       SER  16   1.171  -7.404  -3.209
  123    HB2  SER  16           HB2      SER  16  -0.709  -9.744  -2.882
  124    HB3  SER  16           HB1      SER  16   0.761  -9.734  -3.850
  125    HG   SER  16           HG       SER  16   0.504  -9.528  -1.033
  126    H    THR  17           HN       THR  17  -2.299  -8.144  -3.454
  127    HA   THR  17           HA       THR  17  -2.533  -8.202  -6.202
  128    HB   THR  17           HB       THR  17  -4.620  -7.385  -4.161
  129    HG1  THR  17           HG1      THR  17  -3.908  -9.430  -3.647
  130   HG21  THR  17          HG21      THR  17  -5.316  -6.845  -6.471
  131   HG22  THR  17          HG22      THR  17  -6.257  -8.194  -5.826
  132   HG23  THR  17          HG23      THR  17  -4.956  -8.500  -6.966
  133    H    TYR  18           HN       TYR  18  -2.806  -5.389  -4.035
  134    HA   TYR  18           HA       TYR  18  -3.556  -3.649  -6.173
  135    HB2  TYR  18           HB2      TYR  18  -2.893  -3.171  -3.288
  136    HB3  TYR  18           HB1      TYR  18  -3.091  -1.822  -4.404
  137    HD1  TYR  18           HD1      TYR  18  -5.229  -1.302  -5.346
  138    HD2  TYR  18           HD2      TYR  18  -4.807  -4.563  -2.664
  139    HE1  TYR  18           HE1      TYR  18  -7.657  -1.413  -5.111
  140    HE2  TYR  18           HE2      TYR  18  -7.246  -4.679  -2.407
  141    HH   TYR  18           HH       TYR  18  -9.205  -3.368  -2.730
  142    H    LEU  19           HN       LEU  19  -0.547  -4.418  -4.578
  143    HA   LEU  19           HA       LEU  19   0.894  -2.289  -5.797
  144    HB2  LEU  19           HB2      LEU  19   1.868  -4.855  -4.548
  145    HB3  LEU  19           HB1      LEU  19   2.925  -3.577  -5.111
  146    HG   LEU  19           HG       LEU  19   0.882  -3.277  -2.893
  147   HD11  LEU  19          HD11      LEU  19   2.809  -3.173  -1.415
  148   HD12  LEU  19          HD12      LEU  19   3.879  -3.525  -2.776
  149   HD13  LEU  19          HD13      LEU  19   2.705  -4.729  -2.237
  150   HD21  LEU  19          HD21      LEU  19   1.285  -1.187  -4.108
  151   HD22  LEU  19          HD22      LEU  19   3.018  -1.382  -3.889
  152   HD23  LEU  19          HD23      LEU  19   1.979  -1.121  -2.494
  153    H    GLU  20           HN       GLU  20  -0.116  -5.369  -6.898
  154    HA   GLU  20           HA       GLU  20   1.746  -5.677  -9.018
  155    HB2  GLU  20           HB3      GLU  20  -1.046  -6.736  -8.690
  156    HB3  GLU  20           HB2      GLU  20   0.033  -7.182 -10.003
  157    HG2  GLU  20           HG3      GLU  20   1.591  -8.135  -8.396
  158    HG3  GLU  20           HG2      GLU  20   0.515  -7.668  -7.078
  159    H    GLU  21           HN       GLU  21  -0.969  -3.610  -8.593
  160    HA   GLU  21           HA       GLU  21  -1.224  -3.212 -11.447
  161    HB2  GLU  21           HB3      GLU  21  -2.826  -2.097  -9.146
  162    HB3  GLU  21           HB2      GLU  21  -3.058  -1.586 -10.810
  163    HG2  GLU  21           HG3      GLU  21  -3.549  -3.957 -11.404
  164    HG3  GLU  21           HG2      GLU  21  -3.472  -4.349  -9.687
  165    H    LEU  22           HN       LEU  22   0.960  -2.220  -9.366
  166    HA   LEU  22           HA       LEU  22   1.135   0.501 -10.442
  167    HB2  LEU  22           HB2      LEU  22   2.858  -0.876  -8.336
  168    HB3  LEU  22           HB1      LEU  22   3.082   0.741  -8.928
  169    HG   LEU  22           HG       LEU  22   0.745  -0.234  -7.307
  170   HD11  LEU  22          HD11      LEU  22   2.744  -0.063  -5.997
  171   HD12  LEU  22          HD12      LEU  22   1.723   1.343  -5.636
  172   HD13  LEU  22          HD13      LEU  22   3.115   1.508  -6.698
  173   HD21  LEU  22          HD21      LEU  22   1.394   2.523  -8.355
  174   HD22  LEU  22          HD22      LEU  22   0.111   2.133  -7.216
  175   HD23  LEU  22          HD23      LEU  22   0.039   1.511  -8.863
  176    H    GLU  23           HN       GLU  23   2.551   0.941 -12.053
  177    HA   GLU  23           HA       GLU  23   3.991  -1.304 -13.119
  178    HB2  GLU  23           HB3      GLU  23   4.693   0.153 -14.952
  179    HB3  GLU  23           HB2      GLU  23   2.973   0.340 -14.634
  180    HG2  GLU  23           HG3      GLU  23   3.236   2.433 -13.776
  181    HG3  GLU  23           HG2      GLU  23   4.992   2.245 -13.560
  182    H    ALA  24           HN       ALA  24   6.414  -0.679 -13.914
  183    HA   ALA  24           HA       ALA  24   7.942  -0.950 -11.610
  184    HB1  ALA  24           HB1      ALA  24   8.656  -1.718 -13.848
  185    HB2  ALA  24           HB2      ALA  24   9.896  -0.794 -13.005
  186    HB3  ALA  24           HB3      ALA  24   8.966  -0.038 -14.298
  187    H    VAL  25           HN       VAL  25   7.405   1.979 -13.552
  188    HA   VAL  25           HA       VAL  25   9.151   3.526 -11.942
  189    HB   VAL  25           HB       VAL  25   8.558   4.270 -14.234
  190   HG11  VAL  25          HG11      VAL  25   5.863   4.901 -13.080
  191   HG12  VAL  25          HG12      VAL  25   6.236   3.719 -14.342
  192   HG13  VAL  25          HG13      VAL  25   6.446   5.439 -14.653
  193   HG21  VAL  25          HG21      VAL  25   9.467   5.912 -12.678
  194   HG22  VAL  25          HG22      VAL  25   7.832   6.267 -12.109
  195   HG23  VAL  25          HG23      VAL  25   8.291   6.667 -13.762
  196    H    GLU  26           HN       GLU  26   5.848   2.594 -11.590
  197    HA   GLU  26           HA       GLU  26   5.267   4.627  -9.657
  198    HB2  GLU  26           HB3      GLU  26   3.787   2.080 -10.253
  199    HB3  GLU  26           HB2      GLU  26   3.194   3.390  -9.234
  200    HG2  GLU  26           HG3      GLU  26   3.410   4.871 -11.266
  201    HG3  GLU  26           HG2      GLU  26   3.721   3.387 -12.168
  202    H    LEU  27           HN       LEU  27   6.217   1.257  -9.586
  203    HA   LEU  27           HA       LEU  27   6.229   0.926  -6.788
  204    HB2  LEU  27           HB2      LEU  27   8.010  -0.328  -8.889
  205    HB3  LEU  27           HB1      LEU  27   7.919  -0.858  -7.226
  206    HG   LEU  27           HG       LEU  27   5.618  -0.958  -9.184
  207   HD11  LEU  27          HD11      LEU  27   6.002  -3.370  -9.194
  208   HD12  LEU  27          HD12      LEU  27   7.429  -3.152  -8.180
  209   HD13  LEU  27          HD13      LEU  27   7.398  -2.491  -9.815
  210   HD21  LEU  27          HD21      LEU  27   4.567  -2.379  -7.477
  211   HD22  LEU  27          HD22      LEU  27   4.880  -0.756  -6.870
  212   HD23  LEU  27          HD23      LEU  27   5.931  -2.091  -6.401
  213    H    LYS  28           HN       LYS  28   8.544   2.194  -9.056
  214    HA   LYS  28           HA       LYS  28  10.737   2.691  -7.398
  215    HB2  LYS  28           HB2      LYS  28  10.702   2.769  -9.871
  216    HB3  LYS  28           HB1      LYS  28   9.723   4.213  -9.795
  217    HG2  LYS  28           HG2      LYS  28  11.576   5.453  -8.849
  218    HG3  LYS  28           HG1      LYS  28  12.561   3.977  -8.817
  219    HD2  LYS  28           HD2      LYS  28  12.303   3.769 -11.257
  220    HD3  LYS  28           HD1      LYS  28  11.368   5.261 -11.273
  221    HE2  LYS  28           HE2      LYS  28  14.216   5.019 -10.347
  222    HE3  LYS  28           HE1      LYS  28  13.736   5.524 -11.959
  223    HZ1  LYS  28           HZ1      LYS  28  12.529   7.407 -10.884
  224    HZ2  LYS  28           HZ2      LYS  28  14.189   7.426 -10.708
  225    HZ3  LYS  28           HZ3      LYS  28  13.248   6.977  -9.404
  226    H    LYS  29           HN       LYS  29   7.935   4.688  -8.156
  227    HA   LYS  29           HA       LYS  29   8.596   6.988  -6.632
  228    HB2  LYS  29           HB2      LYS  29   5.868   5.829  -7.200
  229    HB3  LYS  29           HB1      LYS  29   6.196   7.475  -6.697
  230    HG2  LYS  29           HG2      LYS  29   7.329   7.927  -8.771
  231    HG3  LYS  29           HG1      LYS  29   7.117   6.254  -9.283
  232    HD2  LYS  29           HD2      LYS  29   4.676   6.565  -9.202
  233    HD3  LYS  29           HD1      LYS  29   4.918   8.246  -8.745
  234    HE2  LYS  29           HE2      LYS  29   6.134   8.632 -10.829
  235    HE3  LYS  29           HE1      LYS  29   5.854   6.954 -11.300
  236    HZ1  LYS  29           HZ1      LYS  29   3.750   9.005 -10.840
  237    HZ2  LYS  29           HZ2      LYS  29   3.470   7.399 -11.302
  238    HZ3  LYS  29           HZ3      LYS  29   4.267   8.431 -12.335
  239    H    PHE  30           HN       PHE  30   6.558   4.234  -5.996
  240    HA   PHE  30           HA       PHE  30   5.696   4.680  -3.450
  241    HB2  PHE  30           HB2      PHE  30   4.636   3.049  -4.714
  242    HB3  PHE  30           HB1      PHE  30   6.135   2.296  -5.186
  243    HD1  PHE  30           HD1      PHE  30   3.916   2.796  -2.229
  244    HD2  PHE  30           HD2      PHE  30   6.729   0.327  -4.218
  245    HE1  PHE  30           HE1      PHE  30   3.496   0.999  -0.599
  246    HE2  PHE  30           HE2      PHE  30   6.328  -1.464  -2.587
  247    HZ   PHE  30           HZ       PHE  30   4.698  -1.124  -0.777
  248    H    LYS  31           HN       LYS  31   8.585   2.814  -4.405
  249    HA   LYS  31           HA       LYS  31   9.314   2.329  -1.700
  250    HB2  LYS  31           HB2      LYS  31  11.459   1.462  -2.582
  251    HB3  LYS  31           HB1      LYS  31  10.044   0.725  -3.310
  252    HG2  LYS  31           HG2      LYS  31  10.347   2.072  -5.308
  253    HG3  LYS  31           HG1      LYS  31  11.731   2.885  -4.574
  254    HD2  LYS  31           HD2      LYS  31  12.982   0.846  -4.523
  255    HD3  LYS  31           HD1      LYS  31  11.582  -0.094  -5.010
  256    HE2  LYS  31           HE2      LYS  31  11.579   0.938  -7.173
  257    HE3  LYS  31           HE1      LYS  31  12.924   1.996  -6.715
  258    HZ1  LYS  31           HZ1      LYS  31  14.344   0.125  -6.560
  259    HZ2  LYS  31           HZ2      LYS  31  13.515  -0.019  -8.034
  260    HZ3  LYS  31           HZ3      LYS  31  13.047  -0.955  -6.714
  261    H    LEU  32           HN       LEU  32  10.179   4.979  -3.858
  262    HA   LEU  32           HA       LEU  32  12.231   5.735  -1.984
  263    HB2  LEU  32           HB2      LEU  32  12.650   7.657  -3.345
  264    HB3  LEU  32           HB1      LEU  32  12.480   6.277  -4.394
  265    HG   LEU  32           HG       LEU  32  10.049   7.172  -4.777
  266   HD11  LEU  32          HD11      LEU  32  10.043   8.870  -3.033
  267   HD12  LEU  32          HD12      LEU  32   9.844   9.598  -4.628
  268   HD13  LEU  32          HD13      LEU  32  11.402   9.685  -3.809
  269   HD21  LEU  32          HD21      LEU  32  12.480   8.565  -5.817
  270   HD22  LEU  32          HD22      LEU  32  10.888   8.589  -6.586
  271   HD23  LEU  32          HD23      LEU  32  11.796   7.073  -6.457
  272    H    TYR  33           HN       TYR  33   8.888   6.360  -2.451
  273    HA   TYR  33           HA       TYR  33   8.826   8.642  -0.835
  274    HB2  TYR  33           HB2      TYR  33   6.939   8.095  -2.326
  275    HB3  TYR  33           HB1      TYR  33   6.561   6.691  -1.324
  276    HD1  TYR  33           HD1      TYR  33   6.675  10.360  -1.388
  277    HD2  TYR  33           HD2      TYR  33   5.405   6.928   0.760
  278    HE1  TYR  33           HE1      TYR  33   5.371  11.800   0.142
  279    HE2  TYR  33           HE2      TYR  33   4.099   8.337   2.281
  280    HH   TYR  33           HH       TYR  33   4.288  10.838   3.076
  281    H    LEU  34           HN       LEU  34   8.181   5.241  -0.083
  282    HA   LEU  34           HA       LEU  34   8.105   6.016   2.714
  283    HB2  LEU  34           HB2      LEU  34   7.316   3.662   3.112
  284    HB3  LEU  34           HB1      LEU  34   6.256   4.734   2.236
  285    HG   LEU  34           HG       LEU  34   7.050   3.587   0.117
  286   HD11  LEU  34          HD11      LEU  34   7.919   1.321   0.330
  287   HD12  LEU  34          HD12      LEU  34   8.114   1.562   2.070
  288   HD13  LEU  34          HD13      LEU  34   9.059   2.524   0.935
  289   HD21  LEU  34          HD21      LEU  34   4.884   3.225   1.128
  290   HD22  LEU  34          HD22      LEU  34   5.566   1.953   2.154
  291   HD23  LEU  34          HD23      LEU  34   5.522   1.753   0.402
  292    H    GLY  35           HN       GLY  35  10.272   4.308   0.612
  293    HA2  GLY  35           HA3      GLY  35  11.430   2.754   2.640
  294    HA3  GLY  35           HA2      GLY  35  12.141   3.044   1.052
  295    H    THR  36           HN       THR  36  12.293   5.872   1.330
  296    HA   THR  36           HA       THR  36  14.346   6.025   3.414
  297    HB   THR  36           HB       THR  36  15.305   6.155   1.133
  298    HG1  THR  36           HG1      THR  36  15.680   7.980   3.047
  299   HG21  THR  36          HG21      THR  36  14.871   8.111  -0.334
  300   HG22  THR  36          HG22      THR  36  13.631   8.662   0.792
  301   HG23  THR  36          HG23      THR  36  13.416   7.154  -0.086
  302    H    ALA  37           HN       ALA  37  11.442   6.573   3.444
  303    HA   ALA  37           HA       ALA  37  10.960   9.355   3.623
  304    HB1  ALA  37           HB1      ALA  37   9.438   7.121   4.906
  305    HB2  ALA  37           HB2      ALA  37   9.150   7.797   3.295
  306    HB3  ALA  37           HB3      ALA  37   8.903   8.788   4.736
  307    H    THR  38           HN       THR  38  11.574  10.730   5.125
  308    HA   THR  38           HA       THR  38  12.437   9.854   7.701
  309    HB   THR  38           HB       THR  38  12.551  12.368   8.064
  310    HG1  THR  38           HG1      THR  38  12.466  13.426   5.821
  311   HG21  THR  38          HG21      THR  38  14.490  12.681   6.569
  312   HG22  THR  38          HG22      THR  38  14.005  11.256   5.647
  313   HG23  THR  38          HG23      THR  38  14.522  11.088   7.324
  314    H    GLU  39           HN       GLU  39   9.617  10.724   6.126
  315    HA   GLU  39           HA       GLU  39   7.910  11.796   8.086
  316    HB2  GLU  39           HB3      GLU  39   7.432  11.723   5.663
  317    HB3  GLU  39           HB2      GLU  39   7.251   9.982   5.754
  318    HG2  GLU  39           HG3      GLU  39   5.356  10.339   7.333
  319    HG3  GLU  39           HG2      GLU  39   5.479  12.065   6.999
  320    H    LEU  40           HN       LEU  40   8.938   8.536   7.438
  321    HA   LEU  40           HA       LEU  40   7.000   7.298   9.241
  322    HB2  LEU  40           HB2      LEU  40   9.266   6.142   7.655
  323    HB3  LEU  40           HB1      LEU  40   8.076   5.230   8.555
  324    HG   LEU  40           HG       LEU  40   7.510   6.965   6.151
  325   HD11  LEU  40          HD11      LEU  40   8.774   4.975   5.590
  326   HD12  LEU  40          HD12      LEU  40   7.120   4.878   4.993
  327   HD13  LEU  40          HD13      LEU  40   7.588   3.976   6.431
  328   HD21  LEU  40          HD21      LEU  40   5.307   5.919   6.199
  329   HD22  LEU  40          HD22      LEU  40   5.599   6.880   7.649
  330   HD23  LEU  40          HD23      LEU  40   5.709   5.117   7.716
  331    H    GLY  41           HN       GLY  41  10.050   8.618   9.285
  332    HA2  GLY  41           HA3      GLY  41  10.907   8.881  11.615
  333    HA3  GLY  41           HA2      GLY  41  10.833   7.118  11.673
  334    H    GLU  42           HN       GLU  42  12.395   5.973  10.841
  335    HA   GLU  42           HA       GLU  42  14.759   7.425   9.871
  336    HB2  GLU  42           HB3      GLU  42  14.464   4.585  10.822
  337    HB3  GLU  42           HB2      GLU  42  15.971   5.374  10.394
  338    HG2  GLU  42           HG3      GLU  42  14.156   6.111  12.678
  339    HG3  GLU  42           HG2      GLU  42  15.686   5.251  12.791
  340    H    GLY  43           HN       GLY  43  12.220   5.598   8.649
  341    HA2  GLY  43           HA3      GLY  43  11.926   4.712   6.502
  342    HA3  GLY  43           HA2      GLY  43  13.647   4.973   6.190
  343    H    LYS  44           HN       LYS  44  11.346   2.671   6.898
  344    HA   LYS  44           HA       LYS  44  13.110   0.986   8.493
  345    HB2  LYS  44           HB2      LYS  44  10.227   0.619   7.698
  346    HB3  LYS  44           HB1      LYS  44  11.136  -0.471   8.735
  347    HG2  LYS  44           HG2      LYS  44  10.647   2.435   9.339
  348    HG3  LYS  44           HG1      LYS  44   9.669   1.103   9.958
  349    HD2  LYS  44           HD2      LYS  44  11.640   0.175  11.074
  350    HD3  LYS  44           HD1      LYS  44  12.632   1.484  10.428
  351    HE2  LYS  44           HE2      LYS  44  11.994   1.898  12.756
  352    HE3  LYS  44           HE1      LYS  44  11.344   3.111  11.660
  353    HZ1  LYS  44           HZ1      LYS  44   9.737   2.376  13.323
  354    HZ2  LYS  44           HZ2      LYS  44   9.797   0.799  12.730
  355    HZ3  LYS  44           HZ3      LYS  44   9.187   2.035  11.781
  356    H    ILE  45           HN       ILE  45  13.029   1.467   5.388
  357    HA   ILE  45           HA       ILE  45  12.977  -1.332   4.593
  358    HB   ILE  45           HB       ILE  45  13.218   1.208   2.965
  359   HG12  ILE  45          HG12      ILE  45  10.966   0.831   3.886
  360   HG13  ILE  45          HG11      ILE  45  10.975   0.663   2.135
  361   HG21  ILE  45          HG21      ILE  45  13.098  -1.643   1.997
  362   HG22  ILE  45          HG22      ILE  45  14.467  -0.542   1.868
  363   HG23  ILE  45          HG23      ILE  45  12.976  -0.209   0.982
  364   HD11  ILE  45          HD11      ILE  45   9.597  -1.039   3.143
  365   HD12  ILE  45          HD12      ILE  45  10.949  -1.579   4.143
  366   HD13  ILE  45          HD13      ILE  45  11.025  -1.744   2.380
  367    HA   PRO  46           HA       PRO  46  17.377  -1.400   5.000
  368    HB2  PRO  46           HB2      PRO  46  17.782  -3.828   3.814
  369    HB3  PRO  46           HB1      PRO  46  17.207  -3.647   5.473
  370    HG2  PRO  46           HG2      PRO  46  15.657  -4.214   2.990
  371    HG3  PRO  46           HG1      PRO  46  15.457  -4.901   4.611
  372    HD2  PRO  46           HD2      PRO  46  13.875  -2.955   3.607
  373    HD3  PRO  46           HD1      PRO  46  14.233  -3.113   5.338
  374    H    TRP  47           HN       TRP  47  18.620  -0.317   3.852
  375    HA   TRP  47           HA       TRP  47  19.357   0.987   2.128
  376    HB2  TRP  47           HB2      TRP  47  20.621  -1.709   1.669
  377    HB3  TRP  47           HB1      TRP  47  21.321  -0.139   1.298
  378    HD1  TRP  47           HD1      TRP  47  22.000   1.421   3.451
  379    HE1  TRP  47           HE1      TRP  47  22.666   0.740   5.852
  380    HE3  TRP  47           HE3      TRP  47  20.318  -3.402   3.445
  381    HZ2  TRP  47           HZ2      TRP  47  22.513  -1.531   7.490
  382    HZ3  TRP  47           HZ3      TRP  47  20.621  -4.763   5.466
  383    HH2  TRP  47           HH2      TRP  47  21.697  -3.842   7.445
  384    H    GLY  48           HN       GLY  48  19.164  -2.025   0.442
  385    HA2  GLY  48           HA3      GLY  48  17.761  -0.679  -1.762
  386    HA3  GLY  48           HA2      GLY  48  19.322  -1.412  -2.108
  387    H    SER  49           HN       SER  49  17.022  -2.731   0.125
  388    HA   SER  49           HA       SER  49  16.951  -5.262  -1.155
  389    HB2  SER  49           HB2      SER  49  16.569  -4.862   1.284
  390    HB3  SER  49           HB1      SER  49  15.034  -4.104   0.885
  391    HG   SER  49           HG       SER  49  15.088  -6.493  -0.284
  392    H    MET  50           HN       MET  50  15.028  -2.404  -1.285
  393    HA   MET  50           HA       MET  50  12.888  -3.649  -2.717
  394    HB2  MET  50           HB2      MET  50  12.039  -1.205  -2.899
  395    HB3  MET  50           HB1      MET  50  12.007  -2.015  -1.345
  396    HG2  MET  50           HG2      MET  50  12.718   0.259  -1.086
  397    HG3  MET  50           HG1      MET  50  14.026  -0.833  -0.695
  398    HE1  MET  50           HE1      MET  50  15.783   1.153  -0.773
  399    HE2  MET  50           HE2      MET  50  14.474   2.277  -1.137
  400    HE3  MET  50           HE3      MET  50  15.935   2.273  -2.125
  401    H    GLU  51           HN       GLU  51  15.808  -2.867  -3.676
  402    HA   GLU  51           HA       GLU  51  15.214  -1.645  -6.191
  403    HB2  GLU  51           HB3      GLU  51  17.642  -2.858  -4.961
  404    HB3  GLU  51           HB2      GLU  51  17.631  -2.342  -6.648
  405    HG2  GLU  51           HG3      GLU  51  16.983  -0.585  -4.301
  406    HG3  GLU  51           HG2      GLU  51  18.559  -0.652  -5.101
  407    H    LYS  52           HN       LYS  52  15.934  -4.857  -5.045
  408    HA   LYS  52           HA       LYS  52  15.382  -5.963  -7.701
  409    HB2  LYS  52           HB2      LYS  52  16.230  -8.119  -6.686
  410    HB3  LYS  52           HB1      LYS  52  17.405  -6.822  -6.771
  411    HG2  LYS  52           HG2      LYS  52  17.188  -6.388  -4.411
  412    HG3  LYS  52           HG1      LYS  52  15.863  -7.541  -4.285
  413    HD2  LYS  52           HD2      LYS  52  17.968  -8.504  -3.454
  414    HD3  LYS  52           HD1      LYS  52  17.375  -9.377  -4.858
  415    HE2  LYS  52           HE2      LYS  52  19.778  -9.092  -5.014
  416    HE3  LYS  52           HE1      LYS  52  19.000  -8.151  -6.275
  417    HZ1  LYS  52           HZ1      LYS  52  20.079  -7.068  -3.715
  418    HZ2  LYS  52           HZ2      LYS  52  19.339  -6.160  -4.931
  419    HZ3  LYS  52           HZ3      LYS  52  20.777  -6.933  -5.233
  420    H    ALA  53           HN       ALA  53  13.367  -4.845  -5.872
  421    HA   ALA  53           HA       ALA  53  11.817  -7.256  -5.244
  422    HB1  ALA  53           HB1      ALA  53  11.573  -4.512  -4.034
  423    HB2  ALA  53           HB2      ALA  53  12.392  -5.887  -3.288
  424    HB3  ALA  53           HB3      ALA  53  10.650  -5.940  -3.564
  425    H    GLY  54           HN       GLY  54   9.787  -7.488  -6.044
  426    HA2  GLY  54           HA3      GLY  54   8.728  -5.370  -7.760
  427    HA3  GLY  54           HA2      GLY  54   8.497  -7.103  -8.004
  428    HA   PRO  55           HA       PRO  55   4.746  -5.222  -5.834
  429    HB2  PRO  55           HB2      PRO  55   3.598  -7.606  -7.196
  430    HB3  PRO  55           HB1      PRO  55   2.960  -5.965  -7.074
  431    HG2  PRO  55           HG2      PRO  55   4.063  -6.823  -9.337
  432    HG3  PRO  55           HG1      PRO  55   4.308  -5.162  -8.768
  433    HD2  PRO  55           HD2      PRO  55   6.229  -7.473  -8.688
  434    HD3  PRO  55           HD1      PRO  55   6.536  -5.751  -8.928
  435    H    LEU  56           HN       LEU  56   5.567  -8.644  -6.148
  436    HA   LEU  56           HA       LEU  56   4.148  -9.345  -3.707
  437    HB2  LEU  56           HB2      LEU  56   6.022 -11.039  -5.381
  438    HB3  LEU  56           HB1      LEU  56   5.131 -11.612  -3.998
  439    HG   LEU  56           HG       LEU  56   3.986 -12.413  -5.859
  440   HD11  LEU  56          HD11      LEU  56   2.520  -9.968  -4.965
  441   HD12  LEU  56          HD12      LEU  56   2.505 -11.554  -4.192
  442   HD13  LEU  56          HD13      LEU  56   1.804 -11.345  -5.798
  443   HD21  LEU  56          HD21      LEU  56   4.966 -11.057  -7.608
  444   HD22  LEU  56          HD22      LEU  56   4.069  -9.648  -7.057
  445   HD23  LEU  56          HD23      LEU  56   3.207 -11.027  -7.745
  446    H    GLU  57           HN       GLU  57   7.477  -8.956  -4.645
  447    HA   GLU  57           HA       GLU  57   8.602  -9.720  -2.171
  448    HB2  GLU  57           HB3      GLU  57   9.672  -7.755  -4.188
  449    HB3  GLU  57           HB2      GLU  57  10.603  -8.495  -2.890
  450    HG2  GLU  57           HG3      GLU  57   9.338  -9.911  -5.213
  451    HG3  GLU  57           HG2      GLU  57  11.056  -9.564  -5.013
  452    H    MET  58           HN       MET  58   7.452  -6.658  -3.427
  453    HA   MET  58           HA       MET  58   8.188  -4.971  -1.300
  454    HB2  MET  58           HB2      MET  58   5.947  -4.811  -3.292
  455    HB3  MET  58           HB1      MET  58   6.273  -3.535  -2.132
  456    HG2  MET  58           HG2      MET  58   8.346  -4.585  -3.967
  457    HG3  MET  58           HG1      MET  58   7.254  -3.299  -4.522
  458    HE1  MET  58           HE1      MET  58  10.446  -1.300  -4.092
  459    HE2  MET  58           HE2      MET  58   8.993  -1.573  -5.050
  460    HE3  MET  58           HE3      MET  58  10.188  -2.861  -4.874
  461    H    ALA  59           HN       ALA  59   5.185  -6.729  -1.952
  462    HA   ALA  59           HA       ALA  59   3.760  -5.826   0.239
  463    HB1  ALA  59           HB1      ALA  59   3.628  -8.556  -1.031
  464    HB2  ALA  59           HB2      ALA  59   2.773  -7.119  -1.589
  465    HB3  ALA  59           HB3      ALA  59   2.383  -7.826  -0.020
  466    H    GLN  60           HN       GLN  60   5.953  -8.529  -0.040
  467    HA   GLN  60           HA       GLN  60   5.597  -9.399   2.668
  468    HB2  GLN  60           HB2      GLN  60   7.715 -10.143   0.656
  469    HB3  GLN  60           HB1      GLN  60   7.315 -11.023   2.129
  470    HG2  GLN  60           HG2      GLN  60   5.116 -11.538   1.292
  471    HG3  GLN  60           HG1      GLN  60   5.391 -10.501  -0.082
  472   HE21  GLN  60          HE21      GLN  60   4.972 -12.155  -1.504
  473   HE22  GLN  60          HE22      GLN  60   6.135 -13.384  -1.854
  474    H    LEU  61           HN       LEU  61   7.322  -6.938   1.241
  475    HA   LEU  61           HA       LEU  61   9.584  -6.841   3.038
  476    HB2  LEU  61           HB2      LEU  61   9.389  -6.014   0.566
  477    HB3  LEU  61           HB1      LEU  61   8.536  -4.658   1.260
  478    HG   LEU  61           HG       LEU  61  10.604  -4.169   2.601
  479   HD11  LEU  61          HD11      LEU  61  11.637  -6.394   2.408
  480   HD12  LEU  61          HD12      LEU  61  12.695  -5.136   1.744
  481   HD13  LEU  61          HD13      LEU  61  11.744  -6.152   0.660
  482   HD21  LEU  61          HD21      LEU  61  10.002  -2.910   0.598
  483   HD22  LEU  61          HD22      LEU  61  10.795  -4.116  -0.410
  484   HD23  LEU  61          HD23      LEU  61  11.747  -3.127   0.697
  485    H    LEU  62           HN       LEU  62   6.803  -4.709   2.241
  486    HA   LEU  62           HA       LEU  62   7.024  -3.055   4.456
  487    HB2  LEU  62           HB2      LEU  62   4.589  -3.675   2.769
  488    HB3  LEU  62           HB1      LEU  62   4.571  -2.496   4.052
  489    HG   LEU  62           HG       LEU  62   4.714  -1.329   1.970
  490   HD11  LEU  62          HD11      LEU  62   5.999  -0.361   3.714
  491   HD12  LEU  62          HD12      LEU  62   6.729  -0.089   2.131
  492   HD13  LEU  62          HD13      LEU  62   7.405  -1.305   3.213
  493   HD21  LEU  62          HD21      LEU  62   7.118  -2.966   1.348
  494   HD22  LEU  62          HD22      LEU  62   6.447  -1.663   0.344
  495   HD23  LEU  62          HD23      LEU  62   5.521  -3.152   0.642
  496    H    ILE  63           HN       ILE  63   5.197  -6.060   4.031
  497    HA   ILE  63           HA       ILE  63   3.677  -5.891   6.391
  498    HB   ILE  63           HB       ILE  63   3.548  -7.458   4.254
  499   HG12  ILE  63          HG12      ILE  63   1.865  -7.292   6.007
  500   HG13  ILE  63          HG11      ILE  63   1.958  -8.907   5.329
  501   HG21  ILE  63          HG21      ILE  63   5.004  -9.290   6.139
  502   HG22  ILE  63          HG22      ILE  63   5.617  -8.652   4.622
  503   HG23  ILE  63          HG23      ILE  63   4.244  -9.764   4.617
  504   HD11  ILE  63          HD11      ILE  63   3.263  -9.605   7.336
  505   HD12  ILE  63          HD12      ILE  63   1.636  -9.036   7.729
  506   HD13  ILE  63          HD13      ILE  63   3.028  -7.985   7.994
  507    H    THR  64           HN       THR  64   6.944  -6.855   5.872
  508    HA   THR  64           HA       THR  64   7.089  -8.136   8.459
  509    HB   THR  64           HB       THR  64   9.246  -7.752   6.372
  510    HG1  THR  64           HG1      THR  64   7.978  -9.206   5.413
  511   HG21  THR  64          HG21      THR  64  10.386  -9.562   7.577
  512   HG22  THR  64          HG22      THR  64   9.095  -9.583   8.781
  513   HG23  THR  64          HG23      THR  64  10.139  -8.169   8.627
  514    H    HIS  65           HN       HIS  65   8.338  -5.245   6.869
  515    HA   HIS  65           HA       HIS  65   9.902  -4.558   9.187
  516    HB2  HIS  65           HB2      HIS  65   9.370  -2.976   6.668
  517    HB3  HIS  65           HB1      HIS  65  10.451  -2.463   7.959
  518    HD1  HIS  65           HD1      HIS  65  12.630  -4.052   8.331
  519    HD2  HIS  65           HD2      HIS  65  10.441  -4.682   4.861
  520    HE1  HIS  65           HE1      HIS  65  14.120  -5.343   6.784
  521    H    PHE  66           HN       PHE  66   6.956  -3.331   7.701
  522    HA   PHE  66           HA       PHE  66   6.496  -1.580   9.946
  523    HB2  PHE  66           HB2      PHE  66   4.908  -2.133   7.456
  524    HB3  PHE  66           HB1      PHE  66   4.518  -0.885   8.632
  525    HD1  PHE  66           HD1      PHE  66   5.927   1.057   8.886
  526    HD2  PHE  66           HD2      PHE  66   6.749  -1.947   6.036
  527    HE1  PHE  66           HE1      PHE  66   7.580   2.526   7.807
  528    HE2  PHE  66           HE2      PHE  66   8.374  -0.506   4.938
  529    HZ   PHE  66           HZ       PHE  66   8.812   1.694   5.812
  530    H    GLY  67           HN       GLY  67   4.592  -4.148   8.406
  531    HA2  GLY  67           HA3      GLY  67   3.940  -5.845  10.258
  532    HA3  GLY  67           HA2      GLY  67   3.090  -4.439  10.896
  533    HA   PRO  68           HA       PRO  68   0.644  -6.756   7.544
  534    HB2  PRO  68           HB2      PRO  68  -1.508  -7.373   9.140
  535    HB3  PRO  68           HB1      PRO  68  -0.169  -8.477   8.800
  536    HG2  PRO  68           HG2      PRO  68  -0.684  -6.790  11.204
  537    HG3  PRO  68           HG1      PRO  68   0.031  -8.405  11.101
  538    HD2  PRO  68           HD2      PRO  68   1.493  -6.157  11.491
  539    HD3  PRO  68           HD1      PRO  68   2.136  -7.573  10.649
  540    H    GLU  69           HN       GLU  69  -0.504  -4.682  10.131
  541    HA   GLU  69           HA       GLU  69  -2.705  -3.685   8.523
  542    HB2  GLU  69           HB3      GLU  69  -1.784  -2.771  11.261
  543    HB3  GLU  69           HB2      GLU  69  -3.369  -2.537  10.534
  544    HG2  GLU  69           HG3      GLU  69  -3.803  -4.917  10.637
  545    HG3  GLU  69           HG2      GLU  69  -2.189  -5.210  11.264
  546    H    GLU  70           HN       GLU  70   0.443  -2.844   9.562
  547    HA   GLU  70           HA       GLU  70   0.316  -0.049   8.989
  548    HB2  GLU  70           HB3      GLU  70   1.834  -1.352  10.624
  549    HB3  GLU  70           HB2      GLU  70   2.818  -1.680   9.213
  550    HG2  GLU  70           HG3      GLU  70   3.697   0.220  10.406
  551    HG3  GLU  70           HG2      GLU  70   3.034   0.772   8.865
  552    H    ALA  71           HN       ALA  71   1.750  -2.901   7.398
  553    HA   ALA  71           HA       ALA  71   2.923  -1.795   5.140
  554    HB1  ALA  71           HB1      ALA  71   2.572  -3.953   4.089
  555    HB2  ALA  71           HB2      ALA  71   1.403  -4.392   5.335
  556    HB3  ALA  71           HB3      ALA  71   3.094  -4.126   5.756
  557    H    TRP  72           HN       TRP  72  -0.422  -2.849   5.557
  558    HA   TRP  72           HA       TRP  72  -1.198  -2.233   2.955
  559    HB2  TRP  72           HB2      TRP  72  -2.576  -3.736   4.217
  560    HB3  TRP  72           HB1      TRP  72  -2.824  -2.536   5.480
  561    HD1  TRP  72           HD1      TRP  72  -5.300  -1.933   5.395
  562    HE1  TRP  72           HE1      TRP  72  -6.954  -1.197   3.584
  563    HE3  TRP  72           HE3      TRP  72  -2.324  -2.505   1.287
  564    HZ2  TRP  72           HZ2      TRP  72  -6.989  -0.883   0.807
  565    HZ3  TRP  72           HZ3      TRP  72  -3.263  -1.977  -0.944
  566    HH2  TRP  72           HH2      TRP  72  -5.549  -1.180  -1.170
  567    H    ARG  73           HN       ARG  73  -1.319  -0.312   5.908
  568    HA   ARG  73           HA       ARG  73  -2.618   1.856   4.714
  569    HB2  ARG  73           HB2      ARG  73  -2.434   1.647   7.174
  570    HB3  ARG  73           HB1      ARG  73  -0.702   1.941   7.059
  571    HG2  ARG  73           HG2      ARG  73  -1.150   4.168   6.128
  572    HG3  ARG  73           HG1      ARG  73  -2.879   3.883   6.296
  573    HD2  ARG  73           HD2      ARG  73  -2.600   3.672   8.719
  574    HD3  ARG  73           HD1      ARG  73  -0.864   3.950   8.535
  575    HE   ARG  73           HE       ARG  73  -2.597   5.983   7.446
  576   HH11  ARG  73          HH11      ARG  73  -0.672   5.002  10.271
  577   HH12  ARG  73          HH12      ARG  73  -0.523   6.604  10.854
  578   HH21  ARG  73          HH21      ARG  73  -2.397   8.149   8.327
  579   HH22  ARG  73          HH22      ARG  73  -1.507   8.383   9.768
  580    H    LEU  74           HN       LEU  74   0.788   1.078   5.172
  581    HA   LEU  74           HA       LEU  74   1.998   3.316   4.112
  582    HB2  LEU  74           HB2      LEU  74   2.751   0.490   4.440
  583    HB3  LEU  74           HB1      LEU  74   3.644   1.344   3.208
  584    HG   LEU  74           HG       LEU  74   4.828   1.279   5.364
  585   HD11  LEU  74          HD11      LEU  74   3.953   4.040   4.544
  586   HD12  LEU  74          HD12      LEU  74   5.305   3.105   3.886
  587   HD13  LEU  74          HD13      LEU  74   5.345   3.648   5.551
  588   HD21  LEU  74          HD21      LEU  74   2.558   2.965   6.399
  589   HD22  LEU  74          HD22      LEU  74   4.037   2.561   7.270
  590   HD23  LEU  74          HD23      LEU  74   2.882   1.292   6.845
  591    H    ALA  75           HN       ALA  75   0.791   0.472   2.381
  592    HA   ALA  75           HA       ALA  75   1.682   1.447  -0.137
  593    HB1  ALA  75           HB1      ALA  75   0.323  -0.277  -1.139
  594    HB2  ALA  75           HB2      ALA  75  -0.429  -0.618   0.424
  595    HB3  ALA  75           HB3      ALA  75   1.299  -0.904   0.178
  596    H    LEU  76           HN       LEU  76  -1.596   1.395   1.304
  597    HA   LEU  76           HA       LEU  76  -2.705   2.620  -0.977
  598    HB2  LEU  76           HB2      LEU  76  -4.773   2.804   0.194
  599    HB3  LEU  76           HB1      LEU  76  -4.035   1.305   0.685
  600    HG   LEU  76           HG       LEU  76  -3.233   2.764   2.740
  601   HD11  LEU  76          HD11      LEU  76  -4.934   4.402   3.411
  602   HD12  LEU  76          HD12      LEU  76  -5.733   4.199   1.850
  603   HD13  LEU  76          HD13      LEU  76  -4.110   4.875   1.926
  604   HD21  LEU  76          HD21      LEU  76  -4.606   0.795   2.928
  605   HD22  LEU  76          HD22      LEU  76  -6.018   1.685   2.385
  606   HD23  LEU  76          HD23      LEU  76  -5.279   2.072   3.944
  607    H    SER  77           HN       SER  77  -1.475   3.983   2.003
  608    HA   SER  77           HA       SER  77  -2.272   6.603   1.318
  609    HB2  SER  77           HB2      SER  77  -0.658   5.334   3.435
  610    HB3  SER  77           HB1      SER  77  -0.758   7.128   3.374
  611    HG   SER  77           HG       SER  77  -3.176   6.253   3.155
  612    H    THR  78           HN       THR  78   0.305   4.678   0.240
  613    HA   THR  78           HA       THR  78   1.802   7.047  -0.444
  614    HB   THR  78           HB       THR  78   2.410   4.113  -0.966
  615    HG1  THR  78           HG1      THR  78   2.834   4.482   1.091
  616   HG21  THR  78          HG21      THR  78   4.106   6.558  -1.525
  617   HG22  THR  78          HG22      THR  78   3.401   5.490  -2.743
  618   HG23  THR  78          HG23      THR  78   4.652   4.887  -1.650
  619    H    PHE  79           HN       PHE  79  -0.418   4.721  -1.802
  620    HA   PHE  79           HA       PHE  79  -0.102   5.065  -4.515
  621    HB2  PHE  79           HB2      PHE  79  -2.683   4.728  -2.967
  622    HB3  PHE  79           HB1      PHE  79  -2.589   4.644  -4.716
  623    HD1  PHE  79           HD2      PHE  79   0.215   3.062  -4.410
  624    HD2  PHE  79           HD1      PHE  79  -3.740   2.585  -2.919
  625    HE1  PHE  79           HE2      PHE  79   0.583   0.660  -4.182
  626    HE2  PHE  79           HE1      PHE  79  -3.370   0.172  -2.696
  627    HZ   PHE  79           HZ       PHE  79  -1.202  -0.798  -3.334
  628    H    GLU  80           HN       GLU  80  -2.237   6.865  -2.338
  629    HA   GLU  80           HA       GLU  80  -3.293   8.756  -4.074
  630    HB2  GLU  80           HB3      GLU  80  -3.487  10.200  -1.939
  631    HB3  GLU  80           HB2      GLU  80  -4.306   8.638  -1.981
  632    HG2  GLU  80           HG3      GLU  80  -2.837   7.649  -0.627
  633    HG3  GLU  80           HG2      GLU  80  -1.552   8.823  -0.866
  634    H    ARG  81           HN       ARG  81  -0.147   8.708  -2.615
  635    HA   ARG  81           HA       ARG  81   0.280  11.523  -3.234
  636    HB2  ARG  81           HB2      ARG  81   1.936   9.595  -1.622
  637    HB3  ARG  81           HB1      ARG  81   2.271  11.319  -1.806
  638    HG2  ARG  81           HG2      ARG  81   0.286  11.927  -0.719
  639    HG3  ARG  81           HG1      ARG  81  -0.343  10.290  -0.755
  640    HD2  ARG  81           HD2      ARG  81   1.650   9.694   0.699
  641    HD3  ARG  81           HD1      ARG  81   1.858  11.434   0.913
  642    HE   ARG  81           HE       ARG  81  -0.821  10.627   1.401
  643   HH11  ARG  81          HH11      ARG  81   2.375  10.749   2.877
  644   HH12  ARG  81          HH12      ARG  81   1.808  10.640   4.475
  645   HH21  ARG  81          HH21      ARG  81  -1.619  10.496   3.589
  646   HH22  ARG  81          HH22      ARG  81  -0.521  10.511   4.888
  647    H    ILE  82           HN       ILE  82   0.986   8.462  -4.517
  648    HA   ILE  82           HA       ILE  82   3.073   9.624  -6.199
  649    HB   ILE  82           HB       ILE  82   3.485   7.357  -7.085
  650   HG12  ILE  82          HG12      ILE  82   1.396   6.416  -5.104
  651   HG13  ILE  82          HG11      ILE  82   1.172   6.469  -6.849
  652   HG21  ILE  82          HG21      ILE  82   4.744   8.070  -5.159
  653   HG22  ILE  82          HG22      ILE  82   4.421   6.338  -5.068
  654   HG23  ILE  82          HG23      ILE  82   3.491   7.462  -4.074
  655   HD11  ILE  82          HD11      ILE  82   3.172   4.770  -5.368
  656   HD12  ILE  82          HD12      ILE  82   2.944   4.806  -7.116
  657   HD13  ILE  82          HD13      ILE  82   1.652   4.215  -6.070
  658    H    ASN  83           HN       ASN  83   0.101  10.031  -6.143
  659    HA   ASN  83           HA       ASN  83  -1.484  10.753  -7.560
  660    HB2  ASN  83           HB3      ASN  83   0.423  11.734  -8.870
  661    HB3  ASN  83           HB2      ASN  83   0.526  10.251  -9.794
  662   HD21  ASN  83          HD21      ASN  83  -0.947   9.895 -11.406
  663   HD22  ASN  83          HD22      ASN  83  -2.032  11.109 -11.998
  664    H    ARG  84           HN       ARG  84  -0.978   7.953  -6.930
  665    HA   ARG  84           HA       ARG  84  -2.649   6.795  -8.991
  666    HB2  ARG  84           HB2      ARG  84  -0.581   5.641  -8.569
  667    HB3  ARG  84           HB1      ARG  84  -0.980   5.448  -6.874
  668    HG2  ARG  84           HG2      ARG  84  -1.376   3.364  -8.154
  669    HG3  ARG  84           HG1      ARG  84  -2.841   3.995  -7.398
  670    HD2  ARG  84           HD2      ARG  84  -3.359   3.293  -9.590
  671    HD3  ARG  84           HD1      ARG  84  -3.446   5.042  -9.482
  672    HE   ARG  84           HE       ARG  84  -0.848   4.134 -10.397
  673   HH11  ARG  84          HH11      ARG  84  -4.032   5.164 -11.619
  674   HH12  ARG  84          HH12      ARG  84  -3.522   5.148 -13.240
  675   HH21  ARG  84          HH21      ARG  84  -0.194   4.179 -12.494
  676   HH22  ARG  84          HH22      ARG  84  -1.235   4.625 -13.784
  677    H    LYS  85           HN       LYS  85  -4.373   8.045  -8.106
  678    HA   LYS  85           HA       LYS  85  -5.274   7.420  -5.461
  679    HB2  LYS  85           HB2      LYS  85  -5.513   9.633  -5.879
  680    HB3  LYS  85           HB1      LYS  85  -5.963   9.436  -7.563
  681    HG2  LYS  85           HG2      LYS  85  -8.203   8.682  -6.802
  682    HG3  LYS  85           HG1      LYS  85  -7.686   8.978  -5.140
  683    HD2  LYS  85           HD2      LYS  85  -7.505  11.291  -5.487
  684    HD3  LYS  85           HD1      LYS  85  -7.569  11.113  -7.239
  685    HE2  LYS  85           HE2      LYS  85  -9.832  10.478  -5.351
  686    HE3  LYS  85           HE1      LYS  85  -9.686  11.966  -6.282
  687    HZ1  LYS  85           HZ1      LYS  85 -11.097  10.557  -7.486
  688    HZ2  LYS  85           HZ2      LYS  85 -10.143   9.210  -7.302
  689    HZ3  LYS  85           HZ3      LYS  85  -9.624  10.470  -8.317
  690    H    ASP  86           HN       ASP  86  -5.685   6.352  -8.590
  691    HA   ASP  86           HA       ASP  86  -8.255   5.405  -8.832
  692    HB2  ASP  86           HB2      ASP  86  -5.798   3.902  -9.754
  693    HB3  ASP  86           HB1      ASP  86  -7.400   3.855 -10.472
  694    H    LEU  87           HN       LEU  87  -5.410   3.749  -7.581
  695    HA   LEU  87           HA       LEU  87  -6.854   1.381  -6.727
  696    HB2  LEU  87           HB2      LEU  87  -4.044   2.277  -6.101
  697    HB3  LEU  87           HB1      LEU  87  -4.696   0.707  -5.715
  698    HG   LEU  87           HG       LEU  87  -4.255   1.788  -8.499
  699   HD11  LEU  87          HD11      LEU  87  -2.477   0.130  -8.607
  700   HD12  LEU  87          HD12      LEU  87  -2.776  -0.316  -6.927
  701   HD13  LEU  87          HD13      LEU  87  -2.175   1.295  -7.321
  702   HD21  LEU  87          HD21      LEU  87  -4.753  -0.494  -9.209
  703   HD22  LEU  87          HD22      LEU  87  -6.136   0.256  -8.414
  704   HD23  LEU  87          HD23      LEU  87  -5.152  -0.926  -7.548
  705    H    TRP  88           HN       TRP  88  -5.816   4.323  -5.391
  706    HA   TRP  88           HA       TRP  88  -5.703   3.767  -2.667
  707    HB2  TRP  88           HB2      TRP  88  -4.737   5.704  -3.709
  708    HB3  TRP  88           HB1      TRP  88  -6.283   6.264  -4.226
  709    HD1  TRP  88           HD1      TRP  88  -4.465   5.632  -0.920
  710    HE1  TRP  88           HE1      TRP  88  -5.270   7.359   0.800
  711    HE3  TRP  88           HE3      TRP  88  -8.105   7.851  -3.660
  712    HZ2  TRP  88           HZ2      TRP  88  -7.219   9.371   0.992
  713    HZ3  TRP  88           HZ3      TRP  88  -9.413   9.677  -2.653
  714    HH2  TRP  88           HH2      TRP  88  -8.983  10.421  -0.367
  715    H    GLU  89           HN       GLU  89  -8.341   5.077  -4.635
  716    HA   GLU  89           HA       GLU  89 -10.190   5.301  -2.519
  717    HB2  GLU  89           HB3      GLU  89 -10.732   4.990  -5.476
  718    HB3  GLU  89           HB2      GLU  89 -11.902   5.515  -4.275
  719    HG2  GLU  89           HG3      GLU  89 -10.509   7.476  -3.799
  720    HG3  GLU  89           HG2      GLU  89  -9.379   6.940  -5.041
  721    H    ARG  90           HN       ARG  90  -9.373   2.687  -4.645
  722    HA   ARG  90           HA       ARG  90 -11.582   0.981  -3.981
  723    HB2  ARG  90           HB2      ARG  90  -8.826   0.129  -4.799
  724    HB3  ARG  90           HB1      ARG  90 -10.287  -0.836  -4.918
  725    HG2  ARG  90           HG2      ARG  90 -11.078   0.822  -6.646
  726    HG3  ARG  90           HG1      ARG  90  -9.463   1.534  -6.573
  727    HD2  ARG  90           HD2      ARG  90  -8.544  -0.776  -6.989
  728    HD3  ARG  90           HD1      ARG  90 -10.199  -1.268  -7.336
  729    HE   ARG  90           HE       ARG  90  -9.842   0.808  -8.985
  730   HH11  ARG  90          HH11      ARG  90  -8.021  -2.173  -8.392
  731   HH12  ARG  90          HH12      ARG  90  -7.231  -2.196  -9.879
  732   HH21  ARG  90          HH21      ARG  90  -8.849   0.769 -11.065
  733   HH22  ARG  90          HH22      ARG  90  -7.728  -0.447 -11.493
  734    H    GLY  91           HN       GLY  91  -8.391   1.584  -2.750
  735    HA2  GLY  91           HA3      GLY  91  -8.112  -0.559  -0.967
  736    HA3  GLY  91           HA2      GLY  91  -7.280   0.976  -0.892
  737    H    GLN  92           HN       GLN  92  -9.572   2.606  -0.573
  738    HA   GLN  92           HA       GLN  92  -9.879   2.129   2.252
  739    HB2  GLN  92           HB2      GLN  92 -10.913   4.455   0.631
  740    HB3  GLN  92           HB1      GLN  92 -10.812   4.360   2.384
  741    HG2  GLN  92           HG2      GLN  92  -8.279   4.036   2.010
  742    HG3  GLN  92           HG1      GLN  92  -8.602   4.604   0.389
  743   HE21  GLN  92          HE21      GLN  92 -10.735   6.445   1.401
  744   HE22  GLN  92          HE22      GLN  92  -9.863   7.765   2.082
  745    H    ARG  93           HN       ARG  93 -11.950   2.281   3.309
  746    HA   ARG  93           HA       ARG  93 -13.962   0.801   1.787
  747    HB2  ARG  93           HB2      ARG  93 -14.914   0.163   3.916
  748    HB3  ARG  93           HB1      ARG  93 -13.186  -0.165   3.931
  749    HG2  ARG  93           HG2      ARG  93 -12.844   1.935   5.184
  750    HG3  ARG  93           HG1      ARG  93 -14.588   2.162   5.221
  751    HD2  ARG  93           HD2      ARG  93 -13.120  -0.194   6.340
  752    HD3  ARG  93           HD1      ARG  93 -13.629   1.226   7.272
  753    HE   ARG  93           HE       ARG  93 -15.716  -0.284   5.873
  754   HH11  ARG  93          HH11      ARG  93 -14.047   0.344   8.960
  755   HH12  ARG  93          HH12      ARG  93 -15.270  -0.312   9.923
  756   HH21  ARG  93          HH21      ARG  93 -17.411  -1.196   7.219
  757   HH22  ARG  93          HH22      ARG  93 -17.254  -1.185   8.917
  758    H    GLU  94           HN       GLU  94 -16.054   1.501   1.645
  759    HA   GLU  94           HA       GLU  94 -16.678   4.070   2.889
  760    HB2  GLU  94           HB3      GLU  94 -17.540   3.173   0.127
  761    HB3  GLU  94           HB2      GLU  94 -18.162   4.596   0.939
  762    HG2  GLU  94           HG3      GLU  94 -15.795   5.458   0.982
  763    HG3  GLU  94           HG2      GLU  94 -15.383   4.117  -0.090
  764    H    ASP  95           HN       ASP  95 -17.179   1.164   3.523
  765    HA   ASP  95           HA       ASP  95 -20.057   1.055   3.358
  766    HB2  ASP  95           HB2      ASP  95 -19.896  -1.163   4.332
  767    HB3  ASP  95           HB1      ASP  95 -18.791  -1.038   2.970
  768    H    LEU  96           HN       LEU  96 -21.366   1.525   4.868
  769    HA   LEU  96           HA       LEU  96 -20.491   3.013   7.136
  770    HB2  LEU  96           HB2      LEU  96 -22.544   3.561   5.958
  771    HB3  LEU  96           HB1      LEU  96 -23.203   1.984   6.344
  772    HG   LEU  96           HG       LEU  96 -23.189   2.601   8.736
  773   HD11  LEU  96          HD11      LEU  96 -22.396   5.321   7.713
  774   HD12  LEU  96          HD12      LEU  96 -21.414   4.254   8.722
  775   HD13  LEU  96          HD13      LEU  96 -22.901   4.952   9.361
  776   HD21  LEU  96          HD21      LEU  96 -25.090   4.149   8.615
  777   HD22  LEU  96          HD22      LEU  96 -25.217   2.869   7.409
  778   HD23  LEU  96          HD23      LEU  96 -24.701   4.485   6.931
  779    H    VAL  97           HN       VAL  97 -22.345   0.096   6.772
  780    HA   VAL  97           HA       VAL  97 -21.601  -0.683   9.497
  781    HB   VAL  97           HB       VAL  97 -23.616  -2.041   7.670
  782   HG11  VAL  97          HG11      VAL  97 -22.782  -3.477   9.451
  783   HG12  VAL  97          HG12      VAL  97 -24.472  -3.058   9.731
  784   HG13  VAL  97          HG13      VAL  97 -23.198  -2.253  10.651
  785   HG21  VAL  97          HG21      VAL  97 -25.371  -0.909   8.957
  786   HG22  VAL  97          HG22      VAL  97 -24.350   0.236   8.094
  787   HG23  VAL  97          HG23      VAL  97 -24.136   0.002   9.828
  788    H    ARG  98           HN       ARG  98 -22.342  -2.728   6.752
  789    HA   ARG  98           HA       ARG  98 -19.623  -3.368   6.088
  790    HB2  ARG  98           HB2      ARG  98 -21.537  -5.565   7.051
  791    HB3  ARG  98           HB1      ARG  98 -20.015  -5.849   6.239
  792    HG2  ARG  98           HG2      ARG  98 -20.341  -4.561   8.940
  793    HG3  ARG  98           HG1      ARG  98 -19.875  -6.239   8.653
  794    HD2  ARG  98           HD2      ARG  98 -18.330  -3.819   7.704
  795    HD3  ARG  98           HD1      ARG  98 -17.962  -4.746   9.151
  796    HE   ARG  98           HE       ARG  98 -17.671  -6.667   7.637
  797   HH11  ARG  98          HH11      ARG  98 -17.262  -3.364   6.243
  798   HH12  ARG  98          HH12      ARG  98 -15.998  -3.830   5.231
  799   HH21  ARG  98          HH21      ARG  98 -15.941  -7.250   6.157
  800   HH22  ARG  98          HH22      ARG  98 -15.224  -6.080   5.157
  801    H    ASP  99           HN       ASP  99 -22.925  -4.548   5.864
  802    HA   ASP  99           HA       ASP  99 -22.917  -4.278   2.950
  803    HB2  ASP  99           HB2      ASP  99 -23.857  -6.359   3.999
  804    HB3  ASP  99           HB1      ASP  99 -25.017  -5.361   4.866
  805    H    THR 100           HN       THR 100 -23.853  -2.431   2.102
  806    HA   THR 100           HA       THR 100 -25.578  -0.895   3.842
  807    HB   THR 100           HB       THR 100 -23.409   0.501   2.319
  808    HG1  THR 100           HG1      THR 100 -22.523  -1.135   3.807
  809   HG21  THR 100          HG21      THR 100 -24.936   1.107   4.854
  810   HG22  THR 100          HG22      THR 100 -25.218   1.821   3.263
  811   HG23  THR 100          HG23      THR 100 -23.717   2.151   4.135
  812    H    VAL 101           HN       VAL 101 -26.797   0.634   2.581
  813    HA   VAL 101           HA       VAL 101 -27.345  -0.440  -0.038
  814    HB   VAL 101           HB       VAL 101 -29.439   0.892   0.116
  815   HG11  VAL 101          HG11      VAL 101 -28.757  -0.884   2.442
  816   HG12  VAL 101          HG12      VAL 101 -29.378  -1.403   0.881
  817   HG13  VAL 101          HG13      VAL 101 -30.406  -0.455   1.971
  818   HG21  VAL 101          HG21      VAL 101 -28.390   1.582   2.864
  819   HG22  VAL 101          HG22      VAL 101 -30.010   1.956   2.269
  820   HG23  VAL 101          HG23      VAL 101 -28.593   2.715   1.532
  821    H    GLU 102           HN       GLU 102 -27.617   0.872  -1.849
  822    HA   GLU 102           HA       GLU 102 -26.495   3.528  -1.799
  823    HB2  GLU 102           HB3      GLU 102 -24.556   2.115  -2.245
  824    HB3  GLU 102           HB2      GLU 102 -25.413   1.268  -3.513
  825    HG2  GLU 102           HG3      GLU 102 -25.566   3.407  -4.758
  826    HG3  GLU 102           HG2      GLU 102 -24.543   4.136  -3.518
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1   1.680 -10.774 -11.813
    2    H2   GLY   1           HT2      GLY   1   3.146 -10.035 -11.438
    3    H3   GLY   1           HT3      GLY   1   1.886 -10.052 -10.304
    4    HA2  GLY   1           HA2      GLY   1   3.400 -12.384 -11.304
    5    HA3  GLY   1           HA3      GLY   1   3.449 -11.720  -9.669
    6    H    HIS   2           HN       HIS   2   2.799 -13.936  -9.061
    7    HA   HIS   2           HA       HIS   2   0.222 -14.766  -9.929
    8    HB2  HIS   2           HB2      HIS   2   0.450 -16.699  -8.424
    9    HB3  HIS   2           HB1      HIS   2   1.885 -16.492  -9.404
   10    HD1  HIS   2           HD1      HIS   2   4.105 -15.930  -8.118
   11    HD2  HIS   2           HD2      HIS   2   0.775 -16.410  -5.676
   12    HE1  HIS   2           HE1      HIS   2   4.987 -16.211  -5.770
   13    H    MET   3           HN       MET   3  -1.663 -14.632  -9.013
   14    HA   MET   3           HA       MET   3  -2.076 -12.671  -6.986
   15    HB2  MET   3           HB2      MET   3  -3.942 -14.571  -8.386
   16    HB3  MET   3           HB1      MET   3  -4.490 -13.422  -7.179
   17    HG2  MET   3           HG2      MET   3  -3.118 -12.722  -9.769
   18    HG3  MET   3           HG1      MET   3  -4.852 -12.648  -9.483
   19    HE1  MET   3           HE1      MET   3  -4.942 -11.548  -6.479
   20    HE2  MET   3           HE2      MET   3  -5.995 -10.974  -7.770
   21    HE3  MET   3           HE3      MET   3  -5.103  -9.821  -6.778
   22    H    LEU   4           HN       LEU   4  -2.137 -12.972  -4.883
   23    HA   LEU   4           HA       LEU   4  -1.858 -15.593  -3.768
   24    HB2  LEU   4           HB2      LEU   4  -2.230 -12.882  -2.459
   25    HB3  LEU   4           HB1      LEU   4  -2.062 -14.366  -1.553
   26    HG   LEU   4           HG       LEU   4   0.012 -13.221  -1.474
   27   HD11  LEU   4          HD11      LEU   4   1.575 -14.794  -2.464
   28   HD12  LEU   4          HD12      LEU   4   0.263 -15.495  -3.407
   29   HD13  LEU   4          HD13      LEU   4   0.232 -15.588  -1.645
   30   HD21  LEU   4          HD21      LEU   4   1.328 -12.615  -3.473
   31   HD22  LEU   4          HD22      LEU   4  -0.194 -11.733  -3.379
   32   HD23  LEU   4          HD23      LEU   4  -0.030 -13.094  -4.491
   33    H    ARG   5           HN       ARG   5  -3.431 -16.879  -3.145
   34    HA   ARG   5           HA       ARG   5  -6.134 -15.741  -3.010
   35    HB2  ARG   5           HB2      ARG   5  -5.271 -18.514  -3.847
   36    HB3  ARG   5           HB1      ARG   5  -6.939 -17.980  -3.690
   37    HG2  ARG   5           HG2      ARG   5  -4.984 -16.656  -5.557
   38    HG3  ARG   5           HG1      ARG   5  -5.971 -18.023  -6.049
   39    HD2  ARG   5           HD2      ARG   5  -7.015 -15.954  -6.766
   40    HD3  ARG   5           HD1      ARG   5  -7.997 -16.716  -5.522
   41    HE   ARG   5           HE       ARG   5  -6.192 -14.723  -4.493
   42   HH11  ARG   5          HH11      ARG   5  -9.359 -15.197  -6.040
   43   HH12  ARG   5          HH12      ARG   5 -10.037 -13.790  -5.370
   44   HH21  ARG   5          HH21      ARG   5  -7.177 -12.762  -3.559
   45   HH22  ARG   5          HH22      ARG   5  -8.772 -12.364  -3.960
   46    H    THR   6           HN       THR   6  -4.426 -18.649  -1.868
   47    HA   THR   6           HA       THR   6  -5.341 -17.891   0.772
   48    HB   THR   6           HB       THR   6  -5.333 -20.760  -0.246
   49    HG1  THR   6           HG1      THR   6  -7.094 -19.700  -1.096
   50   HG21  THR   6          HG21      THR   6  -6.422 -21.260   1.887
   51   HG22  THR   6          HG22      THR   6  -6.293 -19.567   2.365
   52   HG23  THR   6          HG23      THR   6  -4.834 -20.541   2.158
   53    H    ALA   7           HN       ALA   7  -3.367 -16.929   0.941
   54    HA   ALA   7           HA       ALA   7  -1.380 -18.414   2.186
   55    HB1  ALA   7           HB1      ALA   7  -0.755 -19.062  -0.109
   56    HB2  ALA   7           HB2      ALA   7   0.463 -17.991   0.582
   57    HB3  ALA   7           HB3      ALA   7  -0.704 -17.363  -0.580
   58    H    GLY   8           HN       GLY   8   0.154 -16.911   3.085
   59    HA2  GLY   8           HA3      GLY   8   1.071 -14.762   3.315
   60    HA3  GLY   8           HA2      GLY   8  -0.328 -14.103   2.476
   61    H    ARG   9           HN       ARG   9  -1.420 -12.882   3.765
   62    HA   ARG   9           HA       ARG   9  -2.592 -13.708   6.199
   63    HB2  ARG   9           HB2      ARG   9  -0.094 -13.195   6.767
   64    HB3  ARG   9           HB1      ARG   9  -0.476 -11.533   6.391
   65    HG2  ARG   9           HG2      ARG   9  -1.833 -13.129   8.551
   66    HG3  ARG   9           HG1      ARG   9  -0.416 -12.122   8.814
   67    HD2  ARG   9           HD2      ARG   9  -1.730 -10.166   8.031
   68    HD3  ARG   9           HD1      ARG   9  -3.145 -11.206   7.901
   69    HE   ARG   9           HE       ARG   9  -2.272 -11.567  10.444
   70   HH11  ARG   9          HH11      ARG   9  -3.447  -8.771   8.573
   71   HH12  ARG   9          HH12      ARG   9  -3.738  -7.818   9.965
   72   HH21  ARG   9          HH21      ARG   9  -2.801 -10.268  12.322
   73   HH22  ARG   9          HH22      ARG   9  -3.448  -8.702  12.110
   74    H    ASP  10           HN       ASP  10  -4.370 -12.249   6.479
   75    HA   ASP  10           HA       ASP  10  -4.955 -10.615   4.281
   76    HB2  ASP  10           HB2      ASP  10  -6.282 -10.661   7.009
   77    HB3  ASP  10           HB1      ASP  10  -6.894  -9.749   5.637
   78    H    GLY  11           HN       GLY  11  -4.556  -8.677   3.799
   79    HA2  GLY  11           HA3      GLY  11  -4.126  -6.346   4.520
   80    HA3  GLY  11           HA2      GLY  11  -2.976  -7.051   5.669
   81    H    LEU  12           HN       LEU  12  -1.928  -9.039   4.169
   82    HA   LEU  12           HA       LEU  12   0.038  -7.607   2.577
   83    HB2  LEU  12           HB2      LEU  12   0.346  -9.571   4.271
   84    HB3  LEU  12           HB1      LEU  12  -0.227 -10.575   2.992
   85    HG   LEU  12           HG       LEU  12   2.311  -8.929   2.762
   86   HD11  LEU  12          HD11      LEU  12   2.489 -10.597   4.528
   87   HD12  LEU  12          HD12      LEU  12   3.494 -11.018   3.144
   88   HD13  LEU  12          HD13      LEU  12   1.961 -11.852   3.408
   89   HD21  LEU  12          HD21      LEU  12   1.282 -11.239   1.094
   90   HD22  LEU  12          HD22      LEU  12   2.816 -10.398   0.873
   91   HD23  LEU  12          HD23      LEU  12   1.296  -9.547   0.596
   92    H    CYS  13           HN       CYS  13  -2.463 -10.009   2.206
   93    HA   CYS  13           HA       CYS  13  -1.991 -10.751  -0.436
   94    HB2  CYS  13           HB2      CYS  13  -4.533 -10.833   1.152
   95    HB3  CYS  13           HB1      CYS  13  -4.147 -11.842  -0.260
   96    HG   CYS  13           HG       CYS  13  -2.779 -13.689   1.059
   97    H    ARG  14           HN       ARG  14  -4.040  -8.187   0.908
   98    HA   ARG  14           HA       ARG  14  -5.080  -7.498  -1.705
   99    HB2  ARG  14           HB2      ARG  14  -6.442  -7.323   0.381
  100    HB3  ARG  14           HB1      ARG  14  -5.368  -6.065   0.954
  101    HG2  ARG  14           HG2      ARG  14  -6.133  -4.575  -0.786
  102    HG3  ARG  14           HG1      ARG  14  -7.103  -5.866  -1.511
  103    HD2  ARG  14           HD2      ARG  14  -8.454  -6.011   0.523
  104    HD3  ARG  14           HD1      ARG  14  -7.474  -4.762   1.281
  105    HE   ARG  14           HE       ARG  14  -8.501  -3.703  -1.067
  106   HH11  ARG  14          HH11      ARG  14  -9.910  -5.040   1.913
  107   HH12  ARG  14          HH12      ARG  14 -11.159  -3.888   2.012
  108   HH21  ARG  14          HH21      ARG  14 -10.318  -2.113  -0.923
  109   HH22  ARG  14          HH22      ARG  14 -11.393  -2.246   0.395
  110    H    LEU  15           HN       LEU  15  -2.311  -6.791   0.126
  111    HA   LEU  15           HA       LEU  15  -1.773  -4.115  -0.669
  112    HB2  LEU  15           HB2      LEU  15  -0.993  -5.513   1.372
  113    HB3  LEU  15           HB1      LEU  15   0.136  -6.254   0.279
  114    HG   LEU  15           HG       LEU  15   0.103  -3.368   1.144
  115   HD11  LEU  15          HD11      LEU  15   2.155  -3.909   2.292
  116   HD12  LEU  15          HD12      LEU  15   1.959  -5.603   1.836
  117   HD13  LEU  15          HD13      LEU  15   0.780  -4.832   2.897
  118   HD21  LEU  15          HD21      LEU  15   2.262  -3.178   0.035
  119   HD22  LEU  15          HD22      LEU  15   0.960  -3.527  -1.104
  120   HD23  LEU  15          HD23      LEU  15   2.063  -4.809  -0.610
  121    H    SER  16           HN       SER  16  -0.578  -7.344  -1.498
  122    HA   SER  16           HA       SER  16   1.251  -6.670  -3.482
  123    HB2  SER  16           HB2      SER  16   1.059  -8.886  -2.313
  124    HB3  SER  16           HB1      SER  16  -0.367  -9.226  -3.287
  125    HG   SER  16           HG       SER  16   0.866  -9.565  -4.993
  126    H    THR  17           HN       THR  17  -2.194  -7.517  -3.749
  127    HA   THR  17           HA       THR  17  -2.507  -7.665  -6.463
  128    HB   THR  17           HB       THR  17  -4.436  -6.684  -4.365
  129    HG1  THR  17           HG1      THR  17  -5.077  -8.951  -4.520
  130   HG21  THR  17          HG21      THR  17  -5.279  -6.156  -6.602
  131   HG22  THR  17          HG22      THR  17  -6.195  -7.502  -5.926
  132   HG23  THR  17          HG23      THR  17  -4.948  -7.799  -7.138
  133    H    TYR  18           HN       TYR  18  -2.426  -4.744  -4.452
  134    HA   TYR  18           HA       TYR  18  -3.229  -3.194  -6.736
  135    HB2  TYR  18           HB2      TYR  18  -2.654  -2.377  -3.902
  136    HB3  TYR  18           HB1      TYR  18  -3.023  -1.206  -5.162
  137    HD1  TYR  18           HD2      TYR  18  -5.171  -2.421  -6.670
  138    HD2  TYR  18           HD1      TYR  18  -4.467  -2.532  -2.494
  139    HE1  TYR  18           HE2      TYR  18  -7.561  -2.780  -6.293
  140    HE2  TYR  18           HE1      TYR  18  -6.882  -2.901  -2.099
  141    HH   TYR  18           HH       TYR  18  -9.074  -2.417  -3.355
  142    H    LEU  19           HN       LEU  19  -0.300  -3.999  -5.121
  143    HA   LEU  19           HA       LEU  19   1.299  -2.006  -6.370
  144    HB2  LEU  19           HB2      LEU  19   1.976  -4.708  -5.226
  145    HB3  LEU  19           HB1      LEU  19   3.177  -3.598  -5.853
  146    HG   LEU  19           HG       LEU  19   1.373  -2.983  -3.495
  147   HD11  LEU  19          HD11      LEU  19   4.233  -3.907  -3.619
  148   HD12  LEU  19          HD12      LEU  19   2.839  -4.809  -2.985
  149   HD13  LEU  19          HD13      LEU  19   3.377  -3.345  -2.179
  150   HD21  LEU  19          HD21      LEU  19   2.186  -1.032  -4.754
  151   HD22  LEU  19          HD22      LEU  19   3.839  -1.606  -4.556
  152   HD23  LEU  19          HD23      LEU  19   2.888  -1.140  -3.147
  153    H    GLU  20           HN       GLU  20   0.026  -5.053  -7.314
  154    HA   GLU  20           HA       GLU  20   1.560  -5.795  -9.481
  155    HB2  GLU  20           HB3      GLU  20  -1.371  -6.111  -8.934
  156    HB3  GLU  20           HB2      GLU  20  -0.596  -6.792 -10.353
  157    HG2  GLU  20           HG3      GLU  20   0.241  -7.397  -7.529
  158    HG3  GLU  20           HG2      GLU  20  -0.895  -8.375  -8.458
  159    H    GLU  21           HN       GLU  21  -0.828  -3.210  -9.308
  160    HA   GLU  21           HA       GLU  21  -0.910  -2.964 -12.205
  161    HB2  GLU  21           HB3      GLU  21  -2.352  -1.500 -10.023
  162    HB3  GLU  21           HB2      GLU  21  -2.650  -1.297 -11.740
  163    HG2  GLU  21           HG3      GLU  21  -3.055  -3.851 -10.195
  164    HG3  GLU  21           HG2      GLU  21  -4.330  -2.726 -10.655
  165    H    LEU  22           HN       LEU  22   1.462  -2.259 -10.439
  166    HA   LEU  22           HA       LEU  22   1.734   0.527 -11.317
  167    HB2  LEU  22           HB2      LEU  22   3.221  -0.832  -9.052
  168    HB3  LEU  22           HB1      LEU  22   3.381   0.828  -9.546
  169    HG   LEU  22           HG       LEU  22   0.957  -0.408  -8.258
  170   HD11  LEU  22          HD11      LEU  22   2.801  -0.117  -6.727
  171   HD12  LEU  22          HD12      LEU  22   1.537   1.070  -6.397
  172   HD13  LEU  22          HD13      LEU  22   3.002   1.555  -7.254
  173   HD21  LEU  22          HD21      LEU  22   0.319   1.350  -9.832
  174   HD22  LEU  22          HD22      LEU  22   1.476   2.447  -9.071
  175   HD23  LEU  22          HD23      LEU  22   0.090   1.848  -8.155
  176    H    GLU  23           HN       GLU  23   3.642   1.032 -12.379
  177    HA   GLU  23           HA       GLU  23   5.099  -1.284 -13.366
  178    HB2  GLU  23           HB3      GLU  23   5.880   0.209 -15.168
  179    HB3  GLU  23           HB2      GLU  23   4.125   0.231 -15.016
  180    HG2  GLU  23           HG3      GLU  23   4.161   2.307 -13.942
  181    HG3  GLU  23           HG2      GLU  23   5.929   2.318 -13.892
  182    H    ALA  24           HN       ALA  24   7.536  -0.563 -13.889
  183    HA   ALA  24           HA       ALA  24   8.843  -0.593 -11.470
  184    HB1  ALA  24           HB1      ALA  24   9.846  -1.299 -13.610
  185    HB2  ALA  24           HB2      ALA  24  10.908  -0.267 -12.652
  186    HB3  ALA  24           HB3      ALA  24  10.056   0.398 -14.042
  187    H    VAL  25           HN       VAL  25   8.368   2.292 -13.522
  188    HA   VAL  25           HA       VAL  25   9.755   3.975 -11.707
  189    HB   VAL  25           HB       VAL  25   9.440   4.760 -14.021
  190   HG11  VAL  25          HG11      VAL  25   7.228   3.881 -14.480
  191   HG12  VAL  25          HG12      VAL  25   7.293   5.621 -14.797
  192   HG13  VAL  25          HG13      VAL  25   6.542   5.020 -13.317
  193   HG21  VAL  25          HG21      VAL  25   8.051   6.546 -12.066
  194   HG22  VAL  25          HG22      VAL  25   8.765   7.064 -13.597
  195   HG23  VAL  25          HG23      VAL  25   9.802   6.452 -12.294
  196    H    GLU  26           HN       GLU  26   6.388   3.057 -11.897
  197    HA   GLU  26           HA       GLU  26   5.482   4.967  -9.999
  198    HB2  GLU  26           HB3      GLU  26   4.240   2.343 -10.824
  199    HB3  GLU  26           HB2      GLU  26   3.412   3.626  -9.947
  200    HG2  GLU  26           HG3      GLU  26   4.557   3.815 -12.717
  201    HG3  GLU  26           HG2      GLU  26   2.837   3.617 -12.361
  202    H    LEU  27           HN       LEU  27   6.528   1.625  -9.812
  203    HA   LEU  27           HA       LEU  27   6.137   1.264  -7.047
  204    HB2  LEU  27           HB2      LEU  27   8.120  -0.005  -8.937
  205    HB3  LEU  27           HB1      LEU  27   7.881  -0.512  -7.280
  206    HG   LEU  27           HG       LEU  27   5.726  -0.625  -9.396
  207   HD11  LEU  27          HD11      LEU  27   6.157  -3.032  -9.429
  208   HD12  LEU  27          HD12      LEU  27   7.517  -2.811  -8.328
  209   HD13  LEU  27          HD13      LEU  27   7.576  -2.127  -9.955
  210   HD21  LEU  27          HD21      LEU  27   4.889  -0.482  -7.110
  211   HD22  LEU  27          HD22      LEU  27   5.935  -1.815  -6.632
  212   HD23  LEU  27          HD23      LEU  27   4.618  -2.094  -7.773
  213    H    LYS  28           HN       LYS  28   8.860   2.451  -8.945
  214    HA   LYS  28           HA       LYS  28  10.735   2.697  -6.905
  215    HB2  LYS  28           HB2      LYS  28  11.241   2.903  -9.328
  216    HB3  LYS  28           HB1      LYS  28  10.442   4.469  -9.339
  217    HG2  LYS  28           HG2      LYS  28  12.091   5.326  -7.760
  218    HG3  LYS  28           HG1      LYS  28  12.883   3.751  -7.740
  219    HD2  LYS  28           HD2      LYS  28  13.280   3.981 -10.176
  220    HD3  LYS  28           HD1      LYS  28  12.604   5.609 -10.096
  221    HE2  LYS  28           HE2      LYS  28  15.042   5.682 -10.001
  222    HE3  LYS  28           HE1      LYS  28  14.341   6.250  -8.486
  223    HZ1  LYS  28           HZ1      LYS  28  15.430   3.525  -8.959
  224    HZ2  LYS  28           HZ2      LYS  28  14.811   4.070  -7.496
  225    HZ3  LYS  28           HZ3      LYS  28  16.206   4.738  -8.102
  226    H    LYS  29           HN       LYS  29   8.264   4.928  -8.023
  227    HA   LYS  29           HA       LYS  29   8.996   7.100  -6.374
  228    HB2  LYS  29           HB2      LYS  29   6.325   6.406  -7.545
  229    HB3  LYS  29           HB1      LYS  29   6.692   7.936  -6.767
  230    HG2  LYS  29           HG2      LYS  29   8.456   8.316  -8.543
  231    HG3  LYS  29           HG1      LYS  29   7.870   6.854  -9.313
  232    HD2  LYS  29           HD2      LYS  29   6.121   9.231  -8.707
  233    HD3  LYS  29           HD1      LYS  29   6.911   8.933 -10.260
  234    HE2  LYS  29           HE2      LYS  29   5.726   6.896 -10.542
  235    HE3  LYS  29           HE1      LYS  29   4.996   7.015  -8.940
  236    HZ1  LYS  29           HZ1      LYS  29   3.533   7.639 -10.752
  237    HZ2  LYS  29           HZ2      LYS  29   4.557   8.925 -11.167
  238    HZ3  LYS  29           HZ3      LYS  29   3.753   8.938  -9.686
  239    H    PHE  30           HN       PHE  30   6.696   4.461  -5.924
  240    HA   PHE  30           HA       PHE  30   5.732   5.436  -3.465
  241    HB2  PHE  30           HB2      PHE  30   4.163   3.858  -3.835
  242    HB3  PHE  30           HB1      PHE  30   5.095   3.275  -5.200
  243    HD1  PHE  30           HD1      PHE  30   6.448   1.296  -4.992
  244    HD2  PHE  30           HD2      PHE  30   4.151   2.671  -1.681
  245    HE1  PHE  30           HE1      PHE  30   6.733  -0.874  -3.888
  246    HE2  PHE  30           HE2      PHE  30   4.446   0.503  -0.581
  247    HZ   PHE  30           HZ       PHE  30   5.741  -1.275  -1.693
  248    H    LYS  31           HN       LYS  31   8.347   3.217  -4.252
  249    HA   LYS  31           HA       LYS  31   8.821   2.683  -1.446
  250    HB2  LYS  31           HB2      LYS  31  10.594   1.271  -2.103
  251    HB3  LYS  31           HB1      LYS  31   9.254   0.967  -3.203
  252    HG2  LYS  31           HG2      LYS  31  10.412   2.379  -4.869
  253    HG3  LYS  31           HG1      LYS  31  11.765   2.520  -3.736
  254    HD2  LYS  31           HD2      LYS  31  11.841   0.008  -3.685
  255    HD3  LYS  31           HD1      LYS  31  10.703   0.019  -5.030
  256    HE2  LYS  31           HE2      LYS  31  12.948  -0.240  -5.863
  257    HE3  LYS  31           HE1      LYS  31  12.331   1.341  -6.338
  258    HZ1  LYS  31           HZ1      LYS  31  14.653   1.337  -5.466
  259    HZ2  LYS  31           HZ2      LYS  31  14.064   0.904  -3.967
  260    HZ3  LYS  31           HZ3      LYS  31  13.616   2.382  -4.659
  261    H    LEU  32           HN       LEU  32   9.896   5.127  -3.592
  262    HA   LEU  32           HA       LEU  32  12.054   5.678  -1.803
  263    HB2  LEU  32           HB2      LEU  32  12.497   7.694  -3.099
  264    HB3  LEU  32           HB1      LEU  32  12.297   6.319  -4.148
  265    HG   LEU  32           HG       LEU  32   9.909   7.249  -4.539
  266   HD11  LEU  32          HD11      LEU  32  11.247   9.753  -3.521
  267   HD12  LEU  32          HD12      LEU  32   9.878   8.922  -2.782
  268   HD13  LEU  32          HD13      LEU  32   9.699   9.676  -4.366
  269   HD21  LEU  32          HD21      LEU  32  11.624   7.178  -6.240
  270   HD22  LEU  32          HD22      LEU  32  12.352   8.650  -5.600
  271   HD23  LEU  32          HD23      LEU  32  10.746   8.705  -6.330
  272    H    TYR  33           HN       TYR  33   8.778   6.702  -2.288
  273    HA   TYR  33           HA       TYR  33   8.820   8.886  -0.556
  274    HB2  TYR  33           HB2      TYR  33   6.996   8.476  -2.170
  275    HB3  TYR  33           HB1      TYR  33   6.459   7.109  -1.196
  276    HD1  TYR  33           HD2      TYR  33   6.703  10.762  -1.368
  277    HD2  TYR  33           HD1      TYR  33   5.289   7.458   0.912
  278    HE1  TYR  33           HE2      TYR  33   5.386  12.292   0.023
  279    HE2  TYR  33           HE1      TYR  33   3.986   8.943   2.304
  280    HH   TYR  33           HH       TYR  33   4.231  11.451   2.933
  281    H    LEU  34           HN       LEU  34   7.957   5.498   0.100
  282    HA   LEU  34           HA       LEU  34   7.877   6.273   2.902
  283    HB2  LEU  34           HB2      LEU  34   6.899   4.002   3.298
  284    HB3  LEU  34           HB1      LEU  34   5.921   5.139   2.402
  285    HG   LEU  34           HG       LEU  34   6.627   3.916   0.297
  286   HD11  LEU  34          HD11      LEU  34   7.439   1.633   0.506
  287   HD12  LEU  34          HD12      LEU  34   7.617   1.846   2.245
  288   HD13  LEU  34          HD13      LEU  34   8.616   2.787   1.136
  289   HD21  LEU  34          HD21      LEU  34   5.137   2.355   2.376
  290   HD22  LEU  34          HD22      LEU  34   5.019   2.152   0.619
  291   HD23  LEU  34          HD23      LEU  34   4.488   3.655   1.383
  292    H    GLY  35           HN       GLY  35  10.171   5.096   0.907
  293    HA2  GLY  35           HA3      GLY  35  11.186   3.321   2.938
  294    HA3  GLY  35           HA2      GLY  35  11.865   3.436   1.319
  295    H    THR  36           HN       THR  36  12.239   6.210   1.209
  296    HA   THR  36           HA       THR  36  14.360   6.557   3.234
  297    HB   THR  36           HB       THR  36  15.146   6.586   0.858
  298    HG1  THR  36           HG1      THR  36  16.175   7.940   2.479
  299   HG21  THR  36          HG21      THR  36  13.473   9.082   0.554
  300   HG22  THR  36          HG22      THR  36  13.134   7.518  -0.182
  301   HG23  THR  36          HG23      THR  36  14.571   8.418  -0.658
  302    H    ALA  37           HN       ALA  37  11.546   7.016   3.513
  303    HA   ALA  37           HA       ALA  37  10.775   9.719   3.509
  304    HB1  ALA  37           HB1      ALA  37   9.202   7.900   3.553
  305    HB2  ALA  37           HB2      ALA  37   8.950   8.989   4.923
  306    HB3  ALA  37           HB3      ALA  37   9.764   7.438   5.156
  307    H    THR  38           HN       THR  38  11.409  11.314   4.792
  308    HA   THR  38           HA       THR  38  12.752  10.890   7.269
  309    HB   THR  38           HB       THR  38  11.533  13.456   6.183
  310    HG1  THR  38           HG1      THR  38  14.112  12.298   5.790
  311   HG21  THR  38          HG21      THR  38  13.810  12.987   8.126
  312   HG22  THR  38          HG22      THR  38  12.188  13.504   8.571
  313   HG23  THR  38          HG23      THR  38  13.211  14.561   7.603
  314    H    GLU  39           HN       GLU  39   9.566  11.378   6.161
  315    HA   GLU  39           HA       GLU  39   8.371  12.150   8.622
  316    HB2  GLU  39           HB3      GLU  39   6.186  11.559   7.619
  317    HB3  GLU  39           HB2      GLU  39   7.154  12.588   6.579
  318    HG2  GLU  39           HG3      GLU  39   7.687  10.750   5.147
  319    HG3  GLU  39           HG2      GLU  39   6.944   9.603   6.263
  320    H    LEU  40           HN       LEU  40   9.526   9.173   7.575
  321    HA   LEU  40           HA       LEU  40   7.969   7.668   9.555
  322    HB2  LEU  40           HB2      LEU  40   9.754   6.933   7.304
  323    HB3  LEU  40           HB1      LEU  40   9.634   5.835   8.654
  324    HG   LEU  40           HG       LEU  40   7.209   5.613   8.250
  325   HD11  LEU  40          HD11      LEU  40   7.698   7.340   5.843
  326   HD12  LEU  40          HD12      LEU  40   6.696   7.752   7.246
  327   HD13  LEU  40          HD13      LEU  40   6.242   6.413   6.184
  328   HD21  LEU  40          HD21      LEU  40   8.750   4.056   7.270
  329   HD22  LEU  40          HD22      LEU  40   8.945   5.107   5.869
  330   HD23  LEU  40          HD23      LEU  40   7.386   4.351   6.188
  331    H    GLY  41           HN       GLY  41  10.569   9.576   9.580
  332    HA2  GLY  41           HA3      GLY  41  12.182   9.927  11.159
  333    HA3  GLY  41           HA2      GLY  41  11.648   8.465  11.985
  334    H    GLU  42           HN       GLU  42  12.289   6.486  11.140
  335    HA   GLU  42           HA       GLU  42  15.075   6.406  10.399
  336    HB2  GLU  42           HB3      GLU  42  13.098   4.139  10.530
  337    HB3  GLU  42           HB2      GLU  42  14.839   3.997  10.455
  338    HG2  GLU  42           HG3      GLU  42  14.993   5.055  12.652
  339    HG3  GLU  42           HG2      GLU  42  13.229   5.135  12.712
  340    H    GLY  43           HN       GLY  43  12.024   5.533   8.909
  341    HA2  GLY  43           HA3      GLY  43  11.534   5.100   6.650
  342    HA3  GLY  43           HA2      GLY  43  13.240   5.411   6.262
  343    H    LYS  44           HN       LYS  44  10.941   3.043   7.259
  344    HA   LYS  44           HA       LYS  44  12.628   1.194   8.477
  345    HB2  LYS  44           HB2      LYS  44   9.978   0.778   7.135
  346    HB3  LYS  44           HB1      LYS  44  10.841  -0.445   8.049
  347    HG2  LYS  44           HG2      LYS  44   9.863   2.182   9.163
  348    HG3  LYS  44           HG1      LYS  44   9.044   0.633   9.344
  349    HD2  LYS  44           HD2      LYS  44  11.107  -0.231  10.482
  350    HD3  LYS  44           HD1      LYS  44  11.756   1.409  10.431
  351    HE2  LYS  44           HE2      LYS  44   9.791   2.186  11.707
  352    HE3  LYS  44           HE1      LYS  44   9.224   0.524  11.806
  353    HZ1  LYS  44           HZ1      LYS  44  10.349   1.076  13.814
  354    HZ2  LYS  44           HZ2      LYS  44  11.704   1.640  12.986
  355    HZ3  LYS  44           HZ3      LYS  44  11.360   0.003  12.997
  356    H    ILE  45           HN       ILE  45  11.871   1.583   5.094
  357    HA   ILE  45           HA       ILE  45  12.923  -1.020   4.454
  358    HB   ILE  45           HB       ILE  45  12.208   1.221   2.564
  359   HG12  ILE  45          HG12      ILE  45  10.300   0.491   3.957
  360   HG13  ILE  45          HG11      ILE  45  10.070   0.120   2.249
  361   HG21  ILE  45          HG21      ILE  45  13.733  -0.438   1.615
  362   HG22  ILE  45          HG22      ILE  45  12.149  -0.580   0.851
  363   HG23  ILE  45          HG23      ILE  45  12.654  -1.733   2.098
  364   HD11  ILE  45          HD11      ILE  45  10.875  -1.823   4.432
  365   HD12  ILE  45          HD12      ILE  45  10.701  -2.231   2.727
  366   HD13  ILE  45          HD13      ILE  45   9.295  -1.729   3.657
  367    HA   PRO  46           HA       PRO  46  17.051   0.632   4.032
  368    HB2  PRO  46           HB2      PRO  46  18.102  -1.694   2.967
  369    HB3  PRO  46           HB1      PRO  46  18.033  -1.316   4.687
  370    HG2  PRO  46           HG2      PRO  46  16.267  -3.032   3.044
  371    HG3  PRO  46           HG1      PRO  46  16.767  -3.203   4.763
  372    HD2  PRO  46           HD2      PRO  46  14.333  -2.356   3.847
  373    HD3  PRO  46           HD1      PRO  46  14.985  -1.901   5.429
  374    H    TRP  47           HN       TRP  47  18.023   1.470   2.458
  375    HA   TRP  47           HA       TRP  47  16.909   2.580   0.373
  376    HB2  TRP  47           HB2      TRP  47  19.811   1.852   0.571
  377    HB3  TRP  47           HB1      TRP  47  19.134   3.151  -0.411
  378    HD1  TRP  47           HD1      TRP  47  18.601   5.413   0.779
  379    HE1  TRP  47           HE1      TRP  47  18.899   6.309   3.166
  380    HE3  TRP  47           HE3      TRP  47  19.800   1.036   3.152
  381    HZ2  TRP  47           HZ2      TRP  47  19.555   5.298   5.726
  382    HZ3  TRP  47           HZ3      TRP  47  20.225   1.071   5.555
  383    HH2  TRP  47           HH2      TRP  47  20.113   3.168   6.832
  384    H    GLY  48           HN       GLY  48  18.580  -0.571  -0.010
  385    HA2  GLY  48           HA3      GLY  48  17.560  -0.513  -2.768
  386    HA3  GLY  48           HA2      GLY  48  19.168  -1.101  -2.395
  387    H    SER  49           HN       SER  49  16.409  -1.786  -0.305
  388    HA   SER  49           HA       SER  49  16.865  -4.569  -0.857
  389    HB2  SER  49           HB2      SER  49  16.723  -3.752   1.394
  390    HB3  SER  49           HB1      SER  49  15.040  -3.240   1.159
  391    HG   SER  49           HG       SER  49  14.983  -5.242   2.126
  392    H    MET  50           HN       MET  50  14.600  -2.129  -1.836
  393    HA   MET  50           HA       MET  50  12.932  -4.311  -2.832
  394    HB2  MET  50           HB2      MET  50  12.006  -1.479  -2.234
  395    HB3  MET  50           HB1      MET  50  11.020  -2.725  -3.005
  396    HG2  MET  50           HG2      MET  50  11.507  -4.100  -0.935
  397    HG3  MET  50           HG1      MET  50  12.016  -2.590  -0.191
  398    HE1  MET  50           HE1      MET  50  10.279  -0.471   0.087
  399    HE2  MET  50           HE2      MET  50   8.588  -0.563  -0.405
  400    HE3  MET  50           HE3      MET  50   9.861  -0.590  -1.622
  401    H    GLU  51           HN       GLU  51  15.312  -3.326  -4.077
  402    HA   GLU  51           HA       GLU  51  14.539  -1.840  -6.420
  403    HB2  GLU  51           HB3      GLU  51  17.025  -3.472  -5.823
  404    HB3  GLU  51           HB2      GLU  51  16.758  -2.565  -7.288
  405    HG2  GLU  51           HG3      GLU  51  16.843  -1.356  -4.544
  406    HG3  GLU  51           HG2      GLU  51  18.215  -1.431  -5.653
  407    H    LYS  52           HN       LYS  52  15.553  -5.161  -5.798
  408    HA   LYS  52           HA       LYS  52  14.704  -6.060  -8.429
  409    HB2  LYS  52           HB2      LYS  52  15.924  -7.542  -6.111
  410    HB3  LYS  52           HB1      LYS  52  15.617  -8.222  -7.699
  411    HG2  LYS  52           HG2      LYS  52  17.447  -5.902  -7.155
  412    HG3  LYS  52           HG1      LYS  52  17.971  -7.573  -7.330
  413    HD2  LYS  52           HD2      LYS  52  16.991  -7.591  -9.609
  414    HD3  LYS  52           HD1      LYS  52  16.591  -5.882  -9.417
  415    HE2  LYS  52           HE2      LYS  52  18.660  -6.128 -10.662
  416    HE3  LYS  52           HE1      LYS  52  18.958  -5.371  -9.105
  417    HZ1  LYS  52           HZ1      LYS  52  19.443  -8.247  -9.716
  418    HZ2  LYS  52           HZ2      LYS  52  19.745  -7.477  -8.245
  419    HZ3  LYS  52           HZ3      LYS  52  20.608  -7.035  -9.616
  420    H    ALA  53           HN       ALA  53  13.371  -5.754  -5.410
  421    HA   ALA  53           HA       ALA  53  11.682  -8.072  -5.410
  422    HB1  ALA  53           HB1      ALA  53  10.606  -7.010  -3.477
  423    HB2  ALA  53           HB2      ALA  53  11.488  -5.523  -3.802
  424    HB3  ALA  53           HB3      ALA  53  12.363  -6.974  -3.313
  425    H    GLY  54           HN       GLY  54   9.768  -8.278  -6.464
  426    HA2  GLY  54           HA3      GLY  54   8.753  -5.951  -7.845
  427    HA3  GLY  54           HA2      GLY  54   8.260  -7.630  -8.080
  428    HA   PRO  55           HA       PRO  55   4.958  -5.175  -5.754
  429    HB2  PRO  55           HB2      PRO  55   3.381  -7.186  -7.275
  430    HB3  PRO  55           HB1      PRO  55   3.072  -5.469  -7.044
  431    HG2  PRO  55           HG2      PRO  55   4.014  -6.425  -9.361
  432    HG3  PRO  55           HG1      PRO  55   4.485  -4.835  -8.740
  433    HD2  PRO  55           HD2      PRO  55   6.096  -7.362  -8.831
  434    HD3  PRO  55           HD1      PRO  55   6.608  -5.671  -8.875
  435    H    LEU  56           HN       LEU  56   5.141  -8.630  -6.438
  436    HA   LEU  56           HA       LEU  56   3.589  -9.430  -4.147
  437    HB2  LEU  56           HB2      LEU  56   4.006 -11.680  -4.712
  438    HB3  LEU  56           HB1      LEU  56   3.863 -10.842  -6.234
  439    HG   LEU  56           HG       LEU  56   6.483 -11.709  -4.974
  440   HD11  LEU  56          HD11      LEU  56   6.511 -13.443  -6.685
  441   HD12  LEU  56          HD12      LEU  56   4.898 -12.951  -7.200
  442   HD13  LEU  56          HD13      LEU  56   5.144 -13.614  -5.584
  443   HD21  LEU  56          HD21      LEU  56   6.678  -9.776  -6.554
  444   HD22  LEU  56          HD22      LEU  56   5.971 -10.805  -7.816
  445   HD23  LEU  56          HD23      LEU  56   7.510 -11.230  -7.093
  446    H    GLU  57           HN       GLU  57   6.881  -8.702  -4.588
  447    HA   GLU  57           HA       GLU  57   7.680 -10.100  -2.162
  448    HB2  GLU  57           HB3      GLU  57   9.272  -8.501  -4.160
  449    HB3  GLU  57           HB2      GLU  57   9.955  -9.445  -2.837
  450    HG2  GLU  57           HG3      GLU  57   9.162 -11.478  -3.798
  451    HG3  GLU  57           HG2      GLU  57   8.240 -10.590  -5.004
  452    H    MET  58           HN       MET  58   7.290  -6.870  -3.460
  453    HA   MET  58           HA       MET  58   8.369  -5.385  -1.340
  454    HB2  MET  58           HB2      MET  58   6.196  -4.757  -3.316
  455    HB3  MET  58           HB1      MET  58   6.723  -3.571  -2.134
  456    HG2  MET  58           HG2      MET  58   8.992  -3.692  -3.066
  457    HG3  MET  58           HG1      MET  58   8.446  -4.897  -4.229
  458    HE1  MET  58           HE1      MET  58   9.123  -1.698  -6.393
  459    HE2  MET  58           HE2      MET  58   9.514  -3.396  -6.137
  460    HE3  MET  58           HE3      MET  58   9.994  -2.194  -4.944
  461    H    ALA  59           HN       ALA  59   5.068  -6.545  -1.855
  462    HA   ALA  59           HA       ALA  59   3.869  -5.426   0.400
  463    HB1  ALA  59           HB1      ALA  59   2.699  -6.633  -1.439
  464    HB2  ALA  59           HB2      ALA  59   2.153  -7.024   0.170
  465    HB3  ALA  59           HB3      ALA  59   3.209  -8.162  -0.701
  466    H    GLN  60           HN       GLN  60   5.886  -8.252   0.126
  467    HA   GLN  60           HA       GLN  60   5.411  -9.266   2.757
  468    HB2  GLN  60           HB2      GLN  60   7.824  -9.759   1.021
  469    HB3  GLN  60           HB1      GLN  60   7.176 -10.806   2.276
  470    HG2  GLN  60           HG2      GLN  60   5.169 -11.180   0.886
  471    HG3  GLN  60           HG1      GLN  60   5.866 -10.127  -0.315
  472   HE21  GLN  60          HE21      GLN  60   5.151 -12.921  -0.542
  473   HE22  GLN  60          HE22      GLN  60   6.567 -13.748  -1.066
  474    H    LEU  61           HN       LEU  61   7.774  -7.207   1.182
  475    HA   LEU  61           HA       LEU  61   9.408  -6.992   3.449
  476    HB2  LEU  61           HB2      LEU  61   9.360  -5.737   0.796
  477    HB3  LEU  61           HB1      LEU  61  10.174  -4.805   2.023
  478    HG   LEU  61           HG       LEU  61  11.666  -6.751   2.472
  479   HD11  LEU  61          HD11      LEU  61  10.283  -8.033   0.130
  480   HD12  LEU  61          HD12      LEU  61  10.181  -8.551   1.814
  481   HD13  LEU  61          HD13      LEU  61  11.719  -8.646   0.955
  482   HD21  LEU  61          HD21      LEU  61  12.336  -5.023   0.864
  483   HD22  LEU  61          HD22      LEU  61  11.615  -5.987  -0.434
  484   HD23  LEU  61          HD23      LEU  61  12.989  -6.608   0.469
  485    H    LEU  62           HN       LEU  62   6.764  -4.826   2.280
  486    HA   LEU  62           HA       LEU  62   7.137  -3.038   4.372
  487    HB2  LEU  62           HB2      LEU  62   4.523  -3.819   3.054
  488    HB3  LEU  62           HB1      LEU  62   4.683  -2.510   4.191
  489    HG   LEU  62           HG       LEU  62   4.604  -1.389   2.254
  490   HD11  LEU  62          HD11      LEU  62   6.531  -0.606   3.278
  491   HD12  LEU  62          HD12      LEU  62   6.750  -0.579   1.525
  492   HD13  LEU  62          HD13      LEU  62   7.519  -1.840   2.493
  493   HD21  LEU  62          HD21      LEU  62   6.143  -3.533   0.874
  494   HD22  LEU  62          HD22      LEU  62   5.570  -2.037   0.126
  495   HD23  LEU  62          HD23      LEU  62   4.413  -3.209   0.765
  496    H    ILE  63           HN       ILE  63   5.413  -6.137   4.257
  497    HA   ILE  63           HA       ILE  63   4.271  -5.898   6.868
  498    HB   ILE  63           HB       ILE  63   3.820  -7.583   4.751
  499   HG12  ILE  63          HG12      ILE  63   2.262  -7.094   6.583
  500   HG13  ILE  63          HG11      ILE  63   2.221  -8.783   6.107
  501   HG21  ILE  63          HG21      ILE  63   5.272  -9.313   6.744
  502   HG22  ILE  63          HG22      ILE  63   5.779  -8.955   5.094
  503   HG23  ILE  63          HG23      ILE  63   4.321  -9.904   5.381
  504   HD11  ILE  63          HD11      ILE  63   2.071  -8.602   8.499
  505   HD12  ILE  63          HD12      ILE  63   3.536  -7.622   8.554
  506   HD13  ILE  63          HD13      ILE  63   3.628  -9.317   8.076
  507    H    THR  64           HN       THR  64   7.394  -6.853   5.766
  508    HA   THR  64           HA       THR  64   8.158  -8.266   8.136
  509    HB   THR  64           HB       THR  64   9.869  -7.113   5.906
  510    HG1  THR  64           HG1      THR  64   8.335  -8.707   5.246
  511   HG21  THR  64          HG21      THR  64  11.190  -7.606   7.939
  512   HG22  THR  64          HG22      THR  64  11.583  -8.715   6.627
  513   HG23  THR  64          HG23      THR  64  10.545  -9.250   7.951
  514    H    HIS  65           HN       HIS  65   7.988  -4.952   7.292
  515    HA   HIS  65           HA       HIS  65   9.751  -4.307   9.560
  516    HB2  HIS  65           HB2      HIS  65   9.196  -2.623   7.116
  517    HB3  HIS  65           HB1      HIS  65  10.060  -2.084   8.553
  518    HD1  HIS  65           HD1      HIS  65  12.517  -2.960   8.853
  519    HD2  HIS  65           HD2      HIS  65  10.622  -4.344   5.415
  520    HE1  HIS  65           HE1      HIS  65  14.312  -3.960   7.411
  521    H    PHE  66           HN       PHE  66   6.927  -2.998   7.853
  522    HA   PHE  66           HA       PHE  66   6.288  -1.224   9.965
  523    HB2  PHE  66           HB2      PHE  66   4.687  -2.067   7.558
  524    HB3  PHE  66           HB1      PHE  66   4.301  -0.719   8.629
  525    HD1  PHE  66           HD1      PHE  66   5.654   1.237   8.685
  526    HD2  PHE  66           HD2      PHE  66   6.480  -1.922   6.002
  527    HE1  PHE  66           HE1      PHE  66   7.142   2.704   7.420
  528    HE2  PHE  66           HE2      PHE  66   7.978  -0.466   4.719
  529    HZ   PHE  66           HZ       PHE  66   8.308   1.855   5.433
  530    H    GLY  67           HN       GLY  67   4.759  -4.196   8.812
  531    HA2  GLY  67           HA3      GLY  67   3.991  -5.606  10.802
  532    HA3  GLY  67           HA2      GLY  67   3.092  -4.143  11.216
  533    HA   PRO  68           HA       PRO  68   0.774  -6.967   8.207
  534    HB2  PRO  68           HB2      PRO  68  -1.447  -7.324   9.813
  535    HB3  PRO  68           HB1      PRO  68  -0.108  -8.463   9.670
  536    HG2  PRO  68           HG2      PRO  68  -0.677  -6.464  11.787
  537    HG3  PRO  68           HG1      PRO  68   0.050  -8.070  11.929
  538    HD2  PRO  68           HD2      PRO  68   1.495  -5.763  12.030
  539    HD3  PRO  68           HD1      PRO  68   2.166  -7.281  11.422
  540    H    GLU  69           HN       GLU  69  -0.966  -4.743  10.410
  541    HA   GLU  69           HA       GLU  69  -2.693  -3.891   8.310
  542    HB2  GLU  69           HB3      GLU  69  -2.243  -2.868  11.089
  543    HB3  GLU  69           HB2      GLU  69  -3.381  -2.138   9.973
  544    HG2  GLU  69           HG3      GLU  69  -4.596  -3.536  11.355
  545    HG3  GLU  69           HG2      GLU  69  -4.492  -4.333   9.796
  546    H    GLU  70           HN       GLU  70   0.060  -2.663   9.977
  547    HA   GLU  70           HA       GLU  70   0.107  -0.032   9.048
  548    HB2  GLU  70           HB3      GLU  70   1.500  -1.203  10.886
  549    HB3  GLU  70           HB2      GLU  70   2.631  -1.548   9.589
  550    HG2  GLU  70           HG3      GLU  70   3.379   0.422  10.655
  551    HG3  GLU  70           HG2      GLU  70   2.656   0.936   9.129
  552    H    ALA  71           HN       ALA  71   1.593  -2.968   7.671
  553    HA   ALA  71           HA       ALA  71   3.037  -1.797   5.561
  554    HB1  ALA  71           HB1      ALA  71   3.299  -4.120   6.228
  555    HB2  ALA  71           HB2      ALA  71   2.909  -4.003   4.509
  556    HB3  ALA  71           HB3      ALA  71   1.669  -4.480   5.669
  557    H    TRP  72           HN       TRP  72  -0.219  -3.091   5.688
  558    HA   TRP  72           HA       TRP  72  -0.916  -2.607   3.041
  559    HB2  TRP  72           HB2      TRP  72  -2.259  -4.120   4.304
  560    HB3  TRP  72           HB1      TRP  72  -2.531  -2.934   5.570
  561    HD1  TRP  72           HD1      TRP  72  -5.035  -2.473   5.544
  562    HE1  TRP  72           HE1      TRP  72  -6.767  -1.830   3.748
  563    HE3  TRP  72           HE3      TRP  72  -2.125  -2.864   1.395
  564    HZ2  TRP  72           HZ2      TRP  72  -6.887  -1.524   1.008
  565    HZ3  TRP  72           HZ3      TRP  72  -3.133  -2.377  -0.807
  566    HH2  TRP  72           HH2      TRP  72  -5.480  -1.715  -0.980
  567    H    ARG  73           HN       ARG  73  -1.392  -0.706   5.937
  568    HA   ARG  73           HA       ARG  73  -2.725   1.464   4.860
  569    HB2  ARG  73           HB2      ARG  73  -2.532   1.128   7.250
  570    HB3  ARG  73           HB1      ARG  73  -0.791   1.311   7.177
  571    HG2  ARG  73           HG2      ARG  73  -1.129   3.686   6.505
  572    HG3  ARG  73           HG1      ARG  73  -2.863   3.460   6.767
  573    HD2  ARG  73           HD2      ARG  73  -2.454   2.855   9.084
  574    HD3  ARG  73           HD1      ARG  73  -0.719   2.994   8.828
  575    HE   ARG  73           HE       ARG  73  -2.443   5.332   8.437
  576   HH11  ARG  73          HH11      ARG  73   0.228   3.743  10.243
  577   HH12  ARG  73          HH12      ARG  73   0.623   5.149  11.102
  578   HH21  ARG  73          HH21      ARG  73  -1.858   7.236   9.678
  579   HH22  ARG  73          HH22      ARG  73  -0.598   7.162  10.808
  580    H    LEU  74           HN       LEU  74   0.742   0.945   5.331
  581    HA   LEU  74           HA       LEU  74   1.717   3.348   4.317
  582    HB2  LEU  74           HB2      LEU  74   2.814   0.695   4.907
  583    HB3  LEU  74           HB1      LEU  74   3.695   1.569   3.678
  584    HG   LEU  74           HG       LEU  74   4.625   1.803   5.982
  585   HD11  LEU  74          HD11      LEU  74   4.956   4.224   5.882
  586   HD12  LEU  74          HD12      LEU  74   3.681   4.343   4.661
  587   HD13  LEU  74          HD13      LEU  74   5.156   3.433   4.327
  588   HD21  LEU  74          HD21      LEU  74   3.506   3.253   7.593
  589   HD22  LEU  74          HD22      LEU  74   2.496   1.852   7.220
  590   HD23  LEU  74          HD23      LEU  74   2.126   3.420   6.510
  591    H    ALA  75           HN       ALA  75   1.112   0.298   2.616
  592    HA   ALA  75           HA       ALA  75   2.095   1.180   0.111
  593    HB1  ALA  75           HB1      ALA  75   1.710  -1.175   0.579
  594    HB2  ALA  75           HB2      ALA  75   0.847  -0.622  -0.862
  595    HB3  ALA  75           HB3      ALA  75  -0.034  -0.866   0.645
  596    H    LEU  76           HN       LEU  76  -1.243   1.023   1.350
  597    HA   LEU  76           HA       LEU  76  -2.322   2.063  -1.012
  598    HB2  LEU  76           HB2      LEU  76  -4.447   2.224   0.117
  599    HB3  LEU  76           HB1      LEU  76  -3.652   0.735   0.560
  600    HG   LEU  76           HG       LEU  76  -2.952   2.048   2.699
  601   HD11  LEU  76          HD11      LEU  76  -3.725   4.244   2.032
  602   HD12  LEU  76          HD12      LEU  76  -4.623   3.684   3.443
  603   HD13  LEU  76          HD13      LEU  76  -5.364   3.630   1.840
  604   HD21  LEU  76          HD21      LEU  76  -4.994   1.355   3.802
  605   HD22  LEU  76          HD22      LEU  76  -4.360   0.133   2.702
  606   HD23  LEU  76          HD23      LEU  76  -5.747   1.115   2.228
  607    H    SER  77           HN       SER  77  -1.301   3.692   1.945
  608    HA   SER  77           HA       SER  77  -2.437   6.144   1.094
  609    HB2  SER  77           HB2      SER  77  -2.101   5.506   3.495
  610    HB3  SER  77           HB1      SER  77  -0.373   5.746   3.271
  611    HG   SER  77           HG       SER  77  -2.060   7.787   2.434
  612    H    THR  78           HN       THR  78   0.428   4.520   0.281
  613    HA   THR  78           HA       THR  78   1.695   6.994  -0.476
  614    HB   THR  78           HB       THR  78   2.621   4.141  -0.944
  615    HG1  THR  78           HG1      THR  78   2.710   4.436   1.183
  616   HG21  THR  78          HG21      THR  78   4.823   5.166  -1.303
  617   HG22  THR  78          HG22      THR  78   4.118   6.768  -1.081
  618   HG23  THR  78          HG23      THR  78   3.657   5.789  -2.472
  619    H    PHE  79           HN       PHE  79  -0.367   4.592  -1.822
  620    HA   PHE  79           HA       PHE  79   0.186   4.923  -4.546
  621    HB2  PHE  79           HB2      PHE  79  -2.380   4.185  -3.134
  622    HB3  PHE  79           HB1      PHE  79  -2.235   4.147  -4.902
  623    HD1  PHE  79           HD2      PHE  79   0.735   3.018  -4.593
  624    HD2  PHE  79           HD1      PHE  79  -3.071   1.962  -3.006
  625    HE1  PHE  79           HE2      PHE  79   1.495   0.734  -4.311
  626    HE2  PHE  79           HE1      PHE  79  -2.305  -0.352  -2.714
  627    HZ   PHE  79           HZ       PHE  79  -0.017  -0.978  -3.367
  628    H    GLU  80           HN       GLU  80  -1.943   6.688  -2.374
  629    HA   GLU  80           HA       GLU  80  -3.025   8.422  -4.351
  630    HB2  GLU  80           HB3      GLU  80  -3.822   9.759  -2.449
  631    HB3  GLU  80           HB2      GLU  80  -4.114   8.044  -2.168
  632    HG2  GLU  80           HG3      GLU  80  -2.078   7.942  -0.853
  633    HG3  GLU  80           HG2      GLU  80  -1.875   9.681  -1.070
  634    H    ARG  81           HN       ARG  81  -0.099   8.444  -2.470
  635    HA   ARG  81           HA       ARG  81   0.528  11.222  -2.696
  636    HB2  ARG  81           HB2      ARG  81   2.411   8.938  -2.110
  637    HB3  ARG  81           HB1      ARG  81   2.712  10.642  -1.810
  638    HG2  ARG  81           HG2      ARG  81   0.586   8.975  -0.483
  639    HG3  ARG  81           HG1      ARG  81   2.152   9.418   0.192
  640    HD2  ARG  81           HD2      ARG  81   1.560  11.696   0.305
  641    HD3  ARG  81           HD1      ARG  81   0.123  11.434  -0.686
  642    HE   ARG  81           HE       ARG  81  -0.785  10.116   1.155
  643   HH11  ARG  81          HH11      ARG  81   1.948  12.167   2.085
  644   HH12  ARG  81          HH12      ARG  81   1.304  12.627   3.578
  645   HH21  ARG  81          HH21      ARG  81  -1.659  10.699   3.299
  646   HH22  ARG  81          HH22      ARG  81  -0.780  11.737   4.311
  647    H    ILE  82           HN       ILE  82   1.225   8.352  -4.546
  648    HA   ILE  82           HA       ILE  82   3.033   9.820  -6.322
  649    HB   ILE  82           HB       ILE  82   3.595   7.642  -7.303
  650   HG12  ILE  82          HG12      ILE  82   1.672   6.432  -5.290
  651   HG13  ILE  82          HG11      ILE  82   1.314   6.609  -7.006
  652   HG21  ILE  82          HG21      ILE  82   3.625   7.648  -4.285
  653   HG22  ILE  82          HG22      ILE  82   4.829   8.372  -5.348
  654   HG23  ILE  82          HG23      ILE  82   4.635   6.619  -5.306
  655   HD11  ILE  82          HD11      ILE  82   3.508   4.945  -5.793
  656   HD12  ILE  82          HD12      ILE  82   3.179   5.105  -7.517
  657   HD13  ILE  82          HD13      ILE  82   1.990   4.344  -6.459
  658    H    ASN  83           HN       ASN  83   0.009   9.747  -6.010
  659    HA   ASN  83           HA       ASN  83  -1.853   9.946  -7.146
  660    HB2  ASN  83           HB3      ASN  83  -0.680  11.807  -8.234
  661    HB3  ASN  83           HB2      ASN  83  -0.107  10.714  -9.493
  662   HD21  ASN  83          HD21      ASN  83  -2.927  12.239  -8.109
  663   HD22  ASN  83          HD22      ASN  83  -3.938  12.086  -9.494
  664    H    ARG  84           HN       ARG  84  -2.080   7.816  -6.786
  665    HA   ARG  84           HA       ARG  84  -2.886   6.430  -9.211
  666    HB2  ARG  84           HB2      ARG  84  -0.643   5.702  -7.712
  667    HB3  ARG  84           HB1      ARG  84  -1.921   4.689  -7.068
  668    HG2  ARG  84           HG2      ARG  84  -1.081   4.866  -9.942
  669    HG3  ARG  84           HG1      ARG  84  -0.691   3.569  -8.824
  670    HD2  ARG  84           HD2      ARG  84  -3.145   3.199  -8.560
  671    HD3  ARG  84           HD1      ARG  84  -3.411   4.337  -9.860
  672    HE   ARG  84           HE       ARG  84  -1.600   2.079 -10.357
  673   HH11  ARG  84          HH11      ARG  84  -4.647   3.721 -11.289
  674   HH12  ARG  84          HH12      ARG  84  -4.978   2.600 -12.527
  675   HH21  ARG  84          HH21      ARG  84  -2.065   0.629 -12.124
  676   HH22  ARG  84          HH22      ARG  84  -3.492   0.810 -13.021
  677    H    LYS  85           HN       LYS  85  -4.583   7.814  -8.107
  678    HA   LYS  85           HA       LYS  85  -5.428   7.215  -5.471
  679    HB2  LYS  85           HB2      LYS  85  -5.475   9.447  -6.107
  680    HB3  LYS  85           HB1      LYS  85  -6.277   9.126  -7.636
  681    HG2  LYS  85           HG2      LYS  85  -8.368   8.692  -6.387
  682    HG3  LYS  85           HG1      LYS  85  -7.512   9.020  -4.878
  683    HD2  LYS  85           HD2      LYS  85  -7.078  11.290  -5.519
  684    HD3  LYS  85           HD1      LYS  85  -7.679  10.999  -7.145
  685    HE2  LYS  85           HE2      LYS  85  -9.270  12.262  -5.706
  686    HE3  LYS  85           HE1      LYS  85  -9.931  10.759  -6.335
  687    HZ1  LYS  85           HZ1      LYS  85 -10.360  11.283  -3.925
  688    HZ2  LYS  85           HZ2      LYS  85  -8.740  10.869  -3.613
  689    HZ3  LYS  85           HZ3      LYS  85  -9.825   9.759  -4.335
  690    H    ASP  86           HN       ASP  86  -6.045   6.026  -8.560
  691    HA   ASP  86           HA       ASP  86  -8.654   5.214  -8.529
  692    HB2  ASP  86           HB2      ASP  86  -6.502   3.323  -9.487
  693    HB3  ASP  86           HB1      ASP  86  -8.119   3.521 -10.120
  694    H    LEU  87           HN       LEU  87  -5.718   3.547  -7.624
  695    HA   LEU  87           HA       LEU  87  -7.084   1.278  -6.509
  696    HB2  LEU  87           HB2      LEU  87  -4.220   1.948  -6.962
  697    HB3  LEU  87           HB1      LEU  87  -4.629   0.681  -5.830
  698    HG   LEU  87           HG       LEU  87  -5.747  -0.579  -7.620
  699   HD11  LEU  87          HD11      LEU  87  -4.810   1.625  -9.418
  700   HD12  LEU  87          HD12      LEU  87  -6.498   1.171  -9.092
  701   HD13  LEU  87          HD13      LEU  87  -5.405   0.056  -9.933
  702   HD21  LEU  87          HD21      LEU  87  -3.820  -1.203  -8.834
  703   HD22  LEU  87          HD22      LEU  87  -3.392  -0.914  -7.143
  704   HD23  LEU  87          HD23      LEU  87  -2.989   0.282  -8.379
  705    H    TRP  88           HN       TRP  88  -5.631   4.159  -5.352
  706    HA   TRP  88           HA       TRP  88  -5.361   3.399  -2.676
  707    HB2  TRP  88           HB2      TRP  88  -4.359   5.446  -3.384
  708    HB3  TRP  88           HB1      TRP  88  -5.887   6.101  -3.908
  709    HD1  TRP  88           HD1      TRP  88  -4.377   4.887  -0.535
  710    HE1  TRP  88           HE1      TRP  88  -5.399   6.285   1.369
  711    HE3  TRP  88           HE3      TRP  88  -7.537   7.791  -3.267
  712    HZ2  TRP  88           HZ2      TRP  88  -7.285   8.338   1.670
  713    HZ3  TRP  88           HZ3      TRP  88  -8.925   9.452  -2.096
  714    HH2  TRP  88           HH2      TRP  88  -8.799   9.721   0.323
  715    H    GLU  89           HN       GLU  89  -8.145   4.887  -4.365
  716    HA   GLU  89           HA       GLU  89  -9.754   4.784  -2.058
  717    HB2  GLU  89           HB3      GLU  89 -10.456   5.166  -4.940
  718    HB3  GLU  89           HB2      GLU  89 -11.665   5.150  -3.659
  719    HG2  GLU  89           HG3      GLU  89 -10.408   6.962  -2.534
  720    HG3  GLU  89           HG2      GLU  89  -9.348   7.018  -3.939
  721    H    ARG  90           HN       ARG  90  -8.951   2.470  -4.371
  722    HA   ARG  90           HA       ARG  90 -11.129   0.680  -3.842
  723    HB2  ARG  90           HB2      ARG  90  -8.444   0.289  -5.122
  724    HB3  ARG  90           HB1      ARG  90  -9.606  -1.006  -4.931
  725    HG2  ARG  90           HG2      ARG  90 -11.209   0.269  -6.314
  726    HG3  ARG  90           HG1      ARG  90 -10.000   1.535  -6.514
  727    HD2  ARG  90           HD2      ARG  90 -10.073   0.014  -8.446
  728    HD3  ARG  90           HD1      ARG  90  -8.512  -0.024  -7.628
  729    HE   ARG  90           HE       ARG  90 -10.229  -1.998  -6.594
  730   HH11  ARG  90          HH11      ARG  90  -8.289  -1.375  -9.524
  731   HH12  ARG  90          HH12      ARG  90  -7.956  -3.026  -9.780
  732   HH21  ARG  90          HH21      ARG  90  -9.720  -4.254  -6.997
  733   HH22  ARG  90          HH22      ARG  90  -8.795  -4.695  -8.344
  734    H    GLY  91           HN       GLY  91  -8.440   1.616  -2.159
  735    HA2  GLY  91           HA3      GLY  91  -8.461  -0.827  -0.523
  736    HA3  GLY  91           HA2      GLY  91  -7.093   0.276  -0.645
  737    H    GLN  92           HN       GLN  92  -7.390   2.442   0.155
  738    HA   GLN  92           HA       GLN  92  -7.485   3.729   1.980
  739    HB2  GLN  92           HB2      GLN  92 -10.461   3.194   1.752
  740    HB3  GLN  92           HB1      GLN  92  -9.722   4.546   2.604
  741    HG2  GLN  92           HG2      GLN  92  -8.723   5.287   0.468
  742    HG3  GLN  92           HG1      GLN  92  -9.573   3.964  -0.323
  743   HE21  GLN  92          HE21      GLN  92 -11.834   4.109  -0.580
  744   HE22  GLN  92          HE22      GLN  92 -12.653   5.597  -0.406
  745    H    ARG  93           HN       ARG  93 -10.218   1.892   3.140
  746    HA   ARG  93           HA       ARG  93  -8.800   0.058   4.704
  747    HB2  ARG  93           HB2      ARG  93  -9.397   0.913   6.881
  748    HB3  ARG  93           HB1      ARG  93  -8.322   2.046   6.076
  749    HG2  ARG  93           HG2      ARG  93 -10.376   3.362   5.471
  750    HG3  ARG  93           HG1      ARG  93 -11.286   2.289   6.539
  751    HD2  ARG  93           HD2      ARG  93  -8.973   4.028   7.219
  752    HD3  ARG  93           HD1      ARG  93 -10.645   4.246   7.759
  753    HE   ARG  93           HE       ARG  93 -10.087   1.823   8.709
  754   HH11  ARG  93          HH11      ARG  93  -8.394   4.887   9.009
  755   HH12  ARG  93          HH12      ARG  93  -7.457   4.440  10.358
  756   HH21  ARG  93          HH21      ARG  93  -8.803   1.174  10.603
  757   HH22  ARG  93          HH22      ARG  93  -7.715   2.275  11.302
  758    H    GLU  94           HN       GLU  94 -10.926   0.387   2.766
  759    HA   GLU  94           HA       GLU  94 -13.317   0.140   4.363
  760    HB2  GLU  94           HB3      GLU  94 -14.522   0.404   2.193
  761    HB3  GLU  94           HB2      GLU  94 -13.601   1.792   2.748
  762    HG2  GLU  94           HG3      GLU  94 -11.840   1.277   1.170
  763    HG3  GLU  94           HG2      GLU  94 -12.707  -0.171   0.653
  764    H    ASP  95           HN       ASP  95 -14.672  -1.440   4.302
  765    HA   ASP  95           HA       ASP  95 -13.938  -3.903   2.881
  766    HB2  ASP  95           HB2      ASP  95 -15.326  -3.707   5.581
  767    HB3  ASP  95           HB1      ASP  95 -14.737  -5.162   4.793
  768    H    LEU  96           HN       LEU  96 -16.278  -5.230   3.524
  769    HA   LEU  96           HA       LEU  96 -18.212  -3.664   2.016
  770    HB2  LEU  96           HB2      LEU  96 -19.354  -5.650   1.524
  771    HB3  LEU  96           HB1      LEU  96 -17.670  -6.106   1.450
  772    HG   LEU  96           HG       LEU  96 -19.498  -6.635   3.774
  773   HD11  LEU  96          HD11      LEU  96 -19.473  -8.984   3.005
  774   HD12  LEU  96          HD12      LEU  96 -18.563  -8.486   1.578
  775   HD13  LEU  96          HD13      LEU  96 -20.206  -7.894   1.830
  776   HD21  LEU  96          HD21      LEU  96 -17.745  -8.234   4.515
  777   HD22  LEU  96          HD22      LEU  96 -17.163  -6.573   4.477
  778   HD23  LEU  96          HD23      LEU  96 -16.716  -7.694   3.189
  779    H    VAL  97           HN       VAL  97 -20.493  -3.856   2.763
  780    HA   VAL  97           HA       VAL  97 -20.635  -3.282   5.616
  781    HB   VAL  97           HB       VAL  97 -22.708  -3.044   3.453
  782   HG11  VAL  97          HG11      VAL  97 -22.660  -1.898   6.248
  783   HG12  VAL  97          HG12      VAL  97 -23.705  -3.192   5.658
  784   HG13  VAL  97          HG13      VAL  97 -23.893  -1.552   5.034
  785   HG21  VAL  97          HG21      VAL  97 -20.927  -0.898   4.594
  786   HG22  VAL  97          HG22      VAL  97 -22.256  -0.634   3.459
  787   HG23  VAL  97          HG23      VAL  97 -20.850  -1.587   2.971
  788    H    ARG  98           HN       ARG  98 -22.486  -5.042   3.133
  789    HA   ARG  98           HA       ARG  98 -22.696  -7.407   4.681
  790    HB2  ARG  98           HB2      ARG  98 -24.383  -6.005   5.834
  791    HB3  ARG  98           HB1      ARG  98 -25.170  -5.702   4.299
  792    HG2  ARG  98           HG2      ARG  98 -25.743  -8.053   4.097
  793    HG3  ARG  98           HG1      ARG  98 -24.902  -8.402   5.607
  794    HD2  ARG  98           HD2      ARG  98 -26.448  -6.856   6.776
  795    HD3  ARG  98           HD1      ARG  98 -27.301  -6.621   5.251
  796    HE   ARG  98           HE       ARG  98 -27.219  -9.329   5.676
  797   HH11  ARG  98          HH11      ARG  98 -28.688  -6.510   7.254
  798   HH12  ARG  98          HH12      ARG  98 -29.929  -7.415   7.992
  799   HH21  ARG  98          HH21      ARG  98 -28.911 -10.560   6.703
  800   HH22  ARG  98          HH22      ARG  98 -30.057  -9.771   7.676
  801    H    ASP  99           HN       ASP  99 -22.858  -9.018   3.241
  802    HA   ASP  99           HA       ASP  99 -24.371  -8.714   0.815
  803    HB2  ASP  99           HB2      ASP  99 -22.080  -7.883   0.219
  804    HB3  ASP  99           HB1      ASP  99 -21.425  -9.417   0.763
  805    H    THR 100           HN       THR 100 -24.914 -10.804   0.049
  806    HA   THR 100           HA       THR 100 -23.713 -13.094   1.335
  807    HB   THR 100           HB       THR 100 -26.737 -12.623   1.497
  808    HG1  THR 100           HG1      THR 100 -24.699 -11.784   3.018
  809   HG21  THR 100          HG21      THR 100 -24.984 -14.724   2.815
  810   HG22  THR 100          HG22      THR 100 -26.075 -15.017   1.460
  811   HG23  THR 100          HG23      THR 100 -26.727 -14.551   3.032
  812    H    VAL 101           HN       VAL 101 -23.904 -11.796  -1.362
  813    HA   VAL 101           HA       VAL 101 -25.258 -14.006  -2.715
  814    HB   VAL 101           HB       VAL 101 -25.381 -12.670  -4.762
  815   HG11  VAL 101          HG11      VAL 101 -27.275 -12.638  -3.324
  816   HG12  VAL 101          HG12      VAL 101 -27.058 -11.023  -4.015
  817   HG13  VAL 101          HG13      VAL 101 -26.574 -11.349  -2.353
  818   HG21  VAL 101          HG21      VAL 101 -24.909 -10.270  -4.733
  819   HG22  VAL 101          HG22      VAL 101 -23.459 -11.235  -4.466
  820   HG23  VAL 101          HG23      VAL 101 -24.238 -10.424  -3.107
  821    H    GLU 102           HN       GLU 102 -22.253 -12.249  -2.443
  822    HA   GLU 102           HA       GLU 102 -21.071 -14.035  -4.400
  823    HB2  GLU 102           HB3      GLU 102 -19.850 -11.774  -2.806
  824    HB3  GLU 102           HB2      GLU 102 -19.002 -12.722  -4.018
  825    HG2  GLU 102           HG3      GLU 102 -20.612 -11.901  -5.717
  826    HG3  GLU 102           HG2      GLU 102 -21.336 -10.880  -4.473
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1   0.768 -14.652  25.097
    2    H2   GLY   1           HT2      GLY   1   0.126 -13.769  23.792
    3    H3   GLY   1           HT3      GLY   1  -0.893 -14.729  24.723
    4    HA2  GLY   1           HA2      GLY   1  -0.525 -13.331  26.620
    5    HA3  GLY   1           HA3      GLY   1   0.534 -12.325  25.630
    6    H    HIS   2           HN       HIS   2  -1.158 -10.739  26.405
    7    HA   HIS   2           HA       HIS   2  -3.686 -10.870  25.083
    8    HB2  HIS   2           HB2      HIS   2  -2.311  -8.539  26.451
    9    HB3  HIS   2           HB1      HIS   2  -3.970  -8.534  25.870
   10    HD1  HIS   2           HD1      HIS   2  -2.074  -9.129  28.860
   11    HD2  HIS   2           HD2      HIS   2  -5.554 -10.644  27.200
   12    HE1  HIS   2           HE1      HIS   2  -3.322 -10.243  30.748
   13    H    MET   3           HN       MET   3  -4.120 -10.316  23.095
   14    HA   MET   3           HA       MET   3  -2.011  -9.227  21.460
   15    HB2  MET   3           HB2      MET   3  -4.721 -10.369  20.784
   16    HB3  MET   3           HB1      MET   3  -3.655  -9.655  19.591
   17    HG2  MET   3           HG2      MET   3  -2.972 -12.016  21.321
   18    HG3  MET   3           HG1      MET   3  -3.545 -12.107  19.656
   19    HE1  MET   3           HE1      MET   3  -0.856 -13.474  20.657
   20    HE2  MET   3           HE2      MET   3   0.236 -13.075  19.330
   21    HE3  MET   3           HE3      MET   3  -1.427 -13.560  18.989
   22    H    LEU   4           HN       LEU   4  -1.812  -7.117  21.435
   23    HA   LEU   4           HA       LEU   4  -4.207  -5.455  21.554
   24    HB2  LEU   4           HB2      LEU   4  -1.268  -4.757  21.693
   25    HB3  LEU   4           HB1      LEU   4  -2.505  -3.537  21.529
   26    HG   LEU   4           HG       LEU   4  -3.461  -4.336  23.719
   27   HD11  LEU   4          HD11      LEU   4  -2.486  -6.556  23.796
   28   HD12  LEU   4          HD12      LEU   4  -2.058  -5.614  25.218
   29   HD13  LEU   4          HD13      LEU   4  -0.875  -5.853  23.929
   30   HD21  LEU   4          HD21      LEU   4  -1.770  -3.188  25.071
   31   HD22  LEU   4          HD22      LEU   4  -2.125  -2.331  23.574
   32   HD23  LEU   4          HD23      LEU   4  -0.643  -3.278  23.720
   33    H    ARG   5           HN       ARG   5  -2.662  -7.075  19.310
   34    HA   ARG   5           HA       ARG   5  -3.400  -5.211  17.207
   35    HB2  ARG   5           HB2      ARG   5  -0.947  -5.045  17.590
   36    HB3  ARG   5           HB1      ARG   5  -0.810  -6.777  17.343
   37    HG2  ARG   5           HG2      ARG   5  -0.104  -5.600  15.368
   38    HG3  ARG   5           HG1      ARG   5  -1.595  -6.484  15.025
   39    HD2  ARG   5           HD2      ARG   5  -1.712  -4.289  14.043
   40    HD3  ARG   5           HD1      ARG   5  -2.858  -4.395  15.374
   41    HE   ARG   5           HE       ARG   5  -0.237  -3.267  15.936
   42   HH11  ARG   5          HH11      ARG   5  -3.706  -2.680  15.520
   43   HH12  ARG   5          HH12      ARG   5  -3.637  -1.050  15.998
   44   HH21  ARG   5          HH21      ARG   5  -0.146  -1.058  16.634
   45   HH22  ARG   5          HH22      ARG   5  -1.551  -0.107  16.689
   46    H    THR   6           HN       THR   6  -4.575  -6.271  15.683
   47    HA   THR   6           HA       THR   6  -5.049  -9.070  15.944
   48    HB   THR   6           HB       THR   6  -6.845  -7.525  15.131
   49    HG1  THR   6           HG1      THR   6  -7.658  -9.076  13.904
   50   HG21  THR   6          HG21      THR   6  -5.149  -7.323  12.629
   51   HG22  THR   6          HG22      THR   6  -5.419  -6.021  13.778
   52   HG23  THR   6          HG23      THR   6  -6.766  -6.652  12.831
   53    H    ALA   7           HN       ALA   7  -4.714 -10.578  14.115
   54    HA   ALA   7           HA       ALA   7  -2.020 -10.425  13.167
   55    HB1  ALA   7           HB1      ALA   7  -3.052 -12.572  13.789
   56    HB2  ALA   7           HB2      ALA   7  -2.469 -12.583  12.125
   57    HB3  ALA   7           HB3      ALA   7  -4.192 -12.396  12.454
   58    H    GLY   8           HN       GLY   8  -5.174  -9.726  11.957
   59    HA2  GLY   8           HA3      GLY   8  -5.844  -8.470  10.159
   60    HA3  GLY   8           HA2      GLY   8  -4.154  -8.145   9.821
   61    H    ARG   9           HN       ARG   9  -2.970  -9.853   8.801
   62    HA   ARG   9           HA       ARG   9  -2.467 -11.315   7.139
   63    HB2  ARG   9           HB2      ARG   9  -4.116 -12.782   8.375
   64    HB3  ARG   9           HB1      ARG   9  -5.326 -12.264   7.217
   65    HG2  ARG   9           HG2      ARG   9  -3.884 -13.186   5.404
   66    HG3  ARG   9           HG1      ARG   9  -2.823 -13.831   6.659
   67    HD2  ARG   9           HD2      ARG   9  -5.691 -14.556   6.091
   68    HD3  ARG   9           HD1      ARG   9  -4.269 -15.593   6.058
   69    HE   ARG   9           HE       ARG   9  -5.030 -14.378   8.596
   70   HH11  ARG   9          HH11      ARG   9  -4.830 -17.304   6.626
   71   HH12  ARG   9          HH12      ARG   9  -5.217 -18.353   7.918
   72   HH21  ARG   9          HH21      ARG   9  -5.582 -15.776  10.316
   73   HH22  ARG   9          HH22      ARG   9  -5.650 -17.455  10.089
   74    H    ASP  10           HN       ASP  10  -5.538  -9.732   6.738
   75    HA   ASP  10           HA       ASP  10  -5.888  -9.787   3.976
   76    HB2  ASP  10           HB2      ASP  10  -7.587  -9.056   5.624
   77    HB3  ASP  10           HB1      ASP  10  -6.656  -7.595   5.912
   78    H    GLY  11           HN       GLY  11  -4.128  -7.489   6.039
   79    HA2  GLY  11           HA3      GLY  11  -3.420  -5.688   4.065
   80    HA3  GLY  11           HA2      GLY  11  -2.591  -5.924   5.596
   81    H    LEU  12           HN       LEU  12  -2.346  -8.859   4.246
   82    HA   LEU  12           HA       LEU  12   0.181  -8.183   2.904
   83    HB2  LEU  12           HB2      LEU  12   0.384  -9.769   4.772
   84    HB3  LEU  12           HB1      LEU  12  -0.794 -10.812   4.022
   85    HG   LEU  12           HG       LEU  12   0.755 -11.312   2.189
   86   HD11  LEU  12          HD11      LEU  12   3.103 -10.591   2.290
   87   HD12  LEU  12          HD12      LEU  12   2.722  -9.562   3.665
   88   HD13  LEU  12          HD13      LEU  12   2.000  -9.233   2.090
   89   HD21  LEU  12          HD21      LEU  12   0.771 -12.733   4.169
   90   HD22  LEU  12          HD22      LEU  12   1.986 -11.695   4.918
   91   HD23  LEU  12          HD23      LEU  12   2.386 -12.616   3.469
   92    H    CYS  13           HN       CYS  13  -2.680 -10.257   2.559
   93    HA   CYS  13           HA       CYS  13  -1.975 -11.083  -0.056
   94    HB2  CYS  13           HB2      CYS  13  -4.300 -12.049  -0.064
   95    HB3  CYS  13           HB1      CYS  13  -3.269 -12.545   1.277
   96    HG   CYS  13           HG       CYS  13  -5.892 -12.238   2.184
   97    H    ARG  14           HN       ARG  14  -4.165  -8.599   1.203
   98    HA   ARG  14           HA       ARG  14  -5.191  -7.862  -1.348
   99    HB2  ARG  14           HB2      ARG  14  -6.225  -7.294   0.927
  100    HB3  ARG  14           HB1      ARG  14  -4.977  -6.068   1.084
  101    HG2  ARG  14           HG2      ARG  14  -5.785  -5.104  -1.080
  102    HG3  ARG  14           HG1      ARG  14  -7.143  -6.216  -0.980
  103    HD2  ARG  14           HD2      ARG  14  -6.436  -4.054   0.997
  104    HD3  ARG  14           HD1      ARG  14  -7.741  -4.001  -0.174
  105    HE   ARG  14           HE       ARG  14  -7.639  -5.921   2.064
  106   HH11  ARG  14          HH11      ARG  14  -9.517  -3.687   0.011
  107   HH12  ARG  14          HH12      ARG  14 -10.935  -3.874   0.934
  108   HH21  ARG  14          HH21      ARG  14  -9.525  -6.166   3.235
  109   HH22  ARG  14          HH22      ARG  14 -10.957  -5.292   2.830
  110    H    LEU  15           HN       LEU  15  -2.412  -7.072   0.514
  111    HA   LEU  15           HA       LEU  15  -1.615  -4.676  -0.626
  112    HB2  LEU  15           HB2      LEU  15  -0.798  -5.567   1.472
  113    HB3  LEU  15           HB1      LEU  15  -0.053  -6.905   0.637
  114    HG   LEU  15           HG       LEU  15   1.612  -5.434  -0.335
  115   HD11  LEU  15          HD11      LEU  15   0.190  -3.474  -0.633
  116   HD12  LEU  15          HD12      LEU  15   1.670  -3.091   0.247
  117   HD13  LEU  15          HD13      LEU  15   0.145  -3.255   1.116
  118   HD21  LEU  15          HD21      LEU  15   1.197  -4.936   2.600
  119   HD22  LEU  15          HD22      LEU  15   2.699  -4.684   1.716
  120   HD23  LEU  15          HD23      LEU  15   2.039  -6.312   1.887
  121    H    SER  16           HN       SER  16  -0.498  -7.996  -1.356
  122    HA   SER  16           HA       SER  16   1.143  -7.263  -3.509
  123    HB2  SER  16           HB2      SER  16   1.293  -9.461  -2.368
  124    HB3  SER  16           HB1      SER  16  -0.269  -9.915  -3.050
  125    HG   SER  16           HG       SER  16   0.963 -10.705  -4.545
  126    H    THR  17           HN       THR  17  -2.255  -8.125  -3.337
  127    HA   THR  17           HA       THR  17  -2.864  -8.333  -6.039
  128    HB   THR  17           HB       THR  17  -4.622  -7.344  -3.767
  129    HG1  THR  17           HG1      THR  17  -3.977  -9.414  -3.249
  130   HG21  THR  17          HG21      THR  17  -5.609  -6.841  -5.967
  131   HG22  THR  17          HG22      THR  17  -6.512  -8.119  -5.152
  132   HG23  THR  17          HG23      THR  17  -5.389  -8.522  -6.452
  133    H    TYR  18           HN       TYR  18  -2.727  -5.443  -3.973
  134    HA   TYR  18           HA       TYR  18  -3.607  -3.752  -6.132
  135    HB2  TYR  18           HB2      TYR  18  -2.840  -3.195  -3.294
  136    HB3  TYR  18           HB1      TYR  18  -3.062  -1.883  -4.447
  137    HD1  TYR  18           HD1      TYR  18  -4.838  -4.976  -3.386
  138    HD2  TYR  18           HD2      TYR  18  -5.141  -0.898  -4.475
  139    HE1  TYR  18           HE1      TYR  18  -7.244  -5.061  -2.983
  140    HE2  TYR  18           HE2      TYR  18  -7.544  -0.962  -4.064
  141    HH   TYR  18           HH       TYR  18  -9.347  -2.638  -4.007
  142    H    LEU  19           HN       LEU  19  -0.554  -4.573  -4.652
  143    HA   LEU  19           HA       LEU  19   0.857  -2.516  -5.975
  144    HB2  LEU  19           HB2      LEU  19   1.786  -5.088  -4.713
  145    HB3  LEU  19           HB1      LEU  19   2.895  -3.939  -5.434
  146    HG   LEU  19           HG       LEU  19   1.059  -3.261  -3.096
  147   HD11  LEU  19          HD11      LEU  19   3.987  -3.940  -3.132
  148   HD12  LEU  19          HD12      LEU  19   2.680  -4.914  -2.435
  149   HD13  LEU  19          HD13      LEU  19   3.062  -3.341  -1.752
  150   HD21  LEU  19          HD21      LEU  19   3.380  -1.779  -4.331
  151   HD22  LEU  19          HD22      LEU  19   2.441  -1.270  -2.929
  152   HD23  LEU  19          HD23      LEU  19   1.684  -1.338  -4.507
  153    H    GLU  20           HN       GLU  20  -0.329  -5.537  -7.025
  154    HA   GLU  20           HA       GLU  20   1.157  -5.868  -9.401
  155    HB2  GLU  20           HB3      GLU  20  -1.569  -6.718  -8.510
  156    HB3  GLU  20           HB2      GLU  20  -1.081  -6.955 -10.181
  157    HG2  GLU  20           HG3      GLU  20   0.418  -8.016  -7.803
  158    HG3  GLU  20           HG2      GLU  20  -0.766  -8.937  -8.732
  159    H    GLU  21           HN       GLU  21  -1.182  -3.539  -8.499
  160    HA   GLU  21           HA       GLU  21  -1.823  -2.895 -11.263
  161    HB2  GLU  21           HB3      GLU  21  -2.858  -1.705  -8.688
  162    HB3  GLU  21           HB2      GLU  21  -3.400  -1.259 -10.298
  163    HG2  GLU  21           HG3      GLU  21  -3.726  -3.929  -8.954
  164    HG3  GLU  21           HG2      GLU  21  -4.989  -2.746  -9.282
  165    H    LEU  22           HN       LEU  22   0.769  -2.424  -9.614
  166    HA   LEU  22           HA       LEU  22   1.049   0.365 -10.423
  167    HB2  LEU  22           HB2      LEU  22   2.658  -1.170  -8.369
  168    HB3  LEU  22           HB1      LEU  22   3.028   0.440  -8.909
  169    HG   LEU  22           HG       LEU  22   0.712  -0.461  -7.230
  170   HD11  LEU  22          HD11      LEU  22   1.667   1.209  -5.684
  171   HD12  LEU  22          HD12      LEU  22   3.007   1.434  -6.804
  172   HD13  LEU  22          HD13      LEU  22   2.755  -0.134  -6.035
  173   HD21  LEU  22          HD21      LEU  22  -0.149   1.174  -8.840
  174   HD22  LEU  22          HD22      LEU  22   1.161   2.280  -8.424
  175   HD23  LEU  22          HD23      LEU  22  -0.053   1.864  -7.223
  176    H    GLU  23           HN       GLU  23   2.346   0.792 -12.005
  177    HA   GLU  23           HA       GLU  23   3.748  -1.212 -13.486
  178    HB2  GLU  23           HB3      GLU  23   3.990   1.800 -13.615
  179    HB3  GLU  23           HB2      GLU  23   4.527   0.668 -14.837
  180    HG2  GLU  23           HG3      GLU  23   1.671   1.113 -14.022
  181    HG3  GLU  23           HG2      GLU  23   2.476   1.846 -15.407
  182    H    ALA  24           HN       ALA  24   6.167  -0.721 -14.037
  183    HA   ALA  24           HA       ALA  24   7.764  -0.994 -11.773
  184    HB1  ALA  24           HB1      ALA  24   8.592  -0.007 -14.508
  185    HB2  ALA  24           HB2      ALA  24   8.483  -1.696 -14.009
  186    HB3  ALA  24           HB3      ALA  24   9.677  -0.631 -13.265
  187    H    VAL  25           HN       VAL  25   7.012   1.851 -13.694
  188    HA   VAL  25           HA       VAL  25   8.615   3.694 -12.303
  189    HB   VAL  25           HB       VAL  25   7.680   4.233 -14.516
  190   HG11  VAL  25          HG11      VAL  25   5.340   4.824 -14.804
  191   HG12  VAL  25          HG12      VAL  25   5.047   4.397 -13.121
  192   HG13  VAL  25          HG13      VAL  25   5.508   3.135 -14.282
  193   HG21  VAL  25          HG21      VAL  25   6.657   6.079 -12.393
  194   HG22  VAL  25          HG22      VAL  25   6.843   6.486 -14.094
  195   HG23  VAL  25          HG23      VAL  25   8.280   6.126 -13.110
  196    H    GLU  26           HN       GLU  26   5.367   2.522 -11.717
  197    HA   GLU  26           HA       GLU  26   4.695   4.464  -9.751
  198    HB2  GLU  26           HB3      GLU  26   3.525   1.739 -10.261
  199    HB3  GLU  26           HB2      GLU  26   2.789   3.011  -9.284
  200    HG2  GLU  26           HG3      GLU  26   3.343   3.140 -12.239
  201    HG3  GLU  26           HG2      GLU  26   1.775   2.775 -11.519
  202    H    LEU  27           HN       LEU  27   5.838   1.125  -9.684
  203    HA   LEU  27           HA       LEU  27   6.011   0.792  -6.907
  204    HB2  LEU  27           HB2      LEU  27   7.666  -0.423  -9.122
  205    HB3  LEU  27           HB1      LEU  27   7.686  -0.972  -7.460
  206    HG   LEU  27           HG       LEU  27   5.251  -1.056  -9.248
  207   HD11  LEU  27          HD11      LEU  27   7.166  -3.253  -8.463
  208   HD12  LEU  27          HD12      LEU  27   6.988  -2.554 -10.072
  209   HD13  LEU  27          HD13      LEU  27   5.661  -3.465  -9.358
  210   HD21  LEU  27          HD21      LEU  27   4.359  -2.539  -7.510
  211   HD22  LEU  27          HD22      LEU  27   4.706  -0.935  -6.875
  212   HD23  LEU  27          HD23      LEU  27   5.806  -2.272  -6.536
  213    H    LYS  28           HN       LYS  28   8.210   2.118  -9.264
  214    HA   LYS  28           HA       LYS  28  10.503   2.472  -7.707
  215    HB2  LYS  28           HB2      LYS  28  10.391   2.669 -10.164
  216    HB3  LYS  28           HB1      LYS  28   9.447   4.134  -9.993
  217    HG2  LYS  28           HG2      LYS  28  11.364   5.256  -8.986
  218    HG3  LYS  28           HG1      LYS  28  12.305   3.766  -9.136
  219    HD2  LYS  28           HD2      LYS  28  11.954   3.807 -11.572
  220    HD3  LYS  28           HD1      LYS  28  11.072   5.320 -11.403
  221    HE2  LYS  28           HE2      LYS  28  13.052   6.415 -10.563
  222    HE3  LYS  28           HE1      LYS  28  13.933   4.889 -10.597
  223    HZ1  LYS  28           HZ1      LYS  28  14.474   6.213 -12.542
  224    HZ2  LYS  28           HZ2      LYS  28  12.851   6.327 -12.966
  225    HZ3  LYS  28           HZ3      LYS  28  13.628   4.842 -13.017
  226    H    LYS  29           HN       LYS  29   7.723   4.554  -8.250
  227    HA   LYS  29           HA       LYS  29   8.623   6.756  -6.687
  228    HB2  LYS  29           HB2      LYS  29   5.856   5.890  -7.386
  229    HB3  LYS  29           HB1      LYS  29   6.265   7.474  -6.752
  230    HG2  LYS  29           HG2      LYS  29   7.756   7.820  -8.832
  231    HG3  LYS  29           HG1      LYS  29   7.045   6.343  -9.425
  232    HD2  LYS  29           HD2      LYS  29   5.362   8.693  -8.628
  233    HD3  LYS  29           HD1      LYS  29   6.016   8.471 -10.251
  234    HE2  LYS  29           HE2      LYS  29   4.895   6.338 -10.421
  235    HE3  LYS  29           HE1      LYS  29   4.234   6.532  -8.795
  236    HZ1  LYS  29           HZ1      LYS  29   3.702   8.417 -11.025
  237    HZ2  LYS  29           HZ2      LYS  29   2.867   8.318  -9.557
  238    HZ3  LYS  29           HZ3      LYS  29   2.773   7.068 -10.701
  239    H    PHE  30           HN       PHE  30   6.457   4.099  -6.159
  240    HA   PHE  30           HA       PHE  30   5.596   4.575  -3.611
  241    HB2  PHE  30           HB2      PHE  30   4.425   2.979  -4.767
  242    HB3  PHE  30           HB1      PHE  30   5.868   2.231  -5.400
  243    HD1  PHE  30           HD2      PHE  30   3.812   2.562  -2.330
  244    HD2  PHE  30           HD1      PHE  30   6.638   0.326  -4.502
  245    HE1  PHE  30           HE2      PHE  30   3.552   0.704  -0.724
  246    HE2  PHE  30           HE1      PHE  30   6.394  -1.559  -2.908
  247    HZ   PHE  30           HZ       PHE  30   4.837  -1.352  -1.019
  248    H    LYS  31           HN       LYS  31   8.475   2.716  -4.587
  249    HA   LYS  31           HA       LYS  31   9.177   2.213  -1.842
  250    HB2  LYS  31           HB2      LYS  31  11.161   1.113  -2.668
  251    HB3  LYS  31           HB1      LYS  31   9.781   0.609  -3.623
  252    HG2  LYS  31           HG2      LYS  31  10.495   2.198  -5.392
  253    HG3  LYS  31           HG1      LYS  31  11.935   2.551  -4.433
  254    HD2  LYS  31           HD2      LYS  31  12.524   0.149  -4.496
  255    HD3  LYS  31           HD1      LYS  31  11.130  -0.142  -5.537
  256    HE2  LYS  31           HE2      LYS  31  13.110   0.002  -6.893
  257    HE3  LYS  31           HE1      LYS  31  12.124   1.425  -7.203
  258    HZ1  LYS  31           HZ1      LYS  31  14.434   2.022  -6.964
  259    HZ2  LYS  31           HZ2      LYS  31  14.530   1.242  -5.498
  260    HZ3  LYS  31           HZ3      LYS  31  13.615   2.646  -5.627
  261    H    LEU  32           HN       LEU  32   9.945   4.812  -4.021
  262    HA   LEU  32           HA       LEU  32  12.076   5.619  -2.257
  263    HB2  LEU  32           HB2      LEU  32  12.367   7.568  -3.632
  264    HB3  LEU  32           HB1      LEU  32  12.186   6.190  -4.682
  265    HG   LEU  32           HG       LEU  32   9.697   7.037  -4.897
  266   HD11  LEU  32          HD11      LEU  32   9.742   8.706  -3.176
  267   HD12  LEU  32          HD12      LEU  32   9.454   9.451  -4.749
  268   HD13  LEU  32          HD13      LEU  32  11.047   9.559  -3.997
  269   HD21  LEU  32          HD21      LEU  32  12.019   8.476  -6.158
  270   HD22  LEU  32          HD22      LEU  32  10.364   8.473  -6.769
  271   HD23  LEU  32          HD23      LEU  32  11.296   6.971  -6.729
  272    H    TYR  33           HN       TYR  33   8.706   6.259  -2.673
  273    HA   TYR  33           HA       TYR  33   8.575   8.478  -0.993
  274    HB2  TYR  33           HB2      TYR  33   6.691   7.948  -2.446
  275    HB3  TYR  33           HB1      TYR  33   6.423   6.431  -1.583
  276    HD1  TYR  33           HD1      TYR  33   6.222  10.081  -1.331
  277    HD2  TYR  33           HD2      TYR  33   5.317   6.388   0.527
  278    HE1  TYR  33           HE1      TYR  33   4.822  11.262   0.351
  279    HE2  TYR  33           HE2      TYR  33   3.925   7.525   2.187
  280    HH   TYR  33           HH       TYR  33   4.004   9.935   3.183
  281    H    LEU  34           HN       LEU  34   7.736   5.110  -0.190
  282    HA   LEU  34           HA       LEU  34   7.780   5.886   2.597
  283    HB2  LEU  34           HB2      LEU  34   7.097   3.516   3.008
  284    HB3  LEU  34           HB1      LEU  34   5.995   4.499   2.073
  285    HG   LEU  34           HG       LEU  34   6.836   3.343   0.012
  286   HD11  LEU  34          HD11      LEU  34   8.956   2.505   0.791
  287   HD12  LEU  34          HD12      LEU  34   7.928   1.168   0.269
  288   HD13  LEU  34          HD13      LEU  34   8.150   1.498   1.991
  289   HD21  LEU  34          HD21      LEU  34   5.547   1.673   2.146
  290   HD22  LEU  34          HD22      LEU  34   5.536   1.329   0.416
  291   HD23  LEU  34          HD23      LEU  34   4.739   2.777   1.032
  292    H    GLY  35           HN       GLY  35  10.031   4.505   0.435
  293    HA2  GLY  35           HA3      GLY  35  11.326   3.010   2.422
  294    HA3  GLY  35           HA2      GLY  35  12.001   3.353   0.822
  295    H    THR  36           HN       THR  36  12.231   6.032   0.826
  296    HA   THR  36           HA       THR  36  14.150   6.439   3.010
  297    HB   THR  36           HB       THR  36  15.156   6.595   0.754
  298    HG1  THR  36           HG1      THR  36  15.041   8.968   2.256
  299   HG21  THR  36          HG21      THR  36  14.606   8.430  -0.782
  300   HG22  THR  36          HG22      THR  36  13.320   8.958   0.304
  301   HG23  THR  36          HG23      THR  36  13.203   7.399  -0.508
  302    H    ALA  37           HN       ALA  37  11.269   6.794   3.099
  303    HA   ALA  37           HA       ALA  37  10.490   9.495   3.262
  304    HB1  ALA  37           HB1      ALA  37   8.622   8.684   4.605
  305    HB2  ALA  37           HB2      ALA  37   9.418   7.111   4.742
  306    HB3  ALA  37           HB3      ALA  37   8.889   7.705   3.166
  307    H    THR  38           HN       THR  38  11.272  10.974   4.552
  308    HA   THR  38           HA       THR  38  12.638  10.399   6.975
  309    HB   THR  38           HB       THR  38  11.583  13.082   6.033
  310    HG1  THR  38           HG1      THR  38  14.197  12.405   5.405
  311   HG21  THR  38          HG21      THR  38  12.566  13.007   8.306
  312   HG22  THR  38          HG22      THR  38  13.560  13.957   7.205
  313   HG23  THR  38          HG23      THR  38  14.045  12.317   7.634
  314    H    GLU  39           HN       GLU  39   9.473  11.132   5.990
  315    HA   GLU  39           HA       GLU  39   8.300  11.977   8.428
  316    HB2  GLU  39           HB3      GLU  39   6.122  11.348   7.357
  317    HB3  GLU  39           HB2      GLU  39   7.125  12.417   6.389
  318    HG2  GLU  39           HG3      GLU  39   7.842  10.514   5.041
  319    HG3  GLU  39           HG2      GLU  39   6.835   9.445   6.014
  320    H    LEU  40           HN       LEU  40   9.380   8.924   7.442
  321    HA   LEU  40           HA       LEU  40   7.700   7.473   9.340
  322    HB2  LEU  40           HB2      LEU  40   9.853   6.574   7.476
  323    HB3  LEU  40           HB1      LEU  40   9.001   5.551   8.613
  324    HG   LEU  40           HG       LEU  40   7.857   6.968   6.192
  325   HD11  LEU  40          HD11      LEU  40   8.222   4.056   6.808
  326   HD12  LEU  40          HD12      LEU  40   9.157   5.009   5.654
  327   HD13  LEU  40          HD13      LEU  40   7.441   4.715   5.374
  328   HD21  LEU  40          HD21      LEU  40   5.789   5.794   6.660
  329   HD22  LEU  40          HD22      LEU  40   6.171   6.960   7.928
  330   HD23  LEU  40          HD23      LEU  40   6.430   5.227   8.205
  331    H    GLY  41           HN       GLY  41  10.183   9.325   9.569
  332    HA2  GLY  41           HA3      GLY  41  11.443   9.763  11.505
  333    HA3  GLY  41           HA2      GLY  41  11.051   8.144  12.083
  334    H    GLU  42           HN       GLU  42  12.004   6.394  10.770
  335    HA   GLU  42           HA       GLU  42  14.875   6.953  10.415
  336    HB2  GLU  42           HB3      GLU  42  13.450   4.311  10.467
  337    HB3  GLU  42           HB2      GLU  42  15.177   4.563  10.442
  338    HG2  GLU  42           HG3      GLU  42  14.958   5.641  12.679
  339    HG3  GLU  42           HG2      GLU  42  13.262   5.141  12.670
  340    H    GLY  43           HN       GLY  43  12.031   5.951   8.676
  341    HA2  GLY  43           HA3      GLY  43  11.767   5.360   6.425
  342    HA3  GLY  43           HA2      GLY  43  13.499   5.666   6.187
  343    H    LYS  44           HN       LYS  44  11.144   3.348   7.168
  344    HA   LYS  44           HA       LYS  44  12.851   1.546   8.511
  345    HB2  LYS  44           HB2      LYS  44  10.125   1.061   7.331
  346    HB3  LYS  44           HB1      LYS  44  10.985  -0.060   8.371
  347    HG2  LYS  44           HG2      LYS  44  10.182   2.732   9.175
  348    HG3  LYS  44           HG1      LYS  44   9.254   1.278   9.541
  349    HD2  LYS  44           HD2      LYS  44  11.164   0.398  10.821
  350    HD3  LYS  44           HD1      LYS  44  12.079   1.861  10.457
  351    HE2  LYS  44           HE2      LYS  44  10.420   3.208  11.628
  352    HE3  LYS  44           HE1      LYS  44   9.463   1.769  11.961
  353    HZ1  LYS  44           HZ1      LYS  44  12.234   2.229  12.951
  354    HZ2  LYS  44           HZ2      LYS  44  11.205   0.941  13.391
  355    HZ3  LYS  44           HZ3      LYS  44  10.834   2.516  13.822
  356    H    ILE  45           HN       ILE  45  12.556   1.979   5.167
  357    HA   ILE  45           HA       ILE  45  13.043  -0.783   4.571
  358    HB   ILE  45           HB       ILE  45  13.040   1.636   2.755
  359   HG12  ILE  45          HG12      ILE  45  10.838   1.146   3.642
  360   HG13  ILE  45          HG11      ILE  45  10.886   0.685   1.946
  361   HG21  ILE  45          HG21      ILE  45  13.237  -1.279   1.977
  362   HG22  ILE  45          HG22      ILE  45  14.507  -0.078   1.817
  363   HG23  ILE  45          HG23      ILE  45  13.033   0.070   0.857
  364   HD11  ILE  45          HD11      ILE  45  11.025  -1.176   4.326
  365   HD12  ILE  45          HD12      ILE  45  11.185  -1.673   2.647
  366   HD13  ILE  45          HD13      ILE  45   9.674  -0.967   3.213
  367    HA   PRO  46           HA       PRO  46  17.408  -0.604   5.172
  368    HB2  PRO  46           HB2      PRO  46  17.981  -3.035   4.030
  369    HB3  PRO  46           HB1      PRO  46  17.395  -2.820   5.677
  370    HG2  PRO  46           HG2      PRO  46  15.923  -3.613   3.228
  371    HG3  PRO  46           HG1      PRO  46  15.711  -4.155   4.909
  372    HD2  PRO  46           HD2      PRO  46  14.090  -2.381   3.635
  373    HD3  PRO  46           HD1      PRO  46  14.331  -2.410   5.391
  374    H    TRP  47           HN       TRP  47  19.268  -1.805   3.549
  375    HA   TRP  47           HA       TRP  47  19.627   0.347   1.736
  376    HB2  TRP  47           HB2      TRP  47  21.439  -1.985   2.341
  377    HB3  TRP  47           HB1      TRP  47  21.891  -0.518   1.485
  378    HD1  TRP  47           HD1      TRP  47  22.318   1.672   2.957
  379    HE1  TRP  47           HE1      TRP  47  22.670   2.027   5.485
  380    HE3  TRP  47           HE3      TRP  47  20.697  -2.870   4.653
  381    HZ2  TRP  47           HZ2      TRP  47  22.307   0.571   7.878
  382    HZ3  TRP  47           HZ3      TRP  47  20.724  -3.312   7.061
  383    HH2  TRP  47           HH2      TRP  47  21.518  -1.626   8.649
  384    H    GLY  48           HN       GLY  48  17.799  -0.379   0.379
  385    HA2  GLY  48           HA3      GLY  48  17.434  -0.676  -1.921
  386    HA3  GLY  48           HA2      GLY  48  19.000  -1.438  -2.035
  387    H    SER  49           HN       SER  49  16.531  -2.530   0.226
  388    HA   SER  49           HA       SER  49  16.679  -5.130  -0.920
  389    HB2  SER  49           HB2      SER  49  14.828  -4.073   1.215
  390    HB3  SER  49           HB1      SER  49  15.128  -5.774   0.849
  391    HG   SER  49           HG       SER  49  16.630  -5.570   2.244
  392    H    MET  50           HN       MET  50  14.509  -2.422  -1.343
  393    HA   MET  50           HA       MET  50  12.402  -4.110  -2.410
  394    HB2  MET  50           HB2      MET  50  12.538  -1.091  -2.295
  395    HB3  MET  50           HB1      MET  50  11.158  -2.027  -2.830
  396    HG2  MET  50           HG2      MET  50  10.991  -3.029  -0.602
  397    HG3  MET  50           HG1      MET  50  12.342  -2.031  -0.068
  398    HE1  MET  50           HE1      MET  50   8.177  -0.447  -1.256
  399    HE2  MET  50           HE2      MET  50   8.595  -2.156  -1.126
  400    HE3  MET  50           HE3      MET  50   9.273  -1.179  -2.425
  401    H    GLU  51           HN       GLU  51  15.197  -3.188  -3.578
  402    HA   GLU  51           HA       GLU  51  14.525  -2.185  -6.166
  403    HB2  GLU  51           HB3      GLU  51  16.994  -3.557  -5.204
  404    HB3  GLU  51           HB2      GLU  51  16.841  -2.637  -6.691
  405    HG2  GLU  51           HG3      GLU  51  16.801  -1.649  -3.837
  406    HG3  GLU  51           HG2      GLU  51  17.968  -1.247  -5.090
  407    H    LYS  52           HN       LYS  52  15.525  -5.248  -4.860
  408    HA   LYS  52           HA       LYS  52  15.353  -6.723  -7.342
  409    HB2  LYS  52           HB2      LYS  52  15.474  -7.711  -4.509
  410    HB3  LYS  52           HB1      LYS  52  15.808  -8.657  -5.946
  411    HG2  LYS  52           HG2      LYS  52  17.804  -7.343  -6.382
  412    HG3  LYS  52           HG1      LYS  52  17.442  -6.307  -5.000
  413    HD2  LYS  52           HD2      LYS  52  17.959  -9.283  -4.842
  414    HD3  LYS  52           HD1      LYS  52  19.147  -8.034  -4.473
  415    HE2  LYS  52           HE2      LYS  52  17.718  -7.199  -2.669
  416    HE3  LYS  52           HE1      LYS  52  16.504  -8.410  -3.032
  417    HZ1  LYS  52           HZ1      LYS  52  19.254  -8.930  -2.075
  418    HZ2  LYS  52           HZ2      LYS  52  18.090 -10.129  -2.426
  419    HZ3  LYS  52           HZ3      LYS  52  17.835  -9.034  -1.177
  420    H    ALA  53           HN       ALA  53  13.252  -5.735  -4.926
  421    HA   ALA  53           HA       ALA  53  11.535  -8.065  -4.915
  422    HB1  ALA  53           HB1      ALA  53  10.303  -6.918  -3.187
  423    HB2  ALA  53           HB2      ALA  53  11.206  -5.435  -3.514
  424    HB3  ALA  53           HB3      ALA  53  12.040  -6.839  -2.852
  425    H    GLY  54           HN       GLY  54   9.719  -8.337  -6.055
  426    HA2  GLY  54           HA3      GLY  54   8.713  -6.144  -7.665
  427    HA3  GLY  54           HA2      GLY  54   8.276  -7.858  -7.767
  428    HA   PRO  55           HA       PRO  55   4.849  -5.382  -5.599
  429    HB2  PRO  55           HB2      PRO  55   3.401  -7.602  -6.964
  430    HB3  PRO  55           HB1      PRO  55   2.951  -5.902  -6.813
  431    HG2  PRO  55           HG2      PRO  55   3.923  -6.870  -9.099
  432    HG3  PRO  55           HG1      PRO  55   4.342  -5.240  -8.540
  433    HD2  PRO  55           HD2      PRO  55   6.048  -7.722  -8.528
  434    HD3  PRO  55           HD1      PRO  55   6.498  -6.024  -8.703
  435    H    LEU  56           HN       LEU  56   5.142  -8.854  -6.036
  436    HA   LEU  56           HA       LEU  56   3.752  -9.678  -3.674
  437    HB2  LEU  56           HB2      LEU  56   4.108 -11.184  -5.564
  438    HB3  LEU  56           HB1      LEU  56   5.836 -11.093  -5.324
  439    HG   LEU  56           HG       LEU  56   5.527 -12.205  -3.121
  440   HD11  LEU  56          HD11      LEU  56   3.434 -13.389  -2.699
  441   HD12  LEU  56          HD12      LEU  56   2.709 -12.605  -4.104
  442   HD13  LEU  56          HD13      LEU  56   3.203 -11.641  -2.715
  443   HD21  LEU  56          HD21      LEU  56   5.205 -14.426  -4.095
  444   HD22  LEU  56          HD22      LEU  56   6.235 -13.401  -5.105
  445   HD23  LEU  56          HD23      LEU  56   4.557 -13.681  -5.559
  446    H    GLU  57           HN       GLU  57   7.187  -9.356  -4.393
  447    HA   GLU  57           HA       GLU  57   7.876 -10.128  -1.756
  448    HB2  GLU  57           HB3      GLU  57   9.552  -8.958  -3.949
  449    HB3  GLU  57           HB2      GLU  57  10.224  -9.511  -2.424
  450    HG2  GLU  57           HG3      GLU  57   9.066 -11.733  -2.949
  451    HG3  GLU  57           HG2      GLU  57   8.888 -11.097  -4.582
  452    H    MET  58           HN       MET  58   7.380  -7.051  -3.299
  453    HA   MET  58           HA       MET  58   8.361  -5.429  -1.207
  454    HB2  MET  58           HB2      MET  58   6.182  -4.985  -3.233
  455    HB3  MET  58           HB1      MET  58   6.586  -3.742  -2.066
  456    HG2  MET  58           HG2      MET  58   8.915  -3.768  -2.956
  457    HG3  MET  58           HG1      MET  58   8.400  -4.960  -4.147
  458    HE1  MET  58           HE1      MET  58   9.418  -3.331  -6.051
  459    HE2  MET  58           HE2      MET  58   9.873  -2.238  -4.753
  460    HE3  MET  58           HE3      MET  58   9.006  -1.617  -6.152
  461    H    ALA  59           HN       ALA  59   5.222  -6.916  -1.780
  462    HA   ALA  59           HA       ALA  59   3.841  -5.931   0.384
  463    HB1  ALA  59           HB1      ALA  59   3.678  -8.723  -0.764
  464    HB2  ALA  59           HB2      ALA  59   2.837  -7.307  -1.389
  465    HB3  ALA  59           HB3      ALA  59   2.439  -7.930   0.212
  466    H    GLN  60           HN       GLN  60   6.108  -8.596   0.227
  467    HA   GLN  60           HA       GLN  60   5.714  -9.421   2.921
  468    HB2  GLN  60           HB2      GLN  60   8.132  -9.975   1.223
  469    HB3  GLN  60           HB1      GLN  60   7.541 -10.885   2.611
  470    HG2  GLN  60           HG2      GLN  60   5.487 -11.386   1.299
  471    HG3  GLN  60           HG1      GLN  60   6.275 -10.638  -0.074
  472   HE21  GLN  60          HE21      GLN  60   6.323 -13.331   2.078
  473   HE22  GLN  60          HE22      GLN  60   7.380 -14.327   1.142
  474    H    LEU  61           HN       LEU  61   7.849  -7.189   1.323
  475    HA   LEU  61           HA       LEU  61   9.554  -6.848   3.552
  476    HB2  LEU  61           HB2      LEU  61   9.223  -5.531   0.949
  477    HB3  LEU  61           HB1      LEU  61   9.914  -4.517   2.191
  478    HG   LEU  61           HG       LEU  61  11.740  -6.144   2.509
  479   HD11  LEU  61          HD11      LEU  61  10.489  -7.667   0.238
  480   HD12  LEU  61          HD12      LEU  61  10.576  -8.195   1.916
  481   HD13  LEU  61          HD13      LEU  61  12.057  -7.998   0.974
  482   HD21  LEU  61          HD21      LEU  61  11.328  -5.319  -0.348
  483   HD22  LEU  61          HD22      LEU  61  12.861  -5.806   0.374
  484   HD23  LEU  61          HD23      LEU  61  12.048  -4.346   0.934
  485    H    LEU  62           HN       LEU  62   6.835  -4.813   2.355
  486    HA   LEU  62           HA       LEU  62   6.994  -3.066   4.523
  487    HB2  LEU  62           HB2      LEU  62   4.593  -3.761   2.807
  488    HB3  LEU  62           HB1      LEU  62   4.559  -2.538   4.045
  489    HG   LEU  62           HG       LEU  62   4.757  -1.401   1.965
  490   HD11  LEU  62          HD11      LEU  62   6.837  -0.237   2.123
  491   HD12  LEU  62          HD12      LEU  62   7.453  -1.472   3.222
  492   HD13  LEU  62          HD13      LEU  62   6.090  -0.460   3.706
  493   HD21  LEU  62          HD21      LEU  62   6.535  -1.812   0.371
  494   HD22  LEU  62          HD22      LEU  62   5.479  -3.219   0.629
  495   HD23  LEU  62          HD23      LEU  62   7.072  -3.174   1.374
  496    H    ILE  63           HN       ILE  63   5.336  -6.166   4.160
  497    HA   ILE  63           HA       ILE  63   3.872  -6.007   6.566
  498    HB   ILE  63           HB       ILE  63   3.765  -7.703   4.485
  499   HG12  ILE  63          HG12      ILE  63   2.106  -7.442   6.268
  500   HG13  ILE  63          HG11      ILE  63   2.208  -9.084   5.658
  501   HG21  ILE  63          HG21      ILE  63   4.494  -9.964   5.044
  502   HG22  ILE  63          HG22      ILE  63   5.250  -9.346   6.509
  503   HG23  ILE  63          HG23      ILE  63   5.857  -8.843   4.934
  504   HD11  ILE  63          HD11      ILE  63   3.338  -8.061   8.260
  505   HD12  ILE  63          HD12      ILE  63   3.540  -9.702   7.649
  506   HD13  ILE  63          HD13      ILE  63   1.929  -9.106   8.069
  507    H    THR  64           HN       THR  64   7.176  -6.948   5.963
  508    HA   THR  64           HA       THR  64   7.577  -8.104   8.551
  509    HB   THR  64           HB       THR  64   9.666  -7.147   6.569
  510    HG1  THR  64           HG1      THR  64   8.530  -8.700   5.534
  511   HG21  THR  64          HG21      THR  64  11.137  -8.757   7.708
  512   HG22  THR  64          HG22      THR  64   9.839  -9.150   8.836
  513   HG23  THR  64          HG23      THR  64  10.552  -7.537   8.841
  514    H    HIS  65           HN       HIS  65   8.345  -4.981   7.071
  515    HA   HIS  65           HA       HIS  65   9.704  -4.068   9.427
  516    HB2  HIS  65           HB2      HIS  65   8.939  -2.591   6.910
  517    HB3  HIS  65           HB1      HIS  65   9.860  -1.880   8.234
  518    HD1  HIS  65           HD1      HIS  65  12.351  -2.714   8.521
  519    HD2  HIS  65           HD2      HIS  65  10.324  -4.321   5.269
  520    HE1  HIS  65           HE1      HIS  65  14.069  -3.859   7.120
  521    H    PHE  66           HN       PHE  66   6.695  -3.130   7.826
  522    HA   PHE  66           HA       PHE  66   5.989  -1.435  10.034
  523    HB2  PHE  66           HB2      PHE  66   4.552  -2.135   7.489
  524    HB3  PHE  66           HB1      PHE  66   4.026  -0.907   8.650
  525    HD1  PHE  66           HD2      PHE  66   5.369   1.062   9.038
  526    HD2  PHE  66           HD1      PHE  66   6.374  -1.771   6.063
  527    HE1  PHE  66           HE2      PHE  66   6.973   2.662   8.056
  528    HE2  PHE  66           HE1      PHE  66   7.981  -0.212   5.088
  529    HZ   PHE  66           HZ       PHE  66   8.295   1.973   6.068
  530    H    GLY  67           HN       GLY  67   4.442  -4.242   8.541
  531    HA2  GLY  67           HA3      GLY  67   3.815  -5.893  10.417
  532    HA3  GLY  67           HA2      GLY  67   2.809  -4.544  10.952
  533    HA   PRO  68           HA       PRO  68   0.722  -7.268   7.670
  534    HB2  PRO  68           HB2      PRO  68  -1.630  -7.522   9.127
  535    HB3  PRO  68           HB1      PRO  68  -0.346  -8.730   9.029
  536    HG2  PRO  68           HG2      PRO  68  -0.920  -6.743  11.172
  537    HG3  PRO  68           HG1      PRO  68  -0.273  -8.383  11.301
  538    HD2  PRO  68           HD2      PRO  68   1.277  -6.174  11.543
  539    HD3  PRO  68           HD1      PRO  68   1.890  -7.690  10.872
  540    H    GLU  69           HN       GLU  69  -1.294  -5.205   9.705
  541    HA   GLU  69           HA       GLU  69  -2.711  -4.313   7.380
  542    HB2  GLU  69           HB3      GLU  69  -2.982  -3.514  10.252
  543    HB3  GLU  69           HB2      GLU  69  -4.066  -3.026   8.956
  544    HG2  GLU  69           HG3      GLU  69  -3.594  -5.832   9.952
  545    HG3  GLU  69           HG2      GLU  69  -5.020  -4.811  10.134
  546    H    GLU  70           HN       GLU  70  -0.135  -3.273   9.321
  547    HA   GLU  70           HA       GLU  70  -0.181  -0.469   8.775
  548    HB2  GLU  70           HB3      GLU  70   1.071  -1.739  10.638
  549    HB3  GLU  70           HB2      GLU  70   2.278  -2.090   9.413
  550    HG2  GLU  70           HG3      GLU  70   3.057  -0.207  10.605
  551    HG3  GLU  70           HG2      GLU  70   2.467   0.400   9.059
  552    H    ALA  71           HN       ALA  71   1.507  -3.256   7.301
  553    HA   ALA  71           HA       ALA  71   2.957  -2.041   5.237
  554    HB1  ALA  71           HB1      ALA  71   1.407  -4.619   5.177
  555    HB2  ALA  71           HB2      ALA  71   3.055  -4.399   5.783
  556    HB3  ALA  71           HB3      ALA  71   2.705  -4.157   4.076
  557    H    TRP  72           HN       TRP  72  -0.339  -3.290   5.153
  558    HA   TRP  72           HA       TRP  72  -0.971  -2.495   2.586
  559    HB2  TRP  72           HB2      TRP  72  -2.364  -4.064   3.666
  560    HB3  TRP  72           HB1      TRP  72  -2.692  -2.979   5.013
  561    HD1  TRP  72           HD1      TRP  72  -5.184  -2.396   4.885
  562    HE1  TRP  72           HE1      TRP  72  -6.789  -1.592   3.035
  563    HE3  TRP  72           HE3      TRP  72  -2.059  -2.689   0.883
  564    HZ2  TRP  72           HZ2      TRP  72  -6.719  -1.127   0.333
  565    HZ3  TRP  72           HZ3      TRP  72  -2.954  -2.053  -1.370
  566    HH2  TRP  72           HH2      TRP  72  -5.219  -1.294  -1.610
  567    H    ARG  73           HN       ARG  73  -1.350  -0.803   5.603
  568    HA   ARG  73           HA       ARG  73  -2.684   1.420   4.646
  569    HB2  ARG  73           HB2      ARG  73  -2.532   0.910   6.993
  570    HB3  ARG  73           HB1      ARG  73  -0.791   1.114   6.969
  571    HG2  ARG  73           HG2      ARG  73  -1.094   3.509   6.567
  572    HG3  ARG  73           HG1      ARG  73  -2.851   3.283   6.616
  573    HD2  ARG  73           HD2      ARG  73  -2.665   2.363   8.868
  574    HD3  ARG  73           HD1      ARG  73  -0.926   2.598   8.820
  575    HE   ARG  73           HE       ARG  73  -2.644   4.913   8.484
  576   HH11  ARG  73          HH11      ARG  73  -0.382   3.058  10.510
  577   HH12  ARG  73          HH12      ARG  73  -0.290   4.236  11.727
  578   HH21  ARG  73          HH21      ARG  73  -2.476   6.567  10.215
  579   HH22  ARG  73          HH22      ARG  73  -1.463   6.254  11.556
  580    H    LEU  74           HN       LEU  74   0.752   0.784   5.110
  581    HA   LEU  74           HA       LEU  74   1.830   3.177   4.227
  582    HB2  LEU  74           HB2      LEU  74   2.785   0.428   4.556
  583    HB3  LEU  74           HB1      LEU  74   3.647   1.316   3.328
  584    HG   LEU  74           HG       LEU  74   4.735   1.345   5.566
  585   HD11  LEU  74          HD11      LEU  74   5.258   3.093   3.980
  586   HD12  LEU  74          HD12      LEU  74   5.232   3.735   5.607
  587   HD13  LEU  74          HD13      LEU  74   3.870   4.042   4.522
  588   HD21  LEU  74          HD21      LEU  74   3.809   2.753   7.325
  589   HD22  LEU  74          HD22      LEU  74   2.731   1.409   6.953
  590   HD23  LEU  74          HD23      LEU  74   2.360   3.029   6.359
  591    H    ALA  75           HN       ALA  75   0.955   0.310   2.342
  592    HA   ALA  75           HA       ALA  75   1.869   1.385  -0.115
  593    HB1  ALA  75           HB1      ALA  75   1.552  -0.992   0.177
  594    HB2  ALA  75           HB2      ALA  75   0.650  -0.373  -1.198
  595    HB3  ALA  75           HB3      ALA  75  -0.193  -0.752   0.307
  596    H    LEU  76           HN       LEU  76  -1.450   1.229   1.220
  597    HA   LEU  76           HA       LEU  76  -2.522   2.525  -1.037
  598    HB2  LEU  76           HB2      LEU  76  -4.608   2.765   0.167
  599    HB3  LEU  76           HB1      LEU  76  -3.930   1.193   0.493
  600    HG   LEU  76           HG       LEU  76  -3.058   2.394   2.683
  601   HD11  LEU  76          HD11      LEU  76  -5.475   4.036   1.995
  602   HD12  LEU  76          HD12      LEU  76  -3.812   4.612   2.114
  603   HD13  LEU  76          HD13      LEU  76  -4.642   4.014   3.551
  604   HD21  LEU  76          HD21      LEU  76  -5.894   1.489   2.254
  605   HD22  LEU  76          HD22      LEU  76  -5.104   1.657   3.827
  606   HD23  LEU  76          HD23      LEU  76  -4.510   0.476   2.660
  607    H    SER  77           HN       SER  77  -1.308   3.809   1.976
  608    HA   SER  77           HA       SER  77  -1.973   6.443   1.239
  609    HB2  SER  77           HB2      SER  77  -0.750   5.104   3.527
  610    HB3  SER  77           HB1      SER  77  -0.481   6.881   3.404
  611    HG   SER  77           HG       SER  77  -2.822   6.788   2.944
  612    H    THR  78           HN       THR  78   0.392   4.491   0.171
  613    HA   THR  78           HA       THR  78   2.091   6.741  -0.456
  614    HB   THR  78           HB       THR  78   2.425   3.781  -1.061
  615    HG1  THR  78           HG1      THR  78   2.860   4.208   1.044
  616   HG21  THR  78          HG21      THR  78   4.698   4.396  -1.785
  617   HG22  THR  78          HG22      THR  78   4.258   6.103  -1.642
  618   HG23  THR  78          HG23      THR  78   3.453   5.080  -2.831
  619    H    PHE  79           HN       PHE  79  -0.147   4.407  -1.896
  620    HA   PHE  79           HA       PHE  79   0.091   4.895  -4.576
  621    HB2  PHE  79           HB2      PHE  79  -2.519   4.525  -3.072
  622    HB3  PHE  79           HB1      PHE  79  -2.357   4.401  -4.813
  623    HD1  PHE  79           HD1      PHE  79   0.420   2.814  -4.401
  624    HD2  PHE  79           HD2      PHE  79  -3.566   2.400  -2.970
  625    HE1  PHE  79           HE1      PHE  79   0.764   0.399  -4.111
  626    HE2  PHE  79           HE2      PHE  79  -3.218  -0.012  -2.677
  627    HZ   PHE  79           HZ       PHE  79  -1.048  -1.016  -3.250
  628    H    GLU  80           HN       GLU  80  -1.933   6.584  -2.213
  629    HA   GLU  80           HA       GLU  80  -3.122   8.470  -3.862
  630    HB2  GLU  80           HB3      GLU  80  -3.422   9.807  -1.726
  631    HB3  GLU  80           HB2      GLU  80  -4.059   8.170  -1.717
  632    HG2  GLU  80           HG3      GLU  80  -2.188   7.386  -0.481
  633    HG3  GLU  80           HG2      GLU  80  -1.395   8.945  -0.567
  634    H    ARG  81           HN       ARG  81  -0.049   8.703  -2.149
  635    HA   ARG  81           HA       ARG  81   0.177  11.466  -2.981
  636    HB2  ARG  81           HB2      ARG  81   1.888   9.830  -1.133
  637    HB3  ARG  81           HB1      ARG  81   2.176  11.529  -1.515
  638    HG2  ARG  81           HG2      ARG  81   0.115  12.192  -0.556
  639    HG3  ARG  81           HG1      ARG  81  -0.429  10.533  -0.384
  640    HD2  ARG  81           HD2      ARG  81   1.506  10.182   1.160
  641    HD3  ARG  81           HD1      ARG  81   1.780  11.921   1.086
  642    HE   ARG  81           HE       ARG  81  -0.687  11.980   1.820
  643   HH11  ARG  81          HH11      ARG  81   1.825   9.766   3.003
  644   HH12  ARG  81          HH12      ARG  81   1.016   9.447   4.488
  645   HH21  ARG  81          HH21      ARG  81  -1.734  11.536   3.894
  646   HH22  ARG  81          HH22      ARG  81  -0.987  10.456   4.985
  647    H    ILE  82           HN       ILE  82   1.264   8.481  -4.176
  648    HA   ILE  82           HA       ILE  82   3.427   9.781  -5.653
  649    HB   ILE  82           HB       ILE  82   3.882   7.596  -6.690
  650   HG12  ILE  82          HG12      ILE  82   1.603   6.531  -4.999
  651   HG13  ILE  82          HG11      ILE  82   1.550   6.756  -6.741
  652   HG21  ILE  82          HG21      ILE  82   3.631   7.439  -3.697
  653   HG22  ILE  82          HG22      ILE  82   4.993   8.094  -4.606
  654   HG23  ILE  82          HG23      ILE  82   4.618   6.372  -4.695
  655   HD11  ILE  82          HD11      ILE  82   3.361   4.866  -5.256
  656   HD12  ILE  82          HD12      ILE  82   3.301   5.071  -7.007
  657   HD13  ILE  82          HD13      ILE  82   1.904   4.423  -6.145
  658    H    ASN  83           HN       ASN  83   0.407  10.087  -5.854
  659    HA   ASN  83           HA       ASN  83  -1.133  10.689  -7.361
  660    HB2  ASN  83           HB3      ASN  83   0.679  12.091  -8.300
  661    HB3  ASN  83           HB2      ASN  83   1.158  10.772  -9.354
  662   HD21  ASN  83          HD21      ASN  83  -2.190  11.753  -8.642
  663   HD22  ASN  83          HD22      ASN  83  -2.552  12.265 -10.225
  664    H    ARG  84           HN       ARG  84  -1.342   8.307  -6.750
  665    HA   ARG  84           HA       ARG  84  -2.348   6.980  -9.140
  666    HB2  ARG  84           HB2      ARG  84  -0.027   6.122  -8.006
  667    HB3  ARG  84           HB1      ARG  84  -1.168   5.327  -6.939
  668    HG2  ARG  84           HG2      ARG  84  -0.860   4.966  -9.901
  669    HG3  ARG  84           HG1      ARG  84  -0.489   3.796  -8.647
  670    HD2  ARG  84           HD2      ARG  84  -2.948   3.846  -8.066
  671    HD3  ARG  84           HD1      ARG  84  -3.199   4.777  -9.531
  672    HE   ARG  84           HE       ARG  84  -1.792   2.234  -9.759
  673   HH11  ARG  84          HH11      ARG  84  -4.647   4.131 -10.675
  674   HH12  ARG  84          HH12      ARG  84  -5.383   2.885 -11.553
  675   HH21  ARG  84          HH21      ARG  84  -2.755   0.541 -11.012
  676   HH22  ARG  84          HH22      ARG  84  -4.256   0.753 -11.751
  677    H    LYS  85           HN       LYS  85  -3.748   8.596  -7.665
  678    HA   LYS  85           HA       LYS  85  -4.661   7.823  -5.089
  679    HB2  LYS  85           HB2      LYS  85  -4.604  10.125  -5.714
  680    HB3  LYS  85           HB1      LYS  85  -5.567   9.842  -7.157
  681    HG2  LYS  85           HG2      LYS  85  -7.478   9.262  -5.634
  682    HG3  LYS  85           HG1      LYS  85  -6.446   9.749  -4.287
  683    HD2  LYS  85           HD2      LYS  85  -6.318  11.988  -5.068
  684    HD3  LYS  85           HD1      LYS  85  -7.074  11.563  -6.602
  685    HE2  LYS  85           HE2      LYS  85  -8.413  11.387  -3.905
  686    HE3  LYS  85           HE1      LYS  85  -8.624  12.713  -5.049
  687    HZ1  LYS  85           HZ1      LYS  85  -9.539  11.171  -6.639
  688    HZ2  LYS  85           HZ2      LYS  85 -10.441  11.050  -5.228
  689    HZ3  LYS  85           HZ3      LYS  85  -9.294   9.872  -5.632
  690    H    ASP  86           HN       ASP  86  -5.396   7.039  -8.282
  691    HA   ASP  86           HA       ASP  86  -7.993   6.358  -8.356
  692    HB2  ASP  86           HB2      ASP  86  -5.702   4.785  -9.485
  693    HB3  ASP  86           HB1      ASP  86  -7.376   4.616  -9.972
  694    H    LEU  87           HN       LEU  87  -5.189   4.474  -7.399
  695    HA   LEU  87           HA       LEU  87  -6.648   2.073  -6.815
  696    HB2  LEU  87           HB2      LEU  87  -4.335   2.259  -7.838
  697    HB3  LEU  87           HB1      LEU  87  -3.779   2.719  -6.236
  698    HG   LEU  87           HG       LEU  87  -4.413   0.571  -5.387
  699   HD11  LEU  87          HD11      LEU  87  -6.261   0.042  -6.924
  700   HD12  LEU  87          HD12      LEU  87  -5.036  -1.227  -7.004
  701   HD13  LEU  87          HD13      LEU  87  -5.130  -0.004  -8.273
  702   HD21  LEU  87          HD21      LEU  87  -2.186   0.960  -6.203
  703   HD22  LEU  87          HD22      LEU  87  -2.686   0.538  -7.838
  704   HD23  LEU  87          HD23      LEU  87  -2.672  -0.698  -6.572
  705    H    TRP  88           HN       TRP  88  -5.592   4.849  -5.172
  706    HA   TRP  88           HA       TRP  88  -5.578   3.834  -2.511
  707    HB2  TRP  88           HB2      TRP  88  -4.439   5.876  -3.059
  708    HB3  TRP  88           HB1      TRP  88  -5.909   6.580  -3.694
  709    HD1  TRP  88           HD1      TRP  88  -4.693   5.250  -0.264
  710    HE1  TRP  88           HE1      TRP  88  -5.607   6.818   1.554
  711    HE3  TRP  88           HE3      TRP  88  -7.435   8.376  -3.199
  712    HZ2  TRP  88           HZ2      TRP  88  -7.279   9.071   1.729
  713    HZ3  TRP  88           HZ3      TRP  88  -8.659  10.217  -2.139
  714    HH2  TRP  88           HH2      TRP  88  -8.585  10.559   0.280
  715    H    GLU  89           HN       GLU  89  -7.882   5.471  -4.584
  716    HA   GLU  89           HA       GLU  89 -10.169   5.492  -2.946
  717    HB2  GLU  89           HB3      GLU  89  -9.789   5.374  -5.929
  718    HB3  GLU  89           HB2      GLU  89 -11.363   5.553  -5.185
  719    HG2  GLU  89           HG3      GLU  89  -9.122   7.474  -4.667
  720    HG3  GLU  89           HG2      GLU  89 -10.201   7.647  -6.044
  721    H    ARG  90           HN       ARG  90  -8.550   2.964  -4.516
  722    HA   ARG  90           HA       ARG  90 -10.827   1.130  -4.489
  723    HB2  ARG  90           HB2      ARG  90  -7.956   0.641  -5.328
  724    HB3  ARG  90           HB1      ARG  90  -9.292  -0.476  -5.540
  725    HG2  ARG  90           HG2      ARG  90  -9.033   2.220  -6.886
  726    HG3  ARG  90           HG1      ARG  90  -8.614   0.677  -7.619
  727    HD2  ARG  90           HD2      ARG  90 -10.790   1.444  -8.369
  728    HD3  ARG  90           HD1      ARG  90 -10.947  -0.037  -7.421
  729    HE   ARG  90           HE       ARG  90 -11.283   2.478  -6.028
  730   HH11  ARG  90          HH11      ARG  90 -12.969  -0.118  -7.705
  731   HH12  ARG  90          HH12      ARG  90 -14.356  -0.026  -6.723
  732   HH21  ARG  90          HH21      ARG  90 -13.135   2.556  -4.635
  733   HH22  ARG  90          HH22      ARG  90 -14.478   1.533  -4.970
  734    H    GLY  91           HN       GLY  91  -7.811   1.806  -2.924
  735    HA2  GLY  91           HA3      GLY  91  -7.560  -0.600  -1.467
  736    HA3  GLY  91           HA2      GLY  91  -6.662   0.878  -1.226
  737    H    GLN  92           HN       GLN  92  -8.589   2.652  -0.481
  738    HA   GLN  92           HA       GLN  92  -9.088   1.561   2.146
  739    HB2  GLN  92           HB2      GLN  92  -9.697   3.828   2.824
  740    HB3  GLN  92           HB1      GLN  92  -8.116   3.783   2.061
  741    HG2  GLN  92           HG2      GLN  92  -8.985   4.757   0.064
  742    HG3  GLN  92           HG1      GLN  92 -10.641   4.588   0.638
  743   HE21  GLN  92          HE21      GLN  92  -8.070   5.598   2.780
  744   HE22  GLN  92          HE22      GLN  92  -8.606   7.230   2.923
  745    H    ARG  93           HN       ARG  93 -11.087   1.842   3.196
  746    HA   ARG  93           HA       ARG  93 -13.339   1.680   1.340
  747    HB2  ARG  93           HB2      ARG  93 -14.407   0.138   2.857
  748    HB3  ARG  93           HB1      ARG  93 -12.825  -0.490   2.418
  749    HG2  ARG  93           HG2      ARG  93 -11.920   0.257   4.524
  750    HG3  ARG  93           HG1      ARG  93 -13.481   0.957   4.960
  751    HD2  ARG  93           HD2      ARG  93 -12.888  -1.913   4.425
  752    HD3  ARG  93           HD1      ARG  93 -13.126  -1.130   6.008
  753    HE   ARG  93           HE       ARG  93 -15.371  -0.727   4.337
  754   HH11  ARG  93          HH11      ARG  93 -13.807  -3.300   6.195
  755   HH12  ARG  93          HH12      ARG  93 -15.259  -4.089   6.588
  756   HH21  ARG  93          HH21      ARG  93 -17.400  -1.843   4.900
  757   HH22  ARG  93          HH22      ARG  93 -17.310  -3.227   5.876
  758    H    GLU  94           HN       GLU  94 -15.084   2.929   1.924
  759    HA   GLU  94           HA       GLU  94 -14.616   4.511   4.319
  760    HB2  GLU  94           HB3      GLU  94 -16.364   5.187   1.949
  761    HB3  GLU  94           HB2      GLU  94 -16.181   6.197   3.374
  762    HG2  GLU  94           HG3      GLU  94 -13.782   6.400   2.882
  763    HG3  GLU  94           HG2      GLU  94 -14.023   5.464   1.412
  764    H    ASP  95           HN       ASP  95 -16.142   1.847   3.713
  765    HA   ASP  95           HA       ASP  95 -17.826   0.662   4.591
  766    HB2  ASP  95           HB2      ASP  95 -17.774   2.959   6.456
  767    HB3  ASP  95           HB1      ASP  95 -19.146   1.850   6.573
  768    H    LEU  96           HN       LEU  96 -18.112   2.789   2.595
  769    HA   LEU  96           HA       LEU  96 -20.986   3.253   2.551
  770    HB2  LEU  96           HB2      LEU  96 -19.551   5.148   2.063
  771    HB3  LEU  96           HB1      LEU  96 -18.692   4.232   0.849
  772    HG   LEU  96           HG       LEU  96 -20.762   4.177  -0.528
  773   HD11  LEU  96          HD11      LEU  96 -21.842   6.071   1.542
  774   HD12  LEU  96          HD12      LEU  96 -22.384   4.420   1.259
  775   HD13  LEU  96          HD13      LEU  96 -22.608   5.647   0.011
  776   HD21  LEU  96          HD21      LEU  96 -20.647   6.504  -1.233
  777   HD22  LEU  96          HD22      LEU  96 -19.037   5.861  -0.892
  778   HD23  LEU  96          HD23      LEU  96 -19.828   6.925   0.270
  779    H    VAL  97           HN       VAL  97 -22.242   2.018   1.267
  780    HA   VAL  97           HA       VAL  97 -21.005  -0.132  -0.143
  781    HB   VAL  97           HB       VAL  97 -23.931   0.638  -0.018
  782   HG11  VAL  97          HG11      VAL  97 -22.617  -1.919  -0.959
  783   HG12  VAL  97          HG12      VAL  97 -23.436  -0.736  -1.976
  784   HG13  VAL  97          HG13      VAL  97 -24.357  -1.673  -0.793
  785   HG21  VAL  97          HG21      VAL  97 -23.040   0.071   2.187
  786   HG22  VAL  97          HG22      VAL  97 -22.389  -1.436   1.547
  787   HG23  VAL  97          HG23      VAL  97 -24.135  -1.193   1.618
  788    H    ARG  98           HN       ARG  98 -20.017   0.386  -1.828
  789    HA   ARG  98           HA       ARG  98 -21.451   1.582  -4.080
  790    HB2  ARG  98           HB2      ARG  98 -19.880   3.296  -3.060
  791    HB3  ARG  98           HB1      ARG  98 -18.555   2.180  -3.360
  792    HG2  ARG  98           HG2      ARG  98 -18.548   3.812  -5.104
  793    HG3  ARG  98           HG1      ARG  98 -19.122   2.294  -5.797
  794    HD2  ARG  98           HD2      ARG  98 -20.479   4.154  -6.571
  795    HD3  ARG  98           HD1      ARG  98 -21.435   3.071  -5.558
  796    HE   ARG  98           HE       ARG  98 -20.201   5.306  -4.215
  797   HH11  ARG  98          HH11      ARG  98 -23.154   4.088  -5.758
  798   HH12  ARG  98          HH12      ARG  98 -24.186   5.201  -5.005
  799   HH21  ARG  98          HH21      ARG  98 -21.641   6.838  -3.156
  800   HH22  ARG  98          HH22      ARG  98 -23.296   6.820  -3.497
  801    H    ASP  99           HN       ASP  99 -18.332   0.286  -3.106
  802    HA   ASP  99           HA       ASP  99 -18.466  -1.730  -5.204
  803    HB2  ASP  99           HB2      ASP  99 -16.224  -0.894  -3.351
  804    HB3  ASP  99           HB1      ASP  99 -16.105  -2.179  -4.542
  805    H    THR 100           HN       THR 100 -17.807  -3.894  -4.510
  806    HA   THR 100           HA       THR 100 -18.123  -4.512  -1.705
  807    HB   THR 100           HB       THR 100 -19.777  -5.925  -3.838
  808    HG1  THR 100           HG1      THR 100 -20.195  -3.639  -2.394
  809   HG21  THR 100          HG21      THR 100 -19.924  -6.003  -0.810
  810   HG22  THR 100          HG22      THR 100 -19.208  -7.254  -1.818
  811   HG23  THR 100          HG23      THR 100 -20.938  -6.922  -1.923
  812    H    VAL 101           HN       VAL 101 -15.895  -4.965  -1.889
  813    HA   VAL 101           HA       VAL 101 -15.274  -7.370  -3.403
  814    HB   VAL 101           HB       VAL 101 -13.012  -6.369  -4.038
  815   HG11  VAL 101          HG11      VAL 101 -14.758  -6.739  -5.686
  816   HG12  VAL 101          HG12      VAL 101 -13.888  -5.243  -6.033
  817   HG13  VAL 101          HG13      VAL 101 -15.484  -5.181  -5.288
  818   HG21  VAL 101          HG21      VAL 101 -12.896  -3.916  -4.250
  819   HG22  VAL 101          HG22      VAL 101 -13.049  -4.412  -2.563
  820   HG23  VAL 101          HG23      VAL 101 -14.448  -3.778  -3.423
  821    H    GLU 102           HN       GLU 102 -14.665  -8.821  -2.035
  822    HA   GLU 102           HA       GLU 102 -12.855  -8.048   0.123
  823    HB2  GLU 102           HB3      GLU 102 -14.607 -10.505  -0.227
  824    HB3  GLU 102           HB2      GLU 102 -13.346 -10.414   0.987
  825    HG2  GLU 102           HG3      GLU 102 -15.425 -10.002   2.055
  826    HG3  GLU 102           HG2      GLU 102 -14.558  -8.476   1.991
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1 -16.110 -12.454  24.262
    2    H2   GLY   1           HT2      GLY   1 -16.706 -13.107  22.811
    3    H3   GLY   1           HT3      GLY   1 -15.521 -11.920  22.777
    4    HA2  GLY   1           HA2      GLY   1 -15.158 -14.609  23.914
    5    HA3  GLY   1           HA3      GLY   1 -14.567 -14.074  22.344
    6    H    HIS   2           HN       HIS   2 -12.455 -13.699  22.456
    7    HA   HIS   2           HA       HIS   2 -11.453 -12.094  24.698
    8    HB2  HIS   2           HB2      HIS   2 -10.189 -14.636  23.660
    9    HB3  HIS   2           HB1      HIS   2  -9.375 -13.498  24.727
   10    HD1  HIS   2           HD1      HIS   2 -11.473 -16.449  24.802
   11    HD2  HIS   2           HD2      HIS   2 -10.797 -13.178  27.259
   12    HE1  HIS   2           HE1      HIS   2 -12.415 -17.063  27.049
   13    H    MET   3           HN       MET   3 -12.042 -11.951  21.658
   14    HA   MET   3           HA       MET   3 -11.359 -10.778  19.886
   15    HB2  MET   3           HB2      MET   3 -10.629  -8.982  21.383
   16    HB3  MET   3           HB1      MET   3  -9.097  -9.791  21.660
   17    HG2  MET   3           HG2      MET   3  -8.556  -9.494  19.258
   18    HG3  MET   3           HG1      MET   3 -10.061  -8.603  19.061
   19    HE1  MET   3           HE1      MET   3  -8.778  -6.521  18.023
   20    HE2  MET   3           HE2      MET   3  -7.268  -7.421  18.154
   21    HE3  MET   3           HE3      MET   3  -7.368  -5.775  18.770
   22    H    LEU   4           HN       LEU   4  -8.478 -12.079  21.445
   23    HA   LEU   4           HA       LEU   4  -6.818 -13.468  20.798
   24    HB2  LEU   4           HB2      LEU   4  -8.694 -14.224  18.554
   25    HB3  LEU   4           HB1      LEU   4  -7.209 -15.073  18.940
   26    HG   LEU   4           HG       LEU   4  -9.661 -14.884  20.697
   27   HD11  LEU   4          HD11      LEU   4  -9.872 -17.268  20.268
   28   HD12  LEU   4          HD12      LEU   4  -8.476 -17.206  19.194
   29   HD13  LEU   4          HD13      LEU   4  -9.955 -16.342  18.770
   30   HD21  LEU   4          HD21      LEU   4  -7.649 -14.945  22.055
   31   HD22  LEU   4          HD22      LEU   4  -7.034 -16.305  21.122
   32   HD23  LEU   4          HD23      LEU   4  -8.462 -16.509  22.131
   33    H    ARG   5           HN       ARG   5  -7.142 -10.767  19.802
   34    HA   ARG   5           HA       ARG   5  -6.161  -9.218  18.473
   35    HB2  ARG   5           HB2      ARG   5  -4.207 -11.462  17.974
   36    HB3  ARG   5           HB1      ARG   5  -3.973  -9.821  17.403
   37    HG2  ARG   5           HG2      ARG   5  -3.854  -9.002  19.658
   38    HG3  ARG   5           HG1      ARG   5  -4.265 -10.600  20.290
   39    HD2  ARG   5           HD2      ARG   5  -1.836  -9.995  18.617
   40    HD3  ARG   5           HD1      ARG   5  -1.832 -10.099  20.381
   41    HE   ARG   5           HE       ARG   5  -2.825 -12.429  19.865
   42   HH11  ARG   5          HH11      ARG   5  -0.270 -10.868  17.977
   43   HH12  ARG   5          HH12      ARG   5   0.543 -12.314  17.608
   44   HH21  ARG   5          HH21      ARG   5  -1.672 -14.449  19.358
   45   HH22  ARG   5          HH22      ARG   5  -0.276 -14.358  18.387
   46    H    THR   6           HN       THR   6  -5.358  -8.815  16.138
   47    HA   THR   6           HA       THR   6  -7.235 -10.072  14.361
   48    HB   THR   6           HB       THR   6  -5.178  -7.912  13.812
   49    HG1  THR   6           HG1      THR   6  -7.670  -7.908  15.075
   50   HG21  THR   6          HG21      THR   6  -7.754  -8.649  12.391
   51   HG22  THR   6          HG22      THR   6  -6.132  -9.005  11.802
   52   HG23  THR   6          HG23      THR   6  -6.672  -7.332  11.943
   53    H    ALA   7           HN       ALA   7  -6.546 -12.060  13.790
   54    HA   ALA   7           HA       ALA   7  -3.709 -12.451  13.148
   55    HB1  ALA   7           HB1      ALA   7  -4.564 -13.846  14.964
   56    HB2  ALA   7           HB2      ALA   7  -4.093 -14.826  13.575
   57    HB3  ALA   7           HB3      ALA   7  -5.797 -14.501  13.888
   58    H    GLY   8           HN       GLY   8  -3.510 -14.420  11.513
   59    HA2  GLY   8           HA3      GLY   8  -4.278 -15.490   9.567
   60    HA3  GLY   8           HA2      GLY   8  -5.585 -14.319   9.459
   61    H    ARG   9           HN       ARG   9  -3.323 -12.321  10.071
   62    HA   ARG   9           HA       ARG   9  -2.148 -10.755   8.928
   63    HB2  ARG   9           HB2      ARG   9  -0.599 -12.635   8.560
   64    HB3  ARG   9           HB1      ARG   9  -1.469 -13.041   7.090
   65    HG2  ARG   9           HG2      ARG   9  -0.917 -10.622   6.385
   66    HG3  ARG   9           HG1      ARG   9   0.305 -10.720   7.656
   67    HD2  ARG   9           HD2      ARG   9  -0.063 -12.597   5.384
   68    HD3  ARG   9           HD1      ARG   9   1.184 -11.359   5.483
   69    HE   ARG   9           HE       ARG   9   2.101 -12.587   7.406
   70   HH11  ARG   9          HH11      ARG   9  -0.141 -14.428   5.347
   71   HH12  ARG   9          HH12      ARG   9   0.635 -15.906   5.578
   72   HH21  ARG   9          HH21      ARG   9   3.147 -14.642   7.746
   73   HH22  ARG   9          HH22      ARG   9   2.525 -16.053   7.033
   74    H    ASP  10           HN       ASP  10  -3.829  -9.528   8.309
   75    HA   ASP  10           HA       ASP  10  -5.336 -10.226   5.958
   76    HB2  ASP  10           HB2      ASP  10  -6.520  -9.285   7.876
   77    HB3  ASP  10           HB1      ASP  10  -5.537  -7.839   7.806
   78    H    GLY  11           HN       GLY  11  -2.683  -8.174   6.607
   79    HA2  GLY  11           HA3      GLY  11  -3.175  -6.657   4.153
   80    HA3  GLY  11           HA2      GLY  11  -2.026  -6.234   5.404
   81    H    LEU  12           HN       LEU  12  -2.520  -9.114   3.357
   82    HA   LEU  12           HA       LEU  12   0.059  -8.509   2.134
   83    HB2  LEU  12           HB2      LEU  12   0.601 -10.124   3.872
   84    HB3  LEU  12           HB1      LEU  12  -0.581 -11.249   3.243
   85    HG   LEU  12           HG       LEU  12   0.747 -11.377   1.130
   86   HD11  LEU  12          HD11      LEU  12   2.781  -9.808   2.696
   87   HD12  LEU  12          HD12      LEU  12   1.914  -9.274   1.254
   88   HD13  LEU  12          HD13      LEU  12   3.058 -10.610   1.151
   89   HD21  LEU  12          HD21      LEU  12   2.219 -12.147   3.648
   90   HD22  LEU  12          HD22      LEU  12   2.495 -12.816   2.038
   91   HD23  LEU  12          HD23      LEU  12   0.957 -13.089   2.856
   92    H    CYS  13           HN       CYS  13  -2.545 -10.948   1.999
   93    HA   CYS  13           HA       CYS  13  -2.277 -11.603  -0.678
   94    HB2  CYS  13           HB2      CYS  13  -3.554 -12.911   0.929
   95    HB3  CYS  13           HB1      CYS  13  -4.731 -11.626   1.089
   96    HG   CYS  13           HG       CYS  13  -6.303 -12.529  -0.707
   97    H    ARG  14           HN       ARG  14  -4.203  -9.070   0.804
   98    HA   ARG  14           HA       ARG  14  -5.355  -8.086  -1.635
   99    HB2  ARG  14           HB2      ARG  14  -6.336  -7.740   0.614
  100    HB3  ARG  14           HB1      ARG  14  -4.970  -6.719   1.033
  101    HG2  ARG  14           HG2      ARG  14  -5.660  -5.206  -0.833
  102    HG3  ARG  14           HG1      ARG  14  -7.117  -6.187  -1.001
  103    HD2  ARG  14           HD2      ARG  14  -6.231  -4.681   1.453
  104    HD3  ARG  14           HD1      ARG  14  -7.556  -4.241   0.386
  105    HE   ARG  14           HE       ARG  14  -8.703  -6.236   1.109
  106   HH11  ARG  14          HH11      ARG  14  -6.052  -5.047   3.199
  107   HH12  ARG  14          HH12      ARG  14  -6.620  -5.947   4.553
  108   HH21  ARG  14          HH21      ARG  14  -9.400  -7.394   3.099
  109   HH22  ARG  14          HH22      ARG  14  -8.445  -7.239   4.509
  110    H    LEU  15           HN       LEU  15  -2.474  -7.484   0.215
  111    HA   LEU  15           HA       LEU  15  -1.842  -4.926  -0.760
  112    HB2  LEU  15           HB2      LEU  15  -1.072  -5.813   1.381
  113    HB3  LEU  15           HB1      LEU  15  -0.163  -7.050   0.549
  114    HG   LEU  15           HG       LEU  15   1.348  -5.357  -0.363
  115   HD11  LEU  15          HD11      LEU  15  -0.280  -3.439   1.270
  116   HD12  LEU  15          HD12      LEU  15  -0.240  -3.502  -0.495
  117   HD13  LEU  15          HD13      LEU  15   1.208  -3.057   0.411
  118   HD21  LEU  15          HD21      LEU  15   0.933  -5.150   2.609
  119   HD22  LEU  15          HD22      LEU  15   2.401  -4.709   1.736
  120   HD23  LEU  15          HD23      LEU  15   1.868  -6.390   1.773
  121    H    SER  16           HN       SER  16  -0.816  -8.227  -1.632
  122    HA   SER  16           HA       SER  16   1.091  -7.477  -3.517
  123    HB2  SER  16           HB2      SER  16   0.664  -9.853  -4.356
  124    HB3  SER  16           HB1      SER  16   1.143  -9.690  -2.664
  125    HG   SER  16           HG       SER  16  -0.848 -11.011  -3.419
  126    H    THR  17           HN       THR  17  -2.334  -8.270  -3.841
  127    HA   THR  17           HA       THR  17  -2.618  -8.165  -6.580
  128    HB   THR  17           HB       THR  17  -4.648  -7.291  -4.510
  129    HG1  THR  17           HG1      THR  17  -3.496  -9.661  -5.185
  130   HG21  THR  17          HG21      THR  17  -6.308  -8.023  -6.162
  131   HG22  THR  17          HG22      THR  17  -5.023  -8.448  -7.287
  132   HG23  THR  17          HG23      THR  17  -5.292  -6.758  -6.854
  133    H    TYR  18           HN       TYR  18  -2.886  -5.491  -4.254
  134    HA   TYR  18           HA       TYR  18  -3.506  -3.554  -6.230
  135    HB2  TYR  18           HB2      TYR  18  -2.733  -3.375  -3.350
  136    HB3  TYR  18           HB1      TYR  18  -2.812  -1.922  -4.336
  137    HD1  TYR  18           HD2      TYR  18  -4.780  -4.637  -2.836
  138    HD2  TYR  18           HD1      TYR  18  -4.878  -1.071  -5.094
  139    HE1  TYR  18           HE2      TYR  18  -7.203  -4.483  -2.462
  140    HE2  TYR  18           HE1      TYR  18  -7.299  -0.890  -4.747
  141    HH   TYR  18           HH       TYR  18  -8.954  -2.758  -2.453
  142    H    LEU  19           HN       LEU  19  -0.479  -4.524  -4.724
  143    HA   LEU  19           HA       LEU  19   0.976  -2.386  -5.885
  144    HB2  LEU  19           HB2      LEU  19   1.859  -4.943  -4.585
  145    HB3  LEU  19           HB1      LEU  19   2.998  -3.779  -5.235
  146    HG   LEU  19           HG       LEU  19   0.984  -3.097  -3.071
  147   HD11  LEU  19          HD11      LEU  19   3.895  -3.831  -2.825
  148   HD12  LEU  19          HD12      LEU  19   2.510  -4.771  -2.248
  149   HD13  LEU  19          HD13      LEU  19   2.861  -3.205  -1.537
  150   HD21  LEU  19          HD21      LEU  19   1.797  -1.201  -4.426
  151   HD22  LEU  19          HD22      LEU  19   3.455  -1.662  -4.051
  152   HD23  LEU  19          HD23      LEU  19   2.375  -1.131  -2.767
  153    H    GLU  20           HN       GLU  20   0.096  -5.524  -7.053
  154    HA   GLU  20           HA       GLU  20   1.975  -5.662  -9.192
  155    HB2  GLU  20           HB3      GLU  20  -0.785  -6.827  -8.997
  156    HB3  GLU  20           HB2      GLU  20   0.376  -7.210 -10.254
  157    HG2  GLU  20           HG3      GLU  20   1.867  -8.144  -8.560
  158    HG3  GLU  20           HG2      GLU  20   0.657  -7.778  -7.322
  159    H    GLU  21           HN       GLU  21  -0.832  -3.799  -8.690
  160    HA   GLU  21           HA       GLU  21  -1.476  -3.365 -11.455
  161    HB2  GLU  21           HB3      GLU  21  -2.373  -1.943  -8.951
  162    HB3  GLU  21           HB2      GLU  21  -3.083  -1.721 -10.546
  163    HG2  GLU  21           HG3      GLU  21  -3.050  -4.317  -9.018
  164    HG3  GLU  21           HG2      GLU  21  -4.393  -3.177  -9.032
  165    H    LEU  22           HN       LEU  22   1.038  -2.381  -9.601
  166    HA   LEU  22           HA       LEU  22   1.273   0.232 -10.905
  167    HB2  LEU  22           HB2      LEU  22   2.779  -0.932  -8.563
  168    HB3  LEU  22           HB1      LEU  22   3.087   0.636  -9.267
  169    HG   LEU  22           HG       LEU  22   0.582  -0.193  -7.799
  170   HD11  LEU  22          HD11      LEU  22   2.858   1.637  -7.059
  171   HD12  LEU  22          HD12      LEU  22   2.486   0.074  -6.327
  172   HD13  LEU  22          HD13      LEU  22   1.374   1.429  -6.134
  173   HD21  LEU  22          HD21      LEU  22   0.106   1.436  -9.566
  174   HD22  LEU  22          HD22      LEU  22   1.376   2.489  -8.940
  175   HD23  LEU  22          HD23      LEU  22  -0.059   2.157  -7.967
  176    H    GLU  23           HN       GLU  23   2.888   0.477 -12.382
  177    HA   GLU  23           HA       GLU  23   4.430  -1.872 -13.012
  178    HB2  GLU  23           HB3      GLU  23   5.224  -0.685 -14.977
  179    HB3  GLU  23           HB2      GLU  23   3.495  -0.451 -14.774
  180    HG2  GLU  23           HG3      GLU  23   3.750   1.744 -14.097
  181    HG3  GLU  23           HG2      GLU  23   5.504   1.565 -13.923
  182    H    ALA  24           HN       ALA  24   6.907  -1.211 -13.684
  183    HA   ALA  24           HA       ALA  24   8.151  -1.227 -11.195
  184    HB1  ALA  24           HB1      ALA  24  10.247  -1.217 -12.360
  185    HB2  ALA  24           HB2      ALA  24   9.470  -0.612 -13.817
  186    HB3  ALA  24           HB3      ALA  24   9.097  -2.235 -13.226
  187    H    VAL  25           HN       VAL  25   7.785   1.489 -13.431
  188    HA   VAL  25           HA       VAL  25   9.358   3.203 -11.792
  189    HB   VAL  25           HB       VAL  25   9.071   3.718 -14.188
  190   HG11  VAL  25          HG11      VAL  25   7.012   4.717 -15.014
  191   HG12  VAL  25          HG12      VAL  25   6.252   4.409 -13.452
  192   HG13  VAL  25          HG13      VAL  25   6.746   3.055 -14.476
  193   HG21  VAL  25          HG21      VAL  25   8.729   6.091 -14.002
  194   HG22  VAL  25          HG22      VAL  25   9.648   5.502 -12.598
  195   HG23  VAL  25          HG23      VAL  25   7.912   5.841 -12.462
  196    H    GLU  26           HN       GLU  26   5.991   2.389 -11.850
  197    HA   GLU  26           HA       GLU  26   5.171   4.556 -10.185
  198    HB2  GLU  26           HB3      GLU  26   3.834   1.911 -10.750
  199    HB3  GLU  26           HB2      GLU  26   3.072   3.305  -9.989
  200    HG2  GLU  26           HG3      GLU  26   4.240   3.272 -12.742
  201    HG3  GLU  26           HG2      GLU  26   2.515   3.063 -12.413
  202    H    LEU  27           HN       LEU  27   6.058   1.201  -9.713
  203    HA   LEU  27           HA       LEU  27   5.811   1.093  -6.940
  204    HB2  LEU  27           HB2      LEU  27   7.765  -0.306  -8.772
  205    HB3  LEU  27           HB1      LEU  27   7.551  -0.696  -7.080
  206    HG   LEU  27           HG       LEU  27   5.370  -0.957  -9.157
  207   HD11  LEU  27          HD11      LEU  27   7.171  -3.058  -7.957
  208   HD12  LEU  27          HD12      LEU  27   7.203  -2.493  -9.630
  209   HD13  LEU  27          HD13      LEU  27   5.795  -3.355  -9.018
  210   HD21  LEU  27          HD21      LEU  27   5.597  -1.948  -6.314
  211   HD22  LEU  27          HD22      LEU  27   4.277  -2.304  -7.422
  212   HD23  LEU  27          HD23      LEU  27   4.546  -0.648  -6.874
  213    H    LYS  28           HN       LYS  28   8.499   1.993  -9.044
  214    HA   LYS  28           HA       LYS  28  10.544   2.571  -7.292
  215    HB2  LYS  28           HB2      LYS  28  10.762   2.619  -9.728
  216    HB3  LYS  28           HB1      LYS  28   9.750   4.043  -9.804
  217    HG2  LYS  28           HG2      LYS  28  11.483   5.342  -8.653
  218    HG3  LYS  28           HG1      LYS  28  12.493   3.896  -8.557
  219    HD2  LYS  28           HD2      LYS  28  12.538   3.751 -10.999
  220    HD3  LYS  28           HD1      LYS  28  11.512   5.176 -11.109
  221    HE2  LYS  28           HE2      LYS  28  14.260   5.110  -9.869
  222    HE3  LYS  28           HE1      LYS  28  13.927   5.635 -11.511
  223    HZ1  LYS  28           HZ1      LYS  28  12.970   6.938  -9.007
  224    HZ2  LYS  28           HZ2      LYS  28  12.507   7.400 -10.567
  225    HZ3  LYS  28           HZ3      LYS  28  14.102   7.539 -10.100
  226    H    LYS  29           HN       LYS  29   7.871   4.654  -8.237
  227    HA   LYS  29           HA       LYS  29   8.809   6.894  -6.767
  228    HB2  LYS  29           HB2      LYS  29   6.098   6.302  -7.893
  229    HB3  LYS  29           HB1      LYS  29   6.579   7.859  -7.233
  230    HG2  LYS  29           HG2      LYS  29   8.347   8.013  -9.012
  231    HG3  LYS  29           HG1      LYS  29   7.748   6.494  -9.650
  232    HD2  LYS  29           HD2      LYS  29   6.050   8.964  -9.362
  233    HD3  LYS  29           HD1      LYS  29   6.892   8.492 -10.842
  234    HE2  LYS  29           HE2      LYS  29   5.662   6.406 -10.892
  235    HE3  LYS  29           HE1      LYS  29   4.827   6.827  -9.397
  236    HZ1  LYS  29           HZ1      LYS  29   3.774   8.663 -10.563
  237    HZ2  LYS  29           HZ2      LYS  29   3.511   7.188 -11.361
  238    HZ3  LYS  29           HZ3      LYS  29   4.622   8.281 -11.976
  239    H    PHE  30           HN       PHE  30   6.758   4.179  -5.926
  240    HA   PHE  30           HA       PHE  30   5.834   5.517  -3.545
  241    HB2  PHE  30           HB2      PHE  30   4.150   3.995  -3.566
  242    HB3  PHE  30           HB1      PHE  30   4.819   3.393  -5.063
  243    HD1  PHE  30           HD2      PHE  30   6.168   1.385  -5.050
  244    HD2  PHE  30           HD1      PHE  30   4.280   2.719  -1.489
  245    HE1  PHE  30           HE2      PHE  30   6.472  -0.847  -4.043
  246    HE2  PHE  30           HE1      PHE  30   4.562   0.530  -0.501
  247    HZ   PHE  30           HZ       PHE  30   5.664  -1.275  -1.760
  248    H    LYS  31           HN       LYS  31   8.203   3.083  -4.353
  249    HA   LYS  31           HA       LYS  31   8.968   2.580  -1.636
  250    HB2  LYS  31           HB2      LYS  31  10.947   1.412  -2.627
  251    HB3  LYS  31           HB1      LYS  31   9.413   0.843  -3.252
  252    HG2  LYS  31           HG2      LYS  31   9.762   2.273  -5.251
  253    HG3  LYS  31           HG1      LYS  31  11.350   2.686  -4.616
  254    HD2  LYS  31           HD2      LYS  31  10.572  -0.177  -5.002
  255    HD3  LYS  31           HD1      LYS  31  11.127   0.769  -6.374
  256    HE2  LYS  31           HE2      LYS  31  12.684   0.460  -3.817
  257    HE3  LYS  31           HE1      LYS  31  12.888  -0.592  -5.217
  258    HZ1  LYS  31           HZ1      LYS  31  14.527   1.125  -5.248
  259    HZ2  LYS  31           HZ2      LYS  31  13.399   2.346  -5.119
  260    HZ3  LYS  31           HZ3      LYS  31  13.470   1.410  -6.522
  261    H    LEU  32           HN       LEU  32  10.012   4.967  -3.973
  262    HA   LEU  32           HA       LEU  32  12.200   5.691  -2.283
  263    HB2  LEU  32           HB2      LEU  32  12.539   7.615  -3.715
  264    HB3  LEU  32           HB1      LEU  32  12.331   6.184  -4.684
  265    HG   LEU  32           HG       LEU  32   9.875   7.037  -4.955
  266   HD11  LEU  32          HD11      LEU  32   9.657   9.458  -4.945
  267   HD12  LEU  32          HD12      LEU  32  11.244   9.605  -4.195
  268   HD13  LEU  32          HD13      LEU  32   9.924   8.812  -3.327
  269   HD21  LEU  32          HD21      LEU  32  11.465   6.866  -6.757
  270   HD22  LEU  32          HD22      LEU  32  12.210   8.385  -6.260
  271   HD23  LEU  32          HD23      LEU  32  10.561   8.378  -6.893
  272    H    TYR  33           HN       TYR  33   8.875   6.343  -2.368
  273    HA   TYR  33           HA       TYR  33   8.981   8.794  -0.955
  274    HB2  TYR  33           HB2      TYR  33   7.051   8.148  -2.356
  275    HB3  TYR  33           HB1      TYR  33   6.691   6.838  -1.243
  276    HD1  TYR  33           HD1      TYR  33   6.784  10.492  -1.623
  277    HD2  TYR  33           HD2      TYR  33   5.484   7.247   0.799
  278    HE1  TYR  33           HE1      TYR  33   5.380  12.020  -0.332
  279    HE2  TYR  33           HE2      TYR  33   4.070   8.772   2.101
  280    HH   TYR  33           HH       TYR  33   3.998  11.202   2.618
  281    H    LEU  34           HN       LEU  34   7.709   5.637   0.084
  282    HA   LEU  34           HA       LEU  34   7.911   6.401   2.845
  283    HB2  LEU  34           HB2      LEU  34   7.016   4.120   3.277
  284    HB3  LEU  34           HB1      LEU  34   6.024   5.146   2.274
  285    HG   LEU  34           HG       LEU  34   6.927   3.863   0.271
  286   HD11  LEU  34          HD11      LEU  34   8.870   2.815   1.294
  287   HD12  LEU  34          HD12      LEU  34   7.756   1.604   0.658
  288   HD13  LEU  34          HD13      LEU  34   7.822   1.917   2.392
  289   HD21  LEU  34          HD21      LEU  34   5.318   2.367   2.309
  290   HD22  LEU  34          HD22      LEU  34   5.349   2.072   0.568
  291   HD23  LEU  34          HD23      LEU  34   4.702   3.591   1.200
  292    H    GLY  35           HN       GLY  35  10.076   4.957   0.707
  293    HA2  GLY  35           HA3      GLY  35  11.322   3.471   2.797
  294    HA3  GLY  35           HA2      GLY  35  11.877   3.530   1.125
  295    H    THR  36           HN       THR  36  12.015   6.430   0.981
  296    HA   THR  36           HA       THR  36  14.576   6.657   2.366
  297    HB   THR  36           HB       THR  36  14.973   8.721   1.113
  298    HG1  THR  36           HG1      THR  36  12.527   8.508  -0.269
  299   HG21  THR  36          HG21      THR  36  15.409   6.625  -0.092
  300   HG22  THR  36          HG22      THR  36  14.825   7.865  -1.206
  301   HG23  THR  36          HG23      THR  36  13.740   6.599  -0.657
  302    H    ALA  37           HN       ALA  37  11.393   7.554   2.847
  303    HA   ALA  37           HA       ALA  37  11.561  10.063   4.049
  304    HB1  ALA  37           HB1      ALA  37   9.351   9.681   4.844
  305    HB2  ALA  37           HB2      ALA  37   9.509   7.944   4.581
  306    HB3  ALA  37           HB3      ALA  37   9.487   9.040   3.204
  307    H    THR  38           HN       THR  38  11.940  10.771   6.014
  308    HA   THR  38           HA       THR  38  12.978   8.911   7.949
  309    HB   THR  38           HB       THR  38  13.392  11.177   9.160
  310    HG1  THR  38           HG1      THR  38  13.467  12.232   6.582
  311   HG21  THR  38          HG21      THR  38  15.168   9.776   8.229
  312   HG22  THR  38          HG22      THR  38  15.485  11.473   7.867
  313   HG23  THR  38          HG23      THR  38  14.835  10.405   6.619
  314    H    GLU  39           HN       GLU  39   9.991  10.155   7.243
  315    HA   GLU  39           HA       GLU  39   9.040  10.788   9.853
  316    HB2  GLU  39           HB3      GLU  39   6.797  10.760   8.869
  317    HB3  GLU  39           HB2      GLU  39   7.934  11.680   7.893
  318    HG2  GLU  39           HG3      GLU  39   8.106   9.852   6.322
  319    HG3  GLU  39           HG2      GLU  39   7.030   8.870   7.314
  320    H    LEU  40           HN       LEU  40   9.883   7.890   8.561
  321    HA   LEU  40           HA       LEU  40   7.963   6.278  10.050
  322    HB2  LEU  40           HB2      LEU  40  10.385   5.524   8.447
  323    HB3  LEU  40           HB1      LEU  40   9.354   4.395   9.290
  324    HG   LEU  40           HG       LEU  40   8.768   4.268   7.037
  325   HD11  LEU  40          HD11      LEU  40   6.713   6.033   8.324
  326   HD12  LEU  40          HD12      LEU  40   6.802   4.270   8.384
  327   HD13  LEU  40          HD13      LEU  40   6.489   5.098   6.848
  328   HD21  LEU  40          HD21      LEU  40   8.163   6.188   5.615
  329   HD22  LEU  40          HD22      LEU  40   9.837   6.227   6.167
  330   HD23  LEU  40          HD23      LEU  40   8.636   7.269   6.927
  331    H    GLY  41           HN       GLY  41  10.623   7.977  10.641
  332    HA2  GLY  41           HA3      GLY  41  11.288   7.940  13.071
  333    HA3  GLY  41           HA2      GLY  41  11.613   6.234  12.783
  334    H    GLU  42           HN       GLU  42  12.835   5.987  10.629
  335    HA   GLU  42           HA       GLU  42  15.058   7.901  10.336
  336    HB2  GLU  42           HB3      GLU  42  15.438   4.911  10.682
  337    HB3  GLU  42           HB2      GLU  42  16.695   6.112  10.475
  338    HG2  GLU  42           HG3      GLU  42  16.282   6.995  12.661
  339    HG3  GLU  42           HG2      GLU  42  14.875   5.946  12.849
  340    H    GLY  43           HN       GLY  43  13.687   4.801   9.486
  341    HA2  GLY  43           HA3      GLY  43  12.905   5.021   6.958
  342    HA3  GLY  43           HA2      GLY  43  14.649   4.716   6.821
  343    H    LYS  44           HN       LYS  44  11.721   3.155   7.066
  344    HA   LYS  44           HA       LYS  44  12.444   1.254   9.035
  345    HB2  LYS  44           HB2      LYS  44  10.196   2.380   8.484
  346    HB3  LYS  44           HB1      LYS  44  10.109   1.201   7.198
  347    HG2  LYS  44           HG2      LYS  44   8.899   0.420   9.007
  348    HG3  LYS  44           HG1      LYS  44  10.374  -0.566   8.816
  349    HD2  LYS  44           HD2      LYS  44   9.931  -0.096  11.224
  350    HD3  LYS  44           HD1      LYS  44  11.425   0.674  10.697
  351    HE2  LYS  44           HE2      LYS  44  10.216   2.798  10.419
  352    HE3  LYS  44           HE1      LYS  44   8.728   2.010  10.938
  353    HZ1  LYS  44           HZ1      LYS  44   9.789   1.651  13.123
  354    HZ2  LYS  44           HZ2      LYS  44   9.739   3.280  12.696
  355    HZ3  LYS  44           HZ3      LYS  44  11.177   2.435  12.577
  356    H    ILE  45           HN       ILE  45  13.354   1.552   5.862
  357    HA   ILE  45           HA       ILE  45  13.110  -1.309   5.314
  358    HB   ILE  45           HB       ILE  45  13.635   1.003   3.411
  359   HG12  ILE  45          HG12      ILE  45  11.312   0.955   4.180
  360   HG13  ILE  45          HG11      ILE  45  11.410   0.505   2.484
  361   HG21  ILE  45          HG21      ILE  45  14.790  -1.032   2.702
  362   HG22  ILE  45          HG22      ILE  45  13.502  -0.578   1.598
  363   HG23  ILE  45          HG23      ILE  45  13.257  -1.908   2.729
  364   HD11  ILE  45          HD11      ILE  45   9.812  -0.888   3.636
  365   HD12  ILE  45          HD12      ILE  45  11.023  -1.356   4.823
  366   HD13  ILE  45          HD13      ILE  45  11.196  -1.866   3.140
  367    HA   PRO  46           HA       PRO  46  17.486  -1.478   5.982
  368    HB2  PRO  46           HB2      PRO  46  17.934  -3.943   4.918
  369    HB3  PRO  46           HB1      PRO  46  17.255  -3.691   6.525
  370    HG2  PRO  46           HG2      PRO  46  15.890  -4.384   3.975
  371    HG3  PRO  46           HG1      PRO  46  15.545  -4.951   5.619
  372    HD2  PRO  46           HD2      PRO  46  14.100  -3.025   4.334
  373    HD3  PRO  46           HD1      PRO  46  14.255  -3.124   6.097
  374    H    TRP  47           HN       TRP  47  18.441  -0.047   4.717
  375    HA   TRP  47           HA       TRP  47  19.520   0.949   3.147
  376    HB2  TRP  47           HB2      TRP  47  20.649  -1.819   2.963
  377    HB3  TRP  47           HB1      TRP  47  21.374  -0.352   2.293
  378    HD1  TRP  47           HD1      TRP  47  22.509   1.335   3.941
  379    HE1  TRP  47           HE1      TRP  47  23.141   1.234   6.431
  380    HE3  TRP  47           HE3      TRP  47  19.907  -2.848   5.263
  381    HZ2  TRP  47           HZ2      TRP  47  22.607  -0.414   8.657
  382    HZ3  TRP  47           HZ3      TRP  47  20.020  -3.614   7.595
  383    HH2  TRP  47           HH2      TRP  47  21.347  -2.414   9.251
  384    H    GLY  48           HN       GLY  48  18.997  -2.044   1.447
  385    HA2  GLY  48           HA3      GLY  48  17.851  -0.536  -0.793
  386    HA3  GLY  48           HA2      GLY  48  19.373  -1.353  -1.103
  387    H    SER  49           HN       SER  49  17.084  -2.752   1.080
  388    HA   SER  49           HA       SER  49  17.089  -5.171  -0.318
  389    HB2  SER  49           HB2      SER  49  16.748  -4.915   2.133
  390    HB3  SER  49           HB1      SER  49  15.140  -4.268   1.815
  391    HG   SER  49           HG       SER  49  16.072  -6.849   1.085
  392    H    MET  50           HN       MET  50  14.980  -2.389  -0.647
  393    HA   MET  50           HA       MET  50  12.879  -3.887  -1.974
  394    HB2  MET  50           HB2      MET  50  13.248  -0.909  -1.681
  395    HB3  MET  50           HB1      MET  50  11.902  -1.645  -2.520
  396    HG2  MET  50           HG2      MET  50  11.243  -2.746  -0.421
  397    HG3  MET  50           HG1      MET  50  12.549  -1.908   0.406
  398    HE1  MET  50           HE1      MET  50  12.623   0.863   0.632
  399    HE2  MET  50           HE2      MET  50  11.389   1.869  -0.117
  400    HE3  MET  50           HE3      MET  50  12.484   0.935  -1.123
  401    H    GLU  51           HN       GLU  51  15.845  -2.785  -2.942
  402    HA   GLU  51           HA       GLU  51  15.297  -1.671  -5.456
  403    HB2  GLU  51           HB3      GLU  51  17.694  -3.051  -4.364
  404    HB3  GLU  51           HB2      GLU  51  17.666  -2.357  -5.984
  405    HG2  GLU  51           HG3      GLU  51  17.213  -0.873  -3.399
  406    HG3  GLU  51           HG2      GLU  51  18.679  -0.825  -4.379
  407    H    LYS  52           HN       LYS  52  16.004  -5.008  -4.577
  408    HA   LYS  52           HA       LYS  52  15.524  -5.755  -7.372
  409    HB2  LYS  52           HB2      LYS  52  16.681  -7.393  -5.116
  410    HB3  LYS  52           HB1      LYS  52  16.577  -7.891  -6.794
  411    HG2  LYS  52           HG2      LYS  52  18.229  -5.621  -5.692
  412    HG3  LYS  52           HG1      LYS  52  18.831  -7.171  -6.262
  413    HD2  LYS  52           HD2      LYS  52  17.423  -5.094  -7.960
  414    HD3  LYS  52           HD1      LYS  52  19.158  -5.350  -7.909
  415    HE2  LYS  52           HE2      LYS  52  18.811  -7.654  -8.748
  416    HE3  LYS  52           HE1      LYS  52  17.080  -7.335  -8.836
  417    HZ1  LYS  52           HZ1      LYS  52  18.119  -7.065 -10.969
  418    HZ2  LYS  52           HZ2      LYS  52  19.183  -5.900 -10.370
  419    HZ3  LYS  52           HZ3      LYS  52  17.527  -5.587 -10.437
  420    H    ALA  53           HN       ALA  53  13.508  -5.057  -5.317
  421    HA   ALA  53           HA       ALA  53  12.090  -7.591  -5.049
  422    HB1  ALA  53           HB1      ALA  53  11.613  -4.920  -3.733
  423    HB2  ALA  53           HB2      ALA  53  12.445  -6.287  -3.005
  424    HB3  ALA  53           HB3      ALA  53  10.725  -6.406  -3.388
  425    H    GLY  54           HN       GLY  54  10.263  -7.937  -6.194
  426    HA2  GLY  54           HA3      GLY  54   9.283  -5.804  -7.916
  427    HA3  GLY  54           HA2      GLY  54   8.853  -7.510  -8.019
  428    HA   PRO  55           HA       PRO  55   5.441  -4.960  -5.997
  429    HB2  PRO  55           HB2      PRO  55   3.431  -6.458  -7.204
  430    HB3  PRO  55           HB1      PRO  55   4.046  -4.913  -7.790
  431    HG2  PRO  55           HG2      PRO  55   4.703  -7.676  -8.679
  432    HG3  PRO  55           HG1      PRO  55   4.565  -6.193  -9.637
  433    HD2  PRO  55           HD2      PRO  55   6.949  -7.269  -8.981
  434    HD3  PRO  55           HD1      PRO  55   6.740  -5.519  -9.109
  435    H    LEU  56           HN       LEU  56   5.692  -8.450  -6.466
  436    HA   LEU  56           HA       LEU  56   3.927  -9.127  -4.270
  437    HB2  LEU  56           HB2      LEU  56   5.997 -10.837  -5.664
  438    HB3  LEU  56           HB1      LEU  56   4.725 -11.409  -4.612
  439    HG   LEU  56           HG       LEU  56   4.301 -10.120  -7.312
  440   HD11  LEU  56          HD11      LEU  56   4.054 -12.997  -6.449
  441   HD12  LEU  56          HD12      LEU  56   5.298 -12.326  -7.502
  442   HD13  LEU  56          HD13      LEU  56   3.617 -12.350  -8.029
  443   HD21  LEU  56          HD21      LEU  56   2.343 -11.396  -5.401
  444   HD22  LEU  56          HD22      LEU  56   1.969 -10.841  -7.034
  445   HD23  LEU  56          HD23      LEU  56   2.444  -9.679  -5.797
  446    H    GLU  57           HN       GLU  57   7.345  -8.848  -4.765
  447    HA   GLU  57           HA       GLU  57   8.108  -9.816  -2.213
  448    HB2  GLU  57           HB3      GLU  57   9.587  -8.069  -4.160
  449    HB3  GLU  57           HB2      GLU  57  10.303  -8.890  -2.776
  450    HG2  GLU  57           HG3      GLU  57   9.773 -11.032  -3.743
  451    HG3  GLU  57           HG2      GLU  57   8.957 -10.244  -5.095
  452    H    MET  58           HN       MET  58   7.543  -6.600  -3.559
  453    HA   MET  58           HA       MET  58   8.335  -5.088  -1.334
  454    HB2  MET  58           HB2      MET  58   6.254  -4.528  -3.436
  455    HB3  MET  58           HB1      MET  58   6.726  -3.326  -2.248
  456    HG2  MET  58           HG2      MET  58   9.038  -3.441  -3.088
  457    HG3  MET  58           HG1      MET  58   8.538  -4.668  -4.247
  458    HE1  MET  58           HE1      MET  58   9.311  -1.637  -6.532
  459    HE2  MET  58           HE2      MET  58   9.538  -3.363  -6.271
  460    HE3  MET  58           HE3      MET  58  10.166  -2.213  -5.097
  461    H    ALA  59           HN       ALA  59   5.239  -6.557  -2.125
  462    HA   ALA  59           HA       ALA  59   3.750  -5.644   0.034
  463    HB1  ALA  59           HB1      ALA  59   2.352  -7.627  -0.317
  464    HB2  ALA  59           HB2      ALA  59   3.623  -8.358  -1.294
  465    HB3  ALA  59           HB3      ALA  59   2.804  -6.905  -1.862
  466    H    GLN  60           HN       GLN  60   5.931  -8.377  -0.248
  467    HA   GLN  60           HA       GLN  60   5.454  -9.344   2.373
  468    HB2  GLN  60           HB2      GLN  60   7.801  -9.938   0.570
  469    HB3  GLN  60           HB1      GLN  60   7.257 -10.895   1.947
  470    HG2  GLN  60           HG2      GLN  60   5.081 -11.226   0.740
  471    HG3  GLN  60           HG1      GLN  60   5.818 -10.435  -0.630
  472   HE21  GLN  60          HE21      GLN  60   5.859 -13.246   1.344
  473   HE22  GLN  60          HE22      GLN  60   6.751 -14.270   0.289
  474    H    LEU  61           HN       LEU  61   7.852  -7.203   0.961
  475    HA   LEU  61           HA       LEU  61   9.435  -6.980   3.291
  476    HB2  LEU  61           HB2      LEU  61   9.228  -5.443   0.770
  477    HB3  LEU  61           HB1      LEU  61   9.947  -4.593   2.111
  478    HG   LEU  61           HG       LEU  61  11.648  -6.403   2.302
  479   HD11  LEU  61          HD11      LEU  61  10.416  -8.239   1.334
  480   HD12  LEU  61          HD12      LEU  61  11.944  -7.984   0.490
  481   HD13  LEU  61          HD13      LEU  61  10.431  -7.439  -0.238
  482   HD21  LEU  61          HD21      LEU  61  12.910  -5.774   0.313
  483   HD22  LEU  61          HD22      LEU  61  12.136  -4.385   1.075
  484   HD23  LEU  61          HD23      LEU  61  11.447  -5.085  -0.387
  485    H    LEU  62           HN       LEU  62   6.806  -4.856   2.083
  486    HA   LEU  62           HA       LEU  62   6.830  -3.093   4.173
  487    HB2  LEU  62           HB2      LEU  62   4.567  -4.072   2.453
  488    HB3  LEU  62           HB1      LEU  62   4.280  -2.978   3.751
  489    HG   LEU  62           HG       LEU  62   5.400  -1.140   2.618
  490   HD11  LEU  62          HD11      LEU  62   6.601  -1.367   0.590
  491   HD12  LEU  62          HD12      LEU  62   6.368  -3.128   0.639
  492   HD13  LEU  62          HD13      LEU  62   7.341  -2.331   1.876
  493   HD21  LEU  62          HD21      LEU  62   3.184  -1.697   1.829
  494   HD22  LEU  62          HD22      LEU  62   3.883  -2.804   0.652
  495   HD23  LEU  62          HD23      LEU  62   4.197  -1.070   0.525
  496    H    ILE  63           HN       ILE  63   5.056  -6.175   3.850
  497    HA   ILE  63           HA       ILE  63   3.700  -6.030   6.303
  498    HB   ILE  63           HB       ILE  63   3.413  -7.615   4.173
  499   HG12  ILE  63          HG12      ILE  63   1.840  -7.374   6.027
  500   HG13  ILE  63          HG11      ILE  63   1.854  -8.999   5.360
  501   HG21  ILE  63          HG21      ILE  63   4.049  -9.938   4.572
  502   HG22  ILE  63          HG22      ILE  63   4.924  -9.439   6.016
  503   HG23  ILE  63          HG23      ILE  63   5.456  -8.878   4.434
  504   HD11  ILE  63          HD11      ILE  63   1.660  -9.079   7.763
  505   HD12  ILE  63          HD12      ILE  63   3.112  -8.092   7.945
  506   HD13  ILE  63          HD13      ILE  63   3.229  -9.730   7.282
  507    H    THR  64           HN       THR  64   6.914  -7.146   5.559
  508    HA   THR  64           HA       THR  64   7.330  -8.439   8.060
  509    HB   THR  64           HB       THR  64   9.290  -7.569   5.921
  510    HG1  THR  64           HG1      THR  64   8.103  -9.143   5.064
  511   HG21  THR  64          HG21      THR  64  10.875  -9.142   6.963
  512   HG22  THR  64          HG22      THR  64   9.710  -9.473   8.241
  513   HG23  THR  64          HG23      THR  64  10.432  -7.869   8.103
  514    H    HIS  65           HN       HIS  65   8.084  -5.214   6.832
  515    HA   HIS  65           HA       HIS  65   9.471  -4.648   9.328
  516    HB2  HIS  65           HB2      HIS  65   9.193  -2.909   6.877
  517    HB3  HIS  65           HB1      HIS  65  10.135  -2.510   8.311
  518    HD1  HIS  65           HD1      HIS  65  12.245  -4.171   8.801
  519    HD2  HIS  65           HD2      HIS  65  10.442  -4.438   5.069
  520    HE1  HIS  65           HE1      HIS  65  13.835  -5.452   7.360
  521    H    PHE  66           HN       PHE  66   6.842  -3.161   7.476
  522    HA   PHE  66           HA       PHE  66   6.153  -1.416   9.595
  523    HB2  PHE  66           HB2      PHE  66   4.637  -2.208   7.096
  524    HB3  PHE  66           HB1      PHE  66   4.186  -0.879   8.178
  525    HD1  PHE  66           HD2      PHE  66   5.730   1.013   8.439
  526    HD2  PHE  66           HD1      PHE  66   6.257  -1.982   5.526
  527    HE1  PHE  66           HE2      PHE  66   7.301   2.491   7.218
  528    HE2  PHE  66           HE1      PHE  66   7.817  -0.545   4.278
  529    HZ   PHE  66           HZ       PHE  66   8.345   1.682   5.129
  530    H    GLY  67           HN       GLY  67   4.535  -4.276   8.260
  531    HA2  GLY  67           HA3      GLY  67   3.903  -5.871  10.122
  532    HA3  GLY  67           HA2      GLY  67   3.026  -4.506  10.791
  533    HA   PRO  68           HA       PRO  68   0.587  -7.150   7.689
  534    HB2  PRO  68           HB2      PRO  68  -1.571  -7.525   9.408
  535    HB3  PRO  68           HB1      PRO  68  -0.286  -8.695   9.103
  536    HG2  PRO  68           HG2      PRO  68  -0.622  -6.797  11.376
  537    HG3  PRO  68           HG1      PRO  68   0.056  -8.433  11.370
  538    HD2  PRO  68           HD2      PRO  68   1.596  -6.211  11.504
  539    HD3  PRO  68           HD1      PRO  68   2.154  -7.680  10.694
  540    H    GLU  69           HN       GLU  69  -0.820  -4.836   9.997
  541    HA   GLU  69           HA       GLU  69  -2.631  -3.986   7.877
  542    HB2  GLU  69           HB3      GLU  69  -2.503  -3.154  10.768
  543    HB3  GLU  69           HB2      GLU  69  -3.732  -2.662   9.614
  544    HG2  GLU  69           HG3      GLU  69  -4.364  -5.043   9.351
  545    HG3  GLU  69           HG2      GLU  69  -3.224  -5.438  10.640
  546    H    GLU  70           HN       GLU  70   0.293  -3.128   9.268
  547    HA   GLU  70           HA       GLU  70   0.096  -0.292   8.783
  548    HB2  GLU  70           HB3      GLU  70   1.555  -1.614  10.499
  549    HB3  GLU  70           HB2      GLU  70   2.669  -1.761   9.152
  550    HG2  GLU  70           HG3      GLU  70   3.276   0.131  10.496
  551    HG3  GLU  70           HG2      GLU  70   2.672   0.702   8.939
  552    H    ALA  71           HN       ALA  71   1.550  -3.095   7.220
  553    HA   ALA  71           HA       ALA  71   2.913  -1.938   5.074
  554    HB1  ALA  71           HB1      ALA  71   3.050  -4.266   5.647
  555    HB2  ALA  71           HB2      ALA  71   2.498  -4.101   3.974
  556    HB3  ALA  71           HB3      ALA  71   1.353  -4.505   5.254
  557    H    TRP  72           HN       TRP  72  -0.422  -3.052   5.310
  558    HA   TRP  72           HA       TRP  72  -1.101  -2.349   2.702
  559    HB2  TRP  72           HB2      TRP  72  -2.481  -3.957   3.842
  560    HB3  TRP  72           HB1      TRP  72  -2.848  -2.814   5.129
  561    HD1  TRP  72           HD1      TRP  72  -5.360  -2.358   4.908
  562    HE1  TRP  72           HE1      TRP  72  -6.921  -1.578   2.983
  563    HE3  TRP  72           HE3      TRP  72  -2.090  -2.550   0.997
  564    HZ2  TRP  72           HZ2      TRP  72  -6.768  -1.098   0.294
  565    HZ3  TRP  72           HZ3      TRP  72  -2.892  -1.918  -1.251
  566    HH2  TRP  72           HH2      TRP  72  -5.191  -1.208  -1.593
  567    H    ARG  73           HN       ARG  73  -1.389  -0.571   5.714
  568    HA   ARG  73           HA       ARG  73  -2.721   1.621   4.641
  569    HB2  ARG  73           HB2      ARG  73  -2.578   1.320   7.048
  570    HB3  ARG  73           HB1      ARG  73  -0.830   1.462   6.996
  571    HG2  ARG  73           HG2      ARG  73  -1.097   3.800   6.191
  572    HG3  ARG  73           HG1      ARG  73  -2.835   3.636   6.445
  573    HD2  ARG  73           HD2      ARG  73  -0.764   3.224   8.587
  574    HD3  ARG  73           HD1      ARG  73  -1.587   4.749   8.300
  575    HE   ARG  73           HE       ARG  73  -3.656   3.115   8.644
  576   HH11  ARG  73          HH11      ARG  73  -0.641   2.974  10.488
  577   HH12  ARG  73          HH12      ARG  73  -1.378   3.000  12.015
  578   HH21  ARG  73          HH21      ARG  73  -4.704   3.073  10.726
  579   HH22  ARG  73          HH22      ARG  73  -3.787   3.022  12.162
  580    H    LEU  74           HN       LEU  74   0.725   0.969   5.105
  581    HA   LEU  74           HA       LEU  74   1.808   3.323   4.146
  582    HB2  LEU  74           HB2      LEU  74   2.761   0.564   4.500
  583    HB3  LEU  74           HB1      LEU  74   3.653   1.488   3.324
  584    HG   LEU  74           HG       LEU  74   4.680   1.489   5.576
  585   HD11  LEU  74          HD11      LEU  74   3.767   4.183   4.583
  586   HD12  LEU  74          HD12      LEU  74   5.228   3.296   4.119
  587   HD13  LEU  74          HD13      LEU  74   5.059   3.905   5.751
  588   HD21  LEU  74          HD21      LEU  74   2.645   1.444   6.918
  589   HD22  LEU  74          HD22      LEU  74   2.256   3.085   6.393
  590   HD23  LEU  74          HD23      LEU  74   3.693   2.787   7.374
  591    H    ALA  75           HN       ALA  75   0.905   0.433   2.322
  592    HA   ALA  75           HA       ALA  75   1.845   1.513  -0.133
  593    HB1  ALA  75           HB1      ALA  75  -0.121  -0.723   0.306
  594    HB2  ALA  75           HB2      ALA  75   1.639  -0.878   0.094
  595    HB3  ALA  75           HB3      ALA  75   0.636  -0.287  -1.222
  596    H    LEU  76           HN       LEU  76  -1.466   1.252   1.243
  597    HA   LEU  76           HA       LEU  76  -2.654   2.379  -1.043
  598    HB2  LEU  76           HB2      LEU  76  -4.737   2.481   0.155
  599    HB3  LEU  76           HB1      LEU  76  -3.921   1.020   0.644
  600    HG   LEU  76           HG       LEU  76  -3.179   2.514   2.687
  601   HD11  LEU  76          HD11      LEU  76  -5.734   3.854   1.836
  602   HD12  LEU  76          HD12      LEU  76  -4.127   4.586   1.900
  603   HD13  LEU  76          HD13      LEU  76  -4.919   4.071   3.385
  604   HD21  LEU  76          HD21      LEU  76  -4.480   0.488   2.886
  605   HD22  LEU  76          HD22      LEU  76  -5.940   1.362   2.421
  606   HD23  LEU  76          HD23      LEU  76  -5.132   1.742   3.940
  607    H    SER  77           HN       SER  77  -1.551   3.872   1.939
  608    HA   SER  77           HA       SER  77  -2.448   6.457   1.191
  609    HB2  SER  77           HB2      SER  77  -0.841   5.281   3.375
  610    HB3  SER  77           HB1      SER  77  -1.011   7.067   3.285
  611    HG   SER  77           HG       SER  77  -3.354   6.363   3.118
  612    H    THR  78           HN       THR  78   0.091   4.671   0.030
  613    HA   THR  78           HA       THR  78   1.548   7.100  -0.603
  614    HB   THR  78           HB       THR  78   2.496   4.219  -0.898
  615    HG1  THR  78           HG1      THR  78   2.644   4.660   1.195
  616   HG21  THR  78          HG21      THR  78   4.689   5.199  -1.372
  617   HG22  THR  78          HG22      THR  78   4.008   6.820  -1.232
  618   HG23  THR  78          HG23      THR  78   3.511   5.772  -2.558
  619    H    PHE  79           HN       PHE  79  -0.525   4.678  -1.918
  620    HA   PHE  79           HA       PHE  79   0.024   4.894  -4.639
  621    HB2  PHE  79           HB2      PHE  79  -2.626   4.493  -3.235
  622    HB3  PHE  79           HB1      PHE  79  -2.454   4.375  -4.986
  623    HD1  PHE  79           HD2      PHE  79   0.314   2.881  -4.689
  624    HD2  PHE  79           HD1      PHE  79  -3.545   2.366  -2.977
  625    HE1  PHE  79           HE2      PHE  79   0.774   0.497  -4.362
  626    HE2  PHE  79           HE1      PHE  79  -3.086  -0.025  -2.646
  627    HZ   PHE  79           HZ       PHE  79  -0.921  -0.965  -3.345
  628    H    GLU  80           HN       GLU  80  -1.940   6.850  -2.491
  629    HA   GLU  80           HA       GLU  80  -2.992   8.657  -4.399
  630    HB2  GLU  80           HB3      GLU  80  -3.579  10.058  -2.469
  631    HB3  GLU  80           HB2      GLU  80  -3.992   8.375  -2.172
  632    HG2  GLU  80           HG3      GLU  80  -2.028   8.093  -0.803
  633    HG3  GLU  80           HG2      GLU  80  -1.502   9.726  -1.178
  634    H    ARG  81           HN       ARG  81   0.123   8.399  -2.983
  635    HA   ARG  81           HA       ARG  81   0.804  11.216  -3.158
  636    HB2  ARG  81           HB2      ARG  81   2.650   8.894  -2.658
  637    HB3  ARG  81           HB1      ARG  81   2.951  10.590  -2.304
  638    HG2  ARG  81           HG2      ARG  81   0.844   8.891  -1.023
  639    HG3  ARG  81           HG1      ARG  81   2.412   9.327  -0.323
  640    HD2  ARG  81           HD2      ARG  81   1.792  11.579  -0.144
  641    HD3  ARG  81           HD1      ARG  81   0.393  11.352  -1.201
  642    HE   ARG  81           HE       ARG  81  -0.037   9.643   0.851
  643   HH11  ARG  81          HH11      ARG  81   0.573  13.139   0.720
  644   HH12  ARG  81          HH12      ARG  81  -0.446  13.505   2.021
  645   HH21  ARG  81          HH21      ARG  81  -1.560  10.164   2.523
  646   HH22  ARG  81          HH22      ARG  81  -1.698  11.768   3.076
  647    H    ILE  82           HN       ILE  82   1.148   8.307  -4.948
  648    HA   ILE  82           HA       ILE  82   2.911   9.589  -6.874
  649    HB   ILE  82           HB       ILE  82   3.217   7.330  -7.856
  650   HG12  ILE  82          HG12      ILE  82   1.624   6.254  -5.521
  651   HG13  ILE  82          HG11      ILE  82   0.893   6.455  -7.127
  652   HG21  ILE  82          HG21      ILE  82   4.440   6.364  -5.937
  653   HG22  ILE  82          HG22      ILE  82   3.580   7.471  -4.867
  654   HG23  ILE  82          HG23      ILE  82   4.689   8.108  -6.077
  655   HD11  ILE  82          HD11      ILE  82   3.216   4.700  -6.337
  656   HD12  ILE  82          HD12      ILE  82   2.578   4.855  -7.975
  657   HD13  ILE  82          HD13      ILE  82   1.573   4.173  -6.696
  658    H    ASN  83           HN       ASN  83  -0.042   9.890  -6.351
  659    HA   ASN  83           HA       ASN  83  -1.814  10.650  -7.410
  660    HB2  ASN  83           HB3      ASN  83  -0.245  11.937  -8.843
  661    HB3  ASN  83           HB2      ASN  83  -0.156  10.590  -9.961
  662   HD21  ASN  83          HD21      ASN  83  -1.753  10.345 -11.476
  663   HD22  ASN  83          HD22      ASN  83  -3.088  11.412 -11.667
  664    H    ARG  84           HN       ARG  84  -0.992   7.700  -7.566
  665    HA   ARG  84           HA       ARG  84  -3.119   6.879  -9.390
  666    HB2  ARG  84           HB2      ARG  84  -0.712   5.821  -8.989
  667    HB3  ARG  84           HB1      ARG  84  -1.573   5.039  -7.677
  668    HG2  ARG  84           HG2      ARG  84  -2.402   4.916 -10.588
  669    HG3  ARG  84           HG1      ARG  84  -1.407   3.700  -9.804
  670    HD2  ARG  84           HD2      ARG  84  -3.189   3.184  -8.275
  671    HD3  ARG  84           HD1      ARG  84  -4.170   4.473  -8.900
  672    HE   ARG  84           HE       ARG  84  -4.948   3.020 -10.468
  673   HH11  ARG  84          HH11      ARG  84  -1.549   1.979  -9.977
  674   HH12  ARG  84          HH12      ARG  84  -1.719   0.620 -10.985
  675   HH21  ARG  84          HH21      ARG  84  -5.102   1.100 -11.776
  676   HH22  ARG  84          HH22      ARG  84  -3.744   0.131 -12.033
  677    H    LYS  85           HN       LYS  85  -4.456   8.106  -8.018
  678    HA   LYS  85           HA       LYS  85  -4.870   7.568  -5.235
  679    HB2  LYS  85           HB2      LYS  85  -5.007   9.790  -6.223
  680    HB3  LYS  85           HB1      LYS  85  -6.326   9.268  -7.259
  681    HG2  LYS  85           HG2      LYS  85  -7.745   8.999  -5.291
  682    HG3  LYS  85           HG1      LYS  85  -6.387   9.471  -4.260
  683    HD2  LYS  85           HD2      LYS  85  -7.844  11.373  -4.577
  684    HD3  LYS  85           HD1      LYS  85  -6.312  11.657  -5.394
  685    HE2  LYS  85           HE2      LYS  85  -8.114  12.404  -6.808
  686    HE3  LYS  85           HE1      LYS  85  -7.379  10.991  -7.545
  687    HZ1  LYS  85           HZ1      LYS  85  -9.880  11.007  -5.952
  688    HZ2  LYS  85           HZ2      LYS  85  -9.283   9.643  -6.723
  689    HZ3  LYS  85           HZ3      LYS  85  -9.805  10.971  -7.609
  690    H    ASP  86           HN       ASP  86  -6.014   6.458  -8.194
  691    HA   ASP  86           HA       ASP  86  -8.572   5.675  -7.845
  692    HB2  ASP  86           HB2      ASP  86  -6.415   4.099  -9.247
  693    HB3  ASP  86           HB1      ASP  86  -8.143   4.028  -9.566
  694    H    LEU  87           HN       LEU  87  -5.585   3.899  -7.112
  695    HA   LEU  87           HA       LEU  87  -6.985   1.603  -6.071
  696    HB2  LEU  87           HB2      LEU  87  -4.090   2.379  -5.869
  697    HB3  LEU  87           HB1      LEU  87  -4.727   0.881  -5.248
  698    HG   LEU  87           HG       LEU  87  -4.587   1.735  -8.134
  699   HD11  LEU  87          HD11      LEU  87  -2.462   1.058  -7.158
  700   HD12  LEU  87          HD12      LEU  87  -3.029  -0.096  -8.355
  701   HD13  LEU  87          HD13      LEU  87  -3.180  -0.467  -6.635
  702   HD21  LEU  87          HD21      LEU  87  -6.622   0.438  -7.802
  703   HD22  LEU  87          HD22      LEU  87  -5.714  -0.808  -6.949
  704   HD23  LEU  87          HD23      LEU  87  -5.420  -0.523  -8.661
  705    H    TRP  88           HN       TRP  88  -5.667   4.489  -4.790
  706    HA   TRP  88           HA       TRP  88  -5.628   3.802  -2.067
  707    HB2  TRP  88           HB2      TRP  88  -4.421   5.710  -2.853
  708    HB3  TRP  88           HB1      TRP  88  -5.865   6.422  -3.524
  709    HD1  TRP  88           HD1      TRP  88  -4.494   5.502  -0.033
  710    HE1  TRP  88           HE1      TRP  88  -5.392   7.233   1.673
  711    HE3  TRP  88           HE3      TRP  88  -7.476   8.182  -3.126
  712    HZ2  TRP  88           HZ2      TRP  88  -7.119   9.424   1.667
  713    HZ3  TRP  88           HZ3      TRP  88  -8.721  10.089  -2.221
  714    HH2  TRP  88           HH2      TRP  88  -8.557  10.697   0.125
  715    H    GLU  89           HN       GLU  89  -8.038   5.413  -4.094
  716    HA   GLU  89           HA       GLU  89 -10.046   5.768  -2.192
  717    HB2  GLU  89           HB3      GLU  89 -10.250   5.342  -5.166
  718    HB3  GLU  89           HB2      GLU  89 -11.611   5.799  -4.147
  719    HG2  GLU  89           HG3      GLU  89 -10.502   7.854  -3.544
  720    HG3  GLU  89           HG2      GLU  89  -9.083   7.379  -4.470
  721    H    ARG  90           HN       ARG  90  -9.099   2.939  -3.914
  722    HA   ARG  90           HA       ARG  90 -11.488   1.408  -3.382
  723    HB2  ARG  90           HB2      ARG  90  -8.706   0.379  -3.936
  724    HB3  ARG  90           HB1      ARG  90 -10.196  -0.524  -4.089
  725    HG2  ARG  90           HG2      ARG  90  -9.342   1.782  -5.847
  726    HG3  ARG  90           HG1      ARG  90  -9.186   0.078  -6.250
  727    HD2  ARG  90           HD2      ARG  90 -11.078   0.835  -7.386
  728    HD3  ARG  90           HD1      ARG  90 -11.710  -0.047  -5.998
  729    HE   ARG  90           HE       ARG  90 -11.401   2.809  -5.682
  730   HH11  ARG  90          HH11      ARG  90 -13.608   0.183  -6.568
  731   HH12  ARG  90          HH12      ARG  90 -15.019   1.077  -6.272
  732   HH21  ARG  90          HH21      ARG  90 -13.409   4.083  -5.328
  733   HH22  ARG  90          HH22      ARG  90 -14.897   3.312  -5.557
  734    H    GLY  91           HN       GLY  91  -8.311   1.861  -1.954
  735    HA2  GLY  91           HA3      GLY  91  -8.660  -0.259  -0.019
  736    HA3  GLY  91           HA2      GLY  91  -7.228   0.721  -0.298
  737    H    GLN  92           HN       GLN  92  -9.760   2.803   0.035
  738    HA   GLN  92           HA       GLN  92  -8.961   3.662   2.613
  739    HB2  GLN  92           HB2      GLN  92 -11.412   4.337   0.976
  740    HB3  GLN  92           HB1      GLN  92 -11.055   5.113   2.506
  741    HG2  GLN  92           HG2      GLN  92  -8.967   5.983   1.555
  742    HG3  GLN  92           HG1      GLN  92  -9.343   5.198   0.026
  743   HE21  GLN  92          HE21      GLN  92 -10.158   7.779   2.190
  744   HE22  GLN  92          HE22      GLN  92 -11.143   8.670   1.090
  745    H    ARG  93           HN       ARG  93  -9.095   2.338   4.154
  746    HA   ARG  93           HA       ARG  93 -11.561   0.784   4.617
  747    HB2  ARG  93           HB2      ARG  93 -10.220  -0.804   5.844
  748    HB3  ARG  93           HB1      ARG  93  -9.429  -0.489   4.303
  749    HG2  ARG  93           HG2      ARG  93  -7.830   0.971   5.353
  750    HG3  ARG  93           HG1      ARG  93  -8.689   0.871   6.880
  751    HD2  ARG  93           HD2      ARG  93  -8.183  -1.629   6.788
  752    HD3  ARG  93           HD1      ARG  93  -7.067  -1.184   5.478
  753    HE   ARG  93           HE       ARG  93  -6.199   0.500   7.251
  754   HH11  ARG  93          HH11      ARG  93  -7.025  -2.888   7.940
  755   HH12  ARG  93          HH12      ARG  93  -6.165  -2.923   9.407
  756   HH21  ARG  93          HH21      ARG  93  -5.078   0.442   9.144
  757   HH22  ARG  93          HH22      ARG  93  -4.980  -0.975  10.131
  758    H    GLU  94           HN       GLU  94  -9.464   3.207   5.985
  759    HA   GLU  94           HA       GLU  94 -10.973   3.204   8.484
  760    HB2  GLU  94           HB3      GLU  94  -8.852   3.492   9.745
  761    HB3  GLU  94           HB2      GLU  94  -8.922   1.935   8.941
  762    HG2  GLU  94           HG3      GLU  94  -7.462   2.805   7.161
  763    HG3  GLU  94           HG2      GLU  94  -7.386   4.353   7.997
  764    H    ASP  95           HN       ASP  95 -11.250   4.700   6.231
  765    HA   ASP  95           HA       ASP  95 -10.102   7.315   6.883
  766    HB2  ASP  95           HB2      ASP  95 -10.650   6.132   4.150
  767    HB3  ASP  95           HB1      ASP  95  -9.946   7.706   4.475
  768    H    LEU  96           HN       LEU  96 -11.562   8.811   5.208
  769    HA   LEU  96           HA       LEU  96 -14.216   8.591   6.225
  770    HB2  LEU  96           HB2      LEU  96 -14.776  10.545   4.946
  771    HB3  LEU  96           HB1      LEU  96 -13.231  10.811   5.713
  772    HG   LEU  96           HG       LEU  96 -13.581  10.035   2.843
  773   HD11  LEU  96          HD11      LEU  96 -13.137  12.421   2.336
  774   HD12  LEU  96          HD12      LEU  96 -13.137  12.764   4.064
  775   HD13  LEU  96          HD13      LEU  96 -14.617  12.215   3.277
  776   HD21  LEU  96          HD21      LEU  96 -11.206  11.127   4.354
  777   HD22  LEU  96          HD22      LEU  96 -11.282  10.958   2.603
  778   HD23  LEU  96          HD23      LEU  96 -11.363   9.525   3.622
  779    H    VAL  97           HN       VAL  97 -16.107   8.080   5.179
  780    HA   VAL  97           HA       VAL  97 -17.479   7.001   3.867
  781    HB   VAL  97           HB       VAL  97 -15.287   7.156   1.799
  782   HG11  VAL  97          HG11      VAL  97 -18.142   6.174   1.451
  783   HG12  VAL  97          HG12      VAL  97 -16.710   5.160   1.377
  784   HG13  VAL  97          HG13      VAL  97 -16.980   6.390   0.139
  785   HG21  VAL  97          HG21      VAL  97 -17.918   8.597   2.069
  786   HG22  VAL  97          HG22      VAL  97 -16.783   8.791   0.732
  787   HG23  VAL  97          HG23      VAL  97 -16.317   9.271   2.366
  788    H    ARG  98           HN       ARG  98 -18.061   5.124   4.325
  789    HA   ARG  98           HA       ARG  98 -16.037   3.084   4.766
  790    HB2  ARG  98           HB2      ARG  98 -17.932   1.920   6.017
  791    HB3  ARG  98           HB1      ARG  98 -17.239   3.363   6.735
  792    HG2  ARG  98           HG2      ARG  98 -19.109   4.661   6.246
  793    HG3  ARG  98           HG1      ARG  98 -19.671   3.529   5.018
  794    HD2  ARG  98           HD2      ARG  98 -20.935   3.545   7.164
  795    HD3  ARG  98           HD1      ARG  98 -20.363   1.979   6.599
  796    HE   ARG  98           HE       ARG  98 -18.513   3.171   8.389
  797   HH11  ARG  98          HH11      ARG  98 -21.617   1.464   8.288
  798   HH12  ARG  98          HH12      ARG  98 -21.432   0.770   9.829
  799   HH21  ARG  98          HH21      ARG  98 -18.223   2.171  10.435
  800   HH22  ARG  98          HH22      ARG  98 -19.423   1.158  11.106
  801    H    ASP  99           HN       ASP  99 -16.219   3.182   2.279
  802    HA   ASP  99           HA       ASP  99 -18.346   1.540   1.236
  803    HB2  ASP  99           HB2      ASP  99 -17.271   3.231  -0.234
  804    HB3  ASP  99           HB1      ASP  99 -15.747   2.352  -0.107
  805    H    THR 100           HN       THR 100 -18.072  -0.584   0.397
  806    HA   THR 100           HA       THR 100 -17.512  -2.725   0.555
  807    HB   THR 100           HB       THR 100 -14.732  -1.794   1.428
  808    HG1  THR 100           HG1      THR 100 -15.744  -0.971  -0.696
  809   HG21  THR 100          HG21      THR 100 -15.131  -4.244   1.661
  810   HG22  THR 100          HG22      THR 100 -13.957  -3.896   0.391
  811   HG23  THR 100          HG23      THR 100 -15.617  -4.308  -0.032
  812    H    VAL 101           HN       VAL 101 -18.339  -0.940   2.717
  813    HA   VAL 101           HA       VAL 101 -18.343  -2.896   4.908
  814    HB   VAL 101           HB       VAL 101 -18.467   0.136   5.179
  815   HG11  VAL 101          HG11      VAL 101 -18.485  -2.005   7.298
  816   HG12  VAL 101          HG12      VAL 101 -19.844  -0.985   6.830
  817   HG13  VAL 101          HG13      VAL 101 -18.433  -0.270   7.613
  818   HG21  VAL 101          HG21      VAL 101 -16.191  -0.585   4.715
  819   HG22  VAL 101          HG22      VAL 101 -16.272  -1.735   6.053
  820   HG23  VAL 101          HG23      VAL 101 -16.343  -0.001   6.369
  821    H    GLU 102           HN       GLU 102 -19.792   0.105   3.717
  822    HA   GLU 102           HA       GLU 102 -22.409  -1.095   3.865
  823    HB2  GLU 102           HB3      GLU 102 -21.343   1.586   4.094
  824    HB3  GLU 102           HB2      GLU 102 -22.488   1.520   2.766
  825    HG2  GLU 102           HG3      GLU 102 -23.643   2.199   4.749
  826    HG3  GLU 102           HG2      GLU 102 -24.182   0.587   4.304
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1  -8.609 -16.087  25.468
    2    H2   GLY   1           HT2      GLY   1  -9.507 -16.897  26.625
    3    H3   GLY   1           HT3      GLY   1  -9.217 -15.230  26.796
    4    HA2  GLY   1           HA2      GLY   1 -10.821 -16.561  24.697
    5    HA3  GLY   1           HA3      GLY   1 -11.459 -15.622  26.044
    6    H    HIS   2           HN       HIS   2  -9.209 -15.331  23.283
    7    HA   HIS   2           HA       HIS   2 -10.351 -12.695  22.763
    8    HB2  HIS   2           HB2      HIS   2  -7.403 -13.286  23.031
    9    HB3  HIS   2           HB1      HIS   2  -8.004 -11.915  22.115
   10    HD1  HIS   2           HD1      HIS   2  -8.889  -9.896  23.457
   11    HD2  HIS   2           HD2      HIS   2  -7.657 -13.092  25.806
   12    HE1  HIS   2           HE1      HIS   2  -8.784  -9.029  25.805
   13    H    MET   3           HN       MET   3 -10.062 -11.985  20.609
   14    HA   MET   3           HA       MET   3  -9.153 -13.984  18.696
   15    HB2  MET   3           HB2      MET   3 -11.590 -14.249  18.817
   16    HB3  MET   3           HB1      MET   3 -11.800 -12.519  18.586
   17    HG2  MET   3           HG2      MET   3 -12.266 -13.775  16.541
   18    HG3  MET   3           HG1      MET   3 -10.905 -12.673  16.348
   19    HE1  MET   3           HE1      MET   3 -10.241 -13.926  14.107
   20    HE2  MET   3           HE2      MET   3 -11.604 -15.027  14.321
   21    HE3  MET   3           HE3      MET   3  -9.993 -15.668  13.994
   22    H    LEU   4           HN       LEU   4  -8.016 -13.082  17.079
   23    HA   LEU   4           HA       LEU   4  -7.457 -10.299  17.400
   24    HB2  LEU   4           HB2      LEU   4  -5.547 -10.596  15.919
   25    HB3  LEU   4           HB1      LEU   4  -5.537 -11.767  17.202
   26    HG   LEU   4           HG       LEU   4  -4.689 -12.847  15.326
   27   HD11  LEU   4          HD11      LEU   4  -6.172 -14.655  14.740
   28   HD12  LEU   4          HD12      LEU   4  -7.519 -13.773  15.456
   29   HD13  LEU   4          HD13      LEU   4  -6.175 -14.301  16.470
   30   HD21  LEU   4          HD21      LEU   4  -5.288 -11.323  13.566
   31   HD22  LEU   4          HD22      LEU   4  -6.977 -11.822  13.660
   32   HD23  LEU   4          HD23      LEU   4  -5.751 -12.961  13.102
   33    H    ARG   5           HN       ARG   5  -8.075  -8.710  16.266
   34    HA   ARG   5           HA       ARG   5  -9.312  -9.183  13.647
   35    HB2  ARG   5           HB2      ARG   5  -9.699  -6.877  15.572
   36    HB3  ARG   5           HB1      ARG   5 -10.422  -6.984  13.973
   37    HG2  ARG   5           HG2      ARG   5 -11.674  -8.948  14.657
   38    HG3  ARG   5           HG1      ARG   5 -10.931  -8.878  16.255
   39    HD2  ARG   5           HD2      ARG   5 -11.935  -6.685  16.621
   40    HD3  ARG   5           HD1      ARG   5 -12.661  -6.745  15.018
   41    HE   ARG   5           HE       ARG   5 -13.583  -8.978  16.119
   42   HH11  ARG   5          HH11      ARG   5 -13.492  -5.687  17.374
   43   HH12  ARG   5          HH12      ARG   5 -14.891  -5.843  18.314
   44   HH21  ARG   5          HH21      ARG   5 -15.469  -9.219  17.360
   45   HH22  ARG   5          HH22      ARG   5 -16.092  -7.934  18.298
   46    H    THR   6           HN       THR   6  -6.896  -7.583  15.506
   47    HA   THR   6           HA       THR   6  -5.890  -6.176  13.196
   48    HB   THR   6           HB       THR   6  -4.337  -5.177  14.942
   49    HG1  THR   6           HG1      THR   6  -4.833  -5.469  17.081
   50   HG21  THR   6          HG21      THR   6  -6.045  -3.679  15.915
   51   HG22  THR   6          HG22      THR   6  -7.302  -4.783  15.358
   52   HG23  THR   6          HG23      THR   6  -6.289  -3.933  14.188
   53    H    ALA   7           HN       ALA   7  -3.790  -6.542  12.582
   54    HA   ALA   7           HA       ALA   7  -1.956  -7.730  12.028
   55    HB1  ALA   7           HB1      ALA   7  -1.979  -8.801  14.844
   56    HB2  ALA   7           HB2      ALA   7  -1.339  -7.229  14.384
   57    HB3  ALA   7           HB3      ALA   7  -0.594  -8.703  13.754
   58    H    GLY   8           HN       GLY   8  -2.897  -9.030  10.470
   59    HA2  GLY   8           HA3      GLY   8  -2.822 -11.826  11.169
   60    HA3  GLY   8           HA2      GLY   8  -4.349 -11.209  10.538
   61    H    ARG   9           HN       ARG   9  -3.198 -13.111   9.102
   62    HA   ARG   9           HA       ARG   9  -1.424 -12.107   7.109
   63    HB2  ARG   9           HB2      ARG   9  -1.548 -14.506   7.593
   64    HB3  ARG   9           HB1      ARG   9  -3.222 -14.538   7.058
   65    HG2  ARG   9           HG2      ARG   9  -2.549 -14.023   4.796
   66    HG3  ARG   9           HG1      ARG   9  -0.869 -13.865   5.306
   67    HD2  ARG   9           HD2      ARG   9  -2.526 -16.353   5.536
   68    HD3  ARG   9           HD1      ARG   9  -1.377 -16.034   4.235
   69    HE   ARG   9           HE       ARG   9  -0.286 -15.837   6.900
   70   HH11  ARG   9          HH11      ARG   9  -0.907 -18.034   4.238
   71   HH12  ARG   9          HH12      ARG   9   0.373 -19.088   4.588
   72   HH21  ARG   9          HH21      ARG   9   1.439 -17.261   7.457
   73   HH22  ARG   9          HH22      ARG   9   1.755 -18.640   6.485
   74    H    ASP  10           HN       ASP  10  -4.800 -12.034   7.597
   75    HA   ASP  10           HA       ASP  10  -5.677 -11.472   4.998
   76    HB2  ASP  10           HB2      ASP  10  -7.315 -11.941   6.758
   77    HB3  ASP  10           HB1      ASP  10  -6.798 -10.521   7.660
   78    H    GLY  11           HN       GLY  11  -4.658 -10.029   3.884
   79    HA2  GLY  11           HA3      GLY  11  -4.783  -7.401   3.815
   80    HA3  GLY  11           HA2      GLY  11  -3.622  -7.616   5.128
   81    H    LEU  12           HN       LEU  12  -2.314  -9.888   4.176
   82    HA   LEU  12           HA       LEU  12  -0.269  -8.759   2.615
   83    HB2  LEU  12           HB2      LEU  12  -0.135 -10.793   4.129
   84    HB3  LEU  12           HB1      LEU  12  -0.956 -11.682   2.899
   85    HG   LEU  12           HG       LEU  12   1.577 -12.039   3.066
   86   HD11  LEU  12          HD11      LEU  12   1.900 -12.233   0.655
   87   HD12  LEU  12          HD12      LEU  12   0.438 -11.280   0.383
   88   HD13  LEU  12          HD13      LEU  12   0.331 -12.859   1.160
   89   HD21  LEU  12          HD21      LEU  12   2.992 -10.448   1.873
   90   HD22  LEU  12          HD22      LEU  12   2.233  -9.698   3.277
   91   HD23  LEU  12          HD23      LEU  12   1.613  -9.374   1.658
   92    H    CYS  13           HN       CYS  13  -2.728 -11.077   1.726
   93    HA   CYS  13           HA       CYS  13  -2.188 -11.354  -0.985
   94    HB2  CYS  13           HB2      CYS  13  -4.770 -11.522   0.509
   95    HB3  CYS  13           HB1      CYS  13  -4.396 -12.381  -1.008
   96    HG   CYS  13           HG       CYS  13  -2.913 -14.268   0.050
   97    H    ARG  14           HN       ARG  14  -4.158  -9.072   0.769
   98    HA   ARG  14           HA       ARG  14  -5.535  -7.848  -1.403
   99    HB2  ARG  14           HB2      ARG  14  -6.275  -7.926   0.960
  100    HB3  ARG  14           HB1      ARG  14  -4.920  -6.921   1.402
  101    HG2  ARG  14           HG2      ARG  14  -5.886  -5.032   0.279
  102    HG3  ARG  14           HG1      ARG  14  -7.168  -6.045  -0.403
  103    HD2  ARG  14           HD2      ARG  14  -6.687  -5.556   2.546
  104    HD3  ARG  14           HD1      ARG  14  -7.988  -4.846   1.584
  105    HE   ARG  14           HE       ARG  14  -8.682  -7.213   1.154
  106   HH11  ARG  14          HH11      ARG  14  -7.166  -6.335   4.284
  107   HH12  ARG  14          HH12      ARG  14  -7.744  -7.730   5.074
  108   HH21  ARG  14          HH21      ARG  14  -9.396  -9.090   2.268
  109   HH22  ARG  14          HH22      ARG  14  -8.971  -9.367   3.907
  110    H    LEU  15           HN       LEU  15  -2.758  -7.019   0.571
  111    HA   LEU  15           HA       LEU  15  -1.954  -4.609  -0.509
  112    HB2  LEU  15           HB2      LEU  15  -1.188  -5.584   1.586
  113    HB3  LEU  15           HB1      LEU  15  -0.420  -6.888   0.724
  114    HG   LEU  15           HG       LEU  15   1.209  -5.285  -0.211
  115   HD11  LEU  15          HD11      LEU  15  -0.203  -3.292  -0.162
  116   HD12  LEU  15          HD12      LEU  15   1.316  -3.052   0.703
  117   HD13  LEU  15          HD13      LEU  15  -0.170  -3.332   1.602
  118   HD21  LEU  15          HD21      LEU  15   0.930  -5.236   2.786
  119   HD22  LEU  15          HD22      LEU  15   2.399  -4.890   1.874
  120   HD23  LEU  15          HD23      LEU  15   1.700  -6.505   1.832
  121    H    SER  16           HN       SER  16  -0.909  -7.913  -1.253
  122    HA   SER  16           HA       SER  16   0.979  -7.407  -3.212
  123    HB2  SER  16           HB2      SER  16  -0.875  -9.789  -3.018
  124    HB3  SER  16           HB1      SER  16   0.657  -9.737  -3.893
  125    HG   SER  16           HG       SER  16   0.227  -9.590  -1.088
  126    H    THR  17           HN       THR  17  -2.493  -8.022  -3.621
  127    HA   THR  17           HA       THR  17  -2.476  -8.102  -6.403
  128    HB   THR  17           HB       THR  17  -4.755  -7.407  -4.553
  129    HG1  THR  17           HG1      THR  17  -4.461  -9.406  -3.952
  130   HG21  THR  17          HG21      THR  17  -6.166  -8.328  -6.366
  131   HG22  THR  17          HG22      THR  17  -4.730  -8.551  -7.366
  132   HG23  THR  17          HG23      THR  17  -5.255  -6.926  -6.925
  133    H    TYR  18           HN       TYR  18  -2.929  -5.331  -4.235
  134    HA   TYR  18           HA       TYR  18  -3.559  -3.601  -6.429
  135    HB2  TYR  18           HB2      TYR  18  -3.011  -3.038  -3.528
  136    HB3  TYR  18           HB1      TYR  18  -3.260  -1.751  -4.702
  137    HD1  TYR  18           HD2      TYR  18  -5.411  -2.188  -6.238
  138    HD2  TYR  18           HD1      TYR  18  -4.869  -3.677  -2.304
  139    HE1  TYR  18           HE2      TYR  18  -7.847  -2.371  -5.987
  140    HE2  TYR  18           HE1      TYR  18  -7.304  -3.876  -2.039
  141    HH   TYR  18           HH       TYR  18  -9.362  -2.645  -3.147
  142    H    LEU  19           HN       LEU  19  -0.670  -4.517  -4.754
  143    HA   LEU  19           HA       LEU  19   0.875  -2.400  -5.879
  144    HB2  LEU  19           HB2      LEU  19   1.684  -4.957  -4.514
  145    HB3  LEU  19           HB1      LEU  19   2.838  -3.774  -5.094
  146    HG   LEU  19           HG       LEU  19   0.734  -3.234  -2.986
  147   HD11  LEU  19          HD11      LEU  19   2.421  -4.788  -2.200
  148   HD12  LEU  19          HD12      LEU  19   2.594  -3.213  -1.427
  149   HD13  LEU  19          HD13      LEU  19   3.696  -3.687  -2.722
  150   HD21  LEU  19          HD21      LEU  19   1.982  -1.155  -2.625
  151   HD22  LEU  19          HD22      LEU  19   1.346  -1.237  -4.259
  152   HD23  LEU  19          HD23      LEU  19   3.052  -1.558  -3.966
  153    H    GLU  20           HN       GLU  20  -0.309  -5.316  -7.101
  154    HA   GLU  20           HA       GLU  20   1.716  -5.728  -9.081
  155    HB2  GLU  20           HB3      GLU  20  -1.138  -6.725  -8.999
  156    HB3  GLU  20           HB2      GLU  20   0.075  -7.240 -10.163
  157    HG2  GLU  20           HG3      GLU  20   1.442  -8.111  -8.317
  158    HG3  GLU  20           HG2      GLU  20   0.177  -7.638  -7.187
  159    H    GLU  21           HN       GLU  21  -0.823  -3.512  -8.756
  160    HA   GLU  21           HA       GLU  21  -1.182  -3.051 -11.573
  161    HB2  GLU  21           HB3      GLU  21  -1.987  -1.381  -9.202
  162    HB3  GLU  21           HB2      GLU  21  -2.507  -1.113 -10.858
  163    HG2  GLU  21           HG3      GLU  21  -3.140  -3.494  -9.137
  164    HG3  GLU  21           HG2      GLU  21  -4.248  -2.194  -9.585
  165    H    LEU  22           HN       LEU  22   1.140  -2.260  -9.299
  166    HA   LEU  22           HA       LEU  22   1.939   0.156 -10.732
  167    HB2  LEU  22           HB2      LEU  22   2.870  -0.926  -8.077
  168    HB3  LEU  22           HB1      LEU  22   3.403   0.573  -8.804
  169    HG   LEU  22           HG       LEU  22   0.651  -0.042  -7.734
  170   HD11  LEU  22          HD11      LEU  22   2.307   0.333  -6.023
  171   HD12  LEU  22          HD12      LEU  22   1.188   1.695  -6.111
  172   HD13  LEU  22          HD13      LEU  22   2.803   1.838  -6.800
  173   HD21  LEU  22          HD21      LEU  22   0.117   2.300  -8.221
  174   HD22  LEU  22          HD22      LEU  22   0.476   1.412  -9.699
  175   HD23  LEU  22          HD23      LEU  22   1.681   2.502  -9.007
  176    H    GLU  23           HN       GLU  23   3.746   0.103 -11.913
  177    HA   GLU  23           HA       GLU  23   5.120  -2.446 -12.090
  178    HB2  GLU  23           HB3      GLU  23   5.959  -1.674 -14.187
  179    HB3  GLU  23           HB2      GLU  23   4.265  -1.206 -14.060
  180    HG2  GLU  23           HG3      GLU  23   4.708   0.927 -14.280
  181    HG3  GLU  23           HG2      GLU  23   6.047   0.851 -13.122
  182    H    ALA  24           HN       ALA  24   7.660  -1.738 -12.895
  183    HA   ALA  24           HA       ALA  24   9.045  -1.477 -10.530
  184    HB1  ALA  24           HB1      ALA  24  10.019  -2.396 -12.579
  185    HB2  ALA  24           HB2      ALA  24  11.049  -1.153 -11.867
  186    HB3  ALA  24           HB3      ALA  24  10.061  -0.778 -13.279
  187    H    VAL  25           HN       VAL  25   8.542   1.119 -12.952
  188    HA   VAL  25           HA       VAL  25   9.916   3.024 -11.362
  189    HB   VAL  25           HB       VAL  25   9.675   3.448 -13.774
  190   HG11  VAL  25          HG11      VAL  25   7.463   2.511 -14.149
  191   HG12  VAL  25          HG12      VAL  25   7.557   4.163 -14.761
  192   HG13  VAL  25          HG13      VAL  25   6.740   3.833 -13.231
  193   HG21  VAL  25          HG21      VAL  25  10.000   5.389 -12.328
  194   HG22  VAL  25          HG22      VAL  25   8.244   5.527 -12.159
  195   HG23  VAL  25          HG23      VAL  25   8.996   5.801 -13.731
  196    H    GLU  26           HN       GLU  26   6.612   2.020 -11.448
  197    HA   GLU  26           HA       GLU  26   5.595   4.218  -9.940
  198    HB2  GLU  26           HB3      GLU  26   4.415   1.489 -10.419
  199    HB3  GLU  26           HB2      GLU  26   3.553   2.898  -9.800
  200    HG2  GLU  26           HG3      GLU  26   4.838   2.654 -12.502
  201    HG3  GLU  26           HG2      GLU  26   3.105   2.544 -12.186
  202    H    LEU  27           HN       LEU  27   6.661   0.972  -9.210
  203    HA   LEU  27           HA       LEU  27   6.064   1.069  -6.446
  204    HB2  LEU  27           HB2      LEU  27   7.916  -0.698  -8.031
  205    HB3  LEU  27           HB1      LEU  27   7.589  -0.873  -6.314
  206    HG   LEU  27           HG       LEU  27   5.430  -1.040  -8.410
  207   HD11  LEU  27          HD11      LEU  27   7.026  -3.251  -7.120
  208   HD12  LEU  27          HD12      LEU  27   7.015  -2.815  -8.826
  209   HD13  LEU  27          HD13      LEU  27   5.561  -3.475  -8.076
  210   HD21  LEU  27          HD21      LEU  27   5.563  -1.857  -5.508
  211   HD22  LEU  27          HD22      LEU  27   4.194  -2.132  -6.584
  212   HD23  LEU  27          HD23      LEU  27   4.671  -0.487  -6.161
  213    H    LYS  28           HN       LYS  28   8.539   2.374  -8.354
  214    HA   LYS  28           HA       LYS  28  10.427   2.629  -6.207
  215    HB2  LYS  28           HB2      LYS  28  11.101   2.301  -8.597
  216    HB3  LYS  28           HB1      LYS  28  10.464   3.900  -8.950
  217    HG2  LYS  28           HG2      LYS  28  12.112   4.933  -7.582
  218    HG3  LYS  28           HG1      LYS  28  12.651   3.368  -6.969
  219    HD2  LYS  28           HD2      LYS  28  13.314   2.739  -9.261
  220    HD3  LYS  28           HD1      LYS  28  12.861   4.354  -9.809
  221    HE2  LYS  28           HE2      LYS  28  15.281   4.144  -9.400
  222    HE3  LYS  28           HE1      LYS  28  14.510   5.347  -8.367
  223    HZ1  LYS  28           HZ1      LYS  28  14.517   3.793  -6.554
  224    HZ2  LYS  28           HZ2      LYS  28  16.073   3.943  -7.149
  225    HZ3  LYS  28           HZ3      LYS  28  15.182   2.564  -7.499
  226    H    LYS  29           HN       LYS  29   8.078   4.624  -7.914
  227    HA   LYS  29           HA       LYS  29   8.452   7.090  -6.549
  228    HB2  LYS  29           HB2      LYS  29   5.890   5.777  -7.459
  229    HB3  LYS  29           HB1      LYS  29   6.046   7.459  -7.003
  230    HG2  LYS  29           HG2      LYS  29   7.454   7.912  -8.900
  231    HG3  LYS  29           HG1      LYS  29   7.470   6.197  -9.327
  232    HD2  LYS  29           HD2      LYS  29   5.106   6.232  -9.785
  233    HD3  LYS  29           HD1      LYS  29   4.984   7.878  -9.172
  234    HE2  LYS  29           HE2      LYS  29   6.296   8.714 -10.924
  235    HE3  LYS  29           HE1      LYS  29   6.696   7.090 -11.502
  236    HZ1  LYS  29           HZ1      LYS  29   3.976   8.282 -11.481
  237    HZ2  LYS  29           HZ2      LYS  29   4.432   6.761 -12.112
  238    HZ3  LYS  29           HZ3      LYS  29   4.969   8.184 -12.843
  239    H    PHE  30           HN       PHE  30   6.449   4.325  -5.994
  240    HA   PHE  30           HA       PHE  30   5.404   4.961  -3.488
  241    HB2  PHE  30           HB2      PHE  30   4.277   3.306  -4.674
  242    HB3  PHE  30           HB1      PHE  30   5.758   2.497  -5.135
  243    HD1  PHE  30           HD2      PHE  30   3.735   3.247  -2.128
  244    HD2  PHE  30           HD1      PHE  30   6.262   0.542  -4.137
  245    HE1  PHE  30           HE2      PHE  30   3.391   1.600  -0.323
  246    HE2  PHE  30           HE1      PHE  30   5.912  -1.139  -2.367
  247    HZ   PHE  30           HZ       PHE  30   4.461  -0.597  -0.452
  248    H    LYS  31           HN       LYS  31   8.568   4.191  -4.363
  249    HA   LYS  31           HA       LYS  31   9.060   2.969  -1.814
  250    HB2  LYS  31           HB2      LYS  31  10.074   2.025  -3.961
  251    HB3  LYS  31           HB1      LYS  31  11.146   3.405  -3.911
  252    HG2  LYS  31           HG2      LYS  31  12.171   1.425  -2.939
  253    HG3  LYS  31           HG1      LYS  31  12.032   2.750  -1.791
  254    HD2  LYS  31           HD2      LYS  31  11.450   0.671  -0.683
  255    HD3  LYS  31           HD1      LYS  31  10.011   1.653  -0.799
  256    HE2  LYS  31           HE2      LYS  31  10.696  -0.579  -2.723
  257    HE3  LYS  31           HE1      LYS  31   9.723  -0.813  -1.283
  258    HZ1  LYS  31           HZ1      LYS  31   8.360  -0.621  -3.184
  259    HZ2  LYS  31           HZ2      LYS  31   8.997   0.830  -3.686
  260    HZ3  LYS  31           HZ3      LYS  31   8.075   0.758  -2.260
  261    H    LEU  32           HN       LEU  32  10.270   5.820  -3.659
  262    HA   LEU  32           HA       LEU  32  11.901   6.543  -1.421
  263    HB2  LEU  32           HB2      LEU  32  12.776   8.275  -2.665
  264    HB3  LEU  32           HB1      LEU  32  12.194   7.225  -3.939
  265    HG   LEU  32           HG       LEU  32  10.702   9.643  -2.936
  266   HD11  LEU  32          HD11      LEU  32  12.397   9.289  -5.382
  267   HD12  LEU  32          HD12      LEU  32  12.774  10.295  -3.980
  268   HD13  LEU  32          HD13      LEU  32  11.399  10.695  -5.009
  269   HD21  LEU  32          HD21      LEU  32  10.308   7.838  -5.294
  270   HD22  LEU  32          HD22      LEU  32   9.414   9.349  -4.993
  271   HD23  LEU  32          HD23      LEU  32   9.287   7.990  -3.857
  272    H    TYR  33           HN       TYR  33   8.614   6.968  -2.085
  273    HA   TYR  33           HA       TYR  33   8.331   9.310  -0.613
  274    HB2  TYR  33           HB2      TYR  33   6.455   8.665  -1.995
  275    HB3  TYR  33           HB1      TYR  33   6.287   7.134  -1.135
  276    HD1  TYR  33           HD1      TYR  33   5.945  10.814  -0.739
  277    HD2  TYR  33           HD2      TYR  33   4.985   6.982   0.840
  278    HE1  TYR  33           HE1      TYR  33   4.443  11.860   0.902
  279    HE2  TYR  33           HE2      TYR  33   3.486   8.015   2.469
  280    HH   TYR  33           HH       TYR  33   3.159  10.084   3.538
  281    H    LEU  34           HN       LEU  34   8.532   5.961   0.247
  282    HA   LEU  34           HA       LEU  34   8.144   6.687   3.047
  283    HB2  LEU  34           HB2      LEU  34   7.381   4.333   3.431
  284    HB3  LEU  34           HB1      LEU  34   6.349   5.306   2.415
  285    HG   LEU  34           HG       LEU  34   7.488   4.063   0.443
  286   HD11  LEU  34          HD11      LEU  34   8.081   2.116   2.657
  287   HD12  LEU  34          HD12      LEU  34   9.267   2.973   1.676
  288   HD13  LEU  34          HD13      LEU  34   8.191   1.791   0.927
  289   HD21  LEU  34          HD21      LEU  34   5.834   2.299   0.577
  290   HD22  LEU  34          HD22      LEU  34   5.146   3.837   1.096
  291   HD23  LEU  34          HD23      LEU  34   5.606   2.622   2.291
  292    H    GLY  35           HN       GLY  35  10.163   4.662   0.981
  293    HA2  GLY  35           HA3      GLY  35  11.468   3.494   3.195
  294    HA3  GLY  35           HA2      GLY  35  11.941   3.316   1.516
  295    H    THR  36           HN       THR  36  12.118   6.342   1.331
  296    HA   THR  36           HA       THR  36  14.777   6.545   2.531
  297    HB   THR  36           HB       THR  36  15.165   8.335   0.859
  298    HG1  THR  36           HG1      THR  36  13.546   9.211  -0.103
  299   HG21  THR  36          HG21      THR  36  13.894   5.886  -0.363
  300   HG22  THR  36          HG22      THR  36  15.604   6.039   0.081
  301   HG23  THR  36          HG23      THR  36  14.913   7.025  -1.216
  302    H    ALA  37           HN       ALA  37  11.683   7.326   3.277
  303    HA   ALA  37           HA       ALA  37  11.957  10.121   3.885
  304    HB1  ALA  37           HB1      ALA  37   9.733   8.223   4.641
  305    HB2  ALA  37           HB2      ALA  37   9.792   9.184   3.174
  306    HB3  ALA  37           HB3      ALA  37   9.679   9.981   4.738
  307    H    THR  38           HN       THR  38  12.114  11.104   5.881
  308    HA   THR  38           HA       THR  38  13.561   9.739   7.862
  309    HB   THR  38           HB       THR  38  13.161  11.947   9.090
  310    HG1  THR  38           HG1      THR  38  11.579  13.045   8.249
  311   HG21  THR  38          HG21      THR  38  15.189  11.494   7.759
  312   HG22  THR  38          HG22      THR  38  14.683  13.176   7.583
  313   HG23  THR  38          HG23      THR  38  14.345  12.014   6.301
  314    H    GLU  39           HN       GLU  39  10.314  10.364   7.290
  315    HA   GLU  39           HA       GLU  39   9.110  10.426   9.808
  316    HB2  GLU  39           HB3      GLU  39   7.948   9.402   7.234
  317    HB3  GLU  39           HB2      GLU  39   7.057  10.014   8.623
  318    HG2  GLU  39           HG3      GLU  39   8.019  12.216   8.300
  319    HG3  GLU  39           HG2      GLU  39   8.980  11.596   6.961
  320    H    LEU  40           HN       LEU  40  10.416   7.774   8.121
  321    HA   LEU  40           HA       LEU  40   8.905   5.835   9.753
  322    HB2  LEU  40           HB2      LEU  40  10.656   5.403   7.383
  323    HB3  LEU  40           HB1      LEU  40   9.774   4.197   8.306
  324    HG   LEU  40           HG       LEU  40   8.659   6.379   6.546
  325   HD11  LEU  40          HD11      LEU  40   9.412   4.577   5.257
  326   HD12  LEU  40          HD12      LEU  40   7.644   4.429   5.367
  327   HD13  LEU  40          HD13      LEU  40   8.691   3.411   6.355
  328   HD21  LEU  40          HD21      LEU  40   6.436   5.499   7.025
  329   HD22  LEU  40          HD22      LEU  40   7.208   6.171   8.462
  330   HD23  LEU  40          HD23      LEU  40   7.115   4.420   8.251
  331    H    GLY  41           HN       GLY  41  11.395   7.497  10.129
  332    HA2  GLY  41           HA3      GLY  41  13.004   7.175  11.899
  333    HA3  GLY  41           HA2      GLY  41  12.870   5.440  11.640
  334    H    GLU  42           HN       GLU  42  13.361   7.970   9.290
  335    HA   GLU  42           HA       GLU  42  14.966   8.505   7.793
  336    HB2  GLU  42           HB3      GLU  42  16.740   7.061   9.716
  337    HB3  GLU  42           HB2      GLU  42  17.342   7.950   8.314
  338    HG2  GLU  42           HG3      GLU  42  16.345   9.994   9.198
  339    HG3  GLU  42           HG2      GLU  42  15.732   9.095  10.585
  340    H    GLY  43           HN       GLY  43  13.893   5.518   8.087
  341    HA2  GLY  43           HA3      GLY  43  13.830   4.626   5.660
  342    HA3  GLY  43           HA2      GLY  43  15.564   4.483   5.923
  343    H    LYS  44           HN       LYS  44  12.494   3.062   6.415
  344    HA   LYS  44           HA       LYS  44  13.305   1.258   8.451
  345    HB2  LYS  44           HB2      LYS  44  11.028   2.202   8.164
  346    HB3  LYS  44           HB1      LYS  44  10.922   1.408   6.611
  347    HG2  LYS  44           HG2      LYS  44   9.686   0.174   8.156
  348    HG3  LYS  44           HG1      LYS  44  11.157  -0.716   7.712
  349    HD2  LYS  44           HD2      LYS  44  10.735  -0.933  10.136
  350    HD3  LYS  44           HD1      LYS  44  12.221  -0.046   9.826
  351    HE2  LYS  44           HE2      LYS  44  11.013   2.076  10.213
  352    HE3  LYS  44           HE1      LYS  44   9.538   1.161  10.517
  353    HZ1  LYS  44           HZ1      LYS  44  10.634   1.831  12.556
  354    HZ2  LYS  44           HZ2      LYS  44  12.030   1.018  12.133
  355    HZ3  LYS  44           HZ3      LYS  44  10.622   0.153  12.441
  356    H    ILE  45           HN       ILE  45  13.680   1.574   5.151
  357    HA   ILE  45           HA       ILE  45  13.632  -1.211   4.377
  358    HB   ILE  45           HB       ILE  45  14.214   1.376   2.935
  359   HG12  ILE  45          HG12      ILE  45  11.862   1.002   3.506
  360   HG13  ILE  45          HG11      ILE  45  12.113   0.952   1.767
  361   HG21  ILE  45          HG21      ILE  45  15.575  -0.416   1.967
  362   HG22  ILE  45          HG22      ILE  45  14.380   0.228   0.864
  363   HG23  ILE  45          HG23      ILE  45  14.112  -1.342   1.625
  364   HD11  ILE  45          HD11      ILE  45  11.771  -1.460   3.566
  365   HD12  ILE  45          HD12      ILE  45  12.036  -1.456   1.807
  366   HD13  ILE  45          HD13      ILE  45  10.562  -0.768   2.475
  367    HA   PRO  46           HA       PRO  46  18.038  -1.799   5.055
  368    HB2  PRO  46           HB2      PRO  46  18.407  -4.003   3.524
  369    HB3  PRO  46           HB1      PRO  46  17.541  -4.055   5.067
  370    HG2  PRO  46           HG2      PRO  46  16.438  -3.887   2.289
  371    HG3  PRO  46           HG1      PRO  46  15.948  -4.954   3.620
  372    HD2  PRO  46           HD2      PRO  46  14.597  -2.719   3.021
  373    HD3  PRO  46           HD1      PRO  46  14.777  -3.283   4.694
  374    H    TRP  47           HN       TRP  47  19.829  -2.823   3.282
  375    HA   TRP  47           HA       TRP  47  20.911  -0.675   2.048
  376    HB2  TRP  47           HB2      TRP  47  22.471  -2.201   0.877
  377    HB3  TRP  47           HB1      TRP  47  22.249  -2.617   2.566
  378    HD1  TRP  47           HD1      TRP  47  21.745  -3.974  -0.961
  379    HE1  TRP  47           HE1      TRP  47  21.076  -6.461  -0.841
  380    HE3  TRP  47           HE3      TRP  47  21.013  -4.398   4.087
  381    HZ2  TRP  47           HZ2      TRP  47  20.356  -8.342   1.117
  382    HZ3  TRP  47           HZ3      TRP  47  20.342  -6.582   4.997
  383    HH2  TRP  47           HH2      TRP  47  20.022  -8.508   3.542
  384    H    GLY  48           HN       GLY  48  19.188  -3.161   0.154
  385    HA2  GLY  48           HA3      GLY  48  18.104  -1.230  -1.636
  386    HA3  GLY  48           HA2      GLY  48  19.528  -1.983  -2.342
  387    H    SER  49           HN       SER  49  17.420  -3.636  -0.157
  388    HA   SER  49           HA       SER  49  17.094  -5.854  -1.896
  389    HB2  SER  49           HB2      SER  49  15.707  -5.115   0.652
  390    HB3  SER  49           HB1      SER  49  15.841  -6.742  -0.038
  391    HG   SER  49           HG       SER  49  18.045  -6.679   0.311
  392    H    MET  50           HN       MET  50  15.462  -2.902  -1.621
  393    HA   MET  50           HA       MET  50  12.806  -3.979  -2.206
  394    HB2  MET  50           HB2      MET  50  11.982  -1.862  -1.518
  395    HB3  MET  50           HB1      MET  50  13.193  -2.343  -0.343
  396    HG2  MET  50           HG2      MET  50  13.461  -0.278  -2.510
  397    HG3  MET  50           HG1      MET  50  13.388  -0.010  -0.796
  398    HE1  MET  50           HE1      MET  50  15.666   1.233  -2.720
  399    HE2  MET  50           HE2      MET  50  17.081   1.046  -1.681
  400    HE3  MET  50           HE3      MET  50  15.546   1.571  -0.995
  401    H    GLU  51           HN       GLU  51  15.485  -3.010  -3.715
  402    HA   GLU  51           HA       GLU  51  14.311  -1.397  -5.830
  403    HB2  GLU  51           HB3      GLU  51  16.406  -1.024  -4.559
  404    HB3  GLU  51           HB2      GLU  51  17.104  -2.399  -5.383
  405    HG2  GLU  51           HG3      GLU  51  17.864  -0.443  -6.457
  406    HG3  GLU  51           HG2      GLU  51  16.717  -1.248  -7.540
  407    H    LYS  52           HN       LYS  52  15.017  -4.583  -5.011
  408    HA   LYS  52           HA       LYS  52  14.999  -5.563  -7.798
  409    HB2  LYS  52           HB2      LYS  52  16.168  -6.787  -5.284
  410    HB3  LYS  52           HB1      LYS  52  16.152  -7.560  -6.862
  411    HG2  LYS  52           HG2      LYS  52  17.497  -4.925  -6.326
  412    HG3  LYS  52           HG1      LYS  52  18.321  -6.478  -6.203
  413    HD2  LYS  52           HD2      LYS  52  16.865  -5.638  -8.694
  414    HD3  LYS  52           HD1      LYS  52  18.542  -5.201  -8.413
  415    HE2  LYS  52           HE2      LYS  52  17.450  -8.015  -8.469
  416    HE3  LYS  52           HE1      LYS  52  18.329  -7.231  -9.775
  417    HZ1  LYS  52           HZ1      LYS  52  19.402  -7.825  -7.067
  418    HZ2  LYS  52           HZ2      LYS  52  20.229  -7.000  -8.272
  419    HZ3  LYS  52           HZ3      LYS  52  19.802  -8.611  -8.500
  420    H    ALA  53           HN       ALA  53  12.884  -4.801  -5.899
  421    HA   ALA  53           HA       ALA  53  11.642  -7.370  -5.276
  422    HB1  ALA  53           HB1      ALA  53  11.990  -5.956  -3.377
  423    HB2  ALA  53           HB2      ALA  53  10.251  -5.942  -3.724
  424    HB3  ALA  53           HB3      ALA  53  11.291  -4.587  -4.202
  425    H    GLY  54           HN       GLY  54   9.666  -7.896  -6.233
  426    HA2  GLY  54           HA3      GLY  54   8.598  -6.059  -8.206
  427    HA3  GLY  54           HA2      GLY  54   8.335  -7.811  -8.076
  428    HA   PRO  55           HA       PRO  55   4.670  -5.375  -6.286
  429    HB2  PRO  55           HB2      PRO  55   3.441  -7.815  -7.453
  430    HB3  PRO  55           HB1      PRO  55   2.863  -6.145  -7.472
  431    HG2  PRO  55           HG2      PRO  55   3.952  -7.221  -9.656
  432    HG3  PRO  55           HG1      PRO  55   4.266  -5.534  -9.213
  433    HD2  PRO  55           HD2      PRO  55   6.098  -7.910  -8.934
  434    HD3  PRO  55           HD1      PRO  55   6.462  -6.212  -9.280
  435    H    LEU  56           HN       LEU  56   5.231  -8.846  -6.385
  436    HA   LEU  56           HA       LEU  56   3.824  -9.460  -3.967
  437    HB2  LEU  56           HB2      LEU  56   4.175 -11.091  -5.761
  438    HB3  LEU  56           HB1      LEU  56   5.898 -11.040  -5.482
  439    HG   LEU  56           HG       LEU  56   5.497 -11.950  -3.201
  440   HD11  LEU  56          HD11      LEU  56   2.694 -12.314  -4.232
  441   HD12  LEU  56          HD12      LEU  56   3.199 -11.263  -2.909
  442   HD13  LEU  56          HD13      LEU  56   3.348 -13.014  -2.748
  443   HD21  LEU  56          HD21      LEU  56   6.203 -13.320  -5.059
  444   HD22  LEU  56          HD22      LEU  56   4.525 -13.573  -5.535
  445   HD23  LEU  56          HD23      LEU  56   5.117 -14.229  -4.002
  446    H    GLU  57           HN       GLU  57   7.262  -9.131  -4.763
  447    HA   GLU  57           HA       GLU  57   8.144  -9.607  -2.131
  448    HB2  GLU  57           HB3      GLU  57   9.440  -8.576  -4.586
  449    HB3  GLU  57           HB2      GLU  57  10.241  -8.295  -3.046
  450    HG2  GLU  57           HG3      GLU  57   9.382 -10.977  -4.084
  451    HG3  GLU  57           HG2      GLU  57  11.028 -10.330  -4.152
  452    H    MET  58           HN       MET  58   7.006  -6.806  -3.703
  453    HA   MET  58           HA       MET  58   7.874  -4.911  -1.772
  454    HB2  MET  58           HB2      MET  58   5.575  -4.907  -3.721
  455    HB3  MET  58           HB1      MET  58   5.955  -3.521  -2.710
  456    HG2  MET  58           HG2      MET  58   8.029  -4.776  -4.401
  457    HG3  MET  58           HG1      MET  58   6.896  -3.679  -5.179
  458    HE1  MET  58           HE1      MET  58   8.896  -2.262  -6.037
  459    HE2  MET  58           HE2      MET  58  10.039  -3.364  -5.292
  460    HE3  MET  58           HE3      MET  58  10.190  -1.631  -5.017
  461    H    ALA  59           HN       ALA  59   4.824  -6.650  -2.270
  462    HA   ALA  59           HA       ALA  59   3.532  -5.730   0.009
  463    HB1  ALA  59           HB1      ALA  59   3.301  -8.434  -1.298
  464    HB2  ALA  59           HB2      ALA  59   2.435  -6.976  -1.776
  465    HB3  ALA  59           HB3      ALA  59   2.119  -7.714  -0.205
  466    H    GLN  60           HN       GLN  60   5.590  -8.519  -0.465
  467    HA   GLN  60           HA       GLN  60   5.451  -9.367   2.245
  468    HB2  GLN  60           HB2      GLN  60   7.322 -10.201   0.020
  469    HB3  GLN  60           HB1      GLN  60   7.161 -11.032   1.563
  470    HG2  GLN  60           HG2      GLN  60   4.805 -11.465   1.095
  471    HG3  GLN  60           HG1      GLN  60   4.951 -10.604  -0.417
  472   HE21  GLN  60          HE21      GLN  60   7.582 -11.784  -1.141
  473   HE22  GLN  60          HE22      GLN  60   7.229 -13.415  -1.538
  474    H    LEU  61           HN       LEU  61   7.058  -6.877   0.827
  475    HA   LEU  61           HA       LEU  61   9.469  -6.846   2.456
  476    HB2  LEU  61           HB2      LEU  61   9.252  -5.891   0.099
  477    HB3  LEU  61           HB1      LEU  61   8.222  -4.670   0.814
  478    HG   LEU  61           HG       LEU  61  10.191  -3.994   2.223
  479   HD11  LEU  61          HD11      LEU  61  11.627  -5.679   0.193
  480   HD12  LEU  61          HD12      LEU  61  11.528  -6.028   1.922
  481   HD13  LEU  61          HD13      LEU  61  12.394  -4.596   1.356
  482   HD21  LEU  61          HD21      LEU  61  10.304  -3.740  -0.772
  483   HD22  LEU  61          HD22      LEU  61  11.137  -2.702   0.382
  484   HD23  LEU  61          HD23      LEU  61   9.375  -2.728   0.338
  485    H    LEU  62           HN       LEU  62   6.686  -4.658   1.920
  486    HA   LEU  62           HA       LEU  62   7.162  -3.137   4.201
  487    HB2  LEU  62           HB2      LEU  62   4.565  -3.433   2.665
  488    HB3  LEU  62           HB1      LEU  62   4.838  -2.256   3.919
  489    HG   LEU  62           HG       LEU  62   4.965  -1.060   1.930
  490   HD11  LEU  62          HD11      LEU  62   7.786  -1.633   2.669
  491   HD12  LEU  62          HD12      LEU  62   6.712  -0.385   3.321
  492   HD13  LEU  62          HD13      LEU  62   7.241  -0.306   1.644
  493   HD21  LEU  62          HD21      LEU  62   6.288  -1.657  -0.014
  494   HD22  LEU  62          HD22      LEU  62   5.067  -2.882   0.385
  495   HD23  LEU  62          HD23      LEU  62   6.753  -3.155   0.795
  496    H    ILE  63           HN       ILE  63   5.217  -6.051   3.705
  497    HA   ILE  63           HA       ILE  63   3.815  -5.922   6.144
  498    HB   ILE  63           HB       ILE  63   3.549  -7.437   3.958
  499   HG12  ILE  63          HG12      ILE  63   1.941  -7.215   5.789
  500   HG13  ILE  63          HG11      ILE  63   1.916  -8.812   5.075
  501   HG21  ILE  63          HG21      ILE  63   5.004  -9.331   5.781
  502   HG22  ILE  63          HG22      ILE  63   5.579  -8.719   4.240
  503   HG23  ILE  63          HG23      ILE  63   4.165  -9.780   4.292
  504   HD11  ILE  63          HD11      ILE  63   1.678  -8.991   7.466
  505   HD12  ILE  63          HD12      ILE  63   3.121  -8.010   7.715
  506   HD13  ILE  63          HD13      ILE  63   3.265  -9.622   7.010
  507    H    THR  64           HN       THR  64   7.033  -6.939   5.368
  508    HA   THR  64           HA       THR  64   7.387  -8.316   7.877
  509    HB   THR  64           HB       THR  64   9.366  -7.758   5.654
  510    HG1  THR  64           HG1      THR  64   8.122  -9.214   4.734
  511   HG21  THR  64          HG21      THR  64  10.429  -8.233   7.845
  512   HG22  THR  64          HG22      THR  64  10.705  -9.526   6.686
  513   HG23  THR  64          HG23      THR  64   9.495  -9.723   7.957
  514    H    HIS  65           HN       HIS  65   8.372  -5.322   6.323
  515    HA   HIS  65           HA       HIS  65  10.093  -4.581   8.475
  516    HB2  HIS  65           HB2      HIS  65   9.168  -3.075   6.057
  517    HB3  HIS  65           HB1      HIS  65  10.168  -2.339   7.307
  518    HD1  HIS  65           HD1      HIS  65  12.581  -3.606   7.714
  519    HD2  HIS  65           HD2      HIS  65  10.512  -4.535   4.230
  520    HE1  HIS  65           HE1      HIS  65  14.214  -4.766   6.229
  521    H    PHE  66           HN       PHE  66   6.945  -3.442   7.376
  522    HA   PHE  66           HA       PHE  66   6.617  -1.841   9.763
  523    HB2  PHE  66           HB2      PHE  66   4.794  -2.271   7.399
  524    HB3  PHE  66           HB1      PHE  66   4.570  -1.073   8.673
  525    HD1  PHE  66           HD2      PHE  66   6.675  -2.123   5.901
  526    HD2  PHE  66           HD1      PHE  66   5.788   0.939   8.673
  527    HE1  PHE  66           HE2      PHE  66   8.160  -0.650   4.687
  528    HE2  PHE  66           HE1      PHE  66   7.290   2.452   7.465
  529    HZ   PHE  66           HZ       PHE  66   8.490   1.611   5.439
  530    H    GLY  67           HN       GLY  67   4.283  -3.942   8.170
  531    HA2  GLY  67           HA3      GLY  67   3.912  -5.877  10.020
  532    HA3  GLY  67           HA2      GLY  67   3.000  -4.492  10.635
  533    HA   PRO  68           HA       PRO  68   0.669  -6.976   7.354
  534    HB2  PRO  68           HB2      PRO  68  -1.584  -7.290   8.931
  535    HB3  PRO  68           HB1      PRO  68  -0.317  -8.497   8.728
  536    HG2  PRO  68           HG2      PRO  68  -0.724  -6.527  10.931
  537    HG3  PRO  68           HG1      PRO  68  -0.169  -8.212  11.019
  538    HD2  PRO  68           HD2      PRO  68   1.503  -6.122  11.243
  539    HD3  PRO  68           HD1      PRO  68   2.010  -7.622  10.455
  540    H    GLU  69           HN       GLU  69  -0.837  -4.747   9.677
  541    HA   GLU  69           HA       GLU  69  -2.580  -3.756   7.579
  542    HB2  GLU  69           HB3      GLU  69  -2.377  -3.038  10.494
  543    HB3  GLU  69           HB2      GLU  69  -3.618  -2.479   9.387
  544    HG2  GLU  69           HG3      GLU  69  -4.466  -4.691   9.104
  545    HG3  GLU  69           HG2      GLU  69  -3.131  -5.368  10.040
  546    H    GLU  70           HN       GLU  70   0.265  -2.878   9.306
  547    HA   GLU  70           HA       GLU  70   0.190  -0.120   8.724
  548    HB2  GLU  70           HB3      GLU  70   1.589  -1.231  10.490
  549    HB3  GLU  70           HB2      GLU  70   2.664  -1.779   9.208
  550    HG2  GLU  70           HG3      GLU  70   3.544   0.214  10.236
  551    HG3  GLU  70           HG2      GLU  70   3.054   0.572   8.580
  552    H    ALA  71           HN       ALA  71   1.805  -2.894   7.189
  553    HA   ALA  71           HA       ALA  71   2.955  -1.661   4.976
  554    HB1  ALA  71           HB1      ALA  71   2.706  -3.820   3.853
  555    HB2  ALA  71           HB2      ALA  71   1.591  -4.346   5.114
  556    HB3  ALA  71           HB3      ALA  71   3.274  -4.006   5.506
  557    H    TRP  72           HN       TRP  72  -0.317  -2.822   5.490
  558    HA   TRP  72           HA       TRP  72  -1.262  -2.322   2.931
  559    HB2  TRP  72           HB2      TRP  72  -2.507  -3.770   4.422
  560    HB3  TRP  72           HB1      TRP  72  -2.750  -2.454   5.565
  561    HD1  TRP  72           HD1      TRP  72  -5.276  -1.942   5.505
  562    HE1  TRP  72           HE1      TRP  72  -6.990  -1.439   3.632
  563    HE3  TRP  72           HE3      TRP  72  -2.350  -2.814   1.427
  564    HZ2  TRP  72           HZ2      TRP  72  -7.059  -1.397   0.879
  565    HZ3  TRP  72           HZ3      TRP  72  -3.322  -2.529  -0.813
  566    HH2  TRP  72           HH2      TRP  72  -5.637  -1.834  -1.079
  567    H    ARG  73           HN       ARG  73  -1.279  -0.310   5.818
  568    HA   ARG  73           HA       ARG  73  -2.631   1.790   4.583
  569    HB2  ARG  73           HB2      ARG  73  -2.489   1.619   7.031
  570    HB3  ARG  73           HB1      ARG  73  -0.765   1.922   6.961
  571    HG2  ARG  73           HG2      ARG  73  -1.141   4.153   6.095
  572    HG3  ARG  73           HG1      ARG  73  -2.876   3.869   6.056
  573    HD2  ARG  73           HD2      ARG  73  -2.289   5.184   7.990
  574    HD3  ARG  73           HD1      ARG  73  -2.870   3.605   8.491
  575    HE   ARG  73           HE       ARG  73  -0.370   3.039   8.715
  576   HH11  ARG  73          HH11      ARG  73  -1.455   6.380   9.030
  577   HH12  ARG  73          HH12      ARG  73  -0.400   6.738  10.324
  578   HH21  ARG  73          HH21      ARG  73   1.035   3.500  10.371
  579   HH22  ARG  73          HH22      ARG  73   1.107   5.042  11.126
  580    H    LEU  74           HN       LEU  74   0.818   1.169   5.086
  581    HA   LEU  74           HA       LEU  74   1.864   3.479   3.964
  582    HB2  LEU  74           HB2      LEU  74   2.880   0.746   4.476
  583    HB3  LEU  74           HB1      LEU  74   3.767   1.683   3.304
  584    HG   LEU  74           HG       LEU  74   4.722   1.745   5.620
  585   HD11  LEU  74          HD11      LEU  74   5.076   4.169   5.712
  586   HD12  LEU  74          HD12      LEU  74   3.831   4.388   4.480
  587   HD13  LEU  74          HD13      LEU  74   5.310   3.501   4.108
  588   HD21  LEU  74          HD21      LEU  74   2.617   1.750   6.879
  589   HD22  LEU  74          HD22      LEU  74   2.265   3.369   6.269
  590   HD23  LEU  74          HD23      LEU  74   3.653   3.106   7.323
  591    H    ALA  75           HN       ALA  75   0.652   0.597   2.383
  592    HA   ALA  75           HA       ALA  75   1.606   1.428  -0.191
  593    HB1  ALA  75           HB1      ALA  75   1.203  -0.927   0.272
  594    HB2  ALA  75           HB2      ALA  75   0.266  -0.350  -1.101
  595    HB3  ALA  75           HB3      ALA  75  -0.519  -0.591   0.463
  596    H    LEU  76           HN       LEU  76  -1.682   1.346   1.186
  597    HA   LEU  76           HA       LEU  76  -2.746   2.565  -1.097
  598    HB2  LEU  76           HB2      LEU  76  -4.845   2.813   0.093
  599    HB3  LEU  76           HB1      LEU  76  -4.155   1.244   0.405
  600    HG   LEU  76           HG       LEU  76  -3.318   2.377   2.624
  601   HD11  LEU  76          HD11      LEU  76  -5.682   4.063   1.914
  602   HD12  LEU  76          HD12      LEU  76  -4.017   4.631   2.081
  603   HD13  LEU  76          HD13      LEU  76  -4.898   4.025   3.497
  604   HD21  LEU  76          HD21      LEU  76  -4.845   0.516   2.535
  605   HD22  LEU  76          HD22      LEU  76  -6.182   1.604   2.172
  606   HD23  LEU  76          HD23      LEU  76  -5.371   1.691   3.740
  607    H    SER  77           HN       SER  77  -1.539   3.999   1.845
  608    HA   SER  77           HA       SER  77  -2.499   6.616   1.295
  609    HB2  SER  77           HB2      SER  77  -1.932   5.669   3.549
  610    HB3  SER  77           HB1      SER  77  -0.238   5.725   3.111
  611    HG   SER  77           HG       SER  77  -1.816   8.056   2.953
  612    H    THR  78           HN       THR  78   0.318   4.795   0.256
  613    HA   THR  78           HA       THR  78   1.627   7.201  -0.608
  614    HB   THR  78           HB       THR  78   2.376   4.295  -1.042
  615    HG1  THR  78           HG1      THR  78   2.835   4.552   0.987
  616   HG21  THR  78          HG21      THR  78   4.610   5.194  -1.602
  617   HG22  THR  78          HG22      THR  78   3.962   6.833  -1.498
  618   HG23  THR  78          HG23      THR  78   3.384   5.732  -2.752
  619    H    PHE  79           HN       PHE  79  -0.443   4.704  -1.888
  620    HA   PHE  79           HA       PHE  79  -0.084   4.967  -4.612
  621    HB2  PHE  79           HB2      PHE  79  -2.708   4.587  -3.149
  622    HB3  PHE  79           HB1      PHE  79  -2.526   4.431  -4.886
  623    HD1  PHE  79           HD1      PHE  79   0.347   3.039  -4.300
  624    HD2  PHE  79           HD2      PHE  79  -3.694   2.370  -3.154
  625    HE1  PHE  79           HE1      PHE  79   0.834   0.690  -3.982
  626    HE2  PHE  79           HE2      PHE  79  -3.212  -0.010  -2.827
  627    HZ   PHE  79           HZ       PHE  79  -0.945  -0.868  -3.244
  628    H    GLU  80           HN       GLU  80  -2.319   6.792  -2.553
  629    HA   GLU  80           HA       GLU  80  -3.224   8.442  -4.645
  630    HB2  GLU  80           HB3      GLU  80  -4.174   9.888  -2.850
  631    HB3  GLU  80           HB2      GLU  80  -4.583   8.191  -2.704
  632    HG2  GLU  80           HG3      GLU  80  -3.536   7.993  -0.754
  633    HG3  GLU  80           HG2      GLU  80  -2.204   9.042  -1.237
  634    H    ARG  81           HN       ARG  81  -0.377   8.613  -2.754
  635    HA   ARG  81           HA       ARG  81  -0.055  11.422  -3.370
  636    HB2  ARG  81           HB2      ARG  81   1.525   9.604  -1.564
  637    HB3  ARG  81           HB1      ARG  81   1.897  11.313  -1.824
  638    HG2  ARG  81           HG2      ARG  81  -0.212  11.990  -1.007
  639    HG3  ARG  81           HG1      ARG  81  -0.789  10.333  -0.928
  640    HD2  ARG  81           HD2      ARG  81   0.901   9.912   0.812
  641    HD3  ARG  81           HD1      ARG  81   1.314  11.630   0.767
  642    HE   ARG  81           HE       ARG  81  -1.491  11.007   1.115
  643   HH11  ARG  81          HH11      ARG  81   1.532  11.670   2.868
  644   HH12  ARG  81          HH12      ARG  81   0.731  12.428   4.178
  645   HH21  ARG  81          HH21      ARG  81  -2.543  12.022   2.965
  646   HH22  ARG  81          HH22      ARG  81  -1.605  12.604   4.248
  647    H    ILE  82           HN       ILE  82   0.809   8.492  -4.703
  648    HA   ILE  82           HA       ILE  82   2.864   9.850  -6.275
  649    HB   ILE  82           HB       ILE  82   3.422   7.650  -7.249
  650   HG12  ILE  82          HG12      ILE  82   1.409   6.508  -5.286
  651   HG13  ILE  82          HG11      ILE  82   1.191   6.580  -7.029
  652   HG21  ILE  82          HG21      ILE  82   4.659   8.392  -5.356
  653   HG22  ILE  82          HG22      ILE  82   4.432   6.647  -5.247
  654   HG23  ILE  82          HG23      ILE  82   3.457   7.732  -4.241
  655   HD11  ILE  82          HD11      ILE  82   3.303   5.003  -5.570
  656   HD12  ILE  82          HD12      ILE  82   3.089   5.061  -7.319
  657   HD13  ILE  82          HD13      ILE  82   1.837   4.349  -6.302
  658    H    ASN  83           HN       ASN  83  -0.061  10.164  -6.238
  659    HA   ASN  83           HA       ASN  83  -1.650  10.849  -7.620
  660    HB2  ASN  83           HB3      ASN  83   0.400  10.425  -9.808
  661    HB3  ASN  83           HB2      ASN  83  -1.169  11.194 -10.028
  662   HD21  ASN  83          HD21      ASN  83  -1.161  12.643  -7.519
  663   HD22  ASN  83          HD22      ASN  83   0.028  13.869  -7.643
  664    H    ARG  84           HN       ARG  84  -1.543   8.218  -6.785
  665    HA   ARG  84           HA       ARG  84  -3.200   7.034  -8.862
  666    HB2  ARG  84           HB2      ARG  84  -1.075   5.785  -8.694
  667    HB3  ARG  84           HB1      ARG  84  -1.280   5.642  -6.966
  668    HG2  ARG  84           HG2      ARG  84  -1.761   3.579  -8.337
  669    HG3  ARG  84           HG1      ARG  84  -3.019   4.065  -7.195
  670    HD2  ARG  84           HD2      ARG  84  -3.936   3.404  -9.367
  671    HD3  ARG  84           HD1      ARG  84  -4.265   5.077  -8.914
  672    HE   ARG  84           HE       ARG  84  -2.040   5.301 -10.418
  673   HH11  ARG  84          HH11      ARG  84  -5.158   3.679 -11.124
  674   HH12  ARG  84          HH12      ARG  84  -5.023   3.969 -12.784
  675   HH21  ARG  84          HH21      ARG  84  -1.927   5.675 -12.664
  676   HH22  ARG  84          HH22      ARG  84  -3.165   5.114 -13.696
  677    H    LYS  85           HN       LYS  85  -4.696   8.471  -7.595
  678    HA   LYS  85           HA       LYS  85  -5.432   7.636  -4.928
  679    HB2  LYS  85           HB2      LYS  85  -5.519  10.013  -5.694
  680    HB3  LYS  85           HB1      LYS  85  -6.789   9.579  -6.821
  681    HG2  LYS  85           HG2      LYS  85  -8.250   8.965  -4.983
  682    HG3  LYS  85           HG1      LYS  85  -6.959   9.317  -3.835
  683    HD2  LYS  85           HD2      LYS  85  -8.177  11.345  -5.705
  684    HD3  LYS  85           HD1      LYS  85  -8.663  11.128  -4.026
  685    HE2  LYS  85           HE2      LYS  85  -5.868  11.866  -4.932
  686    HE3  LYS  85           HE1      LYS  85  -7.085  13.005  -4.384
  687    HZ1  LYS  85           HZ1      LYS  85  -5.520  12.438  -2.660
  688    HZ2  LYS  85           HZ2      LYS  85  -5.964  10.823  -2.635
  689    HZ3  LYS  85           HZ3      LYS  85  -7.062  12.020  -2.212
  690    H    ASP  86           HN       ASP  86  -6.188   7.003  -8.127
  691    HA   ASP  86           HA       ASP  86  -8.667   5.930  -8.226
  692    HB2  ASP  86           HB2      ASP  86  -7.642   6.029 -10.262
  693    HB3  ASP  86           HB1      ASP  86  -6.101   5.476  -9.645
  694    H    LEU  87           HN       LEU  87  -5.703   4.156  -7.380
  695    HA   LEU  87           HA       LEU  87  -7.232   1.826  -6.632
  696    HB2  LEU  87           HB2      LEU  87  -4.287   2.402  -6.405
  697    HB3  LEU  87           HB1      LEU  87  -5.021   0.893  -5.917
  698    HG   LEU  87           HG       LEU  87  -5.088   1.966  -8.729
  699   HD11  LEU  87          HD11      LEU  87  -3.361   0.309  -9.184
  700   HD12  LEU  87          HD12      LEU  87  -3.313  -0.124  -7.473
  701   HD13  LEU  87          HD13      LEU  87  -2.802   1.481  -7.991
  702   HD21  LEU  87          HD21      LEU  87  -5.762  -0.733  -7.563
  703   HD22  LEU  87          HD22      LEU  87  -5.699  -0.355  -9.277
  704   HD23  LEU  87          HD23      LEU  87  -6.906   0.423  -8.248
  705    H    TRP  88           HN       TRP  88  -5.921   4.563  -5.089
  706    HA   TRP  88           HA       TRP  88  -5.609   3.697  -2.465
  707    HB2  TRP  88           HB2      TRP  88  -4.824   5.844  -3.162
  708    HB3  TRP  88           HB1      TRP  88  -6.425   6.334  -3.643
  709    HD1  TRP  88           HD1      TRP  88  -4.618   5.427  -0.310
  710    HE1  TRP  88           HE1      TRP  88  -5.624   6.890   1.569
  711    HE3  TRP  88           HE3      TRP  88  -8.226   7.831  -2.965
  712    HZ2  TRP  88           HZ2      TRP  88  -7.652   8.788   1.883
  713    HZ3  TRP  88           HZ3      TRP  88  -9.647   9.449  -1.832
  714    HH2  TRP  88           HH2      TRP  88  -9.375   9.929   0.562
  715    H    GLU  89           HN       GLU  89  -8.452   5.093  -4.048
  716    HA   GLU  89           HA       GLU  89 -10.213   4.895  -1.854
  717    HB2  GLU  89           HB3      GLU  89 -10.879   4.854  -4.785
  718    HB3  GLU  89           HB2      GLU  89 -11.992   5.237  -3.481
  719    HG2  GLU  89           HG3      GLU  89 -10.601   7.198  -2.935
  720    HG3  GLU  89           HG2      GLU  89  -9.569   6.797  -4.310
  721    H    ARG  90           HN       ARG  90  -9.225   2.633  -4.268
  722    HA   ARG  90           HA       ARG  90 -11.351   0.747  -3.786
  723    HB2  ARG  90           HB2      ARG  90  -8.738   0.350  -5.236
  724    HB3  ARG  90           HB1      ARG  90 -10.100  -0.759  -5.247
  725    HG2  ARG  90           HG2      ARG  90 -11.450   1.126  -6.275
  726    HG3  ARG  90           HG1      ARG  90  -9.927   1.985  -6.438
  727    HD2  ARG  90           HD2      ARG  90 -10.464   0.856  -8.503
  728    HD3  ARG  90           HD1      ARG  90  -9.023   0.149  -7.763
  729    HE   ARG  90           HE       ARG  90 -11.160  -1.358  -6.885
  730   HH11  ARG  90          HH11      ARG  90  -9.742  -0.549 -10.021
  731   HH12  ARG  90          HH12      ARG  90 -10.164  -2.012 -10.758
  732   HH21  ARG  90          HH21      ARG  90 -11.800  -3.407  -7.936
  733   HH22  ARG  90          HH22      ARG  90 -11.330  -3.670  -9.549
  734    H    GLY  91           HN       GLY  91  -8.317   1.480  -2.491
  735    HA2  GLY  91           HA3      GLY  91  -7.879  -1.031  -1.173
  736    HA3  GLY  91           HA2      GLY  91  -7.007   0.489  -0.902
  737    H    GLN  92           HN       GLN  92  -7.555   1.814   0.643
  738    HA   GLN  92           HA       GLN  92  -8.286   2.453   2.686
  739    HB2  GLN  92           HB2      GLN  92 -10.854   1.907   1.238
  740    HB3  GLN  92           HB1      GLN  92 -10.735   2.840   2.728
  741    HG2  GLN  92           HG2      GLN  92  -9.267   3.510   0.203
  742    HG3  GLN  92           HG1      GLN  92 -10.822   4.207   0.645
  743   HE21  GLN  92          HE21      GLN  92 -10.921   5.645   2.296
  744   HE22  GLN  92          HE22      GLN  92  -9.541   6.380   3.029
  745    H    ARG  93           HN       ARG  93 -10.249   1.988   4.279
  746    HA   ARG  93           HA       ARG  93 -10.643  -0.825   4.703
  747    HB2  ARG  93           HB2      ARG  93  -8.593  -0.178   6.040
  748    HB3  ARG  93           HB1      ARG  93  -9.592   0.983   6.899
  749    HG2  ARG  93           HG2      ARG  93  -9.376  -0.998   8.242
  750    HG3  ARG  93           HG1      ARG  93 -11.038  -0.846   7.635
  751    HD2  ARG  93           HD2      ARG  93 -10.594  -2.426   5.877
  752    HD3  ARG  93           HD1      ARG  93  -8.905  -2.529   6.345
  753    HE   ARG  93           HE       ARG  93 -10.298  -3.270   8.574
  754   HH11  ARG  93          HH11      ARG  93 -10.248  -4.350   5.229
  755   HH12  ARG  93          HH12      ARG  93 -10.547  -5.986   5.577
  756   HH21  ARG  93          HH21      ARG  93 -10.703  -5.567   9.099
  757   HH22  ARG  93          HH22      ARG  93 -10.773  -6.703   7.842
  758    H    GLU  94           HN       GLU  94 -11.014   2.214   6.534
  759    HA   GLU  94           HA       GLU  94 -13.787   2.048   5.954
  760    HB2  GLU  94           HB3      GLU  94 -14.338   2.503   8.401
  761    HB3  GLU  94           HB2      GLU  94 -13.818   0.885   7.977
  762    HG2  GLU  94           HG3      GLU  94 -11.505   1.609   8.763
  763    HG3  GLU  94           HG2      GLU  94 -12.320   3.001   9.480
  764    H    ASP  95           HN       ASP  95 -13.985   3.752   4.829
  765    HA   ASP  95           HA       ASP  95 -12.421   6.064   4.807
  766    HB2  ASP  95           HB2      ASP  95 -15.156   5.566   3.660
  767    HB3  ASP  95           HB1      ASP  95 -14.248   7.040   3.391
  768    H    LEU  96           HN       LEU  96 -12.897   8.154   5.160
  769    HA   LEU  96           HA       LEU  96 -13.439   9.997   6.281
  770    HB2  LEU  96           HB2      LEU  96 -15.567   9.709   5.155
  771    HB3  LEU  96           HB1      LEU  96 -16.160   8.723   6.472
  772    HG   LEU  96           HG       LEU  96 -15.994  10.684   7.981
  773   HD11  LEU  96          HD11      LEU  96 -14.255  11.911   6.822
  774   HD12  LEU  96          HD12      LEU  96 -15.696  12.907   7.016
  775   HD13  LEU  96          HD13      LEU  96 -15.337  12.170   5.454
  776   HD21  LEU  96          HD21      LEU  96 -18.104  10.139   6.914
  777   HD22  LEU  96          HD22      LEU  96 -17.656  11.100   5.504
  778   HD23  LEU  96          HD23      LEU  96 -17.913  11.885   7.062
  779    H    VAL  97           HN       VAL  97 -12.635  10.574   8.105
  780    HA   VAL  97           HA       VAL  97 -11.985  10.688  10.221
  781    HB   VAL  97           HB       VAL  97 -14.532   9.151  10.801
  782   HG11  VAL  97          HG11      VAL  97 -14.297   9.958  13.130
  783   HG12  VAL  97          HG12      VAL  97 -12.725  10.646  12.718
  784   HG13  VAL  97          HG13      VAL  97 -12.964   8.900  12.664
  785   HG21  VAL  97          HG21      VAL  97 -15.402  11.358  11.503
  786   HG22  VAL  97          HG22      VAL  97 -14.967  11.292   9.794
  787   HG23  VAL  97          HG23      VAL  97 -13.901  12.093  10.944
  788    H    ARG  98           HN       ARG  98 -10.353   9.713  11.175
  789    HA   ARG  98           HA       ARG  98  -8.750   8.182  11.623
  790    HB2  ARG  98           HB2      ARG  98 -10.983   6.141  11.355
  791    HB3  ARG  98           HB1      ARG  98  -9.377   5.781  11.964
  792    HG2  ARG  98           HG2      ARG  98  -9.737   7.204  13.872
  793    HG3  ARG  98           HG1      ARG  98 -11.297   7.718  13.221
  794    HD2  ARG  98           HD2      ARG  98 -10.561   4.895  13.991
  795    HD3  ARG  98           HD1      ARG  98 -11.547   5.985  14.964
  796    HE   ARG  98           HE       ARG  98 -13.043   6.027  12.925
  797   HH11  ARG  98          HH11      ARG  98 -11.228   3.177  13.973
  798   HH12  ARG  98          HH12      ARG  98 -12.204   2.076  13.136
  799   HH21  ARG  98          HH21      ARG  98 -14.388   4.482  11.794
  800   HH22  ARG  98          HH22      ARG  98 -13.998   2.814  11.831
  801    H    ASP  99           HN       ASP  99  -9.661   8.975   8.993
  802    HA   ASP  99           HA       ASP  99  -8.680   6.840   7.252
  803    HB2  ASP  99           HB2      ASP  99 -10.724   7.703   6.442
  804    HB3  ASP  99           HB1      ASP  99 -10.266   9.358   6.783
  805    H    THR 100           HN       THR 100  -8.346  10.357   7.219
  806    HA   THR 100           HA       THR 100  -5.567  10.026   6.376
  807    HB   THR 100           HB       THR 100  -6.227  12.597   5.776
  808    HG1  THR 100           HG1      THR 100  -8.518  11.073   5.133
  809   HG21  THR 100          HG21      THR 100  -6.562  11.780   3.469
  810   HG22  THR 100          HG22      THR 100  -6.767  10.141   4.083
  811   HG23  THR 100          HG23      THR 100  -5.208  10.952   4.242
  812    H    VAL 101           HN       VAL 101  -6.813  10.223   9.145
  813    HA   VAL 101           HA       VAL 101  -4.969  12.270  10.163
  814    HB   VAL 101           HB       VAL 101  -6.541  12.776  12.014
  815   HG11  VAL 101          HG11      VAL 101  -8.203  14.063  10.752
  816   HG12  VAL 101          HG12      VAL 101  -7.758  13.181   9.292
  817   HG13  VAL 101          HG13      VAL 101  -6.580  14.228  10.079
  818   HG21  VAL 101          HG21      VAL 101  -8.893  12.027  11.882
  819   HG22  VAL 101          HG22      VAL 101  -7.762  10.695  12.115
  820   HG23  VAL 101          HG23      VAL 101  -8.460  10.980  10.526
  821    H    GLU 102           HN       GLU 102  -5.064   9.297   9.725
  822    HA   GLU 102           HA       GLU 102  -4.561   7.300  10.630
  823    HB2  GLU 102           HB3      GLU 102  -3.237   8.866  12.835
  824    HB3  GLU 102           HB2      GLU 102  -2.889   7.226  12.350
  825    HG2  GLU 102           HG3      GLU 102  -2.029   8.051  10.210
  826    HG3  GLU 102           HG2      GLU 102  -2.330   9.706  10.751
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1 -11.378  -9.890  18.587
    2    H2   GLY   1           HT2      GLY   1 -12.924  -9.369  19.020
    3    H3   GLY   1           HT3      GLY   1 -11.898  -8.374  18.081
    4    HA2  GLY   1           HA2      GLY   1 -12.997 -10.965  17.214
    5    HA3  GLY   1           HA3      GLY   1 -13.584  -9.387  16.701
    6    H    HIS   2           HN       HIS   2 -12.952 -10.772  14.680
    7    HA   HIS   2           HA       HIS   2 -11.757 -11.046  12.861
    8    HB2  HIS   2           HB2      HIS   2 -10.402  -8.548  13.835
    9    HB3  HIS   2           HB1      HIS   2  -9.877  -9.347  12.361
   10    HD1  HIS   2           HD1      HIS   2 -12.078  -6.718  13.388
   11    HD2  HIS   2           HD2      HIS   2 -12.240  -9.774  10.589
   12    HE1  HIS   2           HE1      HIS   2 -13.801  -6.018  11.695
   13    H    MET   3           HN       MET   3 -11.071 -13.038  13.287
   14    HA   MET   3           HA       MET   3  -8.191 -13.215  13.842
   15    HB2  MET   3           HB2      MET   3 -10.284 -15.414  14.016
   16    HB3  MET   3           HB1      MET   3  -8.577 -15.606  14.340
   17    HG2  MET   3           HG2      MET   3  -9.686 -15.568  16.427
   18    HG3  MET   3           HG1      MET   3  -8.863 -14.020  16.267
   19    HE1  MET   3           HE1      MET   3 -11.188 -14.694  18.399
   20    HE2  MET   3           HE2      MET   3 -12.080 -13.171  18.349
   21    HE3  MET   3           HE3      MET   3 -10.316 -13.168  18.310
   22    H    LEU   4           HN       LEU   4 -10.333 -12.931  11.463
   23    HA   LEU   4           HA       LEU   4  -8.775 -14.487   9.615
   24    HB2  LEU   4           HB2      LEU   4 -10.848 -15.339   8.494
   25    HB3  LEU   4           HB1      LEU   4 -10.506 -16.059  10.044
   26    HG   LEU   4           HG       LEU   4 -12.292 -14.544  11.029
   27   HD11  LEU   4          HD11      LEU   4 -13.995 -13.646   9.532
   28   HD12  LEU   4          HD12      LEU   4 -12.971 -14.030   8.145
   29   HD13  LEU   4          HD13      LEU   4 -12.440 -12.842   9.331
   30   HD21  LEU   4          HD21      LEU   4 -14.156 -15.917  10.214
   31   HD22  LEU   4          HD22      LEU   4 -12.730 -16.867  10.618
   32   HD23  LEU   4          HD23      LEU   4 -13.115 -16.532   8.931
   33    H    ARG   5           HN       ARG   5  -9.373 -13.992   7.393
   34    HA   ARG   5           HA       ARG   5  -9.493 -12.656   5.691
   35    HB2  ARG   5           HB2      ARG   5 -11.906 -12.774   6.122
   36    HB3  ARG   5           HB1      ARG   5 -11.799 -11.384   7.184
   37    HG2  ARG   5           HG2      ARG   5 -12.674 -10.658   5.081
   38    HG3  ARG   5           HG1      ARG   5 -11.040 -10.031   5.251
   39    HD2  ARG   5           HD2      ARG   5 -10.365 -12.187   3.942
   40    HD3  ARG   5           HD1      ARG   5 -12.069 -12.187   3.472
   41    HE   ARG   5           HE       ARG   5 -10.423  -9.814   3.131
   42   HH11  ARG   5          HH11      ARG   5 -12.491 -12.300   1.667
   43   HH12  ARG   5          HH12      ARG   5 -12.343 -11.687   0.090
   44   HH21  ARG   5          HH21      ARG   5 -10.249  -8.975   1.001
   45   HH22  ARG   5          HH22      ARG   5 -11.066  -9.714  -0.316
   46    H    THR   6           HN       THR   6 -10.435 -10.025   7.838
   47    HA   THR   6           HA       THR   6  -8.452  -8.517   6.425
   48    HB   THR   6           HB       THR   6 -10.714  -7.548   8.178
   49    HG1  THR   6           HG1      THR   6 -10.364  -8.160   5.452
   50   HG21  THR   6          HG21      THR   6 -10.309  -5.357   7.121
   51   HG22  THR   6          HG22      THR   6  -8.932  -6.025   6.246
   52   HG23  THR   6          HG23      THR   6  -8.874  -5.883   8.001
   53    H    ALA   7           HN       ALA   7  -6.838  -7.303   7.291
   54    HA   ALA   7           HA       ALA   7  -5.199  -6.669   8.626
   55    HB1  ALA   7           HB1      ALA   7  -5.464  -6.561  11.065
   56    HB2  ALA   7           HB2      ALA   7  -6.945  -7.520  10.943
   57    HB3  ALA   7           HB3      ALA   7  -6.879  -5.908  10.242
   58    H    GLY   8           HN       GLY   8  -6.037  -9.540   7.949
   59    HA2  GLY   8           HA3      GLY   8  -3.613 -10.728   9.104
   60    HA3  GLY   8           HA2      GLY   8  -5.111 -11.660   8.962
   61    H    ARG   9           HN       ARG   9  -6.056 -11.810   6.781
   62    HA   ARG   9           HA       ARG   9  -3.989 -12.396   4.866
   63    HB2  ARG   9           HB2      ARG   9  -5.871 -13.936   5.030
   64    HB3  ARG   9           HB1      ARG   9  -7.000 -12.637   4.685
   65    HG2  ARG   9           HG2      ARG   9  -6.204 -12.450   2.433
   66    HG3  ARG   9           HG1      ARG   9  -4.887 -13.580   2.749
   67    HD2  ARG   9           HD2      ARG   9  -7.821 -14.224   2.908
   68    HD3  ARG   9           HD1      ARG   9  -6.771 -14.604   1.539
   69    HE   ARG   9           HE       ARG   9  -5.443 -15.801   3.433
   70   HH11  ARG   9          HH11      ARG   9  -8.959 -15.814   2.901
   71   HH12  ARG   9          HH12      ARG   9  -9.219 -17.319   3.641
   72   HH21  ARG   9          HH21      ARG   9  -5.808 -17.922   4.414
   73   HH22  ARG   9          HH22      ARG   9  -7.390 -18.550   4.499
   74    H    ASP  10           HN       ASP  10  -6.642 -10.080   5.223
   75    HA   ASP  10           HA       ASP  10  -5.878  -8.673   2.843
   76    HB2  ASP  10           HB2      ASP  10  -7.572  -7.586   5.112
   77    HB3  ASP  10           HB1      ASP  10  -7.276  -6.801   3.596
   78    H    GLY  11           HN       GLY  11  -3.781  -8.694   3.340
   79    HA2  GLY  11           HA3      GLY  11  -2.834  -6.160   4.239
   80    HA3  GLY  11           HA2      GLY  11  -2.247  -7.537   5.191
   81    H    LEU  12           HN       LEU  12  -0.978  -9.075   4.274
   82    HA   LEU  12           HA       LEU  12   0.874  -8.256   2.333
   83    HB2  LEU  12           HB2      LEU  12   0.978 -10.100   4.185
   84    HB3  LEU  12           HB1      LEU  12   0.263 -11.133   2.982
   85    HG   LEU  12           HG       LEU  12   2.965  -9.784   2.692
   86   HD11  LEU  12          HD11      LEU  12   2.278 -12.623   3.383
   87   HD12  LEU  12          HD12      LEU  12   2.929 -11.427   4.494
   88   HD13  LEU  12          HD13      LEU  12   3.901 -11.984   3.124
   89   HD21  LEU  12          HD21      LEU  12   3.313 -11.339   0.842
   90   HD22  LEU  12          HD22      LEU  12   1.904 -10.320   0.535
   91   HD23  LEU  12          HD23      LEU  12   1.688 -11.987   1.069
   92    H    CYS  13           HN       CYS  13  -1.859 -10.518   2.086
   93    HA   CYS  13           HA       CYS  13  -1.543 -11.133  -0.652
   94    HB2  CYS  13           HB2      CYS  13  -2.754 -12.530   0.921
   95    HB3  CYS  13           HB1      CYS  13  -3.939 -11.242   1.141
   96    HG   CYS  13           HG       CYS  13  -3.750 -13.599  -1.207
   97    H    ARG  14           HN       ARG  14  -3.452  -8.717   1.040
   98    HA   ARG  14           HA       ARG  14  -4.834  -7.810  -1.258
   99    HB2  ARG  14           HB2      ARG  14  -5.672  -7.360   1.020
  100    HB3  ARG  14           HB1      ARG  14  -4.269  -6.353   1.346
  101    HG2  ARG  14           HG2      ARG  14  -4.980  -4.795  -0.390
  102    HG3  ARG  14           HG1      ARG  14  -6.381  -5.812  -0.720
  103    HD2  ARG  14           HD2      ARG  14  -5.835  -4.628   1.986
  104    HD3  ARG  14           HD1      ARG  14  -6.726  -3.762   0.747
  105    HE   ARG  14           HE       ARG  14  -7.965  -6.212   1.039
  106   HH11  ARG  14          HH11      ARG  14  -7.228  -3.479   3.204
  107   HH12  ARG  14          HH12      ARG  14  -8.708  -3.596   4.061
  108   HH21  ARG  14          HH21      ARG  14  -9.976  -6.317   2.242
  109   HH22  ARG  14          HH22      ARG  14 -10.251  -5.226   3.550
  110    H    LEU  15           HN       LEU  15  -1.820  -6.861   0.299
  111    HA   LEU  15           HA       LEU  15  -1.107  -4.677  -1.308
  112    HB2  LEU  15           HB2      LEU  15   0.564  -6.810  -0.058
  113    HB3  LEU  15           HB1      LEU  15   1.228  -5.330  -0.775
  114    HG   LEU  15           HG       LEU  15  -0.468  -5.618   1.685
  115   HD11  LEU  15          HD11      LEU  15   1.458  -4.825   2.859
  116   HD12  LEU  15          HD12      LEU  15   2.364  -4.689   1.354
  117   HD13  LEU  15          HD13      LEU  15   1.870  -6.278   1.949
  118   HD21  LEU  15          HD21      LEU  15  -1.059  -3.591   0.507
  119   HD22  LEU  15          HD22      LEU  15   0.645  -3.153   0.392
  120   HD23  LEU  15          HD23      LEU  15  -0.144  -3.214   1.971
  121    H    SER  16           HN       SER  16  -0.417  -8.130  -1.624
  122    HA   SER  16           HA       SER  16   1.084  -8.103  -3.945
  123    HB2  SER  16           HB2      SER  16  -0.841 -10.256  -3.018
  124    HB3  SER  16           HB1      SER  16   0.493 -10.481  -4.149
  125    HG   SER  16           HG       SER  16   0.637  -9.835  -1.380
  126    H    THR  17           HN       THR  17  -2.348  -7.807  -3.525
  127    HA   THR  17           HA       THR  17  -2.999  -8.338  -6.257
  128    HB   THR  17           HB       THR  17  -4.661  -7.029  -4.092
  129    HG1  THR  17           HG1      THR  17  -3.718  -9.337  -3.904
  130   HG21  THR  17          HG21      THR  17  -5.555  -6.695  -6.363
  131   HG22  THR  17          HG22      THR  17  -6.573  -7.806  -5.444
  132   HG23  THR  17          HG23      THR  17  -5.453  -8.431  -6.656
  133    H    TYR  18           HN       TYR  18  -2.936  -5.368  -4.233
  134    HA   TYR  18           HA       TYR  18  -3.567  -3.746  -6.506
  135    HB2  TYR  18           HB2      TYR  18  -2.877  -2.973  -3.681
  136    HB3  TYR  18           HB1      TYR  18  -3.234  -1.802  -4.945
  137    HD1  TYR  18           HD1      TYR  18  -5.478  -1.852  -6.049
  138    HD2  TYR  18           HD2      TYR  18  -4.614  -4.123  -2.569
  139    HE1  TYR  18           HE1      TYR  18  -7.880  -2.126  -5.641
  140    HE2  TYR  18           HE2      TYR  18  -7.015  -4.400  -2.149
  141    HH   TYR  18           HH       TYR  18  -9.117  -3.355  -2.705
  142    H    LEU  19           HN       LEU  19  -0.576  -4.586  -4.930
  143    HA   LEU  19           HA       LEU  19   0.827  -2.462  -6.183
  144    HB2  LEU  19           HB2      LEU  19   1.810  -4.933  -4.778
  145    HB3  LEU  19           HB1      LEU  19   2.895  -3.746  -5.471
  146    HG   LEU  19           HG       LEU  19   0.896  -3.157  -3.242
  147   HD11  LEU  19          HD11      LEU  19   3.875  -3.504  -3.145
  148   HD12  LEU  19          HD12      LEU  19   2.679  -4.626  -2.496
  149   HD13  LEU  19          HD13      LEU  19   2.833  -3.006  -1.813
  150   HD21  LEU  19          HD21      LEU  19   3.089  -1.471  -4.460
  151   HD22  LEU  19          HD22      LEU  19   2.098  -1.038  -3.068
  152   HD23  LEU  19          HD23      LEU  19   1.356  -1.206  -4.651
  153    H    GLU  20           HN       GLU  20  -0.323  -5.394  -7.404
  154    HA   GLU  20           HA       GLU  20   1.653  -5.555  -9.498
  155    HB2  GLU  20           HB3      GLU  20  -1.021  -6.938  -9.262
  156    HB3  GLU  20           HB2      GLU  20   0.109  -7.199 -10.579
  157    HG2  GLU  20           HG3      GLU  20   1.779  -7.902  -8.836
  158    HG3  GLU  20           HG2      GLU  20   0.445  -7.883  -7.688
  159    H    GLU  21           HN       GLU  21  -0.965  -3.599  -8.891
  160    HA   GLU  21           HA       GLU  21  -1.667  -3.140 -11.647
  161    HB2  GLU  21           HB3      GLU  21  -2.372  -1.628  -9.132
  162    HB3  GLU  21           HB2      GLU  21  -2.996  -1.241 -10.728
  163    HG2  GLU  21           HG3      GLU  21  -3.457  -3.800  -9.212
  164    HG3  GLU  21           HG2      GLU  21  -4.614  -2.484  -9.411
  165    H    LEU  22           HN       LEU  22   0.838  -2.256  -9.609
  166    HA   LEU  22           HA       LEU  22   1.309   0.260 -11.036
  167    HB2  LEU  22           HB2      LEU  22   2.747  -0.752  -8.561
  168    HB3  LEU  22           HB1      LEU  22   3.007   0.704  -9.501
  169    HG   LEU  22           HG       LEU  22   0.458   0.110  -8.000
  170   HD11  LEU  22          HD11      LEU  22   1.252   1.775  -6.390
  171   HD12  LEU  22          HD12      LEU  22   2.797   1.852  -7.240
  172   HD13  LEU  22          HD13      LEU  22   2.293   0.355  -6.451
  173   HD21  LEU  22          HD21      LEU  22   0.013   2.504  -8.367
  174   HD22  LEU  22          HD22      LEU  22   0.137   1.619  -9.880
  175   HD23  LEU  22          HD23      LEU  22   1.482   2.623  -9.337
  176    H    GLU  23           HN       GLU  23   3.204   0.795 -11.700
  177    HA   GLU  23           HA       GLU  23   4.531  -1.229 -13.266
  178    HB2  GLU  23           HB3      GLU  23   3.759   1.391 -13.583
  179    HB3  GLU  23           HB2      GLU  23   5.471   1.524 -13.204
  180    HG2  GLU  23           HG3      GLU  23   4.299  -0.174 -15.263
  181    HG3  GLU  23           HG2      GLU  23   4.920   1.470 -15.566
  182    H    ALA  24           HN       ALA  24   6.949  -1.177 -13.253
  183    HA   ALA  24           HA       ALA  24   8.043  -1.492 -10.689
  184    HB1  ALA  24           HB1      ALA  24   9.442  -1.075 -13.327
  185    HB2  ALA  24           HB2      ALA  24   8.934  -2.625 -12.662
  186    HB3  ALA  24           HB3      ALA  24  10.199  -1.693 -11.856
  187    H    VAL  25           HN       VAL  25   8.111   1.212 -12.975
  188    HA   VAL  25           HA       VAL  25   9.806   2.859 -11.421
  189    HB   VAL  25           HB       VAL  25   9.435   3.382 -13.788
  190   HG11  VAL  25          HG11      VAL  25   7.325   4.335 -14.591
  191   HG12  VAL  25          HG12      VAL  25   6.606   4.046 -13.008
  192   HG13  VAL  25          HG13      VAL  25   7.120   2.682 -14.005
  193   HG21  VAL  25          HG21      VAL  25  10.086   5.245 -12.356
  194   HG22  VAL  25          HG22      VAL  25   8.385   5.558 -11.997
  195   HG23  VAL  25          HG23      VAL  25   8.994   5.799 -13.634
  196    H    GLU  26           HN       GLU  26   6.373   2.306 -11.371
  197    HA   GLU  26           HA       GLU  26   5.713   4.465  -9.629
  198    HB2  GLU  26           HB3      GLU  26   4.271   1.909 -10.261
  199    HB3  GLU  26           HB2      GLU  26   3.535   3.271  -9.414
  200    HG2  GLU  26           HG3      GLU  26   4.602   3.286 -12.226
  201    HG3  GLU  26           HG2      GLU  26   2.900   3.121 -11.792
  202    H    LEU  27           HN       LEU  27   6.395   1.032  -9.254
  203    HA   LEU  27           HA       LEU  27   6.062   0.884  -6.462
  204    HB2  LEU  27           HB2      LEU  27   7.787  -0.762  -8.317
  205    HB3  LEU  27           HB1      LEU  27   7.475  -1.171  -6.645
  206    HG   LEU  27           HG       LEU  27   5.335  -0.984  -8.770
  207   HD11  LEU  27          HD11      LEU  27   6.865  -2.803  -9.262
  208   HD12  LEU  27          HD12      LEU  27   5.314  -3.419  -8.703
  209   HD13  LEU  27          HD13      LEU  27   6.702  -3.410  -7.612
  210   HD21  LEU  27          HD21      LEU  27   4.501  -0.595  -6.509
  211   HD22  LEU  27          HD22      LEU  27   5.287  -2.072  -5.954
  212   HD23  LEU  27          HD23      LEU  27   3.964  -2.161  -7.115
  213    H    LYS  28           HN       LYS  28   8.711   1.795  -8.517
  214    HA   LYS  28           HA       LYS  28  10.734   1.994  -6.603
  215    HB2  LYS  28           HB2      LYS  28  11.194   2.079  -9.000
  216    HB3  LYS  28           HB1      LYS  28  10.287   3.574  -9.140
  217    HG2  LYS  28           HG2      LYS  28  11.955   4.730  -7.791
  218    HG3  LYS  28           HG1      LYS  28  12.852   3.223  -7.601
  219    HD2  LYS  28           HD2      LYS  28  13.204   3.101  -9.997
  220    HD3  LYS  28           HD1      LYS  28  12.265   4.576 -10.229
  221    HE2  LYS  28           HE2      LYS  28  13.898   5.858  -9.002
  222    HE3  LYS  28           HE1      LYS  28  14.789   4.393  -8.593
  223    HZ1  LYS  28           HZ1      LYS  28  15.816   5.583 -10.425
  224    HZ2  LYS  28           HZ2      LYS  28  14.403   5.457 -11.340
  225    HZ3  LYS  28           HZ3      LYS  28  15.266   4.072 -10.916
  226    H    LYS  29           HN       LYS  29   8.363   4.353  -7.756
  227    HA   LYS  29           HA       LYS  29   9.109   6.583  -6.172
  228    HB2  LYS  29           HB2      LYS  29   6.350   5.729  -7.033
  229    HB3  LYS  29           HB1      LYS  29   6.792   7.331  -6.493
  230    HG2  LYS  29           HG2      LYS  29   8.182   7.658  -8.476
  231    HG3  LYS  29           HG1      LYS  29   7.797   6.019  -9.002
  232    HD2  LYS  29           HD2      LYS  29   5.464   6.550  -9.194
  233    HD3  LYS  29           HD1      LYS  29   5.721   8.143  -8.503
  234    HE2  LYS  29           HE2      LYS  29   6.889   7.171 -11.104
  235    HE3  LYS  29           HE1      LYS  29   5.433   8.151 -10.949
  236    HZ1  LYS  29           HZ1      LYS  29   8.166   8.977 -10.108
  237    HZ2  LYS  29           HZ2      LYS  29   6.780   9.928  -9.980
  238    HZ3  LYS  29           HZ3      LYS  29   7.364   9.490 -11.489
  239    H    PHE  30           HN       PHE  30   6.762   4.049  -5.743
  240    HA   PHE  30           HA       PHE  30   5.702   4.687  -3.297
  241    HB2  PHE  30           HB2      PHE  30   4.516   3.144  -4.538
  242    HB3  PHE  30           HB1      PHE  30   5.951   2.239  -4.960
  243    HD1  PHE  30           HD1      PHE  30   3.848   3.030  -1.942
  244    HD2  PHE  30           HD2      PHE  30   6.192   0.223  -4.090
  245    HE1  PHE  30           HE1      PHE  30   3.270   1.317  -0.312
  246    HE2  PHE  30           HE2      PHE  30   5.611  -1.519  -2.444
  247    HZ   PHE  30           HZ       PHE  30   4.129  -0.960  -0.554
  248    H    LYS  31           HN       LYS  31   8.445   2.434  -3.897
  249    HA   LYS  31           HA       LYS  31   8.857   2.041  -1.097
  250    HB2  LYS  31           HB2      LYS  31  10.962   0.952  -1.672
  251    HB3  LYS  31           HB1      LYS  31   9.612   0.316  -2.623
  252    HG2  LYS  31           HG2      LYS  31  11.447   0.408  -4.120
  253    HG3  LYS  31           HG1      LYS  31  10.508   1.848  -4.487
  254    HD2  LYS  31           HD2      LYS  31  12.070   3.172  -3.088
  255    HD3  LYS  31           HD1      LYS  31  13.010   1.709  -2.798
  256    HE2  LYS  31           HE2      LYS  31  12.470   2.915  -5.506
  257    HE3  LYS  31           HE1      LYS  31  13.944   3.158  -4.575
  258    HZ1  LYS  31           HZ1      LYS  31  13.020   0.457  -5.493
  259    HZ2  LYS  31           HZ2      LYS  31  14.470   0.908  -4.718
  260    HZ3  LYS  31           HZ3      LYS  31  14.204   1.433  -6.236
  261    H    LEU  32           HN       LEU  32   9.946   4.414  -3.275
  262    HA   LEU  32           HA       LEU  32  12.164   5.378  -1.867
  263    HB2  LEU  32           HB2      LEU  32  11.782   5.836  -4.132
  264    HB3  LEU  32           HB1      LEU  32  10.170   6.422  -3.792
  265    HG   LEU  32           HG       LEU  32  11.521   8.109  -2.344
  266   HD11  LEU  32          HD11      LEU  32  13.698   7.196  -2.739
  267   HD12  LEU  32          HD12      LEU  32  13.615   8.809  -3.473
  268   HD13  LEU  32          HD13      LEU  32  13.476   7.369  -4.483
  269   HD21  LEU  32          HD21      LEU  32  11.517   9.717  -4.256
  270   HD22  LEU  32          HD22      LEU  32  10.021   8.843  -3.980
  271   HD23  LEU  32          HD23      LEU  32  11.085   8.363  -5.313
  272    H    TYR  33           HN       TYR  33   8.778   6.309  -2.145
  273    HA   TYR  33           HA       TYR  33   8.881   8.547  -0.573
  274    HB2  TYR  33           HB2      TYR  33   7.098   8.109  -2.204
  275    HB3  TYR  33           HB1      TYR  33   6.462   6.836  -1.167
  276    HD1  TYR  33           HD2      TYR  33   6.904  10.446  -1.552
  277    HD2  TYR  33           HD1      TYR  33   5.207   7.367   0.848
  278    HE1  TYR  33           HE2      TYR  33   5.638  12.118  -0.296
  279    HE2  TYR  33           HE1      TYR  33   3.952   9.013   2.097
  280    HH   TYR  33           HH       TYR  33   4.252  11.456   2.622
  281    H    LEU  34           HN       LEU  34   8.455   5.216   0.371
  282    HA   LEU  34           HA       LEU  34   7.980   6.216   3.085
  283    HB2  LEU  34           HB2      LEU  34   6.895   3.995   3.534
  284    HB3  LEU  34           HB1      LEU  34   6.043   5.132   2.513
  285    HG   LEU  34           HG       LEU  34   6.962   3.819   0.541
  286   HD11  LEU  34          HD11      LEU  34   7.457   1.468   0.914
  287   HD12  LEU  34          HD12      LEU  34   7.438   1.737   2.656
  288   HD13  LEU  34          HD13      LEU  34   8.667   2.516   1.658
  289   HD21  LEU  34          HD21      LEU  34   5.144   2.245   0.653
  290   HD22  LEU  34          HD22      LEU  34   4.676   3.845   1.260
  291   HD23  LEU  34          HD23      LEU  34   5.005   2.530   2.392
  292    H    GLY  35           HN       GLY  35  10.137   4.450   1.202
  293    HA2  GLY  35           HA3      GLY  35  11.067   2.899   3.405
  294    HA3  GLY  35           HA2      GLY  35  11.693   2.875   1.759
  295    H    THR  36           HN       THR  36  12.118   5.683   1.575
  296    HA   THR  36           HA       THR  36  14.273   5.926   3.553
  297    HB   THR  36           HB       THR  36  15.166   5.218   1.335
  298    HG1  THR  36           HG1      THR  36  16.204   6.836   2.873
  299   HG21  THR  36          HG21      THR  36  14.163   7.908   0.370
  300   HG22  THR  36          HG22      THR  36  13.552   6.333  -0.131
  301   HG23  THR  36          HG23      THR  36  15.198   6.812  -0.547
  302    H    ALA  37           HN       ALA  37  11.548   7.108   3.326
  303    HA   ALA  37           HA       ALA  37  11.998   9.940   2.920
  304    HB1  ALA  37           HB1      ALA  37   9.614   8.495   4.018
  305    HB2  ALA  37           HB2      ALA  37   9.864   8.914   2.334
  306    HB3  ALA  37           HB3      ALA  37   9.668  10.188   3.540
  307    H    THR  38           HN       THR  38  11.734  11.534   4.559
  308    HA   THR  38           HA       THR  38  12.815  10.641   7.072
  309    HB   THR  38           HB       THR  38  13.530  12.801   5.732
  310    HG1  THR  38           HG1      THR  38  14.400  12.360   7.703
  311   HG21  THR  38          HG21      THR  38  12.333  14.813   6.482
  312   HG22  THR  38          HG22      THR  38  11.203  13.738   7.342
  313   HG23  THR  38          HG23      THR  38  11.279  13.701   5.583
  314    H    GLU  39           HN       GLU  39   9.764  11.198   5.767
  315    HA   GLU  39           HA       GLU  39   8.501  11.930   8.252
  316    HB2  GLU  39           HB3      GLU  39   6.351  11.682   7.060
  317    HB3  GLU  39           HB2      GLU  39   7.468  12.736   6.228
  318    HG2  GLU  39           HG3      GLU  39   8.001  10.876   4.676
  319    HG3  GLU  39           HG2      GLU  39   6.790   9.888   5.492
  320    H    LEU  40           HN       LEU  40   9.795   9.171   7.232
  321    HA   LEU  40           HA       LEU  40   8.077   7.495   8.934
  322    HB2  LEU  40           HB2      LEU  40   9.908   6.907   6.664
  323    HB3  LEU  40           HB1      LEU  40   9.656   5.724   7.937
  324    HG   LEU  40           HG       LEU  40   8.237   5.169   6.074
  325   HD11  LEU  40          HD11      LEU  40   6.045   5.153   7.074
  326   HD12  LEU  40          HD12      LEU  40   6.540   6.385   8.222
  327   HD13  LEU  40          HD13      LEU  40   7.292   4.787   8.268
  328   HD21  LEU  40          HD21      LEU  40   8.131   7.334   4.970
  329   HD22  LEU  40          HD22      LEU  40   7.089   7.951   6.259
  330   HD23  LEU  40          HD23      LEU  40   6.520   6.653   5.198
  331    H    GLY  41           HN       GLY  41  10.175   9.468   9.365
  332    HA2  GLY  41           HA3      GLY  41  11.634   9.889  11.094
  333    HA3  GLY  41           HA2      GLY  41  11.524   8.190  11.546
  334    H    GLU  42           HN       GLU  42  12.726   6.755  10.512
  335    HA   GLU  42           HA       GLU  42  15.238   7.836   9.409
  336    HB2  GLU  42           HB3      GLU  42  14.685   5.058  10.421
  337    HB3  GLU  42           HB2      GLU  42  16.241   5.722   9.967
  338    HG2  GLU  42           HG3      GLU  42  16.070   7.318  11.826
  339    HG3  GLU  42           HG2      GLU  42  14.545   6.569  12.291
  340    H    GLY  43           HN       GLY  43  12.502   5.877   8.747
  341    HA2  GLY  43           HA3      GLY  43  11.868   5.053   6.641
  342    HA3  GLY  43           HA2      GLY  43  13.550   5.207   6.100
  343    H    LYS  44           HN       LYS  44  11.280   3.040   7.063
  344    HA   LYS  44           HA       LYS  44  13.025   1.359   8.647
  345    HB2  LYS  44           HB2      LYS  44  10.205   0.888   7.679
  346    HB3  LYS  44           HB1      LYS  44  11.085  -0.179   8.764
  347    HG2  LYS  44           HG2      LYS  44  10.359   2.692   9.341
  348    HG3  LYS  44           HG1      LYS  44   9.516   1.276   9.964
  349    HD2  LYS  44           HD2      LYS  44  11.550   0.570  11.141
  350    HD3  LYS  44           HD1      LYS  44  12.421   1.946  10.471
  351    HE2  LYS  44           HE2      LYS  44  11.737   2.378  12.773
  352    HE3  LYS  44           HE1      LYS  44  10.959   3.480  11.641
  353    HZ1  LYS  44           HZ1      LYS  44   9.426   2.693  13.294
  354    HZ2  LYS  44           HZ2      LYS  44   9.687   1.076  12.862
  355    HZ3  LYS  44           HZ3      LYS  44   8.958   2.135  11.786
  356    H    ILE  45           HN       ILE  45  12.679   1.815   5.430
  357    HA   ILE  45           HA       ILE  45  13.121  -0.981   4.733
  358    HB   ILE  45           HB       ILE  45  12.618   1.456   3.003
  359   HG12  ILE  45          HG12      ILE  45  10.616   0.864   4.212
  360   HG13  ILE  45          HG11      ILE  45  10.420   0.387   2.529
  361   HG21  ILE  45          HG21      ILE  45  12.360  -0.046   1.090
  362   HG22  ILE  45          HG22      ILE  45  12.804  -1.417   2.102
  363   HG23  ILE  45          HG23      ILE  45  13.982  -0.160   1.777
  364   HD11  ILE  45          HD11      ILE  45  11.014  -1.395   4.877
  365   HD12  ILE  45          HD12      ILE  45  11.054  -1.903   3.196
  366   HD13  ILE  45          HD13      ILE  45   9.532  -1.349   3.903
  367    HA   PRO  46           HA       PRO  46  17.559  -0.401   4.311
  368    HB2  PRO  46           HB2      PRO  46  17.355  -1.938   1.844
  369    HB3  PRO  46           HB1      PRO  46  18.246  -2.300   3.315
  370    HG2  PRO  46           HG2      PRO  46  15.855  -3.443   2.431
  371    HG3  PRO  46           HG1      PRO  46  16.628  -3.676   4.016
  372    HD2  PRO  46           HD2      PRO  46  14.182  -2.325   3.416
  373    HD3  PRO  46           HD1      PRO  46  14.976  -2.480   4.990
  374    H    TRP  47           HN       TRP  47  19.068   0.202   2.497
  375    HA   TRP  47           HA       TRP  47  18.027   2.648   1.470
  376    HB2  TRP  47           HB2      TRP  47  20.796   1.458   1.391
  377    HB3  TRP  47           HB1      TRP  47  20.388   3.098   0.898
  378    HD1  TRP  47           HD1      TRP  47  20.036   4.897   2.824
  379    HE1  TRP  47           HE1      TRP  47  20.440   4.859   5.366
  380    HE3  TRP  47           HE3      TRP  47  20.683  -0.141   3.498
  381    HZ2  TRP  47           HZ2      TRP  47  20.954   2.961   7.384
  382    HZ3  TRP  47           HZ3      TRP  47  21.116  -0.973   5.760
  383    HH2  TRP  47           HH2      TRP  47  21.253   0.558   7.663
  384    H    GLY  48           HN       GLY  48  18.810  -0.477   0.150
  385    HA2  GLY  48           HA3      GLY  48  17.705   0.332  -2.378
  386    HA3  GLY  48           HA2      GLY  48  19.434   0.056  -2.436
  387    H    SER  49           HN       SER  49  17.001  -1.803  -0.534
  388    HA   SER  49           HA       SER  49  17.970  -4.179  -1.906
  389    HB2  SER  49           HB2      SER  49  16.107  -3.817   0.420
  390    HB3  SER  49           HB1      SER  49  16.733  -5.362  -0.170
  391    HG   SER  49           HG       SER  49  18.870  -4.204   0.148
  392    H    MET  50           HN       MET  50  15.540  -1.933  -2.123
  393    HA   MET  50           HA       MET  50  13.688  -3.922  -3.188
  394    HB2  MET  50           HB2      MET  50  13.066  -1.194  -2.153
  395    HB3  MET  50           HB1      MET  50  11.932  -2.498  -2.525
  396    HG2  MET  50           HG2      MET  50  13.929  -2.349  -0.299
  397    HG3  MET  50           HG1      MET  50  12.200  -2.528  -0.236
  398    HE1  MET  50           HE1      MET  50  10.895  -5.007  -0.788
  399    HE2  MET  50           HE2      MET  50  11.800  -6.340  -1.487
  400    HE3  MET  50           HE3      MET  50  11.624  -4.831  -2.371
  401    H    GLU  51           HN       GLU  51  15.822  -2.679  -4.532
  402    HA   GLU  51           HA       GLU  51  14.777  -0.767  -6.395
  403    HB2  GLU  51           HB3      GLU  51  17.276  -2.450  -6.622
  404    HB3  GLU  51           HB2      GLU  51  16.873  -1.055  -7.612
  405    HG2  GLU  51           HG3      GLU  51  17.625  -1.135  -4.708
  406    HG3  GLU  51           HG2      GLU  51  18.406  -0.255  -6.025
  407    H    LYS  52           HN       LYS  52  15.743  -4.144  -6.653
  408    HA   LYS  52           HA       LYS  52  14.368  -4.437  -9.216
  409    HB2  LYS  52           HB2      LYS  52  16.031  -6.414  -7.634
  410    HB3  LYS  52           HB1      LYS  52  15.493  -6.608  -9.298
  411    HG2  LYS  52           HG2      LYS  52  16.859  -4.740 -10.000
  412    HG3  LYS  52           HG1      LYS  52  17.329  -4.429  -8.333
  413    HD2  LYS  52           HD2      LYS  52  19.127  -5.570  -9.453
  414    HD3  LYS  52           HD1      LYS  52  18.409  -6.666  -8.280
  415    HE2  LYS  52           HE2      LYS  52  17.183  -7.789 -10.031
  416    HE3  LYS  52           HE1      LYS  52  17.785  -6.649 -11.234
  417    HZ1  LYS  52           HZ1      LYS  52  20.034  -7.451 -10.753
  418    HZ2  LYS  52           HZ2      LYS  52  19.044  -8.685 -11.306
  419    HZ3  LYS  52           HZ3      LYS  52  19.413  -8.576  -9.665
  420    H    ALA  53           HN       ALA  53  13.047  -4.091  -6.586
  421    HA   ALA  53           HA       ALA  53  11.834  -6.666  -6.015
  422    HB1  ALA  53           HB1      ALA  53  10.783  -5.455  -4.117
  423    HB2  ALA  53           HB2      ALA  53  11.611  -3.991  -4.622
  424    HB3  ALA  53           HB3      ALA  53  12.526  -5.388  -4.108
  425    H    GLY  54           HN       GLY  54   9.831  -7.173  -6.531
  426    HA2  GLY  54           HA3      GLY  54   8.255  -5.204  -8.014
  427    HA3  GLY  54           HA2      GLY  54   8.221  -6.946  -8.270
  428    HA   PRO  55           HA       PRO  55   4.525  -5.627  -5.723
  429    HB2  PRO  55           HB2      PRO  55   3.621  -8.153  -7.006
  430    HB3  PRO  55           HB1      PRO  55   2.757  -6.622  -6.804
  431    HG2  PRO  55           HG2      PRO  55   3.759  -7.285  -9.173
  432    HG3  PRO  55           HG1      PRO  55   3.847  -5.616  -8.583
  433    HD2  PRO  55           HD2      PRO  55   6.025  -7.679  -8.716
  434    HD3  PRO  55           HD1      PRO  55   6.093  -5.930  -8.976
  435    H    LEU  56           HN       LEU  56   5.835  -8.872  -6.134
  436    HA   LEU  56           HA       LEU  56   4.665  -9.928  -3.727
  437    HB2  LEU  56           HB2      LEU  56   7.009 -11.000  -5.288
  438    HB3  LEU  56           HB1      LEU  56   6.083 -11.876  -4.093
  439    HG   LEU  56           HG       LEU  56   5.127 -10.961  -6.801
  440   HD11  LEU  56          HD11      LEU  56   6.585 -12.915  -6.830
  441   HD12  LEU  56          HD12      LEU  56   4.927 -13.330  -7.259
  442   HD13  LEU  56          HD13      LEU  56   5.537 -13.704  -5.650
  443   HD21  LEU  56          HD21      LEU  56   3.319 -10.768  -5.155
  444   HD22  LEU  56          HD22      LEU  56   3.606 -12.439  -4.655
  445   HD23  LEU  56          HD23      LEU  56   3.037 -12.088  -6.286
  446    H    GLU  57           HN       GLU  57   7.955  -8.964  -4.578
  447    HA   GLU  57           HA       GLU  57   9.084  -9.357  -2.053
  448    HB2  GLU  57           HB3      GLU  57   9.831  -7.513  -4.306
  449    HB3  GLU  57           HB2      GLU  57  10.801  -7.648  -2.854
  450    HG2  GLU  57           HG3      GLU  57  10.177  -9.866  -4.794
  451    HG3  GLU  57           HG2      GLU  57  11.712  -9.006  -4.636
  452    H    MET  58           HN       MET  58   7.437  -6.607  -3.448
  453    HA   MET  58           HA       MET  58   7.936  -4.794  -1.334
  454    HB2  MET  58           HB2      MET  58   5.818  -4.862  -3.454
  455    HB3  MET  58           HB1      MET  58   5.972  -3.532  -2.316
  456    HG2  MET  58           HG2      MET  58   8.225  -4.474  -4.005
  457    HG3  MET  58           HG1      MET  58   7.106  -3.257  -4.647
  458    HE1  MET  58           HE1      MET  58   8.888  -1.406  -5.066
  459    HE2  MET  58           HE2      MET  58   9.970  -2.773  -4.860
  460    HE3  MET  58           HE3      MET  58  10.321  -1.247  -4.047
  461    H    ALA  59           HN       ALA  59   5.130  -6.895  -2.032
  462    HA   ALA  59           HA       ALA  59   3.549  -6.022   0.081
  463    HB1  ALA  59           HB1      ALA  59   3.662  -8.822  -1.045
  464    HB2  ALA  59           HB2      ALA  59   2.746  -7.477  -1.732
  465    HB3  ALA  59           HB3      ALA  59   2.334  -8.096  -0.134
  466    H    GLN  60           HN       GLN  60   6.072  -8.448   0.024
  467    HA   GLN  60           HA       GLN  60   5.669  -9.201   2.755
  468    HB2  GLN  60           HB2      GLN  60   8.081  -9.678   1.007
  469    HB3  GLN  60           HB1      GLN  60   7.712 -10.496   2.520
  470    HG2  GLN  60           HG2      GLN  60   5.682 -11.422   1.491
  471    HG3  GLN  60           HG1      GLN  60   6.117 -10.628  -0.010
  472   HE21  GLN  60          HE21      GLN  60   8.491 -12.114   2.109
  473   HE22  GLN  60          HE22      GLN  60   8.913 -13.395   1.050
  474    H    LEU  61           HN       LEU  61   7.627  -6.912   1.047
  475    HA   LEU  61           HA       LEU  61   9.577  -6.190   2.906
  476    HB2  LEU  61           HB2      LEU  61   9.387  -5.445   0.520
  477    HB3  LEU  61           HB1      LEU  61   8.054  -4.425   1.018
  478    HG   LEU  61           HG       LEU  61   9.625  -3.173   2.475
  479   HD11  LEU  61          HD11      LEU  61  12.042  -3.387   2.057
  480   HD12  LEU  61          HD12      LEU  61  11.732  -4.563   0.849
  481   HD13  LEU  61          HD13      LEU  61  11.421  -4.978   2.544
  482   HD21  LEU  61          HD21      LEU  61   8.873  -2.387   0.259
  483   HD22  LEU  61          HD22      LEU  61  10.269  -3.171  -0.488
  484   HD23  LEU  61          HD23      LEU  61  10.496  -1.848   0.654
  485    H    LEU  62           HN       LEU  62   6.454  -4.593   2.247
  486    HA   LEU  62           HA       LEU  62   6.649  -2.891   4.437
  487    HB2  LEU  62           HB2      LEU  62   4.207  -3.687   2.851
  488    HB3  LEU  62           HB1      LEU  62   4.184  -2.489   4.117
  489    HG   LEU  62           HG       LEU  62   4.188  -1.320   2.063
  490   HD11  LEU  62          HD11      LEU  62   6.963  -1.230   3.104
  491   HD12  LEU  62          HD12      LEU  62   5.569  -0.336   3.717
  492   HD13  LEU  62          HD13      LEU  62   6.174  -0.024   2.087
  493   HD21  LEU  62          HD21      LEU  62   5.846  -1.625   0.323
  494   HD22  LEU  62          HD22      LEU  62   4.922  -3.113   0.640
  495   HD23  LEU  62          HD23      LEU  62   6.555  -2.939   1.268
  496    H    ILE  63           HN       ILE  63   5.142  -6.064   4.064
  497    HA   ILE  63           HA       ILE  63   3.723  -5.939   6.508
  498    HB   ILE  63           HB       ILE  63   3.523  -7.541   4.354
  499   HG12  ILE  63          HG12      ILE  63   1.885  -7.261   6.165
  500   HG13  ILE  63          HG11      ILE  63   1.914  -8.896   5.533
  501   HG21  ILE  63          HG21      ILE  63   4.972  -9.325   6.298
  502   HG22  ILE  63          HG22      ILE  63   5.594  -8.749   4.759
  503   HG23  ILE  63          HG23      ILE  63   4.203  -9.834   4.792
  504   HD11  ILE  63          HD11      ILE  63   1.662  -8.900   7.946
  505   HD12  ILE  63          HD12      ILE  63   3.140  -7.946   8.114
  506   HD13  ILE  63          HD13      ILE  63   3.221  -9.594   7.495
  507    H    THR  64           HN       THR  64   6.991  -6.897   5.740
  508    HA   THR  64           HA       THR  64   7.403  -8.208   8.248
  509    HB   THR  64           HB       THR  64   9.438  -7.312   6.193
  510    HG1  THR  64           HG1      THR  64   8.105  -8.746   5.239
  511   HG21  THR  64          HG21      THR  64  10.880  -9.033   7.215
  512   HG22  THR  64          HG22      THR  64   9.632  -9.369   8.414
  513   HG23  THR  64          HG23      THR  64  10.439  -7.800   8.395
  514    H    HIS  65           HN       HIS  65   8.279  -5.059   6.886
  515    HA   HIS  65           HA       HIS  65   9.708  -4.388   9.304
  516    HB2  HIS  65           HB2      HIS  65   9.137  -2.707   6.854
  517    HB3  HIS  65           HB1      HIS  65  10.103  -2.169   8.222
  518    HD1  HIS  65           HD1      HIS  65  12.573  -3.008   8.310
  519    HD2  HIS  65           HD2      HIS  65  10.324  -4.667   5.233
  520    HE1  HIS  65           HE1      HIS  65  14.198  -4.186   6.808
  521    H    PHE  66           HN       PHE  66   6.787  -3.149   7.703
  522    HA   PHE  66           HA       PHE  66   6.170  -1.483   9.947
  523    HB2  PHE  66           HB2      PHE  66   4.613  -2.117   7.461
  524    HB3  PHE  66           HB1      PHE  66   4.190  -0.875   8.640
  525    HD1  PHE  66           HD1      PHE  66   5.508   1.136   8.834
  526    HD2  PHE  66           HD2      PHE  66   6.450  -1.874   6.028
  527    HE1  PHE  66           HE1      PHE  66   7.062   2.685   7.694
  528    HE2  PHE  66           HE2      PHE  66   7.965  -0.377   4.865
  529    HZ   PHE  66           HZ       PHE  66   8.297   1.901   5.700
  530    H    GLY  67           HN       GLY  67   4.405  -4.204   8.470
  531    HA2  GLY  67           HA3      GLY  67   3.749  -5.844  10.372
  532    HA3  GLY  67           HA2      GLY  67   2.890  -4.421  10.970
  533    HA   PRO  68           HA       PRO  68   0.455  -6.876   7.729
  534    HB2  PRO  68           HB2      PRO  68  -1.747  -7.377   9.360
  535    HB3  PRO  68           HB1      PRO  68  -0.479  -8.531   8.959
  536    HG2  PRO  68           HG2      PRO  68  -0.887  -6.967  11.434
  537    HG3  PRO  68           HG1      PRO  68  -0.093  -8.530  11.206
  538    HD2  PRO  68           HD2      PRO  68   1.229  -6.147  11.642
  539    HD3  PRO  68           HD1      PRO  68   1.955  -7.556  10.862
  540    H    GLU  69           HN       GLU  69  -1.221  -4.901  10.241
  541    HA   GLU  69           HA       GLU  69  -3.016  -3.808   8.333
  542    HB2  GLU  69           HB3      GLU  69  -2.330  -2.705  11.053
  543    HB3  GLU  69           HB2      GLU  69  -3.759  -2.345  10.100
  544    HG2  GLU  69           HG3      GLU  69  -4.658  -3.846  11.491
  545    HG3  GLU  69           HG2      GLU  69  -4.066  -4.949  10.268
  546    H    GLU  70           HN       GLU  70  -0.020  -2.869   9.770
  547    HA   GLU  70           HA       GLU  70  -0.051  -0.154   9.060
  548    HB2  GLU  70           HB3      GLU  70   1.357  -1.265  10.829
  549    HB3  GLU  70           HB2      GLU  70   2.400  -1.831   9.531
  550    HG2  GLU  70           HG3      GLU  70   3.329   0.163  10.494
  551    HG3  GLU  70           HG2      GLU  70   2.773   0.505   8.854
  552    H    ALA  71           HN       ALA  71   1.415  -2.985   7.506
  553    HA   ALA  71           HA       ALA  71   2.650  -1.787   5.316
  554    HB1  ALA  71           HB1      ALA  71   2.476  -3.918   4.242
  555    HB2  ALA  71           HB2      ALA  71   1.176  -4.408   5.326
  556    HB3  ALA  71           HB3      ALA  71   2.807  -4.165   5.954
  557    H    TRP  72           HN       TRP  72  -0.707  -2.728   5.777
  558    HA   TRP  72           HA       TRP  72  -1.435  -2.218   3.120
  559    HB2  TRP  72           HB2      TRP  72  -2.843  -3.692   4.419
  560    HB3  TRP  72           HB1      TRP  72  -3.169  -2.424   5.594
  561    HD1  TRP  72           HD1      TRP  72  -5.680  -1.912   5.308
  562    HE1  TRP  72           HE1      TRP  72  -7.210  -1.269   3.345
  563    HE3  TRP  72           HE3      TRP  72  -2.366  -2.513   1.478
  564    HZ2  TRP  72           HZ2      TRP  72  -7.010  -1.046   0.537
  565    HZ3  TRP  72           HZ3      TRP  72  -3.089  -2.089  -0.811
  566    HH2  TRP  72           HH2      TRP  72  -5.379  -1.354  -1.288
  567    H    ARG  73           HN       ARG  73  -1.589  -0.266   6.034
  568    HA   ARG  73           HA       ARG  73  -2.835   1.917   4.828
  569    HB2  ARG  73           HB2      ARG  73  -2.641   1.821   7.266
  570    HB3  ARG  73           HB1      ARG  73  -0.887   1.921   7.159
  571    HG2  ARG  73           HG2      ARG  73  -1.068   4.174   6.220
  572    HG3  ARG  73           HG1      ARG  73  -2.822   4.077   6.322
  573    HD2  ARG  73           HD2      ARG  73  -1.951   5.365   8.171
  574    HD3  ARG  73           HD1      ARG  73  -2.650   3.863   8.760
  575    HE   ARG  73           HE       ARG  73  -0.346   3.016   9.015
  576   HH11  ARG  73          HH11      ARG  73  -0.628   6.521   8.630
  577   HH12  ARG  73          HH12      ARG  73   0.694   6.851   9.647
  578   HH21  ARG  73          HH21      ARG  73   1.392   3.495  10.416
  579   HH22  ARG  73          HH22      ARG  73   1.896   5.104  10.691
  580    H    LEU  74           HN       LEU  74   0.561   1.108   5.247
  581    HA   LEU  74           HA       LEU  74   1.678   3.361   4.098
  582    HB2  LEU  74           HB2      LEU  74   2.619   0.634   4.701
  583    HB3  LEU  74           HB1      LEU  74   3.551   1.512   3.515
  584    HG   LEU  74           HG       LEU  74   4.495   1.678   5.791
  585   HD11  LEU  74          HD11      LEU  74   3.480   4.285   4.681
  586   HD12  LEU  74          HD12      LEU  74   4.961   3.439   4.235
  587   HD13  LEU  74          HD13      LEU  74   4.780   4.096   5.854
  588   HD21  LEU  74          HD21      LEU  74   3.392   3.002   7.510
  589   HD22  LEU  74          HD22      LEU  74   2.392   1.612   7.072
  590   HD23  LEU  74          HD23      LEU  74   1.988   3.216   6.466
  591    H    ALA  75           HN       ALA  75   0.384   0.525   2.493
  592    HA   ALA  75           HA       ALA  75   1.433   1.385  -0.071
  593    HB1  ALA  75           HB1      ALA  75   0.083  -0.360  -1.032
  594    HB2  ALA  75           HB2      ALA  75  -0.688  -0.669   0.526
  595    HB3  ALA  75           HB3      ALA  75   1.045  -0.977   0.303
  596    H    LEU  76           HN       LEU  76  -1.857   1.359   1.346
  597    HA   LEU  76           HA       LEU  76  -2.941   2.517  -0.997
  598    HB2  LEU  76           HB2      LEU  76  -5.045   2.659   0.091
  599    HB3  LEU  76           HB1      LEU  76  -4.284   1.197   0.658
  600    HG   LEU  76           HG       LEU  76  -3.624   2.739   2.721
  601   HD11  LEU  76          HD11      LEU  76  -6.131   4.080   1.692
  602   HD12  LEU  76          HD12      LEU  76  -4.527   4.808   1.796
  603   HD13  LEU  76          HD13      LEU  76  -5.381   4.347   3.269
  604   HD21  LEU  76          HD21      LEU  76  -4.945   0.738   2.897
  605   HD22  LEU  76          HD22      LEU  76  -6.333   1.543   2.209
  606   HD23  LEU  76          HD23      LEU  76  -5.745   2.021   3.813
  607    H    SER  77           HN       SER  77  -1.846   3.947   2.004
  608    HA   SER  77           HA       SER  77  -2.746   6.534   1.289
  609    HB2  SER  77           HB2      SER  77  -1.114   5.351   3.460
  610    HB3  SER  77           HB1      SER  77  -1.338   7.132   3.390
  611    HG   SER  77           HG       SER  77  -3.675   5.992   3.106
  612    H    THR  78           HN       THR  78  -0.064   4.702   0.294
  613    HA   THR  78           HA       THR  78   1.392   7.145  -0.261
  614    HB   THR  78           HB       THR  78   2.260   4.249  -0.494
  615    HG1  THR  78           HG1      THR  78   2.657   4.554   1.468
  616   HG21  THR  78          HG21      THR  78   3.893   6.775  -0.934
  617   HG22  THR  78          HG22      THR  78   3.424   5.632  -2.191
  618   HG23  THR  78          HG23      THR  78   4.533   5.132  -0.913
  619    H    PHE  79           HN       PHE  79  -0.683   4.855  -1.698
  620    HA   PHE  79           HA       PHE  79   0.022   5.109  -4.382
  621    HB2  PHE  79           HB2      PHE  79  -2.695   4.691  -3.124
  622    HB3  PHE  79           HB1      PHE  79  -2.454   4.664  -4.873
  623    HD1  PHE  79           HD2      PHE  79   0.275   3.148  -4.635
  624    HD2  PHE  79           HD1      PHE  79  -3.588   2.553  -2.943
  625    HE1  PHE  79           HE2      PHE  79   0.739   0.766  -4.425
  626    HE2  PHE  79           HE1      PHE  79  -3.124   0.152  -2.725
  627    HZ   PHE  79           HZ       PHE  79  -0.957  -0.751  -3.473
  628    H    GLU  80           HN       GLU  80  -2.220   7.027  -2.425
  629    HA   GLU  80           HA       GLU  80  -2.854   8.885  -4.445
  630    HB2  GLU  80           HB3      GLU  80  -3.629  10.359  -2.584
  631    HB3  GLU  80           HB2      GLU  80  -4.265   8.723  -2.475
  632    HG2  GLU  80           HG3      GLU  80  -2.785   8.151  -0.795
  633    HG3  GLU  80           HG2      GLU  80  -1.833   9.631  -1.007
  634    H    ARG  81           HN       ARG  81  -0.198   8.700  -2.208
  635    HA   ARG  81           HA       ARG  81   0.783  11.351  -2.402
  636    HB2  ARG  81           HB2      ARG  81   2.263   8.819  -1.753
  637    HB3  ARG  81           HB1      ARG  81   2.905  10.435  -1.549
  638    HG2  ARG  81           HG2      ARG  81   0.559   9.247  -0.091
  639    HG3  ARG  81           HG1      ARG  81   2.179   9.531   0.541
  640    HD2  ARG  81           HD2      ARG  81   1.824  11.950   0.004
  641    HD3  ARG  81           HD1      ARG  81   0.127  11.547  -0.280
  642    HE   ARG  81           HE       ARG  81   1.336  10.774   2.246
  643   HH11  ARG  81          HH11      ARG  81  -0.988  12.891   0.581
  644   HH12  ARG  81          HH12      ARG  81  -1.579  13.602   1.996
  645   HH21  ARG  81          HH21      ARG  81   0.511  11.746   4.203
  646   HH22  ARG  81          HH22      ARG  81  -0.735  12.913   4.109
  647    H    ILE  82           HN       ILE  82   1.414   8.422  -4.248
  648    HA   ILE  82           HA       ILE  82   3.437   9.789  -5.832
  649    HB   ILE  82           HB       ILE  82   3.812   7.616  -6.941
  650   HG12  ILE  82          HG12      ILE  82   1.688   6.563  -5.044
  651   HG13  ILE  82          HG11      ILE  82   1.495   6.742  -6.782
  652   HG21  ILE  82          HG21      ILE  82   4.722   6.428  -4.976
  653   HG22  ILE  82          HG22      ILE  82   3.827   7.546  -3.930
  654   HG23  ILE  82          HG23      ILE  82   5.094   8.152  -4.996
  655   HD11  ILE  82          HD11      ILE  82   1.912   4.436  -6.151
  656   HD12  ILE  82          HD12      ILE  82   3.436   4.904  -5.396
  657   HD13  ILE  82          HD13      ILE  82   3.229   5.061  -7.145
  658    H    ASN  83           HN       ASN  83   0.453  10.122  -5.763
  659    HA   ASN  83           HA       ASN  83  -1.175  10.787  -7.045
  660    HB2  ASN  83           HB3      ASN  83   0.505  12.179  -8.211
  661    HB3  ASN  83           HB2      ASN  83   0.814  10.861  -9.333
  662   HD21  ASN  83          HD21      ASN  83  -1.473  13.270  -8.307
  663   HD22  ASN  83          HD22      ASN  83  -2.439  13.227  -9.735
  664    H    ARG  84           HN       ARG  84  -1.907   8.806  -6.509
  665    HA   ARG  84           HA       ARG  84  -3.022   7.492  -8.755
  666    HB2  ARG  84           HB2      ARG  84  -1.028   6.101  -8.548
  667    HB3  ARG  84           HB1      ARG  84  -1.274   5.931  -6.824
  668    HG2  ARG  84           HG2      ARG  84  -1.878   3.895  -8.040
  669    HG3  ARG  84           HG1      ARG  84  -3.259   4.595  -7.196
  670    HD2  ARG  84           HD2      ARG  84  -4.038   3.941  -9.342
  671    HD3  ARG  84           HD1      ARG  84  -3.893   5.686  -9.296
  672    HE   ARG  84           HE       ARG  84  -1.628   5.268 -10.380
  673   HH11  ARG  84          HH11      ARG  84  -4.559   3.292 -11.147
  674   HH12  ARG  84          HH12      ARG  84  -3.971   2.900 -12.677
  675   HH21  ARG  84          HH21      ARG  84  -0.909   4.646 -12.477
  676   HH22  ARG  84          HH22      ARG  84  -1.858   3.633 -13.456
  677    H    LYS  85           HN       LYS  85  -4.737   8.609  -7.820
  678    HA   LYS  85           HA       LYS  85  -5.679   7.895  -5.195
  679    HB2  LYS  85           HB2      LYS  85  -5.878  10.144  -5.914
  680    HB3  LYS  85           HB1      LYS  85  -6.744   9.705  -7.388
  681    HG2  LYS  85           HG2      LYS  85  -8.675   9.064  -5.985
  682    HG3  LYS  85           HG1      LYS  85  -7.734   9.493  -4.550
  683    HD2  LYS  85           HD2      LYS  85  -7.552  11.803  -5.357
  684    HD3  LYS  85           HD1      LYS  85  -8.518  11.378  -6.769
  685    HE2  LYS  85           HE2      LYS  85  -9.472  11.129  -3.919
  686    HE3  LYS  85           HE1      LYS  85  -9.785  12.520  -4.937
  687    HZ1  LYS  85           HZ1      LYS  85 -11.628  10.921  -4.878
  688    HZ2  LYS  85           HZ2      LYS  85 -10.669   9.753  -5.667
  689    HZ3  LYS  85           HZ3      LYS  85 -11.055  11.177  -6.416
  690    H    ASP  86           HN       ASP  86  -5.961   6.956  -8.391
  691    HA   ASP  86           HA       ASP  86  -8.369   5.678  -8.618
  692    HB2  ASP  86           HB2      ASP  86  -7.214   5.930 -10.603
  693    HB3  ASP  86           HB1      ASP  86  -5.709   5.349  -9.928
  694    H    LEU  87           HN       LEU  87  -5.306   4.248  -7.448
  695    HA   LEU  87           HA       LEU  87  -6.663   1.763  -6.843
  696    HB2  LEU  87           HB2      LEU  87  -3.845   2.629  -6.183
  697    HB3  LEU  87           HB1      LEU  87  -4.502   1.056  -5.818
  698    HG   LEU  87           HG       LEU  87  -4.067   2.177  -8.586
  699   HD11  LEU  87          HD11      LEU  87  -2.004   1.625  -7.411
  700   HD12  LEU  87          HD12      LEU  87  -2.321   0.514  -8.739
  701   HD13  LEU  87          HD13      LEU  87  -2.630   0.009  -7.076
  702   HD21  LEU  87          HD21      LEU  87  -5.989   0.673  -8.525
  703   HD22  LEU  87          HD22      LEU  87  -5.015  -0.540  -7.689
  704   HD23  LEU  87          HD23      LEU  87  -4.621  -0.077  -9.343
  705    H    TRP  88           HN       TRP  88  -5.747   4.620  -5.246
  706    HA   TRP  88           HA       TRP  88  -5.733   3.876  -2.579
  707    HB2  TRP  88           HB2      TRP  88  -4.887   5.979  -3.353
  708    HB3  TRP  88           HB1      TRP  88  -6.430   6.438  -3.999
  709    HD1  TRP  88           HD1      TRP  88  -4.844   5.778  -0.547
  710    HE1  TRP  88           HE1      TRP  88  -5.953   7.382   1.162
  711    HE3  TRP  88           HE3      TRP  88  -8.303   7.893  -3.562
  712    HZ2  TRP  88           HZ2      TRP  88  -8.041   9.287   1.193
  713    HZ3  TRP  88           HZ3      TRP  88  -9.829   9.590  -2.643
  714    HH2  TRP  88           HH2      TRP  88  -9.691  10.271  -0.314
  715    H    GLU  89           HN       GLU  89  -8.416   5.122  -4.546
  716    HA   GLU  89           HA       GLU  89 -10.375   4.881  -2.539
  717    HB2  GLU  89           HB3      GLU  89 -10.650   5.013  -5.521
  718    HB3  GLU  89           HB2      GLU  89 -12.016   5.044  -4.411
  719    HG2  GLU  89           HG3      GLU  89 -11.116   7.043  -3.355
  720    HG3  GLU  89           HG2      GLU  89  -9.751   6.983  -4.472
  721    H    ARG  90           HN       ARG  90  -9.194   2.575  -4.842
  722    HA   ARG  90           HA       ARG  90 -11.319   0.671  -4.506
  723    HB2  ARG  90           HB2      ARG  90  -8.445   0.041  -5.190
  724    HB3  ARG  90           HB1      ARG  90  -9.850  -0.946  -5.530
  725    HG2  ARG  90           HG2      ARG  90 -10.617   0.734  -7.142
  726    HG3  ARG  90           HG1      ARG  90  -9.176   1.697  -6.796
  727    HD2  ARG  90           HD2      ARG  90  -7.832  -0.368  -7.391
  728    HD3  ARG  90           HD1      ARG  90  -9.326  -1.036  -8.031
  729    HE   ARG  90           HE       ARG  90  -8.620   1.562  -9.030
  730   HH11  ARG  90          HH11      ARG  90  -8.602  -1.927  -9.621
  731   HH12  ARG  90          HH12      ARG  90  -7.963  -1.830 -11.184
  732   HH21  ARG  90          HH21      ARG  90  -7.710   1.723 -11.196
  733   HH22  ARG  90          HH22      ARG  90  -7.461   0.309 -12.125
  734    H    GLY  91           HN       GLY  91  -8.193   1.281  -3.105
  735    HA2  GLY  91           HA3      GLY  91  -7.887  -0.887  -1.361
  736    HA3  GLY  91           HA2      GLY  91  -7.157   0.692  -1.211
  737    H    GLN  92           HN       GLN  92  -9.065   2.392  -0.638
  738    HA   GLN  92           HA       GLN  92  -9.846   1.289   1.890
  739    HB2  GLN  92           HB2      GLN  92 -10.374   3.573   2.646
  740    HB3  GLN  92           HB1      GLN  92  -8.724   3.412   2.076
  741    HG2  GLN  92           HG2      GLN  92  -9.304   4.529   0.004
  742    HG3  GLN  92           HG1      GLN  92 -10.994   4.607   0.498
  743   HE21  GLN  92          HE21      GLN  92 -11.120   6.808   0.476
  744   HE22  GLN  92          HE22      GLN  92 -10.297   7.814   1.602
  745    H    ARG  93           HN       ARG  93 -11.281  -0.080   1.164
  746    HA   ARG  93           HA       ARG  93 -13.987   0.962   0.619
  747    HB2  ARG  93           HB2      ARG  93 -14.635  -1.370   0.398
  748    HB3  ARG  93           HB1      ARG  93 -13.075  -1.231  -0.413
  749    HG2  ARG  93           HG2      ARG  93 -11.958  -2.053   1.587
  750    HG3  ARG  93           HG1      ARG  93 -13.538  -2.155   2.374
  751    HD2  ARG  93           HD2      ARG  93 -14.182  -3.799   0.640
  752    HD3  ARG  93           HD1      ARG  93 -12.474  -3.744   0.117
  753    HE   ARG  93           HE       ARG  93 -12.128  -4.215   2.668
  754   HH11  ARG  93          HH11      ARG  93 -14.397  -5.869   0.512
  755   HH12  ARG  93          HH12      ARG  93 -14.486  -7.262   1.477
  756   HH21  ARG  93          HH21      ARG  93 -12.263  -6.042   3.969
  757   HH22  ARG  93          HH22      ARG  93 -13.257  -7.371   3.524
  758    H    GLU  94           HN       GLU  94 -11.836   0.449   3.034
  759    HA   GLU  94           HA       GLU  94 -13.736   0.001   5.217
  760    HB2  GLU  94           HB3      GLU  94 -10.762  -0.631   5.103
  761    HB3  GLU  94           HB2      GLU  94 -11.882  -1.065   6.390
  762    HG2  GLU  94           HG3      GLU  94 -13.022  -2.617   4.957
  763    HG3  GLU  94           HG2      GLU  94 -12.107  -2.020   3.581
  764    H    ASP  95           HN       ASP  95 -13.493   1.515   6.848
  765    HA   ASP  95           HA       ASP  95 -12.261   3.977   6.073
  766    HB2  ASP  95           HB2      ASP  95 -14.409   3.906   7.233
  767    HB3  ASP  95           HB1      ASP  95 -13.558   3.187   8.625
  768    H    LEU  96           HN       LEU  96 -10.893   5.133   7.509
  769    HA   LEU  96           HA       LEU  96  -8.907   3.417   8.847
  770    HB2  LEU  96           HB2      LEU  96  -8.428   3.986   6.555
  771    HB3  LEU  96           HB1      LEU  96  -8.507   5.678   6.959
  772    HG   LEU  96           HG       LEU  96  -6.545   5.295   8.543
  773   HD11  LEU  96          HD11      LEU  96  -6.343   2.688   7.051
  774   HD12  LEU  96          HD12      LEU  96  -6.774   2.873   8.744
  775   HD13  LEU  96          HD13      LEU  96  -5.160   3.330   8.191
  776   HD21  LEU  96          HD21      LEU  96  -6.243   6.361   6.374
  777   HD22  LEU  96          HD22      LEU  96  -6.071   4.782   5.607
  778   HD23  LEU  96          HD23      LEU  96  -4.861   5.340   6.767
  779    H    VAL  97           HN       VAL  97  -9.776   6.738   8.207
  780    HA   VAL  97           HA       VAL  97  -8.813   7.647  10.870
  781    HB   VAL  97           HB       VAL  97  -9.111   9.075   8.213
  782   HG11  VAL  97          HG11      VAL  97  -8.174  11.081   9.249
  783   HG12  VAL  97          HG12      VAL  97  -8.237  10.292  10.834
  784   HG13  VAL  97          HG13      VAL  97  -9.730  10.619   9.947
  785   HG21  VAL  97          HG21      VAL  97  -6.683   9.357   8.373
  786   HG22  VAL  97          HG22      VAL  97  -7.166   7.658   8.366
  787   HG23  VAL  97          HG23      VAL  97  -6.689   8.436   9.879
  788    H    ARG  98           HN       ARG  98 -11.616   7.027   9.185
  789    HA   ARG  98           HA       ARG  98 -13.642   7.539   9.162
  790    HB2  ARG  98           HB2      ARG  98 -13.814   7.836  11.600
  791    HB3  ARG  98           HB1      ARG  98 -13.157   9.457  11.470
  792    HG2  ARG  98           HG2      ARG  98 -15.643   9.304  11.863
  793    HG3  ARG  98           HG1      ARG  98 -15.141  10.301  10.497
  794    HD2  ARG  98           HD2      ARG  98 -17.017   8.954   9.835
  795    HD3  ARG  98           HD1      ARG  98 -15.525   8.445   9.024
  796    HE   ARG  98           HE       ARG  98 -16.180   6.967  11.401
  797   HH11  ARG  98          HH11      ARG  98 -16.626   7.115   7.902
  798   HH12  ARG  98          HH12      ARG  98 -16.836   5.441   7.691
  799   HH21  ARG  98          HH21      ARG  98 -16.546   4.634  11.126
  800   HH22  ARG  98          HH22      ARG  98 -16.844   4.020   9.560
  801    H    ASP  99           HN       ASP  99 -13.152   8.012   7.241
  802    HA   ASP  99           HA       ASP  99 -12.989  10.847   6.463
  803    HB2  ASP  99           HB2      ASP  99 -11.293   9.286   5.488
  804    HB3  ASP  99           HB1      ASP  99 -12.598   8.324   4.809
  805    H    THR 100           HN       THR 100 -14.770  11.746   5.497
  806    HA   THR 100           HA       THR 100 -17.047   9.963   5.455
  807    HB   THR 100           HB       THR 100 -17.084  12.980   5.355
  808    HG1  THR 100           HG1      THR 100 -17.204  11.150   7.539
  809   HG21  THR 100          HG21      THR 100 -19.172  10.927   6.154
  810   HG22  THR 100          HG22      THR 100 -19.193  11.898   4.678
  811   HG23  THR 100          HG23      THR 100 -19.367  12.674   6.247
  812    H    VAL 101           HN       VAL 101 -16.289  12.829   3.447
  813    HA   VAL 101           HA       VAL 101 -16.948  11.245   1.099
  814    HB   VAL 101           HB       VAL 101 -18.492  13.072   0.282
  815   HG11  VAL 101          HG11      VAL 101 -20.439  12.325   1.629
  816   HG12  VAL 101          HG12      VAL 101 -19.319  11.530   2.740
  817   HG13  VAL 101          HG13      VAL 101 -19.423  11.002   1.069
  818   HG21  VAL 101          HG21      VAL 101 -18.367  13.921   3.173
  819   HG22  VAL 101          HG22      VAL 101 -19.541  14.498   1.999
  820   HG23  VAL 101          HG23      VAL 101 -17.825  14.854   1.777
  821    H    GLU 102           HN       GLU 102 -16.298  12.178  -0.863
  822    HA   GLU 102           HA       GLU 102 -15.136  14.657  -1.242
  823    HB2  GLU 102           HB3      GLU 102 -13.330  13.619   0.233
  824    HB3  GLU 102           HB2      GLU 102 -13.116  12.388  -0.999
  825    HG2  GLU 102           HG3      GLU 102 -11.392  14.044  -1.222
  826    HG3  GLU 102           HG2      GLU 102 -12.477  14.164  -2.603
  Start of MODEL   11
    1    H1   GLY   1           HT1      GLY   1  -8.489 -23.405  12.887
    2    H2   GLY   1           HT2      GLY   1  -8.246 -25.050  12.586
    3    H3   GLY   1           HT3      GLY   1  -9.416 -24.569  13.703
    4    HA2  GLY   1           HA2      GLY   1 -10.403 -25.243  11.608
    5    HA3  GLY   1           HA3      GLY   1 -10.698 -23.546  11.967
    6    H    HIS   2           HN       HIS   2 -10.308 -25.285   9.431
    7    HA   HIS   2           HA       HIS   2  -8.532 -23.327   8.131
    8    HB2  HIS   2           HB2      HIS   2  -8.631 -26.299   7.575
    9    HB3  HIS   2           HB1      HIS   2  -7.821 -25.145   6.535
   10    HD1  HIS   2           HD1      HIS   2  -5.650 -23.931   7.646
   11    HD2  HIS   2           HD2      HIS   2  -7.190 -27.216   9.676
   12    HE1  HIS   2           HE1      HIS   2  -3.849 -24.680   9.233
   13    H    MET   3           HN       MET   3 -11.608 -24.092   8.369
   14    HA   MET   3           HA       MET   3 -12.128 -24.159   5.478
   15    HB2  MET   3           HB2      MET   3 -14.060 -24.707   7.730
   16    HB3  MET   3           HB1      MET   3 -14.378 -24.902   6.018
   17    HG2  MET   3           HG2      MET   3 -12.400 -26.488   7.633
   18    HG3  MET   3           HG1      MET   3 -13.989 -27.040   7.116
   19    HE1  MET   3           HE1      MET   3 -11.498 -29.210   5.032
   20    HE2  MET   3           HE2      MET   3 -12.865 -29.220   6.145
   21    HE3  MET   3           HE3      MET   3 -11.293 -28.636   6.688
   22    H    LEU   4           HN       LEU   4 -13.405 -22.670   4.534
   23    HA   LEU   4           HA       LEU   4 -14.416 -20.760   4.068
   24    HB2  LEU   4           HB2      LEU   4 -15.171 -20.798   6.975
   25    HB3  LEU   4           HB1      LEU   4 -15.602 -19.455   5.943
   26    HG   LEU   4           HG       LEU   4 -16.874 -21.089   4.506
   27   HD11  LEU   4          HD11      LEU   4 -16.402 -22.966   6.805
   28   HD12  LEU   4          HD12      LEU   4 -15.782 -23.144   5.165
   29   HD13  LEU   4          HD13      LEU   4 -17.519 -23.228   5.463
   30   HD21  LEU   4          HD21      LEU   4 -17.725 -20.812   7.382
   31   HD22  LEU   4          HD22      LEU   4 -18.781 -21.210   6.027
   32   HD23  LEU   4          HD23      LEU   4 -17.989 -19.639   6.091
   33    H    ARG   5           HN       ARG   5 -13.363 -19.120   3.382
   34    HA   ARG   5           HA       ARG   5 -11.336 -17.951   5.036
   35    HB2  ARG   5           HB2      ARG   5 -10.831 -16.483   3.072
   36    HB3  ARG   5           HB1      ARG   5 -10.752 -18.190   2.696
   37    HG2  ARG   5           HG2      ARG   5 -12.940 -18.039   1.599
   38    HG3  ARG   5           HG1      ARG   5 -13.011 -16.322   1.990
   39    HD2  ARG   5           HD2      ARG   5 -10.919 -17.666   0.270
   40    HD3  ARG   5           HD1      ARG   5 -12.269 -16.701  -0.319
   41    HE   ARG   5           HE       ARG   5 -10.989 -15.048   1.400
   42   HH11  ARG   5          HH11      ARG   5  -9.976 -16.853  -1.468
   43   HH12  ARG   5          HH12      ARG   5  -8.761 -15.748  -1.933
   44   HH21  ARG   5          HH21      ARG   5  -9.303 -13.485   0.750
   45   HH22  ARG   5          HH22      ARG   5  -8.383 -13.818  -0.643
   46    H    THR   6           HN       THR   6 -12.197 -16.972   6.670
   47    HA   THR   6           HA       THR   6 -13.766 -14.592   6.153
   48    HB   THR   6           HB       THR   6 -14.556 -16.616   8.281
   49    HG1  THR   6           HG1      THR   6 -15.198 -16.397   5.594
   50   HG21  THR   6          HG21      THR   6 -15.997 -14.205   7.150
   51   HG22  THR   6          HG22      THR   6 -15.174 -14.255   8.706
   52   HG23  THR   6          HG23      THR   6 -16.595 -15.264   8.430
   53    H    ALA   7           HN       ALA   7 -12.090 -13.282   6.764
   54    HA   ALA   7           HA       ALA   7 -10.704 -12.073   8.073
   55    HB1  ALA   7           HB1      ALA   7 -12.385 -13.161  10.330
   56    HB2  ALA   7           HB2      ALA   7 -12.756 -11.735   9.360
   57    HB3  ALA   7           HB3      ALA   7 -11.338 -11.744  10.408
   58    H    GLY   8           HN       GLY   8  -9.866 -14.754   7.431
   59    HA2  GLY   8           HA3      GLY   8  -8.621 -15.977   9.668
   60    HA3  GLY   8           HA2      GLY   8  -8.268 -16.298   7.974
   61    H    ARG   9           HN       ARG   9  -7.055 -14.393   6.875
   62    HA   ARG   9           HA       ARG   9  -5.257 -13.091   8.746
   63    HB2  ARG   9           HB2      ARG   9  -4.261 -15.292   8.161
   64    HB3  ARG   9           HB1      ARG   9  -4.228 -14.793   6.482
   65    HG2  ARG   9           HG2      ARG   9  -2.680 -12.998   7.026
   66    HG3  ARG   9           HG1      ARG   9  -2.753 -13.438   8.734
   67    HD2  ARG   9           HD2      ARG   9  -1.709 -15.134   6.466
   68    HD3  ARG   9           HD1      ARG   9  -0.772 -14.395   7.767
   69    HE   ARG   9           HE       ARG   9  -2.779 -16.036   8.851
   70   HH11  ARG   9          HH11      ARG   9   0.362 -16.289   7.280
   71   HH12  ARG   9          HH12      ARG   9   0.709 -17.831   7.921
   72   HH21  ARG   9          HH21      ARG   9  -2.349 -18.103   9.686
   73   HH22  ARG   9          HH22      ARG   9  -0.869 -18.892   9.368
   74    H    ASP  10           HN       ASP  10  -5.032 -13.634   5.226
   75    HA   ASP  10           HA       ASP  10  -4.938 -12.240   3.461
   76    HB2  ASP  10           HB2      ASP  10  -7.355 -11.893   4.168
   77    HB3  ASP  10           HB1      ASP  10  -6.840 -10.498   5.094
   78    H    GLY  11           HN       GLY  11  -5.061  -9.286   3.574
   79    HA2  GLY  11           HA3      GLY  11  -3.834  -7.454   4.377
   80    HA3  GLY  11           HA2      GLY  11  -2.864  -8.564   5.351
   81    H    LEU  12           HN       LEU  12  -1.578 -10.102   4.111
   82    HA   LEU  12           HA       LEU  12   0.268  -8.802   2.402
   83    HB2  LEU  12           HB2      LEU  12   0.543 -10.887   3.920
   84    HB3  LEU  12           HB1      LEU  12  -0.170 -11.779   2.620
   85    HG   LEU  12           HG       LEU  12   2.312 -11.994   2.727
   86   HD11  LEU  12          HD11      LEU  12   1.211 -12.444   0.622
   87   HD12  LEU  12          HD12      LEU  12   2.784 -11.695   0.364
   88   HD13  LEU  12          HD13      LEU  12   1.314 -10.740   0.185
   89   HD21  LEU  12          HD21      LEU  12   3.720 -10.162   2.000
   90   HD22  LEU  12          HD22      LEU  12   2.822  -9.726   3.459
   91   HD23  LEU  12          HD23      LEU  12   2.315  -9.104   1.889
   92    H    CYS  13           HN       CYS  13  -2.232 -11.206   1.849
   93    HA   CYS  13           HA       CYS  13  -2.059 -11.574  -0.888
   94    HB2  CYS  13           HB2      CYS  13  -4.449 -11.620   0.932
   95    HB3  CYS  13           HB1      CYS  13  -4.378 -12.387  -0.667
   96    HG   CYS  13           HG       CYS  13  -3.218 -14.525   0.038
   97    H    ARG  14           HN       ARG  14  -4.193  -9.422   0.948
   98    HA   ARG  14           HA       ARG  14  -5.470  -8.030  -1.057
   99    HB2  ARG  14           HB2      ARG  14  -5.899  -7.978   1.392
  100    HB3  ARG  14           HB1      ARG  14  -4.469  -6.991   1.580
  101    HG2  ARG  14           HG2      ARG  14  -5.533  -5.244   0.198
  102    HG3  ARG  14           HG1      ARG  14  -6.999  -6.231   0.132
  103    HD2  ARG  14           HD2      ARG  14  -5.686  -5.019   2.550
  104    HD3  ARG  14           HD1      ARG  14  -7.298  -4.686   1.911
  105    HE   ARG  14           HE       ARG  14  -7.600  -7.224   2.455
  106   HH11  ARG  14          HH11      ARG  14  -5.898  -4.820   4.455
  107   HH12  ARG  14          HH12      ARG  14  -6.185  -5.613   5.907
  108   HH21  ARG  14          HH21      ARG  14  -7.918  -8.357   4.447
  109   HH22  ARG  14          HH22      ARG  14  -7.380  -7.696   5.933
  110    H    LEU  15           HN       LEU  15  -2.481  -7.224   0.666
  111    HA   LEU  15           HA       LEU  15  -1.893  -4.778  -0.427
  112    HB2  LEU  15           HB2      LEU  15  -0.915  -5.819   1.574
  113    HB3  LEU  15           HB1      LEU  15  -0.018  -6.914   0.554
  114    HG   LEU  15           HG       LEU  15   1.313  -5.058  -0.308
  115   HD11  LEU  15          HD11      LEU  15  -0.392  -3.321  -0.211
  116   HD12  LEU  15          HD12      LEU  15   1.055  -2.846   0.685
  117   HD13  LEU  15          HD13      LEU  15  -0.374  -3.416   1.550
  118   HD21  LEU  15          HD21      LEU  15   1.096  -5.058   2.696
  119   HD22  LEU  15          HD22      LEU  15   2.472  -4.486   1.748
  120   HD23  LEU  15          HD23      LEU  15   2.036  -6.194   1.727
  121    H    SER  16           HN       SER  16  -0.707  -7.971  -1.472
  122    HA   SER  16           HA       SER  16   0.903  -7.016  -3.569
  123    HB2  SER  16           HB2      SER  16   1.054  -9.287  -2.484
  124    HB3  SER  16           HB1      SER  16  -0.398  -9.748  -3.365
  125    HG   SER  16           HG       SER  16   0.715  -9.663  -5.263
  126    H    THR  17           HN       THR  17  -2.500  -7.782  -3.384
  127    HA   THR  17           HA       THR  17  -3.036  -7.953  -6.162
  128    HB   THR  17           HB       THR  17  -4.934  -7.274  -3.888
  129    HG1  THR  17           HG1      THR  17  -3.984  -9.262  -3.472
  130   HG21  THR  17          HG21      THR  17  -5.891  -6.817  -6.122
  131   HG22  THR  17          HG22      THR  17  -6.682  -8.191  -5.357
  132   HG23  THR  17          HG23      THR  17  -5.486  -8.459  -6.628
  133    H    TYR  18           HN       TYR  18  -2.617  -5.278  -4.019
  134    HA   TYR  18           HA       TYR  18  -3.704  -3.391  -5.963
  135    HB2  TYR  18           HB2      TYR  18  -2.542  -2.993  -3.209
  136    HB3  TYR  18           HB1      TYR  18  -2.957  -1.656  -4.270
  137    HD1  TYR  18           HD1      TYR  18  -4.412  -4.679  -2.693
  138    HD2  TYR  18           HD2      TYR  18  -5.113  -0.773  -4.212
  139    HE1  TYR  18           HE1      TYR  18  -6.692  -4.775  -1.828
  140    HE2  TYR  18           HE2      TYR  18  -7.416  -0.866  -3.336
  141    HH   TYR  18           HH       TYR  18  -9.065  -2.477  -2.652
  142    H    LEU  19           HN       LEU  19  -0.674  -4.337  -4.504
  143    HA   LEU  19           HA       LEU  19   0.867  -2.396  -5.807
  144    HB2  LEU  19           HB2      LEU  19   1.592  -4.994  -4.493
  145    HB3  LEU  19           HB1      LEU  19   2.796  -3.934  -5.199
  146    HG   LEU  19           HG       LEU  19   0.930  -3.056  -2.937
  147   HD11  LEU  19          HD11      LEU  19   2.834  -3.278  -1.512
  148   HD12  LEU  19          HD12      LEU  19   3.796  -3.929  -2.840
  149   HD13  LEU  19          HD13      LEU  19   2.417  -4.838  -2.217
  150   HD21  LEU  19          HD21      LEU  19   2.452  -1.200  -2.792
  151   HD22  LEU  19          HD22      LEU  19   1.763  -1.281  -4.413
  152   HD23  LEU  19          HD23      LEU  19   3.408  -1.838  -4.127
  153    H    GLU  20           HN       GLU  20  -0.352  -5.426  -6.958
  154    HA   GLU  20           HA       GLU  20   1.433  -5.630  -9.165
  155    HB2  GLU  20           HB3      GLU  20  -0.174  -7.252 -10.097
  156    HB3  GLU  20           HB2      GLU  20   0.215  -7.589  -8.417
  157    HG2  GLU  20           HG3      GLU  20  -1.859  -6.593  -7.716
  158    HG3  GLU  20           HG2      GLU  20  -2.242  -6.187  -9.387
  159    H    GLU  21           HN       GLU  21  -1.146  -3.550  -8.505
  160    HA   GLU  21           HA       GLU  21  -1.881  -2.988 -11.244
  161    HB2  GLU  21           HB3      GLU  21  -2.555  -1.645  -8.625
  162    HB3  GLU  21           HB2      GLU  21  -3.147  -1.090 -10.181
  163    HG2  GLU  21           HG3      GLU  21  -3.631  -3.863  -9.157
  164    HG3  GLU  21           HG2      GLU  21  -4.706  -2.516  -8.798
  165    H    LEU  22           HN       LEU  22   0.737  -2.339  -9.390
  166    HA   LEU  22           HA       LEU  22   1.180   0.315 -10.523
  167    HB2  LEU  22           HB2      LEU  22   2.596  -1.152  -8.318
  168    HB3  LEU  22           HB1      LEU  22   3.089   0.406  -8.911
  169    HG   LEU  22           HG       LEU  22   0.599  -0.287  -7.377
  170   HD11  LEU  22          HD11      LEU  22   1.516   1.338  -5.793
  171   HD12  LEU  22          HD12      LEU  22   2.943   1.512  -6.816
  172   HD13  LEU  22          HD13      LEU  22   2.587  -0.036  -6.049
  173   HD21  LEU  22          HD21      LEU  22   1.323   2.354  -8.662
  174   HD22  LEU  22          HD22      LEU  22   0.020   2.089  -7.507
  175   HD23  LEU  22          HD23      LEU  22  -0.047   1.317  -9.090
  176    H    GLU  23           HN       GLU  23   2.808   0.687 -11.882
  177    HA   GLU  23           HA       GLU  23   4.103  -1.516 -13.218
  178    HB2  GLU  23           HB3      GLU  23   4.750   1.411 -13.411
  179    HB3  GLU  23           HB2      GLU  23   5.186   0.147 -14.543
  180    HG2  GLU  23           HG3      GLU  23   2.710  -0.111 -14.988
  181    HG3  GLU  23           HG2      GLU  23   2.560   1.364 -13.995
  182    H    ALA  24           HN       ALA  24   6.543  -1.222 -13.624
  183    HA   ALA  24           HA       ALA  24   7.989  -1.454 -11.249
  184    HB1  ALA  24           HB1      ALA  24   9.022  -0.760 -14.004
  185    HB2  ALA  24           HB2      ALA  24   8.745  -2.391 -13.393
  186    HB3  ALA  24           HB3      ALA  24   9.980  -1.371 -12.656
  187    H    VAL  25           HN       VAL  25   7.469   1.275 -13.430
  188    HA   VAL  25           HA       VAL  25   9.100   3.118 -12.074
  189    HB   VAL  25           HB       VAL  25   8.357   3.715 -14.322
  190   HG11  VAL  25          HG11      VAL  25   6.186   2.578 -14.331
  191   HG12  VAL  25          HG12      VAL  25   6.034   4.276 -14.826
  192   HG13  VAL  25          HG13      VAL  25   5.588   3.792 -13.190
  193   HG21  VAL  25          HG21      VAL  25   8.738   5.599 -12.802
  194   HG22  VAL  25          HG22      VAL  25   7.021   5.517 -12.350
  195   HG23  VAL  25          HG23      VAL  25   7.467   5.944 -13.996
  196    H    GLU  26           HN       GLU  26   5.687   2.328 -11.659
  197    HA   GLU  26           HA       GLU  26   5.162   4.306  -9.723
  198    HB2  GLU  26           HB3      GLU  26   3.780   1.674 -10.161
  199    HB3  GLU  26           HB2      GLU  26   3.146   3.013  -9.201
  200    HG2  GLU  26           HG3      GLU  26   3.582   2.891 -12.175
  201    HG3  GLU  26           HG2      GLU  26   2.042   2.977 -11.321
  202    H    LEU  27           HN       LEU  27   6.106   0.927  -9.474
  203    HA   LEU  27           HA       LEU  27   6.032   0.753  -6.700
  204    HB2  LEU  27           HB2      LEU  27   7.763  -0.739  -8.668
  205    HB3  LEU  27           HB1      LEU  27   7.614  -1.119  -6.963
  206    HG   LEU  27           HG       LEU  27   5.318  -1.208  -8.924
  207   HD11  LEU  27          HD11      LEU  27   5.524  -3.639  -8.770
  208   HD12  LEU  27          HD12      LEU  27   6.997  -3.455  -7.813
  209   HD13  LEU  27          HD13      LEU  27   6.952  -2.902  -9.489
  210   HD21  LEU  27          HD21      LEU  27   4.202  -2.469  -7.120
  211   HD22  LEU  27          HD22      LEU  27   4.578  -0.817  -6.659
  212   HD23  LEU  27          HD23      LEU  27   5.579  -2.145  -6.064
  213    H    LYS  28           HN       LYS  28   8.574   1.756  -8.910
  214    HA   LYS  28           HA       LYS  28  10.693   2.020  -7.095
  215    HB2  LYS  28           HB2      LYS  28  10.906   2.042  -9.575
  216    HB3  LYS  28           HB1      LYS  28  10.123   3.604  -9.603
  217    HG2  LYS  28           HG2      LYS  28  11.978   4.604  -8.429
  218    HG3  LYS  28           HG1      LYS  28  12.757   3.026  -8.272
  219    HD2  LYS  28           HD2      LYS  28  12.887   2.846 -10.715
  220    HD3  LYS  28           HD1      LYS  28  12.109   4.420 -10.872
  221    HE2  LYS  28           HE2      LYS  28  14.544   4.550 -11.148
  222    HE3  LYS  28           HE1      LYS  28  13.985   5.486  -9.763
  223    HZ1  LYS  28           HZ1      LYS  28  15.980   4.194  -9.277
  224    HZ2  LYS  28           HZ2      LYS  28  15.173   2.752  -9.601
  225    HZ3  LYS  28           HZ3      LYS  28  14.702   3.721  -8.309
  226    H    LYS  29           HN       LYS  29   8.169   4.255  -8.113
  227    HA   LYS  29           HA       LYS  29   9.134   6.498  -6.665
  228    HB2  LYS  29           HB2      LYS  29   6.317   5.939  -7.560
  229    HB3  LYS  29           HB1      LYS  29   6.941   7.499  -7.061
  230    HG2  LYS  29           HG2      LYS  29   8.506   7.388  -9.100
  231    HG3  LYS  29           HG1      LYS  29   7.623   5.944  -9.538
  232    HD2  LYS  29           HD2      LYS  29   6.312   8.605  -9.086
  233    HD3  LYS  29           HD1      LYS  29   6.791   7.989 -10.671
  234    HE2  LYS  29           HE2      LYS  29   5.328   6.117 -10.436
  235    HE3  LYS  29           HE1      LYS  29   4.891   6.572  -8.791
  236    HZ1  LYS  29           HZ1      LYS  29   3.800   8.547  -9.711
  237    HZ2  LYS  29           HZ2      LYS  29   3.228   7.110 -10.408
  238    HZ3  LYS  29           HZ3      LYS  29   4.288   8.086 -11.268
  239    H    PHE  30           HN       PHE  30   6.693   4.027  -5.976
  240    HA   PHE  30           HA       PHE  30   5.870   5.213  -3.556
  241    HB2  PHE  30           HB2      PHE  30   4.176   3.747  -3.758
  242    HB3  PHE  30           HB1      PHE  30   4.965   3.118  -5.185
  243    HD1  PHE  30           HD2      PHE  30   6.481   1.123  -4.895
  244    HD2  PHE  30           HD1      PHE  30   3.852   2.459  -1.857
  245    HE1  PHE  30           HE2      PHE  30   6.566  -1.100  -3.869
  246    HE2  PHE  30           HE1      PHE  30   3.931   0.229  -0.808
  247    HZ   PHE  30           HZ       PHE  30   5.299  -1.553  -1.832
  248    H    LYS  31           HN       LYS  31   8.355   2.883  -4.281
  249    HA   LYS  31           HA       LYS  31   8.940   2.415  -1.501
  250    HB2  LYS  31           HB2      LYS  31  10.379   1.674  -4.018
  251    HB3  LYS  31           HB1      LYS  31  11.064   1.414  -2.414
  252    HG2  LYS  31           HG2      LYS  31   8.437   0.281  -3.328
  253    HG3  LYS  31           HG1      LYS  31   9.973  -0.583  -3.406
  254    HD2  LYS  31           HD2      LYS  31  10.209  -0.306  -0.952
  255    HD3  LYS  31           HD1      LYS  31   8.626   0.468  -0.912
  256    HE2  LYS  31           HE2      LYS  31   7.614  -1.567  -1.800
  257    HE3  LYS  31           HE1      LYS  31   9.199  -2.334  -1.846
  258    HZ1  LYS  31           HZ1      LYS  31   7.822  -1.370   0.591
  259    HZ2  LYS  31           HZ2      LYS  31   9.333  -2.141   0.540
  260    HZ3  LYS  31           HZ3      LYS  31   7.932  -2.978   0.085
  261    H    LEU  32           HN       LEU  32   9.996   4.822  -3.789
  262    HA   LEU  32           HA       LEU  32  12.109   5.502  -1.998
  263    HB2  LEU  32           HB2      LEU  32  12.516   7.472  -3.344
  264    HB3  LEU  32           HB1      LEU  32  12.334   6.100  -4.396
  265    HG   LEU  32           HG       LEU  32   9.900   7.030  -4.734
  266   HD11  LEU  32          HD11      LEU  32   9.942   8.708  -2.988
  267   HD12  LEU  32          HD12      LEU  32   9.713   9.445  -4.571
  268   HD13  LEU  32          HD13      LEU  32  11.287   9.527  -3.783
  269   HD21  LEU  32          HD21      LEU  32  10.711   8.443  -6.567
  270   HD22  LEU  32          HD22      LEU  32  11.585   6.912  -6.474
  271   HD23  LEU  32          HD23      LEU  32  12.330   8.394  -5.868
  272    H    TYR  33           HN       TYR  33   8.806   6.420  -2.475
  273    HA   TYR  33           HA       TYR  33   8.807   8.598  -0.726
  274    HB2  TYR  33           HB2      TYR  33   6.963   8.150  -2.310
  275    HB3  TYR  33           HB1      TYR  33   6.503   6.743  -1.352
  276    HD1  TYR  33           HD2      TYR  33   5.420   7.018   0.827
  277    HD2  TYR  33           HD1      TYR  33   6.525  10.381  -1.510
  278    HE1  TYR  33           HE2      TYR  33   4.026   8.433   2.251
  279    HE2  TYR  33           HE1      TYR  33   5.135  11.826  -0.095
  280    HH   TYR  33           HH       TYR  33   4.036  10.923   2.884
  281    H    LEU  34           HN       LEU  34   7.584   5.291  -0.058
  282    HA   LEU  34           HA       LEU  34   7.625   5.949   2.773
  283    HB2  LEU  34           HB2      LEU  34   6.690   3.676   3.075
  284    HB3  LEU  34           HB1      LEU  34   5.693   4.774   2.138
  285    HG   LEU  34           HG       LEU  34   6.600   3.560   0.078
  286   HD11  LEU  34          HD11      LEU  34   8.511   2.434   1.036
  287   HD12  LEU  34          HD12      LEU  34   7.341   1.254   0.417
  288   HD13  LEU  34          HD13      LEU  34   7.455   1.554   2.144
  289   HD21  LEU  34          HD21      LEU  34   4.927   2.022   2.033
  290   HD22  LEU  34          HD22      LEU  34   5.051   1.751   0.288
  291   HD23  LEU  34          HD23      LEU  34   4.363   3.259   0.900
  292    H    GLY  35           HN       GLY  35   9.982   5.080   0.837
  293    HA2  GLY  35           HA3      GLY  35  11.084   3.148   2.680
  294    HA3  GLY  35           HA2      GLY  35  11.774   3.537   1.092
  295    H    THR  36           HN       THR  36  12.069   6.187   1.182
  296    HA   THR  36           HA       THR  36  13.954   6.506   3.421
  297    HB   THR  36           HB       THR  36  15.071   6.598   1.235
  298    HG1  THR  36           HG1      THR  36  16.307   7.934   2.217
  299   HG21  THR  36          HG21      THR  36  14.648   8.430  -0.372
  300   HG22  THR  36          HG22      THR  36  13.273   8.947   0.606
  301   HG23  THR  36          HG23      THR  36  13.254   7.371  -0.181
  302    H    ALA  37           HN       ALA  37  11.059   7.022   3.213
  303    HA   ALA  37           HA       ALA  37  10.224   9.634   3.316
  304    HB1  ALA  37           HB1      ALA  37   8.440   8.854   4.816
  305    HB2  ALA  37           HB2      ALA  37   9.332   7.335   5.008
  306    HB3  ALA  37           HB3      ALA  37   8.711   7.803   3.428
  307    H    THR  38           HN       THR  38  10.924  11.293   4.457
  308    HA   THR  38           HA       THR  38  12.322  11.037   6.933
  309    HB   THR  38           HB       THR  38  11.113  13.570   5.774
  310    HG1  THR  38           HG1      THR  38  13.272  11.971   4.982
  311   HG21  THR  38          HG21      THR  38  13.054  14.637   6.834
  312   HG22  THR  38          HG22      THR  38  13.650  13.065   7.357
  313   HG23  THR  38          HG23      THR  38  12.154  13.707   8.034
  314    H    GLU  39           HN       GLU  39   9.114  11.241   5.925
  315    HA   GLU  39           HA       GLU  39   7.969  12.187   8.387
  316    HB2  GLU  39           HB3      GLU  39   5.810  11.691   7.316
  317    HB3  GLU  39           HB2      GLU  39   6.856  12.665   6.298
  318    HG2  GLU  39           HG3      GLU  39   7.518  10.541   5.148
  319    HG3  GLU  39           HG2      GLU  39   6.194   9.757   6.013
  320    H    LEU  40           HN       LEU  40   9.437   9.407   7.697
  321    HA   LEU  40           HA       LEU  40   7.750   7.878   9.563
  322    HB2  LEU  40           HB2      LEU  40   9.973   6.899   7.756
  323    HB3  LEU  40           HB1      LEU  40   9.113   5.898   8.902
  324    HG   LEU  40           HG       LEU  40   7.962   7.171   6.421
  325   HD11  LEU  40          HD11      LEU  40   8.542   4.312   7.137
  326   HD12  LEU  40          HD12      LEU  40   9.423   5.295   5.969
  327   HD13  LEU  40          HD13      LEU  40   7.741   4.860   5.666
  328   HD21  LEU  40          HD21      LEU  40   6.275   7.075   8.193
  329   HD22  LEU  40          HD22      LEU  40   6.632   5.359   8.439
  330   HD23  LEU  40          HD23      LEU  40   5.954   5.915   6.903
  331    H    GLY  41           HN       GLY  41  11.150   8.520   8.759
  332    HA2  GLY  41           HA3      GLY  41  12.445   9.674  10.488
  333    HA3  GLY  41           HA2      GLY  41  11.660   8.612  11.656
  334    H    GLU  42           HN       GLU  42  11.850   6.197  10.622
  335    HA   GLU  42           HA       GLU  42  14.608   5.574  10.990
  336    HB2  GLU  42           HB3      GLU  42  12.307   3.798  10.169
  337    HB3  GLU  42           HB2      GLU  42  13.923   3.231  10.526
  338    HG2  GLU  42           HG3      GLU  42  12.520   2.796  12.407
  339    HG3  GLU  42           HG2      GLU  42  13.651   4.070  12.839
  340    H    GLY  43           HN       GLY  43  12.398   5.176   8.268
  341    HA2  GLY  43           HA3      GLY  43  12.890   5.042   5.978
  342    HA3  GLY  43           HA2      GLY  43  14.606   5.238   6.365
  343    H    LYS  44           HN       LYS  44  11.928   2.974   6.522
  344    HA   LYS  44           HA       LYS  44  13.477   0.844   7.584
  345    HB2  LYS  44           HB2      LYS  44  10.715   0.893   6.404
  346    HB3  LYS  44           HB1      LYS  44  11.468  -0.556   7.040
  347    HG2  LYS  44           HG2      LYS  44  10.846   1.949   8.613
  348    HG3  LYS  44           HG1      LYS  44   9.931   0.440   8.658
  349    HD2  LYS  44           HD2      LYS  44  12.025  -0.702   9.433
  350    HD3  LYS  44           HD1      LYS  44  12.776   0.888   9.564
  351    HE2  LYS  44           HE2      LYS  44  12.017   0.259  11.740
  352    HE3  LYS  44           HE1      LYS  44  10.949   1.528  11.150
  353    HZ1  LYS  44           HZ1      LYS  44   9.705  -0.237  12.186
  354    HZ2  LYS  44           HZ2      LYS  44  10.355  -1.387  11.156
  355    HZ3  LYS  44           HZ3      LYS  44   9.326  -0.192  10.555
  356    H    ILE  45           HN       ILE  45  12.735   1.778   4.318
  357    HA   ILE  45           HA       ILE  45  13.418  -0.885   3.417
  358    HB   ILE  45           HB       ILE  45  12.510   1.493   1.792
  359   HG12  ILE  45          HG12      ILE  45  10.793   0.515   3.303
  360   HG13  ILE  45          HG11      ILE  45  10.379   0.332   1.601
  361   HG21  ILE  45          HG21      ILE  45  12.240  -0.205  -0.046
  362   HG22  ILE  45          HG22      ILE  45  13.119  -1.356   0.992
  363   HG23  ILE  45          HG23      ILE  45  13.914   0.086   0.437
  364   HD11  ILE  45          HD11      ILE  45   9.848  -1.699   2.808
  365   HD12  ILE  45          HD12      ILE  45  11.501  -1.803   3.414
  366   HD13  ILE  45          HD13      ILE  45  11.182  -1.975   1.679
  367    HA   PRO  46           HA       PRO  46  17.587   0.423   2.511
  368    HB2  PRO  46           HB2      PRO  46  18.343  -2.008   1.508
  369    HB3  PRO  46           HB1      PRO  46  18.386  -1.596   3.222
  370    HG2  PRO  46           HG2      PRO  46  16.382  -3.142   1.680
  371    HG3  PRO  46           HG1      PRO  46  16.999  -3.381   3.360
  372    HD2  PRO  46           HD2      PRO  46  14.591  -2.314   2.614
  373    HD3  PRO  46           HD1      PRO  46  15.379  -1.949   4.156
  374    H    TRP  47           HN       TRP  47  18.693   0.761   0.676
  375    HA   TRP  47           HA       TRP  47  17.299   1.822  -1.446
  376    HB2  TRP  47           HB2      TRP  47  20.221   1.093  -1.406
  377    HB3  TRP  47           HB1      TRP  47  19.451   2.370  -2.337
  378    HD1  TRP  47           HD1      TRP  47  19.213   4.706  -1.174
  379    HE1  TRP  47           HE1      TRP  47  19.862   5.627   1.154
  380    HE3  TRP  47           HE3      TRP  47  20.412   0.323   1.171
  381    HZ2  TRP  47           HZ2      TRP  47  20.747   4.630   3.629
  382    HZ3  TRP  47           HZ3      TRP  47  21.118   0.368   3.487
  383    HH2  TRP  47           HH2      TRP  47  21.302   2.486   4.709
  384    H    GLY  48           HN       GLY  48  18.648  -1.393  -1.155
  385    HA2  GLY  48           HA3      GLY  48  17.958  -1.820  -3.979
  386    HA3  GLY  48           HA2      GLY  48  19.457  -2.431  -3.316
  387    H    SER  49           HN       SER  49  16.282  -2.462  -1.790
  388    HA   SER  49           HA       SER  49  16.420  -5.405  -1.859
  389    HB2  SER  49           HB2      SER  49  14.778  -5.268   0.011
  390    HB3  SER  49           HB1      SER  49  16.345  -4.539   0.364
  391    HG   SER  49           HG       SER  49  15.442  -2.494   0.109
  392    H    MET  50           HN       MET  50  14.974  -2.837  -3.302
  393    HA   MET  50           HA       MET  50  12.594  -4.367  -3.947
  394    HB2  MET  50           HB2      MET  50  11.416  -2.059  -4.017
  395    HB3  MET  50           HB1      MET  50  11.650  -2.875  -2.486
  396    HG2  MET  50           HG2      MET  50  12.110  -0.556  -2.214
  397    HG3  MET  50           HG1      MET  50  13.594  -1.452  -2.040
  398    HE1  MET  50           HE1      MET  50  15.016   0.748  -2.263
  399    HE2  MET  50           HE2      MET  50  13.543   1.706  -2.444
  400    HE3  MET  50           HE3      MET  50  14.865   1.891  -3.596
  401    H    GLU  51           HN       GLU  51  15.134  -3.896  -5.342
  402    HA   GLU  51           HA       GLU  51  14.332  -2.309  -7.642
  403    HB2  GLU  51           HB3      GLU  51  16.785  -3.993  -7.186
  404    HB3  GLU  51           HB2      GLU  51  16.546  -2.861  -8.498
  405    HG2  GLU  51           HG3      GLU  51  16.436  -1.024  -6.860
  406    HG3  GLU  51           HG2      GLU  51  16.736  -2.189  -5.573
  407    H    LYS  52           HN       LYS  52  15.247  -5.584  -6.826
  408    HA   LYS  52           HA       LYS  52  14.258  -6.661  -9.351
  409    HB2  LYS  52           HB2      LYS  52  15.501  -8.056  -6.979
  410    HB3  LYS  52           HB1      LYS  52  15.192  -8.761  -8.559
  411    HG2  LYS  52           HG2      LYS  52  16.811  -7.260  -9.568
  412    HG3  LYS  52           HG1      LYS  52  17.085  -6.485  -8.010
  413    HD2  LYS  52           HD2      LYS  52  18.866  -8.060  -8.417
  414    HD3  LYS  52           HD1      LYS  52  17.847  -8.666  -7.115
  415    HE2  LYS  52           HE2      LYS  52  18.400 -10.487  -8.590
  416    HE3  LYS  52           HE1      LYS  52  16.689 -10.128  -8.749
  417    HZ1  LYS  52           HZ1      LYS  52  17.215  -8.875 -10.807
  418    HZ2  LYS  52           HZ2      LYS  52  17.668 -10.494 -10.883
  419    HZ3  LYS  52           HZ3      LYS  52  18.842  -9.316 -10.627
  420    H    ALA  53           HN       ALA  53  12.727  -5.619  -6.845
  421    HA   ALA  53           HA       ALA  53  11.192  -7.969  -6.129
  422    HB1  ALA  53           HB1      ALA  53  11.065  -5.124  -5.162
  423    HB2  ALA  53           HB2      ALA  53  11.824  -6.485  -4.326
  424    HB3  ALA  53           HB3      ALA  53  10.073  -6.432  -4.540
  425    H    GLY  54           HN       GLY  54   9.004  -8.214  -6.546
  426    HA2  GLY  54           HA3      GLY  54   7.811  -6.345  -8.457
  427    HA3  GLY  54           HA2      GLY  54   7.546  -8.099  -8.449
  428    HA   PRO  55           HA       PRO  55   4.211  -5.847  -5.947
  429    HB2  PRO  55           HB2      PRO  55   2.365  -7.873  -6.611
  430    HB3  PRO  55           HB1      PRO  55   2.440  -6.247  -7.285
  431    HG2  PRO  55           HG2      PRO  55   3.427  -8.802  -8.406
  432    HG3  PRO  55           HG1      PRO  55   2.877  -7.349  -9.243
  433    HD2  PRO  55           HD2      PRO  55   5.488  -8.040  -9.091
  434    HD3  PRO  55           HD1      PRO  55   4.960  -6.351  -9.144
  435    H    LEU  56           HN       LEU  56   4.911  -9.249  -6.228
  436    HA   LEU  56           HA       LEU  56   3.797 -10.088  -3.727
  437    HB2  LEU  56           HB2      LEU  56   4.217 -11.558  -5.716
  438    HB3  LEU  56           HB1      LEU  56   5.926 -11.373  -5.457
  439    HG   LEU  56           HG       LEU  56   4.951 -13.577  -4.775
  440   HD11  LEU  56          HD11      LEU  56   6.205 -13.789  -2.701
  441   HD12  LEU  56          HD12      LEU  56   6.318 -12.031  -2.598
  442   HD13  LEU  56          HD13      LEU  56   7.097 -12.886  -3.928
  443   HD21  LEU  56          HD21      LEU  56   3.773 -13.716  -2.634
  444   HD22  LEU  56          HD22      LEU  56   2.858 -12.801  -3.834
  445   HD23  LEU  56          HD23      LEU  56   3.727 -11.957  -2.551
  446    H    GLU  57           HN       GLU  57   7.174  -9.491  -4.720
  447    HA   GLU  57           HA       GLU  57   8.198  -9.894  -2.131
  448    HB2  GLU  57           HB3      GLU  57   9.394  -8.359  -4.439
  449    HB3  GLU  57           HB2      GLU  57  10.268  -8.787  -2.981
  450    HG2  GLU  57           HG3      GLU  57  10.960 -10.324  -4.612
  451    HG3  GLU  57           HG2      GLU  57   9.801 -11.211  -3.630
  452    H    MET  58           HN       MET  58   7.132  -7.038  -3.864
  453    HA   MET  58           HA       MET  58   7.979  -5.039  -2.087
  454    HB2  MET  58           HB2      MET  58   5.524  -5.165  -3.819
  455    HB3  MET  58           HB1      MET  58   6.006  -3.712  -2.962
  456    HG2  MET  58           HG2      MET  58   7.687  -5.174  -4.964
  457    HG3  MET  58           HG1      MET  58   6.676  -3.802  -5.408
  458    HE1  MET  58           HE1      MET  58   9.718  -3.948  -6.161
  459    HE2  MET  58           HE2      MET  58  10.172  -2.286  -5.783
  460    HE3  MET  58           HE3      MET  58   8.605  -2.644  -6.507
  461    H    ALA  59           HN       ALA  59   4.974  -6.890  -2.175
  462    HA   ALA  59           HA       ALA  59   3.689  -5.709  -0.023
  463    HB1  ALA  59           HB1      ALA  59   3.529  -8.576  -0.956
  464    HB2  ALA  59           HB2      ALA  59   2.603  -7.226  -1.614
  465    HB3  ALA  59           HB3      ALA  59   2.339  -7.748   0.049
  466    H    GLN  60           HN       GLN  60   5.810  -8.523  -0.129
  467    HA   GLN  60           HA       GLN  60   5.710  -9.174   2.597
  468    HB2  GLN  60           HB2      GLN  60   7.985  -9.589   0.664
  469    HB3  GLN  60           HB1      GLN  60   7.763 -10.429   2.192
  470    HG2  GLN  60           HG2      GLN  60   5.683 -11.432   1.322
  471    HG3  GLN  60           HG1      GLN  60   5.933 -10.561  -0.173
  472   HE21  GLN  60          HE21      GLN  60   5.860 -13.458   0.377
  473   HE22  GLN  60          HE22      GLN  60   7.344 -14.058  -0.290
  474    H    LEU  61           HN       LEU  61   7.834  -7.070   0.780
  475    HA   LEU  61           HA       LEU  61   9.598  -6.339   2.788
  476    HB2  LEU  61           HB2      LEU  61   8.751  -5.202   0.237
  477    HB3  LEU  61           HB1      LEU  61   9.364  -4.009   1.346
  478    HG   LEU  61           HG       LEU  61  11.509  -5.199   1.461
  479   HD11  LEU  61          HD11      LEU  61  11.992  -7.066  -0.019
  480   HD12  LEU  61          HD12      LEU  61  10.306  -7.105  -0.535
  481   HD13  LEU  61          HD13      LEU  61  10.725  -7.488   1.134
  482   HD21  LEU  61          HD21      LEU  61  11.185  -3.499  -0.228
  483   HD22  LEU  61          HD22      LEU  61  10.547  -4.705  -1.344
  484   HD23  LEU  61          HD23      LEU  61  12.233  -4.782  -0.833
  485    H    LEU  62           HN       LEU  62   6.363  -4.808   2.084
  486    HA   LEU  62           HA       LEU  62   6.790  -2.958   4.167
  487    HB2  LEU  62           HB2      LEU  62   4.236  -3.837   2.846
  488    HB3  LEU  62           HB1      LEU  62   4.314  -2.609   4.082
  489    HG   LEU  62           HG       LEU  62   4.126  -1.416   2.196
  490   HD11  LEU  62          HD11      LEU  62   6.196  -0.293   1.687
  491   HD12  LEU  62          HD12      LEU  62   7.073  -1.553   2.552
  492   HD13  LEU  62          HD13      LEU  62   5.929  -0.522   3.417
  493   HD21  LEU  62          HD21      LEU  62   5.987  -3.272   0.791
  494   HD22  LEU  62          HD22      LEU  62   5.323  -1.788   0.106
  495   HD23  LEU  62          HD23      LEU  62   4.243  -3.113   0.559
  496    H    ILE  63           HN       ILE  63   5.230  -6.112   3.982
  497    HA   ILE  63           HA       ILE  63   4.009  -5.964   6.551
  498    HB   ILE  63           HB       ILE  63   3.708  -7.577   4.373
  499   HG12  ILE  63          HG12      ILE  63   2.034  -7.190   6.159
  500   HG13  ILE  63          HG11      ILE  63   2.047  -8.859   5.639
  501   HG21  ILE  63          HG21      ILE  63   5.132  -9.324   6.362
  502   HG22  ILE  63          HG22      ILE  63   5.698  -8.881   4.756
  503   HG23  ILE  63          HG23      ILE  63   4.267  -9.902   4.936
  504   HD11  ILE  63          HD11      ILE  63   3.263  -7.732   8.137
  505   HD12  ILE  63          HD12      ILE  63   3.369  -9.417   7.629
  506   HD13  ILE  63          HD13      ILE  63   1.799  -8.712   8.018
  507    H    THR  64           HN       THR  64   7.190  -6.864   5.528
  508    HA   THR  64           HA       THR  64   7.853  -8.188   7.985
  509    HB   THR  64           HB       THR  64   9.664  -7.248   5.752
  510    HG1  THR  64           HG1      THR  64   8.191  -8.724   4.989
  511   HG21  THR  64          HG21      THR  64  10.868  -7.698   7.861
  512   HG22  THR  64          HG22      THR  64  11.244  -8.912   6.640
  513   HG23  THR  64          HG23      THR  64  10.117  -9.293   7.943
  514    H    HIS  65           HN       HIS  65   8.410  -4.991   6.593
  515    HA   HIS  65           HA       HIS  65  10.117  -4.296   8.834
  516    HB2  HIS  65           HB2      HIS  65   9.316  -2.659   6.426
  517    HB3  HIS  65           HB1      HIS  65  10.347  -2.070   7.721
  518    HD1  HIS  65           HD1      HIS  65  12.879  -2.765   7.601
  519    HD2  HIS  65           HD2      HIS  65  10.474  -4.666   4.788
  520    HE1  HIS  65           HE1      HIS  65  14.421  -3.914   6.017
  521    H    PHE  66           HN       PHE  66   7.005  -3.207   7.537
  522    HA   PHE  66           HA       PHE  66   6.554  -1.516   9.818
  523    HB2  PHE  66           HB2      PHE  66   4.774  -2.171   7.463
  524    HB3  PHE  66           HB1      PHE  66   4.494  -0.903   8.654
  525    HD1  PHE  66           HD1      PHE  66   6.640  -2.008   5.920
  526    HD2  PHE  66           HD2      PHE  66   5.685   1.164   8.555
  527    HE1  PHE  66           HE1      PHE  66   8.069  -0.515   4.614
  528    HE2  PHE  66           HE2      PHE  66   7.110   2.675   7.250
  529    HZ   PHE  66           HZ       PHE  66   8.319   1.797   5.273
  530    H    GLY  67           HN       GLY  67   4.348  -3.926   8.410
  531    HA2  GLY  67           HA3      GLY  67   3.976  -5.694  10.421
  532    HA3  GLY  67           HA2      GLY  67   3.113  -4.248  10.972
  533    HA   PRO  68           HA       PRO  68   0.575  -6.805   7.922
  534    HB2  PRO  68           HB2      PRO  68  -1.552  -7.338   9.562
  535    HB3  PRO  68           HB1      PRO  68  -0.175  -8.418   9.353
  536    HG2  PRO  68           HG2      PRO  68  -0.717  -6.483  11.569
  537    HG3  PRO  68           HG1      PRO  68  -0.030  -8.110  11.651
  538    HD2  PRO  68           HD2      PRO  68   1.489  -5.862  11.788
  539    HD3  PRO  68           HD1      PRO  68   2.099  -7.366  11.083
  540    H    GLU  69           HN       GLU  69  -0.758  -4.606  10.406
  541    HA   GLU  69           HA       GLU  69  -2.717  -3.580   8.590
  542    HB2  GLU  69           HB3      GLU  69  -1.889  -2.836  11.356
  543    HB3  GLU  69           HB2      GLU  69  -3.081  -1.906  10.449
  544    HG2  GLU  69           HG3      GLU  69  -3.260  -4.815  11.189
  545    HG3  GLU  69           HG2      GLU  69  -4.152  -3.457  11.887
  546    H    GLU  70           HN       GLU  70   0.315  -2.555   9.951
  547    HA   GLU  70           HA       GLU  70   0.226   0.078   9.046
  548    HB2  GLU  70           HB3      GLU  70   1.619  -0.899  10.883
  549    HB3  GLU  70           HB2      GLU  70   2.703  -1.512   9.649
  550    HG2  GLU  70           HG3      GLU  70   3.314   0.702   8.984
  551    HG3  GLU  70           HG2      GLU  70   2.021   1.398   9.953
  552    H    ALA  71           HN       ALA  71   1.653  -2.838   7.629
  553    HA   ALA  71           HA       ALA  71   2.960  -1.764   5.416
  554    HB1  ALA  71           HB1      ALA  71   3.110  -4.116   6.030
  555    HB2  ALA  71           HB2      ALA  71   2.623  -3.951   4.342
  556    HB3  ALA  71           HB3      ALA  71   1.427  -4.353   5.571
  557    H    TRP  72           HN       TRP  72  -0.369  -2.883   5.678
  558    HA   TRP  72           HA       TRP  72  -1.087  -2.306   3.041
  559    HB2  TRP  72           HB2      TRP  72  -2.433  -3.881   4.210
  560    HB3  TRP  72           HB1      TRP  72  -2.704  -2.772   5.546
  561    HD1  TRP  72           HD1      TRP  72  -5.190  -2.236   5.554
  562    HE1  TRP  72           HE1      TRP  72  -6.913  -1.461   3.828
  563    HE3  TRP  72           HE3      TRP  72  -2.324  -2.544   1.339
  564    HZ2  TRP  72           HZ2      TRP  72  -7.044  -1.027   1.069
  565    HZ3  TRP  72           HZ3      TRP  72  -3.336  -1.930  -0.816
  566    HH2  TRP  72           HH2      TRP  72  -5.650  -1.193  -0.943
  567    H    ARG  73           HN       ARG  73  -1.398  -0.442   5.993
  568    HA   ARG  73           HA       ARG  73  -2.814   1.692   4.850
  569    HB2  ARG  73           HB2      ARG  73  -2.569   1.168   7.261
  570    HB3  ARG  73           HB1      ARG  73  -0.920   1.768   7.191
  571    HG2  ARG  73           HG2      ARG  73  -1.777   3.986   6.619
  572    HG3  ARG  73           HG1      ARG  73  -3.430   3.355   6.689
  573    HD2  ARG  73           HD2      ARG  73  -1.434   3.463   8.935
  574    HD3  ARG  73           HD1      ARG  73  -2.906   4.421   8.785
  575    HE   ARG  73           HE       ARG  73  -4.072   2.145   8.849
  576   HH11  ARG  73          HH11      ARG  73  -1.036   2.785  10.596
  577   HH12  ARG  73          HH12      ARG  73  -1.368   1.690  11.839
  578   HH21  ARG  73          HH21      ARG  73  -4.505   0.593  10.564
  579   HH22  ARG  73          HH22      ARG  73  -3.400   0.420  11.830
  580    H    LEU  74           HN       LEU  74   0.628   1.102   5.387
  581    HA   LEU  74           HA       LEU  74   1.672   3.477   4.419
  582    HB2  LEU  74           HB2      LEU  74   2.679   0.773   4.927
  583    HB3  LEU  74           HB1      LEU  74   3.542   1.615   3.666
  584    HG   LEU  74           HG       LEU  74   4.592   1.806   5.915
  585   HD11  LEU  74          HD11      LEU  74   5.046   3.440   4.204
  586   HD12  LEU  74          HD12      LEU  74   5.047   4.180   5.796
  587   HD13  LEU  74          HD13      LEU  74   3.664   4.407   4.717
  588   HD21  LEU  74          HD21      LEU  74   2.172   3.490   6.576
  589   HD22  LEU  74          HD22      LEU  74   3.608   3.296   7.581
  590   HD23  LEU  74          HD23      LEU  74   2.553   1.915   7.273
  591    H    ALA  75           HN       ALA  75   0.865   0.523   2.643
  592    HA   ALA  75           HA       ALA  75   1.828   1.549   0.152
  593    HB1  ALA  75           HB1      ALA  75   1.602  -0.836   0.473
  594    HB2  ALA  75           HB2      ALA  75   0.653  -0.267  -0.893
  595    HB3  ALA  75           HB3      ALA  75  -0.152  -0.658   0.629
  596    H    LEU  76           HN       LEU  76  -1.479   1.297   1.522
  597    HA   LEU  76           HA       LEU  76  -2.648   2.372  -0.793
  598    HB2  LEU  76           HB2      LEU  76  -4.747   2.433   0.336
  599    HB3  LEU  76           HB1      LEU  76  -3.907   1.034   0.939
  600    HG   LEU  76           HG       LEU  76  -3.299   2.658   2.933
  601   HD11  LEU  76          HD11      LEU  76  -5.876   3.847   1.903
  602   HD12  LEU  76          HD12      LEU  76  -4.308   4.657   1.944
  603   HD13  LEU  76          HD13      LEU  76  -5.113   4.214   3.451
  604   HD21  LEU  76          HD21      LEU  76  -6.006   1.406   2.587
  605   HD22  LEU  76          HD22      LEU  76  -5.296   1.908   4.119
  606   HD23  LEU  76          HD23      LEU  76  -4.545   0.617   3.178
  607    H    SER  77           HN       SER  77  -1.613   3.937   2.180
  608    HA   SER  77           HA       SER  77  -2.485   6.519   1.288
  609    HB2  SER  77           HB2      SER  77  -1.044   5.428   3.670
  610    HB3  SER  77           HB1      SER  77  -1.251   7.196   3.482
  611    HG   SER  77           HG       SER  77  -3.613   6.360   3.219
  612    H    THR  78           HN       THR  78   0.087   4.685   0.314
  613    HA   THR  78           HA       THR  78   1.664   7.079  -0.231
  614    HB   THR  78           HB       THR  78   2.426   4.146  -0.379
  615    HG1  THR  78           HG1      THR  78   2.667   4.716   1.604
  616   HG21  THR  78          HG21      THR  78   4.144   6.545  -1.074
  617   HG22  THR  78          HG22      THR  78   3.536   5.356  -2.225
  618   HG23  THR  78          HG23      THR  78   4.697   4.872  -0.987
  619    H    PHE  79           HN       PHE  79  -0.383   4.702  -1.670
  620    HA   PHE  79           HA       PHE  79   0.333   4.881  -4.351
  621    HB2  PHE  79           HB2      PHE  79  -2.407   4.565  -3.119
  622    HB3  PHE  79           HB1      PHE  79  -2.107   4.388  -4.853
  623    HD1  PHE  79           HD1      PHE  79   0.554   2.871  -4.420
  624    HD2  PHE  79           HD2      PHE  79  -3.333   2.487  -2.755
  625    HE1  PHE  79           HE1      PHE  79   0.973   0.487  -3.983
  626    HE2  PHE  79           HE2      PHE  79  -2.925   0.102  -2.317
  627    HZ   PHE  79           HZ       PHE  79  -0.766  -0.903  -2.933
  628    H    GLU  80           HN       GLU  80  -1.873   6.891  -2.484
  629    HA   GLU  80           HA       GLU  80  -2.560   8.592  -4.622
  630    HB2  GLU  80           HB3      GLU  80  -3.391  10.148  -2.836
  631    HB3  GLU  80           HB2      GLU  80  -3.978   8.504  -2.705
  632    HG2  GLU  80           HG3      GLU  80  -2.797   8.108  -0.794
  633    HG3  GLU  80           HG2      GLU  80  -1.584   9.336  -1.165
  634    H    ARG  81           HN       ARG  81   0.201   8.495  -2.601
  635    HA   ARG  81           HA       ARG  81   0.956  11.262  -2.802
  636    HB2  ARG  81           HB2      ARG  81   2.607   8.890  -1.971
  637    HB3  ARG  81           HB1      ARG  81   2.976  10.584  -1.672
  638    HG2  ARG  81           HG2      ARG  81   0.567   9.139  -0.611
  639    HG3  ARG  81           HG1      ARG  81   2.072   9.411   0.264
  640    HD2  ARG  81           HD2      ARG  81   1.748  11.715   0.342
  641    HD3  ARG  81           HD1      ARG  81   0.512  11.665  -0.914
  642    HE   ARG  81           HE       ARG  81  -1.019  10.741   0.632
  643   HH11  ARG  81          HH11      ARG  81   2.011  11.627   2.264
  644   HH12  ARG  81          HH12      ARG  81   1.242  11.881   3.760
  645   HH21  ARG  81          HH21      ARG  81  -2.005  11.020   2.594
  646   HH22  ARG  81          HH22      ARG  81  -1.103  11.468   3.989
  647    H    ILE  82           HN       ILE  82   1.376   8.441  -4.683
  648    HA   ILE  82           HA       ILE  82   3.530   9.713  -6.206
  649    HB   ILE  82           HB       ILE  82   3.986   7.518  -7.193
  650   HG12  ILE  82          HG12      ILE  82   1.784   6.466  -5.387
  651   HG13  ILE  82          HG11      ILE  82   1.643   6.646  -7.128
  652   HG21  ILE  82          HG21      ILE  82   5.128   8.104  -5.135
  653   HG22  ILE  82          HG22      ILE  82   4.787   6.373  -5.145
  654   HG23  ILE  82          HG23      ILE  82   3.790   7.467  -4.184
  655   HD11  ILE  82          HD11      ILE  82   3.416   4.984  -7.430
  656   HD12  ILE  82          HD12      ILE  82   2.058   4.341  -6.502
  657   HD13  ILE  82          HD13      ILE  82   3.542   4.816  -5.679
  658    H    ASN  83           HN       ASN  83   0.572  10.187  -6.205
  659    HA   ASN  83           HA       ASN  83  -0.981  10.956  -7.624
  660    HB2  ASN  83           HB3      ASN  83   1.068  11.800  -8.934
  661    HB3  ASN  83           HB2      ASN  83   0.892  10.381  -9.952
  662   HD21  ASN  83          HD21      ASN  83  -1.791  12.282  -8.660
  663   HD22  ASN  83          HD22      ASN  83  -2.317  12.895 -10.177
  664    H    ARG  84           HN       ARG  84  -0.841   8.271  -6.818
  665    HA   ARG  84           HA       ARG  84  -2.526   7.112  -8.882
  666    HB2  ARG  84           HB2      ARG  84  -0.455   5.837  -8.760
  667    HB3  ARG  84           HB1      ARG  84  -0.574   5.736  -7.031
  668    HG2  ARG  84           HG2      ARG  84  -1.138   3.611  -8.224
  669    HG3  ARG  84           HG1      ARG  84  -2.358   4.186  -7.094
  670    HD2  ARG  84           HD2      ARG  84  -3.502   3.428  -9.010
  671    HD3  ARG  84           HD1      ARG  84  -3.541   5.180  -9.019
  672    HE   ARG  84           HE       ARG  84  -1.517   4.882 -10.587
  673   HH11  ARG  84          HH11      ARG  84  -4.567   2.973 -10.663
  674   HH12  ARG  84          HH12      ARG  84  -4.285   2.410 -12.229
  675   HH21  ARG  84          HH21      ARG  84  -1.212   4.053 -12.790
  676   HH22  ARG  84          HH22      ARG  84  -2.371   3.010 -13.445
  677    H    LYS  85           HN       LYS  85  -3.955   8.591  -7.576
  678    HA   LYS  85           HA       LYS  85  -4.808   7.723  -4.945
  679    HB2  LYS  85           HB2      LYS  85  -4.796  10.107  -5.890
  680    HB3  LYS  85           HB1      LYS  85  -6.209   9.635  -6.825
  681    HG2  LYS  85           HG2      LYS  85  -7.395   9.156  -4.772
  682    HG3  LYS  85           HG1      LYS  85  -5.967   9.589  -3.826
  683    HD2  LYS  85           HD2      LYS  85  -6.071  11.857  -4.884
  684    HD3  LYS  85           HD1      LYS  85  -7.614  11.387  -5.597
  685    HE2  LYS  85           HE2      LYS  85  -8.087  12.611  -3.613
  686    HE3  LYS  85           HE1      LYS  85  -8.441  10.920  -3.287
  687    HZ1  LYS  85           HZ1      LYS  85  -6.020  12.404  -2.461
  688    HZ2  LYS  85           HZ2      LYS  85  -6.223  10.774  -2.115
  689    HZ3  LYS  85           HZ3      LYS  85  -7.238  11.931  -1.436
  690    H    ASP  86           HN       ASP  86  -5.391   7.021  -8.180
  691    HA   ASP  86           HA       ASP  86  -7.957   6.088  -8.305
  692    HB2  ASP  86           HB2      ASP  86  -6.810   6.261 -10.326
  693    HB3  ASP  86           HB1      ASP  86  -5.417   5.382  -9.730
  694    H    LEU  87           HN       LEU  87  -5.046   4.463  -7.227
  695    HA   LEU  87           HA       LEU  87  -6.332   1.896  -6.840
  696    HB2  LEU  87           HB2      LEU  87  -3.966   2.230  -7.620
  697    HB3  LEU  87           HB1      LEU  87  -3.609   2.817  -6.002
  698    HG   LEU  87           HG       LEU  87  -3.987   0.657  -5.099
  699   HD11  LEU  87          HD11      LEU  87  -4.443  -1.249  -6.633
  700   HD12  LEU  87          HD12      LEU  87  -4.670  -0.080  -7.951
  701   HD13  LEU  87          HD13      LEU  87  -5.761  -0.081  -6.565
  702   HD21  LEU  87          HD21      LEU  87  -1.822   1.226  -5.955
  703   HD22  LEU  87          HD22      LEU  87  -2.285   0.674  -7.560
  704   HD23  LEU  87          HD23      LEU  87  -2.141  -0.490  -6.235
  705    H    TRP  88           HN       TRP  88  -5.244   4.623  -5.046
  706    HA   TRP  88           HA       TRP  88  -5.428   3.759  -2.407
  707    HB2  TRP  88           HB2      TRP  88  -4.396   5.830  -3.067
  708    HB3  TRP  88           HB1      TRP  88  -5.881   6.391  -3.779
  709    HD1  TRP  88           HD1      TRP  88  -4.330   5.788  -0.364
  710    HE1  TRP  88           HE1      TRP  88  -5.543   7.296   1.385
  711    HE3  TRP  88           HE3      TRP  88  -7.969   7.589  -3.324
  712    HZ2  TRP  88           HZ2      TRP  88  -7.794   9.006   1.438
  713    HZ3  TRP  88           HZ3      TRP  88  -9.605   9.121  -2.445
  714    HH2  TRP  88           HH2      TRP  88  -9.547   9.841  -0.081
  715    H    GLU  89           HN       GLU  89  -7.792   5.244  -4.532
  716    HA   GLU  89           HA       GLU  89 -10.055   5.243  -2.871
  717    HB2  GLU  89           HB3      GLU  89  -9.869   5.057  -5.864
  718    HB3  GLU  89           HB2      GLU  89 -11.371   5.321  -4.996
  719    HG2  GLU  89           HG3      GLU  89 -10.386   7.415  -4.087
  720    HG3  GLU  89           HG2      GLU  89  -8.967   7.122  -5.094
  721    H    ARG  90           HN       ARG  90  -8.563   2.642  -4.514
  722    HA   ARG  90           HA       ARG  90 -10.917   0.927  -4.451
  723    HB2  ARG  90           HB2      ARG  90  -8.055   0.128  -4.960
  724    HB3  ARG  90           HB1      ARG  90  -9.491  -0.813  -5.323
  725    HG2  ARG  90           HG2      ARG  90 -10.094   0.895  -6.997
  726    HG3  ARG  90           HG1      ARG  90  -8.573   1.730  -6.653
  727    HD2  ARG  90           HD2      ARG  90  -7.536  -0.633  -7.113
  728    HD3  ARG  90           HD1      ARG  90  -9.058  -0.911  -7.932
  729    HE   ARG  90           HE       ARG  90  -7.897   1.510  -8.834
  730   HH11  ARG  90          HH11      ARG  90  -7.686  -1.986  -9.139
  731   HH12  ARG  90          HH12      ARG  90  -6.859  -2.002 -10.607
  732   HH21  ARG  90          HH21      ARG  90  -6.720   1.585 -10.801
  733   HH22  ARG  90          HH22      ARG  90  -6.294   0.142 -11.636
  734    H    GLY  91           HN       GLY  91  -8.208   1.758  -2.566
  735    HA2  GLY  91           HA3      GLY  91  -8.072  -0.515  -0.870
  736    HA3  GLY  91           HA2      GLY  91  -7.408   1.080  -0.524
  737    H    GLN  92           HN       GLN  92  -8.994   2.745   0.116
  738    HA   GLN  92           HA       GLN  92 -10.927   1.475   1.849
  739    HB2  GLN  92           HB2      GLN  92 -11.169   3.762   2.928
  740    HB3  GLN  92           HB1      GLN  92  -9.642   2.943   3.167
  741    HG2  GLN  92           HG2      GLN  92  -8.599   4.385   1.491
  742    HG3  GLN  92           HG1      GLN  92 -10.149   5.178   1.204
  743   HE21  GLN  92          HE21      GLN  92 -10.937   5.206   3.999
  744   HE22  GLN  92          HE22      GLN  92  -9.963   6.385   4.780
  745    H    ARG  93           HN       ARG  93 -12.688   1.063   0.911
  746    HA   ARG  93           HA       ARG  93 -14.068   3.195  -0.559
  747    HB2  ARG  93           HB2      ARG  93 -14.744   1.783  -2.365
  748    HB3  ARG  93           HB1      ARG  93 -13.005   1.642  -2.224
  749    HG2  ARG  93           HG2      ARG  93 -14.976  -0.402  -1.163
  750    HG3  ARG  93           HG1      ARG  93 -14.192  -0.500  -2.736
  751    HD2  ARG  93           HD2      ARG  93 -12.032  -0.700  -1.703
  752    HD3  ARG  93           HD1      ARG  93 -12.707  -0.382  -0.114
  753    HE   ARG  93           HE       ARG  93 -14.030  -2.606  -0.895
  754   HH11  ARG  93          HH11      ARG  93 -10.601  -1.781  -0.775
  755   HH12  ARG  93          HH12      ARG  93 -10.078  -3.356  -0.450
  756   HH21  ARG  93          HH21      ARG  93 -13.343  -4.749  -0.351
  757   HH22  ARG  93          HH22      ARG  93 -11.689  -5.099  -0.146
  758    H    GLU  94           HN       GLU  94 -14.265   0.356   1.493
  759    HA   GLU  94           HA       GLU  94 -17.117   0.816   1.738
  760    HB2  GLU  94           HB3      GLU  94 -17.463  -1.623   1.881
  761    HB3  GLU  94           HB2      GLU  94 -16.833  -1.136   0.315
  762    HG2  GLU  94           HG3      GLU  94 -14.583  -1.849   1.059
  763    HG3  GLU  94           HG2      GLU  94 -15.299  -2.432   2.557
  764    H    ASP  95           HN       ASP  95 -17.897   0.684   3.743
  765    HA   ASP  95           HA       ASP  95 -18.059   0.722   5.930
  766    HB2  ASP  95           HB2      ASP  95 -17.322  -1.761   5.481
  767    HB3  ASP  95           HB1      ASP  95 -15.794  -1.233   6.188
  768    H    LEU  96           HN       LEU  96 -16.127   0.591   7.991
  769    HA   LEU  96           HA       LEU  96 -14.157   2.625   7.311
  770    HB2  LEU  96           HB2      LEU  96 -16.258   3.846   7.707
  771    HB3  LEU  96           HB1      LEU  96 -16.366   3.128   9.298
  772    HG   LEU  96           HG       LEU  96 -14.225   4.298   9.893
  773   HD11  LEU  96          HD11      LEU  96 -13.505   6.172   8.504
  774   HD12  LEU  96          HD12      LEU  96 -14.660   5.691   7.260
  775   HD13  LEU  96          HD13      LEU  96 -13.318   4.625   7.684
  776   HD21  LEU  96          HD21      LEU  96 -16.388   5.204  10.568
  777   HD22  LEU  96          HD22      LEU  96 -16.524   6.054   9.033
  778   HD23  LEU  96          HD23      LEU  96 -15.262   6.503  10.183
  779    H    VAL  97           HN       VAL  97 -12.563   2.859   8.957
  780    HA   VAL  97           HA       VAL  97 -12.404   0.666  10.804
  781    HB   VAL  97           HB       VAL  97 -10.361   1.493   9.656
  782   HG11  VAL  97          HG11      VAL  97  -9.308   3.621  10.298
  783   HG12  VAL  97          HG12      VAL  97 -10.738   4.003  11.265
  784   HG13  VAL  97          HG13      VAL  97 -10.879   3.853   9.520
  785   HG21  VAL  97          HG21      VAL  97 -10.080   0.325  11.758
  786   HG22  VAL  97          HG22      VAL  97 -10.302   1.830  12.646
  787   HG23  VAL  97          HG23      VAL  97  -8.872   1.612  11.630
  788    H    ARG  98           HN       ARG  98 -12.813   0.788  12.993
  789    HA   ARG  98           HA       ARG  98 -13.563   3.382  14.112
  790    HB2  ARG  98           HB2      ARG  98 -15.355   0.954  14.015
  791    HB3  ARG  98           HB1      ARG  98 -15.665   2.382  14.988
  792    HG2  ARG  98           HG2      ARG  98 -16.154   3.697  13.142
  793    HG3  ARG  98           HG1      ARG  98 -15.266   2.648  12.040
  794    HD2  ARG  98           HD2      ARG  98 -17.868   1.981  13.403
  795    HD3  ARG  98           HD1      ARG  98 -17.646   2.438  11.704
  796    HE   ARG  98           HE       ARG  98 -16.360   0.044  12.845
  797   HH11  ARG  98          HH11      ARG  98 -18.593   1.415  10.449
  798   HH12  ARG  98          HH12      ARG  98 -18.408   0.062   9.407
  799   HH21  ARG  98          HH21      ARG  98 -16.201  -1.696  11.483
  800   HH22  ARG  98          HH22      ARG  98 -16.991  -1.716   9.950
  801    H    ASP  99           HN       ASP  99 -13.824   3.291  16.421
  802    HA   ASP  99           HA       ASP  99 -12.662   0.934  17.731
  803    HB2  ASP  99           HB2      ASP  99 -12.145   3.857  18.292
  804    HB3  ASP  99           HB1      ASP  99 -11.878   2.623  19.511
  805    H    THR 100           HN       THR 100 -15.459   2.230  17.179
  806    HA   THR 100           HA       THR 100 -16.283   2.437  19.957
  807    HB   THR 100           HB       THR 100 -17.751   3.292  17.444
  808    HG1  THR 100           HG1      THR 100 -16.521   4.800  19.515
  809   HG21  THR 100          HG21      THR 100 -18.455   3.758  20.352
  810   HG22  THR 100          HG22      THR 100 -19.302   2.657  19.272
  811   HG23  THR 100          HG23      THR 100 -19.332   4.394  18.963
  812    H    VAL 101           HN       VAL 101 -17.950   1.163  17.009
  813    HA   VAL 101           HA       VAL 101 -18.931  -0.977  18.736
  814    HB   VAL 101           HB       VAL 101 -19.900  -0.182  15.970
  815   HG11  VAL 101          HG11      VAL 101 -21.135  -2.047  17.998
  816   HG12  VAL 101          HG12      VAL 101 -20.349  -2.526  16.498
  817   HG13  VAL 101          HG13      VAL 101 -21.844  -1.588  16.448
  818   HG21  VAL 101          HG21      VAL 101 -21.093   0.408  18.680
  819   HG22  VAL 101          HG22      VAL 101 -21.805   0.840  17.119
  820   HG23  VAL 101          HG23      VAL 101 -20.272   1.558  17.629
  821    H    GLU 102           HN       GLU 102 -18.122  -0.821  15.276
  822    HA   GLU 102           HA       GLU 102 -16.758  -3.377  15.601
  823    HB2  GLU 102           HB3      GLU 102 -18.002  -2.082  13.174
  824    HB3  GLU 102           HB2      GLU 102 -16.981  -3.503  13.083
  825    HG2  GLU 102           HG3      GLU 102 -19.603  -3.292  14.547
  826    HG3  GLU 102           HG2      GLU 102 -19.327  -4.096  13.002
  Start of MODEL   12
    1    H1   GLY   1           HT1      GLY   1 -13.367 -15.730   8.942
    2    H2   GLY   1           HT2      GLY   1 -13.050 -14.116   9.339
    3    H3   GLY   1           HT3      GLY   1 -14.238 -14.506   8.180
    4    HA2  GLY   1           HA2      GLY   1 -14.335 -15.250  11.027
    5    HA3  GLY   1           HA3      GLY   1 -15.254 -13.936  10.295
    6    H    HIS   2           HN       HIS   2 -17.120 -15.107  11.062
    7    HA   HIS   2           HA       HIS   2 -18.982 -16.284  10.773
    8    HB2  HIS   2           HB2      HIS   2 -18.893 -15.495   8.416
    9    HB3  HIS   2           HB1      HIS   2 -17.932 -16.901   7.986
   10    HD1  HIS   2           HD1      HIS   2 -21.440 -15.818   8.658
   11    HD2  HIS   2           HD2      HIS   2 -19.381 -19.316   7.808
   12    HE1  HIS   2           HE1      HIS   2 -23.191 -17.538   8.069
   13    H    MET   3           HN       MET   3 -16.806 -18.324   8.912
   14    HA   MET   3           HA       MET   3 -17.087 -20.372  10.994
   15    HB2  MET   3           HB2      MET   3 -18.709 -20.843   9.213
   16    HB3  MET   3           HB1      MET   3 -17.414 -20.825   8.029
   17    HG2  MET   3           HG2      MET   3 -16.460 -22.820   8.980
   18    HG3  MET   3           HG1      MET   3 -17.642 -22.787  10.293
   19    HE1  MET   3           HE1      MET   3 -18.873 -23.416   5.894
   20    HE2  MET   3           HE2      MET   3 -17.220 -23.033   6.386
   21    HE3  MET   3           HE3      MET   3 -18.506 -21.842   6.590
   22    H    LEU   4           HN       LEU   4 -15.102 -18.615   8.901
   23    HA   LEU   4           HA       LEU   4 -12.894 -20.465   9.419
   24    HB2  LEU   4           HB2      LEU   4 -13.253 -18.512   7.132
   25    HB3  LEU   4           HB1      LEU   4 -11.709 -19.228   7.522
   26    HG   LEU   4           HG       LEU   4 -12.588 -20.382   5.650
   27   HD11  LEU   4          HD11      LEU   4 -12.951 -22.123   8.063
   28   HD12  LEU   4          HD12      LEU   4 -11.445 -21.786   7.212
   29   HD13  LEU   4          HD13      LEU   4 -12.732 -22.676   6.403
   30   HD21  LEU   4          HD21      LEU   4 -14.937 -19.824   5.798
   31   HD22  LEU   4          HD22      LEU   4 -15.115 -20.836   7.233
   32   HD23  LEU   4          HD23      LEU   4 -14.757 -21.576   5.673
   33    H    ARG   5           HN       ARG   5 -12.035 -19.772  11.220
   34    HA   ARG   5           HA       ARG   5 -12.054 -17.024  11.972
   35    HB2  ARG   5           HB2      ARG   5 -12.360 -18.753  13.667
   36    HB3  ARG   5           HB1      ARG   5 -10.784 -19.428  13.302
   37    HG2  ARG   5           HG2      ARG   5 -10.751 -18.139  15.370
   38    HG3  ARG   5           HG1      ARG   5  -9.710 -17.408  14.144
   39    HD2  ARG   5           HD2      ARG   5 -11.565 -15.844  13.594
   40    HD3  ARG   5           HD1      ARG   5 -12.481 -16.528  14.938
   41    HE   ARG   5           HE       ARG   5 -10.350 -15.830  16.221
   42   HH11  ARG   5          HH11      ARG   5 -12.003 -13.991  13.668
   43   HH12  ARG   5          HH12      ARG   5 -11.519 -12.477  14.257
   44   HH21  ARG   5          HH21      ARG   5  -9.684 -13.710  17.024
   45   HH22  ARG   5          HH22      ARG   5 -10.206 -12.309  16.229
   46    H    THR   6           HN       THR   6  -9.706 -19.164  10.528
   47    HA   THR   6           HA       THR   6  -7.439 -17.556  11.073
   48    HB   THR   6           HB       THR   6  -7.817 -19.538   8.798
   49    HG1  THR   6           HG1      THR   6  -7.890 -20.987  10.288
   50   HG21  THR   6          HG21      THR   6  -5.762 -18.171   8.648
   51   HG22  THR   6          HG22      THR   6  -5.380 -19.854   9.019
   52   HG23  THR   6          HG23      THR   6  -5.337 -18.640  10.294
   53    H    ALA   7           HN       ALA   7  -9.967 -17.435   8.716
   54    HA   ALA   7           HA       ALA   7  -8.508 -15.518   7.075
   55    HB1  ALA   7           HB1      ALA   7 -11.216 -16.789   6.655
   56    HB2  ALA   7           HB2      ALA   7  -9.702 -17.314   5.915
   57    HB3  ALA   7           HB3      ALA   7 -10.378 -15.734   5.518
   58    H    GLY   8           HN       GLY   8  -9.342 -13.422   6.717
   59    HA2  GLY   8           HA3      GLY   8 -11.483 -12.098   7.260
   60    HA3  GLY   8           HA2      GLY   8 -11.028 -12.458   8.918
   61    H    ARG   9           HN       ARG   9  -8.237 -12.265   8.544
   62    HA   ARG   9           HA       ARG   9  -7.943  -9.421   7.905
   63    HB2  ARG   9           HB2      ARG   9  -7.852  -9.675  10.323
   64    HB3  ARG   9           HB1      ARG   9  -6.649 -10.945  10.175
   65    HG2  ARG   9           HG2      ARG   9  -5.063  -9.330   9.208
   66    HG3  ARG   9           HG1      ARG   9  -6.264  -8.057   9.391
   67    HD2  ARG   9           HD2      ARG   9  -5.099  -9.685  11.646
   68    HD3  ARG   9           HD1      ARG   9  -4.580  -8.065  11.195
   69    HE   ARG   9           HE       ARG   9  -7.374  -8.205  11.684
   70   HH11  ARG   9          HH11      ARG   9  -4.227  -7.931  13.324
   71   HH12  ARG   9          HH12      ARG   9  -4.849  -7.138  14.676
   72   HH21  ARG   9          HH21      ARG   9  -8.218  -7.075  13.589
   73   HH22  ARG   9          HH22      ARG   9  -7.129  -6.646  14.814
   74    H    ASP  10           HN       ASP  10  -6.649  -9.165   6.246
   75    HA   ASP  10           HA       ASP  10  -4.244 -10.811   6.059
   76    HB2  ASP  10           HB2      ASP  10  -4.626 -11.413   3.879
   77    HB3  ASP  10           HB1      ASP  10  -6.308 -11.074   4.242
   78    H    GLY  11           HN       GLY  11  -2.475  -9.649   5.382
   79    HA2  GLY  11           HA3      GLY  11  -2.844  -6.830   4.722
   80    HA3  GLY  11           HA2      GLY  11  -1.827  -7.246   6.103
   81    H    LEU  12           HN       LEU  12  -2.159  -9.188   3.302
   82    HA   LEU  12           HA       LEU  12   0.497  -8.441   2.357
   83    HB2  LEU  12           HB2      LEU  12   0.960 -10.157   4.017
   84    HB3  LEU  12           HB1      LEU  12  -0.201 -11.232   3.279
   85    HG   LEU  12           HG       LEU  12   1.249 -11.378   1.273
   86   HD11  LEU  12          HD11      LEU  12   2.366  -9.245   1.449
   87   HD12  LEU  12          HD12      LEU  12   3.542 -10.560   1.395
   88   HD13  LEU  12          HD13      LEU  12   3.175  -9.765   2.928
   89   HD21  LEU  12          HD21      LEU  12   2.590 -12.069   3.883
   90   HD22  LEU  12          HD22      LEU  12   2.981 -12.755   2.306
   91   HD23  LEU  12          HD23      LEU  12   1.402 -13.054   3.031
   92    H    CYS  13           HN       CYS  13  -2.211 -10.697   1.982
   93    HA   CYS  13           HA       CYS  13  -1.724 -11.289  -0.703
   94    HB2  CYS  13           HB2      CYS  13  -3.087 -12.698   0.775
   95    HB3  CYS  13           HB1      CYS  13  -4.292 -11.431   0.899
   96    HG   CYS  13           HG       CYS  13  -3.543 -12.566  -2.186
   97    H    ARG  14           HN       ARG  14  -3.985  -9.056   0.832
   98    HA   ARG  14           HA       ARG  14  -5.208  -7.945  -1.462
   99    HB2  ARG  14           HB2      ARG  14  -5.803  -7.833   1.017
  100    HB3  ARG  14           HB1      ARG  14  -4.628  -6.540   1.122
  101    HG2  ARG  14           HG2      ARG  14  -5.960  -5.318  -0.603
  102    HG3  ARG  14           HG1      ARG  14  -7.192  -6.577  -0.440
  103    HD2  ARG  14           HD2      ARG  14  -6.229  -4.626   1.631
  104    HD3  ARG  14           HD1      ARG  14  -7.868  -4.866   1.030
  105    HE   ARG  14           HE       ARG  14  -6.840  -7.222   2.304
  106   HH11  ARG  14          HH11      ARG  14  -8.328  -4.076   3.034
  107   HH12  ARG  14          HH12      ARG  14  -8.869  -4.567   4.563
  108   HH21  ARG  14          HH21      ARG  14  -7.552  -7.859   4.291
  109   HH22  ARG  14          HH22      ARG  14  -8.438  -6.817   5.322
  110    H    LEU  15           HN       LEU  15  -2.522  -7.024   0.538
  111    HA   LEU  15           HA       LEU  15  -1.733  -4.597  -0.500
  112    HB2  LEU  15           HB2      LEU  15  -0.982  -5.535   1.603
  113    HB3  LEU  15           HB1      LEU  15  -0.201  -6.855   0.772
  114    HG   LEU  15           HG       LEU  15   1.466  -5.301  -0.134
  115   HD11  LEU  15          HD11      LEU  15   0.056  -3.305  -0.213
  116   HD12  LEU  15          HD12      LEU  15   1.564  -3.035   0.660
  117   HD13  LEU  15          HD13      LEU  15   0.061  -3.257   1.551
  118   HD21  LEU  15          HD21      LEU  15   1.073  -5.127   2.840
  119   HD22  LEU  15          HD22      LEU  15   2.577  -4.809   1.974
  120   HD23  LEU  15          HD23      LEU  15   1.878  -6.428   1.966
  121    H    SER  16           HN       SER  16  -0.483  -7.833  -1.205
  122    HA   SER  16           HA       SER  16   1.307  -7.163  -3.225
  123    HB2  SER  16           HB2      SER  16   1.149  -9.311  -1.882
  124    HB3  SER  16           HB1      SER  16  -0.204  -9.770  -2.902
  125    HG   SER  16           HG       SER  16   1.114 -10.007  -4.589
  126    H    THR  17           HN       THR  17  -2.106  -8.140  -3.365
  127    HA   THR  17           HA       THR  17  -2.385  -8.412  -6.117
  128    HB   THR  17           HB       THR  17  -4.462  -7.593  -4.064
  129    HG1  THR  17           HG1      THR  17  -3.607  -9.584  -3.549
  130   HG21  THR  17          HG21      THR  17  -4.824  -8.768  -6.835
  131   HG22  THR  17          HG22      THR  17  -5.255  -7.129  -6.344
  132   HG23  THR  17          HG23      THR  17  -6.112  -8.510  -5.659
  133    H    TYR  18           HN       TYR  18  -2.730  -5.465  -4.133
  134    HA   TYR  18           HA       TYR  18  -3.483  -3.971  -6.463
  135    HB2  TYR  18           HB2      TYR  18  -3.062  -3.133  -3.612
  136    HB3  TYR  18           HB1      TYR  18  -3.327  -1.954  -4.899
  137    HD1  TYR  18           HD2      TYR  18  -5.394  -2.310  -6.371
  138    HD2  TYR  18           HD1      TYR  18  -4.908  -4.110  -2.556
  139    HE1  TYR  18           HE2      TYR  18  -7.817  -2.668  -6.246
  140    HE2  TYR  18           HE1      TYR  18  -7.328  -4.476  -2.411
  141    HH   TYR  18           HH       TYR  18  -9.440  -3.496  -3.427
  142    H    LEU  19           HN       LEU  19  -0.552  -4.439  -4.644
  143    HA   LEU  19           HA       LEU  19   0.846  -2.348  -5.941
  144    HB2  LEU  19           HB2      LEU  19   1.850  -4.792  -4.492
  145    HB3  LEU  19           HB1      LEU  19   2.905  -3.541  -5.112
  146    HG   LEU  19           HG       LEU  19   0.787  -3.108  -2.979
  147   HD11  LEU  19          HD11      LEU  19   2.581  -4.499  -2.163
  148   HD12  LEU  19          HD12      LEU  19   2.651  -2.888  -1.455
  149   HD13  LEU  19          HD13      LEU  19   3.774  -3.332  -2.743
  150   HD21  LEU  19          HD21      LEU  19   2.948  -1.261  -4.026
  151   HD22  LEU  19          HD22      LEU  19   1.856  -0.919  -2.693
  152   HD23  LEU  19          HD23      LEU  19   1.221  -1.082  -4.312
  153    H    GLU  20           HN       GLU  20  -0.084  -5.465  -6.958
  154    HA   GLU  20           HA       GLU  20   1.795  -6.028  -8.974
  155    HB2  GLU  20           HB3      GLU  20  -1.154  -6.608  -8.868
  156    HB3  GLU  20           HB2      GLU  20  -0.092  -7.198 -10.128
  157    HG2  GLU  20           HG3      GLU  20   1.193  -8.413  -8.400
  158    HG3  GLU  20           HG2      GLU  20   0.013  -7.874  -7.204
  159    H    GLU  21           HN       GLU  21  -0.779  -3.719  -8.847
  160    HA   GLU  21           HA       GLU  21  -0.821  -3.423 -11.728
  161    HB2  GLU  21           HB3      GLU  21  -2.415  -1.985  -9.613
  162    HB3  GLU  21           HB2      GLU  21  -2.685  -1.889 -11.347
  163    HG2  GLU  21           HG3      GLU  21  -3.022  -4.313  -9.592
  164    HG3  GLU  21           HG2      GLU  21  -4.298  -3.382 -10.368
  165    H    LEU  22           HN       LEU  22   1.321  -2.429  -9.632
  166    HA   LEU  22           HA       LEU  22   1.476   0.309 -10.628
  167    HB2  LEU  22           HB2      LEU  22   3.109  -1.038  -8.463
  168    HB3  LEU  22           HB1      LEU  22   3.284   0.615  -8.976
  169    HG   LEU  22           HG       LEU  22   0.929  -0.593  -7.554
  170   HD11  LEU  22          HD11      LEU  22   2.820  -0.165  -6.134
  171   HD12  LEU  22          HD12      LEU  22   1.552   1.032  -5.833
  172   HD13  LEU  22          HD13      LEU  22   2.969   1.471  -6.778
  173   HD21  LEU  22          HD21      LEU  22   0.130   1.051  -9.184
  174   HD22  LEU  22          HD22      LEU  22   1.287   2.233  -8.563
  175   HD23  LEU  22          HD23      LEU  22  -0.019   1.647  -7.534
  176    H    GLU  23           HN       GLU  23   3.054   1.022 -11.897
  177    HA   GLU  23           HA       GLU  23   4.619  -0.823 -13.467
  178    HB2  GLU  23           HB3      GLU  23   5.057   2.152 -13.291
  179    HB3  GLU  23           HB2      GLU  23   5.354   1.099 -14.658
  180    HG2  GLU  23           HG3      GLU  23   2.863   0.856 -14.891
  181    HG3  GLU  23           HG2      GLU  23   2.746   2.055 -13.584
  182    H    ALA  24           HN       ALA  24   7.080  -0.255 -13.687
  183    HA   ALA  24           HA       ALA  24   8.335  -0.568 -11.192
  184    HB1  ALA  24           HB1      ALA  24   9.355  -1.346 -13.297
  185    HB2  ALA  24           HB2      ALA  24  10.446  -0.288 -12.407
  186    HB3  ALA  24           HB3      ALA  24   9.571   0.329 -13.808
  187    H    VAL  25           HN       VAL  25   7.782   2.220 -13.241
  188    HA   VAL  25           HA       VAL  25   9.145   4.098 -11.665
  189    HB   VAL  25           HB       VAL  25   8.514   4.709 -13.941
  190   HG11  VAL  25          HG11      VAL  25   6.200   5.155 -14.590
  191   HG12  VAL  25          HG12      VAL  25   5.669   4.570 -13.010
  192   HG13  VAL  25          HG13      VAL  25   6.441   3.460 -14.147
  193   HG21  VAL  25          HG21      VAL  25   8.723   6.579 -12.403
  194   HG22  VAL  25          HG22      VAL  25   7.014   6.375 -11.970
  195   HG23  VAL  25          HG23      VAL  25   7.444   6.886 -13.598
  196    H    GLU  26           HN       GLU  26   5.821   2.945 -11.511
  197    HA   GLU  26           HA       GLU  26   4.921   4.729  -9.505
  198    HB2  GLU  26           HB3      GLU  26   3.974   1.964 -10.245
  199    HB3  GLU  26           HB2      GLU  26   3.120   3.049  -9.148
  200    HG2  GLU  26           HG3      GLU  26   3.705   3.602 -12.049
  201    HG3  GLU  26           HG2      GLU  26   2.184   2.959 -11.433
  202    H    LEU  27           HN       LEU  27   6.234   1.445  -9.433
  203    HA   LEU  27           HA       LEU  27   6.180   1.078  -6.658
  204    HB2  LEU  27           HB2      LEU  27   8.001  -0.096  -8.758
  205    HB3  LEU  27           HB1      LEU  27   7.974  -0.635  -7.092
  206    HG   LEU  27           HG       LEU  27   5.590  -0.787  -8.951
  207   HD11  LEU  27          HD11      LEU  27   7.572  -2.928  -8.184
  208   HD12  LEU  27          HD12      LEU  27   7.361  -2.210  -9.784
  209   HD13  LEU  27          HD13      LEU  27   6.072  -3.178  -9.077
  210   HD21  LEU  27          HD21      LEU  27   6.138  -2.030  -6.255
  211   HD22  LEU  27          HD22      LEU  27   4.721  -2.332  -7.257
  212   HD23  LEU  27          HD23      LEU  27   4.996  -0.725  -6.586
  213    H    LYS  28           HN       LYS  28   8.625   2.436  -8.774
  214    HA   LYS  28           HA       LYS  28  10.638   2.876  -6.908
  215    HB2  LYS  28           HB2      LYS  28  11.011   3.141  -9.294
  216    HB3  LYS  28           HB1      LYS  28   9.874   4.473  -9.353
  217    HG2  LYS  28           HG2      LYS  28  11.386   5.803  -7.937
  218    HG3  LYS  28           HG1      LYS  28  12.538   4.465  -7.951
  219    HD2  LYS  28           HD2      LYS  28  12.785   4.636 -10.341
  220    HD3  LYS  28           HD1      LYS  28  11.513   5.852 -10.423
  221    HE2  LYS  28           HE2      LYS  28  13.671   6.929 -10.584
  222    HE3  LYS  28           HE1      LYS  28  12.902   7.358  -9.064
  223    HZ1  LYS  28           HZ1      LYS  28  14.342   5.695  -7.951
  224    HZ2  LYS  28           HZ2      LYS  28  15.194   6.896  -8.713
  225    HZ3  LYS  28           HZ3      LYS  28  15.093   5.379  -9.437
  226    H    LYS  29           HN       LYS  29   7.901   4.931  -7.825
  227    HA   LYS  29           HA       LYS  29   8.479   7.202  -6.222
  228    HB2  LYS  29           HB2      LYS  29   5.780   6.073  -6.942
  229    HB3  LYS  29           HB1      LYS  29   6.081   7.685  -6.343
  230    HG2  LYS  29           HG2      LYS  29   7.267   8.234  -8.440
  231    HG3  LYS  29           HG1      LYS  29   6.968   6.585  -8.997
  232    HD2  LYS  29           HD2      LYS  29   4.574   6.905  -8.830
  233    HD3  LYS  29           HD1      LYS  29   4.829   8.523  -8.186
  234    HE2  LYS  29           HE2      LYS  29   5.749   9.262 -10.267
  235    HE3  LYS  29           HE1      LYS  29   5.693   7.623 -10.916
  236    HZ1  LYS  29           HZ1      LYS  29   3.805   9.058 -11.612
  237    HZ2  LYS  29           HZ2      LYS  29   3.245   9.053 -10.011
  238    HZ3  LYS  29           HZ3      LYS  29   3.393   7.611 -10.873
  239    H    PHE  30           HN       PHE  30   6.293   4.518  -5.754
  240    HA   PHE  30           HA       PHE  30   5.369   4.895  -3.205
  241    HB2  PHE  30           HB2      PHE  30   4.280   3.299  -4.464
  242    HB3  PHE  30           HB1      PHE  30   5.765   2.607  -5.065
  243    HD1  PHE  30           HD2      PHE  30   3.610   2.806  -2.023
  244    HD2  PHE  30           HD1      PHE  30   6.521   0.623  -4.217
  245    HE1  PHE  30           HE2      PHE  30   3.333   0.893  -0.504
  246    HE2  PHE  30           HE1      PHE  30   6.245  -1.284  -2.702
  247    HZ   PHE  30           HZ       PHE  30   4.640  -1.146  -0.845
  248    H    LYS  31           HN       LYS  31   8.192   3.073  -4.229
  249    HA   LYS  31           HA       LYS  31   9.008   2.315  -1.664
  250    HB2  LYS  31           HB2      LYS  31   9.697   0.998  -3.503
  251    HB3  LYS  31           HB1      LYS  31  10.362   2.370  -4.354
  252    HG2  LYS  31           HG2      LYS  31  11.564   1.400  -1.781
  253    HG3  LYS  31           HG1      LYS  31  11.942   0.613  -3.309
  254    HD2  LYS  31           HD2      LYS  31  12.368   3.560  -2.729
  255    HD3  LYS  31           HD1      LYS  31  13.621   2.328  -2.622
  256    HE2  LYS  31           HE2      LYS  31  12.092   3.066  -5.135
  257    HE3  LYS  31           HE1      LYS  31  13.720   3.591  -4.732
  258    HZ1  LYS  31           HZ1      LYS  31  14.400   1.235  -4.738
  259    HZ2  LYS  31           HZ2      LYS  31  13.845   1.748  -6.215
  260    HZ3  LYS  31           HZ3      LYS  31  12.860   0.788  -5.266
  261    H    LEU  32           HN       LEU  32   9.990   5.123  -3.649
  262    HA   LEU  32           HA       LEU  32  12.013   5.789  -1.761
  263    HB2  LEU  32           HB2      LEU  32  12.362   7.851  -3.024
  264    HB3  LEU  32           HB1      LEU  32  12.280   6.476  -4.088
  265    HG   LEU  32           HG       LEU  32   9.794   7.255  -4.432
  266   HD11  LEU  32          HD11      LEU  32   9.485   9.667  -4.319
  267   HD12  LEU  32          HD12      LEU  32  11.056   9.831  -3.536
  268   HD13  LEU  32          HD13      LEU  32   9.755   8.962  -2.723
  269   HD21  LEU  32          HD21      LEU  32  12.132   8.731  -5.630
  270   HD22  LEU  32          HD22      LEU  32  10.505   8.658  -6.308
  271   HD23  LEU  32          HD23      LEU  32  11.473   7.191  -6.183
  272    H    TYR  33           HN       TYR  33   8.694   6.558  -2.120
  273    HA   TYR  33           HA       TYR  33   8.668   8.782  -0.396
  274    HB2  TYR  33           HB2      TYR  33   6.985   8.460  -2.126
  275    HB3  TYR  33           HB1      TYR  33   6.421   6.997  -1.336
  276    HD1  TYR  33           HD1      TYR  33   6.625  10.666  -1.050
  277    HD2  TYR  33           HD2      TYR  33   4.908   7.104   0.511
  278    HE1  TYR  33           HE1      TYR  33   5.050  11.993   0.268
  279    HE2  TYR  33           HE2      TYR  33   3.342   8.422   1.813
  280    HH   TYR  33           HH       TYR  33   3.061  10.555   2.694
  281    H    LEU  34           HN       LEU  34   8.525   5.347   0.190
  282    HA   LEU  34           HA       LEU  34   7.995   6.014   2.997
  283    HB2  LEU  34           HB2      LEU  34   6.923   3.795   3.290
  284    HB3  LEU  34           HB1      LEU  34   6.066   4.931   2.275
  285    HG   LEU  34           HG       LEU  34   6.928   3.663   0.283
  286   HD11  LEU  34          HD11      LEU  34   8.772   2.454   1.252
  287   HD12  LEU  34          HD12      LEU  34   7.572   1.313   0.632
  288   HD13  LEU  34          HD13      LEU  34   7.685   1.626   2.362
  289   HD21  LEU  34          HD21      LEU  34   5.135   2.247   2.233
  290   HD22  LEU  34          HD22      LEU  34   5.242   1.920   0.501
  291   HD23  LEU  34          HD23      LEU  34   4.661   3.484   1.068
  292    H    GLY  35           HN       GLY  35  10.143   4.294   0.938
  293    HA2  GLY  35           HA3      GLY  35  11.068   2.687   3.101
  294    HA3  GLY  35           HA2      GLY  35  11.745   2.691   1.473
  295    H    THR  36           HN       THR  36  12.471   5.310   1.206
  296    HA   THR  36           HA       THR  36  14.548   5.576   3.261
  297    HB   THR  36           HB       THR  36  15.431   5.114   0.986
  298    HG1  THR  36           HG1      THR  36  16.746   6.426   2.209
  299   HG21  THR  36          HG21      THR  36  14.027   7.660   0.152
  300   HG22  THR  36          HG22      THR  36  13.631   6.021  -0.371
  301   HG23  THR  36          HG23      THR  36  15.164   6.754  -0.847
  302    H    ALA  37           HN       ALA  37  11.774   6.446   3.234
  303    HA   ALA  37           HA       ALA  37  11.450   9.165   2.662
  304    HB1  ALA  37           HB1      ALA  37   9.937   7.528   4.687
  305    HB2  ALA  37           HB2      ALA  37   9.616   7.558   2.957
  306    HB3  ALA  37           HB3      ALA  37   9.398   9.011   3.896
  307    H    THR  38           HN       THR  38  11.895  10.918   3.730
  308    HA   THR  38           HA       THR  38  13.618  10.935   5.959
  309    HB   THR  38           HB       THR  38  11.955  13.224   4.907
  310    HG1  THR  38           HG1      THR  38  14.514  12.455   3.920
  311   HG21  THR  38          HG21      THR  38  14.734  13.100   6.092
  312   HG22  THR  38          HG22      THR  38  13.280  13.615   6.943
  313   HG23  THR  38          HG23      THR  38  13.886  14.564   5.584
  314    H    GLU  39           HN       GLU  39  10.280  11.362   5.395
  315    HA   GLU  39           HA       GLU  39   9.450  12.413   7.895
  316    HB2  GLU  39           HB3      GLU  39   7.176  11.855   7.174
  317    HB3  GLU  39           HB2      GLU  39   8.085  12.642   5.894
  318    HG2  GLU  39           HG3      GLU  39   8.549  10.401   4.934
  319    HG3  GLU  39           HG2      GLU  39   7.482   9.705   6.135
  320    H    LEU  40           HN       LEU  40  10.094   9.215   6.813
  321    HA   LEU  40           HA       LEU  40   8.578   7.913   8.892
  322    HB2  LEU  40           HB2      LEU  40   9.001   7.023   6.581
  323    HB3  LEU  40           HB1      LEU  40  10.652   6.727   7.073
  324    HG   LEU  40           HG       LEU  40   9.708   5.355   8.956
  325   HD11  LEU  40          HD11      LEU  40   7.422   6.134   8.864
  326   HD12  LEU  40          HD12      LEU  40   7.508   4.388   8.665
  327   HD13  LEU  40          HD13      LEU  40   7.234   5.424   7.258
  328   HD21  LEU  40          HD21      LEU  40   9.333   4.386   6.128
  329   HD22  LEU  40          HD22      LEU  40   9.444   3.348   7.550
  330   HD23  LEU  40          HD23      LEU  40  10.825   4.330   7.066
  331    H    GLY  41           HN       GLY  41  11.588   9.315   8.543
  332    HA2  GLY  41           HA3      GLY  41  13.167   9.650  10.244
  333    HA3  GLY  41           HA2      GLY  41  12.432   8.331  11.146
  334    H    GLU  42           HN       GLU  42  14.660   9.192   8.609
  335    HA   GLU  42           HA       GLU  42  16.400   8.311   7.724
  336    HB2  GLU  42           HB3      GLU  42  17.027   7.657  10.002
  337    HB3  GLU  42           HB2      GLU  42  16.156   6.140   9.808
  338    HG2  GLU  42           HG3      GLU  42  18.488   5.758   9.507
  339    HG3  GLU  42           HG2      GLU  42  17.596   5.596   7.974
  340    H    GLY  43           HN       GLY  43  14.488   5.468   8.550
  341    HA2  GLY  43           HA3      GLY  43  13.177   4.762   6.433
  342    HA3  GLY  43           HA2      GLY  43  14.805   4.594   5.779
  343    H    LYS  44           HN       LYS  44  12.345   3.019   7.235
  344    HA   LYS  44           HA       LYS  44  13.945   1.178   8.770
  345    HB2  LYS  44           HB2      LYS  44  10.991   1.398   8.260
  346    HB3  LYS  44           HB1      LYS  44  11.654  -0.079   8.929
  347    HG2  LYS  44           HG2      LYS  44  10.799   1.330  10.701
  348    HG3  LYS  44           HG1      LYS  44  12.544   1.188  10.839
  349    HD2  LYS  44           HD2      LYS  44  12.734   3.422   9.723
  350    HD3  LYS  44           HD1      LYS  44  10.978   3.544   9.771
  351    HE2  LYS  44           HE2      LYS  44  11.018   3.362  12.214
  352    HE3  LYS  44           HE1      LYS  44  12.767   3.203  12.176
  353    HZ1  LYS  44           HZ1      LYS  44  11.254   5.612  11.276
  354    HZ2  LYS  44           HZ2      LYS  44  12.931   5.453  11.296
  355    HZ3  LYS  44           HZ3      LYS  44  12.071   5.451  12.735
  356    H    ILE  45           HN       ILE  45  13.430   1.545   5.627
  357    HA   ILE  45           HA       ILE  45  13.313  -1.277   4.934
  358    HB   ILE  45           HB       ILE  45  13.201   1.252   3.274
  359   HG12  ILE  45          HG12      ILE  45  11.156   0.796   4.558
  360   HG13  ILE  45          HG11      ILE  45  10.875   0.609   2.831
  361   HG21  ILE  45          HG21      ILE  45  12.711  -0.158   1.333
  362   HG22  ILE  45          HG22      ILE  45  13.001  -1.591   2.321
  363   HG23  ILE  45          HG23      ILE  45  14.321  -0.475   1.990
  364   HD11  ILE  45          HD11      ILE  45  11.140  -1.781   3.085
  365   HD12  ILE  45          HD12      ILE  45   9.760  -1.143   3.986
  366   HD13  ILE  45          HD13      ILE  45  11.251  -1.594   4.838
  367    HA   PRO  46           HA       PRO  46  17.799  -1.391   4.486
  368    HB2  PRO  46           HB2      PRO  46  17.766  -3.433   2.563
  369    HB3  PRO  46           HB1      PRO  46  17.870  -3.669   4.305
  370    HG2  PRO  46           HG2      PRO  46  15.515  -3.874   2.507
  371    HG3  PRO  46           HG1      PRO  46  15.894  -4.784   3.978
  372    HD2  PRO  46           HD2      PRO  46  14.052  -2.841   3.896
  373    HD3  PRO  46           HD1      PRO  46  15.022  -3.152   5.350
  374    H    TRP  47           HN       TRP  47  19.125  -0.377   3.202
  375    HA   TRP  47           HA       TRP  47  18.544   1.637   1.623
  376    HB2  TRP  47           HB2      TRP  47  20.828   1.751   0.894
  377    HB3  TRP  47           HB1      TRP  47  20.777   1.154   2.541
  378    HD1  TRP  47           HD1      TRP  47  22.182   0.416  -0.803
  379    HE1  TRP  47           HE1      TRP  47  23.382  -1.835  -0.846
  380    HE3  TRP  47           HE3      TRP  47  20.519  -1.470   3.664
  381    HZ2  TRP  47           HZ2      TRP  47  23.605  -4.134   0.797
  382    HZ3  TRP  47           HZ3      TRP  47  21.278  -3.703   4.344
  383    HH2  TRP  47           HH2      TRP  47  22.788  -5.007   2.940
  384    H    GLY  48           HN       GLY  48  19.006  -1.575   0.203
  385    HA2  GLY  48           HA3      GLY  48  17.655  -0.623  -2.173
  386    HA3  GLY  48           HA2      GLY  48  19.330  -1.082  -2.413
  387    H    SER  49           HN       SER  49  16.938  -2.603  -0.311
  388    HA   SER  49           HA       SER  49  17.487  -5.156  -1.587
  389    HB2  SER  49           HB2      SER  49  17.044  -5.026   0.879
  390    HB3  SER  49           HB1      SER  49  15.424  -4.445   0.516
  391    HG   SER  49           HG       SER  49  15.968  -6.854   0.903
  392    H    MET  50           HN       MET  50  15.122  -2.690  -1.574
  393    HA   MET  50           HA       MET  50  13.136  -4.244  -2.911
  394    HB2  MET  50           HB2      MET  50  11.969  -1.854  -2.847
  395    HB3  MET  50           HB1      MET  50  11.980  -2.954  -1.483
  396    HG2  MET  50           HG2      MET  50  12.466  -0.600  -0.895
  397    HG3  MET  50           HG1      MET  50  13.702  -1.728  -0.401
  398    HE1  MET  50           HE1      MET  50  15.766   1.517  -1.222
  399    HE2  MET  50           HE2      MET  50  15.417   0.288  -0.011
  400    HE3  MET  50           HE3      MET  50  14.161   1.429  -0.495
  401    H    GLU  51           HN       GLU  51  15.744  -3.208  -4.188
  402    HA   GLU  51           HA       GLU  51  14.818  -1.698  -6.440
  403    HB2  GLU  51           HB3      GLU  51  17.284  -3.349  -6.026
  404    HB3  GLU  51           HB2      GLU  51  16.987  -2.366  -7.452
  405    HG2  GLU  51           HG3      GLU  51  16.844  -0.391  -5.880
  406    HG3  GLU  51           HG2      GLU  51  17.446  -1.470  -4.619
  407    H    LYS  52           HN       LYS  52  15.605  -5.036  -5.789
  408    HA   LYS  52           HA       LYS  52  14.853  -6.027  -8.390
  409    HB2  LYS  52           HB2      LYS  52  15.212  -8.245  -7.374
  410    HB3  LYS  52           HB1      LYS  52  16.567  -7.164  -7.080
  411    HG2  LYS  52           HG2      LYS  52  15.869  -6.791  -4.806
  412    HG3  LYS  52           HG1      LYS  52  14.372  -7.678  -5.075
  413    HD2  LYS  52           HD2      LYS  52  15.661  -9.734  -5.413
  414    HD3  LYS  52           HD1      LYS  52  17.159  -8.838  -5.175
  415    HE2  LYS  52           HE2      LYS  52  16.441 -10.076  -3.161
  416    HE3  LYS  52           HE1      LYS  52  16.552  -8.340  -2.891
  417    HZ1  LYS  52           HZ1      LYS  52  14.558  -9.400  -1.921
  418    HZ2  LYS  52           HZ2      LYS  52  13.956  -9.755  -3.449
  419    HZ3  LYS  52           HZ3      LYS  52  14.187  -8.165  -2.963
  420    H    ALA  53           HN       ALA  53  13.283  -5.174  -5.571
  421    HA   ALA  53           HA       ALA  53  11.358  -7.214  -5.346
  422    HB1  ALA  53           HB1      ALA  53  11.321  -4.441  -4.213
  423    HB2  ALA  53           HB2      ALA  53  12.026  -5.876  -3.460
  424    HB3  ALA  53           HB3      ALA  53  10.281  -5.777  -3.713
  425    H    GLY  54           HN       GLY  54   9.469  -7.475  -6.170
  426    HA2  GLY  54           HA3      GLY  54   8.302  -5.331  -7.782
  427    HA3  GLY  54           HA2      GLY  54   8.101  -7.053  -8.127
  428    HA   PRO  55           HA       PRO  55   4.367  -5.529  -5.762
  429    HB2  PRO  55           HB2      PRO  55   2.876  -7.724  -6.625
  430    HB3  PRO  55           HB1      PRO  55   2.854  -6.100  -7.313
  431    HG2  PRO  55           HG2      PRO  55   4.319  -8.530  -8.232
  432    HG3  PRO  55           HG1      PRO  55   3.600  -7.228  -9.191
  433    HD2  PRO  55           HD2      PRO  55   6.233  -7.409  -8.816
  434    HD3  PRO  55           HD1      PRO  55   5.421  -5.836  -8.879
  435    H    LEU  56           HN       LEU  56   5.480  -8.852  -6.057
  436    HA   LEU  56           HA       LEU  56   4.190  -9.663  -3.621
  437    HB2  LEU  56           HB2      LEU  56   6.259 -11.119  -5.287
  438    HB3  LEU  56           HB1      LEU  56   5.564 -11.770  -3.828
  439    HG   LEU  56           HG       LEU  56   3.310 -11.678  -4.952
  440   HD11  LEU  56          HD11      LEU  56   3.766 -10.046  -6.678
  441   HD12  LEU  56          HD12      LEU  56   3.230 -11.569  -7.391
  442   HD13  LEU  56          HD13      LEU  56   4.939 -11.130  -7.425
  443   HD21  LEU  56          HD21      LEU  56   3.708 -13.692  -6.290
  444   HD22  LEU  56          HD22      LEU  56   4.553 -13.739  -4.740
  445   HD23  LEU  56          HD23      LEU  56   5.444 -13.382  -6.219
  446    H    GLU  57           HN       GLU  57   7.549  -9.053  -4.489
  447    HA   GLU  57           HA       GLU  57   8.503  -9.518  -1.867
  448    HB2  GLU  57           HB3      GLU  57   9.749  -7.964  -4.114
  449    HB3  GLU  57           HB2      GLU  57  10.581  -8.375  -2.626
  450    HG2  GLU  57           HG3      GLU  57  10.201 -10.767  -3.155
  451    HG3  GLU  57           HG2      GLU  57   9.536 -10.268  -4.710
  452    H    MET  58           HN       MET  58   7.375  -6.616  -3.490
  453    HA   MET  58           HA       MET  58   8.091  -4.780  -1.474
  454    HB2  MET  58           HB2      MET  58   5.924  -4.758  -3.549
  455    HB3  MET  58           HB1      MET  58   6.094  -3.437  -2.407
  456    HG2  MET  58           HG2      MET  58   8.305  -4.388  -4.170
  457    HG3  MET  58           HG1      MET  58   7.193  -3.121  -4.694
  458    HE1  MET  58           HE1      MET  58  10.165  -2.580  -4.886
  459    HE2  MET  58           HE2      MET  58  10.349  -1.029  -4.064
  460    HE3  MET  58           HE3      MET  58   8.951  -1.319  -5.102
  461    H    ALA  59           HN       ALA  59   5.151  -6.675  -1.996
  462    HA   ALA  59           HA       ALA  59   3.746  -5.686   0.189
  463    HB1  ALA  59           HB1      ALA  59   2.760  -7.095  -1.573
  464    HB2  ALA  59           HB2      ALA  59   2.388  -7.696   0.035
  465    HB3  ALA  59           HB3      ALA  59   3.634  -8.487  -0.938
  466    H    GLN  60           HN       GLN  60   6.087  -8.277  -0.035
  467    HA   GLN  60           HA       GLN  60   5.865  -9.143   2.656
  468    HB2  GLN  60           HB2      GLN  60   8.174  -9.430   0.746
  469    HB3  GLN  60           HB1      GLN  60   7.958 -10.318   2.249
  470    HG2  GLN  60           HG2      GLN  60   5.921 -11.328   1.358
  471    HG3  GLN  60           HG1      GLN  60   6.138 -10.414  -0.120
  472   HE21  GLN  60          HE21      GLN  60   8.824 -11.820   1.603
  473   HE22  GLN  60          HE22      GLN  60   9.204 -13.011   0.432
  474    H    LEU  61           HN       LEU  61   7.805  -6.795   0.991
  475    HA   LEU  61           HA       LEU  61   9.762  -6.146   2.857
  476    HB2  LEU  61           HB2      LEU  61   9.510  -5.369   0.467
  477    HB3  LEU  61           HB1      LEU  61   8.273  -4.273   1.034
  478    HG   LEU  61           HG       LEU  61  10.058  -3.313   2.546
  479   HD11  LEU  61          HD11      LEU  61  11.710  -5.089   2.302
  480   HD12  LEU  61          HD12      LEU  61  12.368  -3.555   1.711
  481   HD13  LEU  61          HD13      LEU  61  11.794  -4.765   0.568
  482   HD21  LEU  61          HD21      LEU  61   9.135  -2.122   0.670
  483   HD22  LEU  61          HD22      LEU  61  10.173  -2.999  -0.445
  484   HD23  LEU  61          HD23      LEU  61  10.881  -1.862   0.704
  485    H    LEU  62           HN       LEU  62   6.651  -4.512   2.239
  486    HA   LEU  62           HA       LEU  62   6.795  -2.836   4.464
  487    HB2  LEU  62           HB2      LEU  62   4.404  -3.674   2.816
  488    HB3  LEU  62           HB1      LEU  62   4.299  -2.544   4.133
  489    HG   LEU  62           HG       LEU  62   4.287  -1.323   2.045
  490   HD11  LEU  62          HD11      LEU  62   5.371  -0.277   3.883
  491   HD12  LEU  62          HD12      LEU  62   6.061   0.174   2.323
  492   HD13  LEU  62          HD13      LEU  62   6.909  -0.975   3.364
  493   HD21  LEU  62          HD21      LEU  62   5.371  -2.936   0.652
  494   HD22  LEU  62          HD22      LEU  62   6.883  -2.660   1.500
  495   HD23  LEU  62          HD23      LEU  62   6.178  -1.357   0.518
  496    H    ILE  63           HN       ILE  63   5.255  -5.991   4.019
  497    HA   ILE  63           HA       ILE  63   3.876  -5.971   6.488
  498    HB   ILE  63           HB       ILE  63   3.711  -7.543   4.300
  499   HG12  ILE  63          HG12      ILE  63   2.026  -7.316   6.065
  500   HG13  ILE  63          HG11      ILE  63   2.128  -8.955   5.452
  501   HG21  ILE  63          HG21      ILE  63   5.766  -8.768   4.674
  502   HG22  ILE  63          HG22      ILE  63   4.379  -9.855   4.762
  503   HG23  ILE  63          HG23      ILE  63   5.172  -9.320   6.241
  504   HD11  ILE  63          HD11      ILE  63   3.416  -9.581   7.456
  505   HD12  ILE  63          HD12      ILE  63   1.812  -8.963   7.848
  506   HD13  ILE  63          HD13      ILE  63   3.236  -7.935   8.062
  507    H    THR  64           HN       THR  64   7.158  -6.839   5.704
  508    HA   THR  64           HA       THR  64   7.603  -8.206   8.170
  509    HB   THR  64           HB       THR  64   9.622  -7.151   6.174
  510    HG1  THR  64           HG1      THR  64   8.409  -8.641   5.143
  511   HG21  THR  64          HG21      THR  64  11.124  -8.821   7.175
  512   HG22  THR  64          HG22      THR  64   9.873  -9.248   8.340
  513   HG23  THR  64          HG23      THR  64  10.605  -7.646   8.385
  514    H    HIS  65           HN       HIS  65   8.226  -4.954   6.976
  515    HA   HIS  65           HA       HIS  65   9.647  -4.340   9.427
  516    HB2  HIS  65           HB2      HIS  65   9.195  -2.630   6.974
  517    HB3  HIS  65           HB1      HIS  65  10.130  -2.133   8.380
  518    HD1  HIS  65           HD1      HIS  65  12.414  -3.456   8.792
  519    HD2  HIS  65           HD2      HIS  65  10.506  -4.280   5.200
  520    HE1  HIS  65           HE1      HIS  65  14.090  -4.684   7.374
  521    H    PHE  66           HN       PHE  66   6.696  -3.234   7.825
  522    HA   PHE  66           HA       PHE  66   6.045  -1.567  10.086
  523    HB2  PHE  66           HB2      PHE  66   4.519  -2.171   7.553
  524    HB3  PHE  66           HB1      PHE  66   4.091  -0.931   8.736
  525    HD1  PHE  66           HD1      PHE  66   6.395  -1.939   6.160
  526    HD2  PHE  66           HD2      PHE  66   5.396   1.084   8.938
  527    HE1  PHE  66           HE1      PHE  66   7.953  -0.446   5.043
  528    HE2  PHE  66           HE2      PHE  66   6.973   2.620   7.818
  529    HZ   PHE  66           HZ       PHE  66   8.272   1.808   5.869
  530    H    GLY  67           HN       GLY  67   4.212  -4.139   8.453
  531    HA2  GLY  67           HA3      GLY  67   3.605  -5.923  10.280
  532    HA3  GLY  67           HA2      GLY  67   2.687  -4.546  10.901
  533    HA   PRO  68           HA       PRO  68   0.453  -6.928   7.450
  534    HB2  PRO  68           HB2      PRO  68  -1.812  -7.465   8.950
  535    HB3  PRO  68           HB1      PRO  68  -0.490  -8.598   8.668
  536    HG2  PRO  68           HG2      PRO  68  -1.060  -6.905  11.051
  537    HG3  PRO  68           HG1      PRO  68  -0.357  -8.526  10.950
  538    HD2  PRO  68           HD2      PRO  68   1.119  -6.295  11.421
  539    HD3  PRO  68           HD1      PRO  68   1.781  -7.704  10.593
  540    H    GLU  69           HN       GLU  69  -1.185  -4.951   9.929
  541    HA   GLU  69           HA       GLU  69  -3.012  -3.902   7.965
  542    HB2  GLU  69           HB3      GLU  69  -2.543  -3.023  10.823
  543    HB3  GLU  69           HB2      GLU  69  -3.898  -2.564   9.808
  544    HG2  GLU  69           HG3      GLU  69  -4.601  -4.938   9.731
  545    HG3  GLU  69           HG2      GLU  69  -3.286  -5.326  10.838
  546    H    GLU  70           HN       GLU  70  -0.119  -2.961   9.598
  547    HA   GLU  70           HA       GLU  70  -0.161  -0.221   8.937
  548    HB2  GLU  70           HB3      GLU  70   1.236  -1.503  10.707
  549    HB3  GLU  70           HB2      GLU  70   2.366  -1.768   9.392
  550    HG2  GLU  70           HG3      GLU  70   3.046   0.157  10.673
  551    HG3  GLU  70           HG2      GLU  70   2.509   0.688   9.076
  552    H    ALA  71           HN       ALA  71   1.402  -3.033   7.408
  553    HA   ALA  71           HA       ALA  71   2.738  -1.824   5.277
  554    HB1  ALA  71           HB1      ALA  71   2.959  -4.174   5.877
  555    HB2  ALA  71           HB2      ALA  71   2.557  -3.984   4.169
  556    HB3  ALA  71           HB3      ALA  71   1.317  -4.475   5.323
  557    H    TRP  72           HN       TRP  72  -0.537  -3.151   5.364
  558    HA   TRP  72           HA       TRP  72  -1.209  -2.462   2.745
  559    HB2  TRP  72           HB2      TRP  72  -2.510  -4.118   3.889
  560    HB3  TRP  72           HB1      TRP  72  -2.913  -2.999   5.180
  561    HD1  TRP  72           HD1      TRP  72  -5.427  -2.664   5.015
  562    HE1  TRP  72           HE1      TRP  72  -7.082  -2.015   3.180
  563    HE3  TRP  72           HE3      TRP  72  -2.258  -2.696   1.031
  564    HZ2  TRP  72           HZ2      TRP  72  -7.053  -1.560   0.405
  565    HZ3  TRP  72           HZ3      TRP  72  -3.167  -2.154  -1.220
  566    HH2  TRP  72           HH2      TRP  72  -5.511  -1.597  -1.507
  567    H    ARG  73           HN       ARG  73  -1.639  -0.742   5.750
  568    HA   ARG  73           HA       ARG  73  -3.026   1.427   4.726
  569    HB2  ARG  73           HB2      ARG  73  -2.894   0.959   7.095
  570    HB3  ARG  73           HB1      ARG  73  -1.163   1.214   7.085
  571    HG2  ARG  73           HG2      ARG  73  -1.528   3.586   6.587
  572    HG3  ARG  73           HG1      ARG  73  -3.275   3.310   6.640
  573    HD2  ARG  73           HD2      ARG  73  -1.354   2.796   8.905
  574    HD3  ARG  73           HD1      ARG  73  -2.427   4.189   8.774
  575    HE   ARG  73           HE       ARG  73  -4.290   2.575   8.832
  576   HH11  ARG  73          HH11      ARG  73  -1.169   1.519  10.211
  577   HH12  ARG  73          HH12      ARG  73  -1.906   0.475  11.334
  578   HH21  ARG  73          HH21      ARG  73  -5.236   1.149  10.350
  579   HH22  ARG  73          HH22      ARG  73  -4.278   0.268  11.449
  580    H    LEU  74           HN       LEU  74   0.442   0.900   5.235
  581    HA   LEU  74           HA       LEU  74   1.464   3.327   4.340
  582    HB2  LEU  74           HB2      LEU  74   2.499   0.613   4.737
  583    HB3  LEU  74           HB1      LEU  74   3.340   1.503   3.493
  584    HG   LEU  74           HG       LEU  74   4.419   1.591   5.738
  585   HD11  LEU  74          HD11      LEU  74   3.528   4.234   4.590
  586   HD12  LEU  74          HD12      LEU  74   4.951   3.299   4.126
  587   HD13  LEU  74          HD13      LEU  74   4.857   4.014   5.723
  588   HD21  LEU  74          HD21      LEU  74   3.472   3.039   7.468
  589   HD22  LEU  74          HD22      LEU  74   2.403   1.676   7.125
  590   HD23  LEU  74          HD23      LEU  74   2.027   3.276   6.488
  591    H    ALA  75           HN       ALA  75   0.527   0.471   2.494
  592    HA   ALA  75           HA       ALA  75   1.568   1.477   0.034
  593    HB1  ALA  75           HB1      ALA  75   0.306  -0.279  -1.039
  594    HB2  ALA  75           HB2      ALA  75  -0.519  -0.632   0.483
  595    HB3  ALA  75           HB3      ALA  75   1.228  -0.895   0.328
  596    H    LEU  76           HN       LEU  76  -1.774   1.210   1.245
  597    HA   LEU  76           HA       LEU  76  -2.776   2.500  -1.034
  598    HB2  LEU  76           HB2      LEU  76  -4.938   2.566   0.030
  599    HB3  LEU  76           HB1      LEU  76  -4.185   1.031   0.362
  600    HG   LEU  76           HG       LEU  76  -3.562   2.138   2.640
  601   HD11  LEU  76          HD11      LEU  76  -5.927   3.780   1.782
  602   HD12  LEU  76          HD12      LEU  76  -4.301   4.392   2.095
  603   HD13  LEU  76          HD13      LEU  76  -5.274   3.736   3.423
  604   HD21  LEU  76          HD21      LEU  76  -4.998   0.243   2.420
  605   HD22  LEU  76          HD22      LEU  76  -6.356   1.277   1.966
  606   HD23  LEU  76          HD23      LEU  76  -5.672   1.371   3.595
  607    H    SER  77           HN       SER  77  -1.722   3.791   2.058
  608    HA   SER  77           HA       SER  77  -2.758   6.368   1.419
  609    HB2  SER  77           HB2      SER  77  -2.428   5.329   3.760
  610    HB3  SER  77           HB1      SER  77  -0.751   5.830   3.590
  611    HG   SER  77           HG       SER  77  -2.743   7.688   3.012
  612    H    THR  78           HN       THR  78  -0.061   4.700   0.380
  613    HA   THR  78           HA       THR  78   1.358   7.166  -0.179
  614    HB   THR  78           HB       THR  78   2.113   4.266  -0.676
  615    HG1  THR  78           HG1      THR  78   2.499   4.587   1.350
  616   HG21  THR  78          HG21      THR  78   3.103   5.643  -2.430
  617   HG22  THR  78          HG22      THR  78   4.364   5.156  -1.289
  618   HG23  THR  78          HG23      THR  78   3.688   6.788  -1.230
  619    H    PHE  79           HN       PHE  79  -0.748   4.817  -1.615
  620    HA   PHE  79           HA       PHE  79  -0.310   5.293  -4.301
  621    HB2  PHE  79           HB2      PHE  79  -2.909   4.638  -2.882
  622    HB3  PHE  79           HB1      PHE  79  -2.766   4.663  -4.640
  623    HD1  PHE  79           HD1      PHE  79   0.201   3.330  -4.159
  624    HD2  PHE  79           HD2      PHE  79  -3.831   2.423  -3.146
  625    HE1  PHE  79           HE1      PHE  79   0.756   0.949  -4.058
  626    HE2  PHE  79           HE2      PHE  79  -3.275   0.036  -3.052
  627    HZ   PHE  79           HZ       PHE  79  -0.979  -0.704  -3.515
  628    H    GLU  80           HN       GLU  80  -2.419   6.912  -1.970
  629    HA   GLU  80           HA       GLU  80  -3.574   8.894  -3.647
  630    HB2  GLU  80           HB3      GLU  80  -4.071  10.082  -1.453
  631    HB3  GLU  80           HB2      GLU  80  -4.647   8.418  -1.554
  632    HG2  GLU  80           HG3      GLU  80  -2.860   7.626  -0.322
  633    HG3  GLU  80           HG2      GLU  80  -2.039   9.186  -0.338
  634    H    ARG  81           HN       ARG  81  -0.378   8.624  -2.765
  635    HA   ARG  81           HA       ARG  81   0.119  11.524  -2.607
  636    HB2  ARG  81           HB2      ARG  81   2.031   9.271  -2.035
  637    HB3  ARG  81           HB1      ARG  81   2.258  10.975  -1.668
  638    HG2  ARG  81           HG2      ARG  81   0.132   9.220  -0.471
  639    HG3  ARG  81           HG1      ARG  81   1.670   9.654   0.271
  640    HD2  ARG  81           HD2      ARG  81   1.085  11.856   0.535
  641    HD3  ARG  81           HD1      ARG  81  -0.210  11.759  -0.667
  642    HE   ARG  81           HE       ARG  81  -1.414  10.358   0.956
  643   HH11  ARG  81          HH11      ARG  81   1.104  12.463   2.272
  644   HH12  ARG  81          HH12      ARG  81   0.306  12.706   3.748
  645   HH21  ARG  81          HH21      ARG  81  -2.516  10.728   2.854
  646   HH22  ARG  81          HH22      ARG  81  -1.844  11.640   4.128
  647    H    ILE  82           HN       ILE  82   1.249   8.582  -4.189
  648    HA   ILE  82           HA       ILE  82   3.090   9.970  -5.929
  649    HB   ILE  82           HB       ILE  82   3.612   7.721  -6.785
  650   HG12  ILE  82          HG12      ILE  82   1.397   6.777  -4.938
  651   HG13  ILE  82          HG11      ILE  82   1.305   6.797  -6.691
  652   HG21  ILE  82          HG21      ILE  82   4.709   8.496  -4.738
  653   HG22  ILE  82          HG22      ILE  82   4.439   6.754  -4.677
  654   HG23  ILE  82          HG23      ILE  82   3.387   7.840  -3.772
  655   HD11  ILE  82          HD11      ILE  82   3.204   5.154  -5.036
  656   HD12  ILE  82          HD12      ILE  82   3.112   5.152  -6.797
  657   HD13  ILE  82          HD13      ILE  82   1.746   4.566  -5.836
  658    H    ASN  83           HN       ASN  83   0.103  10.283  -6.107
  659    HA   ASN  83           HA       ASN  83  -1.619  10.459  -7.491
  660    HB2  ASN  83           HB3      ASN  83  -0.008  11.824  -8.883
  661    HB3  ASN  83           HB2      ASN  83   0.338  10.364  -9.808
  662   HD21  ASN  83          HD21      ASN  83  -1.268   9.554 -11.222
  663   HD22  ASN  83          HD22      ASN  83  -2.652  10.488 -11.667
  664    H    ARG  84           HN       ARG  84  -1.916   8.390  -6.610
  665    HA   ARG  84           HA       ARG  84  -2.619   6.578  -8.725
  666    HB2  ARG  84           HB2      ARG  84  -0.376   5.832  -7.969
  667    HB3  ARG  84           HB1      ARG  84  -0.946   5.775  -6.312
  668    HG2  ARG  84           HG2      ARG  84  -0.736   3.572  -7.477
  669    HG3  ARG  84           HG1      ARG  84  -2.315   3.894  -6.761
  670    HD2  ARG  84           HD2      ARG  84  -2.558   2.929  -8.955
  671    HD3  ARG  84           HD1      ARG  84  -3.166   4.582  -8.888
  672    HE   ARG  84           HE       ARG  84  -0.484   4.632  -9.758
  673   HH11  ARG  84          HH11      ARG  84  -3.685   3.620 -11.129
  674   HH12  ARG  84          HH12      ARG  84  -3.122   3.873 -12.703
  675   HH21  ARG  84          HH21      ARG  84   0.127   4.903 -11.814
  676   HH22  ARG  84          HH22      ARG  84  -0.889   4.605 -13.163
  677    H    LYS  85           HN       LYS  85  -4.107   8.371  -7.410
  678    HA   LYS  85           HA       LYS  85  -5.377   7.492  -5.050
  679    HB2  LYS  85           HB2      LYS  85  -5.373   9.783  -5.726
  680    HB3  LYS  85           HB1      LYS  85  -6.189   9.405  -7.247
  681    HG2  LYS  85           HG2      LYS  85  -8.192   8.758  -5.848
  682    HG3  LYS  85           HG1      LYS  85  -7.280   9.358  -4.450
  683    HD2  LYS  85           HD2      LYS  85  -8.781  11.072  -5.202
  684    HD3  LYS  85           HD1      LYS  85  -7.122  11.561  -5.502
  685    HE2  LYS  85           HE2      LYS  85  -8.435  12.146  -7.420
  686    HE3  LYS  85           HE1      LYS  85  -7.392  10.814  -7.879
  687    HZ1  LYS  85           HZ1      LYS  85  -9.518  10.370  -8.742
  688    HZ2  LYS  85           HZ2      LYS  85 -10.293  10.767  -7.321
  689    HZ3  LYS  85           HZ3      LYS  85  -9.453   9.328  -7.406
  690    H    ASP  86           HN       ASP  86  -5.573   6.984  -8.381
  691    HA   ASP  86           HA       ASP  86  -7.865   5.826  -9.013
  692    HB2  ASP  86           HB2      ASP  86  -6.359   6.122 -10.719
  693    HB3  ASP  86           HB1      ASP  86  -5.041   5.378  -9.832
  694    H    LEU  87           HN       LEU  87  -5.097   4.193  -7.419
  695    HA   LEU  87           HA       LEU  87  -6.741   1.794  -7.075
  696    HB2  LEU  87           HB2      LEU  87  -3.794   2.189  -6.567
  697    HB3  LEU  87           HB1      LEU  87  -4.661   0.707  -6.238
  698    HG   LEU  87           HG       LEU  87  -4.291   1.934  -8.968
  699   HD11  LEU  87          HD11      LEU  87  -2.233   1.060  -7.961
  700   HD12  LEU  87          HD12      LEU  87  -2.752   0.115  -9.355
  701   HD13  LEU  87          HD13      LEU  87  -3.024  -0.498  -7.719
  702   HD21  LEU  87          HD21      LEU  87  -5.184  -0.212  -9.778
  703   HD22  LEU  87          HD22      LEU  87  -6.364   0.676  -8.827
  704   HD23  LEU  87          HD23      LEU  87  -5.512  -0.695  -8.112
  705    H    TRP  88           HN       TRP  88  -5.626   4.479  -5.413
  706    HA   TRP  88           HA       TRP  88  -5.677   3.559  -2.744
  707    HB2  TRP  88           HB2      TRP  88  -4.695   5.671  -3.414
  708    HB3  TRP  88           HB1      TRP  88  -6.234   6.218  -3.998
  709    HD1  TRP  88           HD1      TRP  88  -4.841   5.120  -0.559
  710    HE1  TRP  88           HE1      TRP  88  -5.873   6.650   1.228
  711    HE3  TRP  88           HE3      TRP  88  -7.897   7.824  -3.526
  712    HZ2  TRP  88           HZ2      TRP  88  -7.756   8.742   1.356
  713    HZ3  TRP  88           HZ3      TRP  88  -9.292   9.586  -2.526
  714    HH2  TRP  88           HH2      TRP  88  -9.223  10.032  -0.140
  715    H    GLU  89           HN       GLU  89  -8.148   5.065  -4.791
  716    HA   GLU  89           HA       GLU  89 -10.252   4.853  -2.920
  717    HB2  GLU  89           HB3      GLU  89 -10.291   5.092  -5.920
  718    HB3  GLU  89           HB2      GLU  89 -11.711   5.256  -4.894
  719    HG2  GLU  89           HG3      GLU  89 -10.693   7.188  -3.784
  720    HG3  GLU  89           HG2      GLU  89  -9.238   6.964  -4.742
  721    H    ARG  90           HN       ARG  90  -8.793   2.612  -4.922
  722    HA   ARG  90           HA       ARG  90 -10.871   0.630  -5.015
  723    HB2  ARG  90           HB2      ARG  90  -7.888   0.436  -5.439
  724    HB3  ARG  90           HB1      ARG  90  -8.967  -0.940  -5.579
  725    HG2  ARG  90           HG2      ARG  90  -9.167   1.557  -7.242
  726    HG3  ARG  90           HG1      ARG  90  -8.357   0.071  -7.744
  727    HD2  ARG  90           HD2      ARG  90 -11.273   0.377  -7.042
  728    HD3  ARG  90           HD1      ARG  90 -10.593   0.137  -8.654
  729    HE   ARG  90           HE       ARG  90  -9.802  -2.019  -7.903
  730   HH11  ARG  90          HH11      ARG  90 -12.551  -0.558  -6.185
  731   HH12  ARG  90          HH12      ARG  90 -13.061  -2.011  -5.465
  732   HH21  ARG  90          HH21      ARG  90 -10.529  -4.018  -6.912
  733   HH22  ARG  90          HH22      ARG  90 -11.869  -4.040  -5.880
  734    H    GLY  91           HN       GLY  91  -8.123   1.294  -2.927
  735    HA2  GLY  91           HA3      GLY  91  -8.618  -0.999  -1.231
  736    HA3  GLY  91           HA2      GLY  91  -7.454   0.300  -0.947
  737    H    GLN  92           HN       GLN  92  -9.213   2.417  -1.226
  738    HA   GLN  92           HA       GLN  92 -10.278   2.536   1.421
  739    HB2  GLN  92           HB2      GLN  92 -10.224   4.516  -0.837
  740    HB3  GLN  92           HB1      GLN  92 -10.950   4.841   0.732
  741    HG2  GLN  92           HG2      GLN  92  -8.085   4.035   0.370
  742    HG3  GLN  92           HG1      GLN  92  -8.627   5.712   0.383
  743   HE21  GLN  92          HE21      GLN  92  -9.427   6.563   2.242
  744   HE22  GLN  92          HE22      GLN  92  -9.155   5.881   3.798
  745    H    ARG  93           HN       ARG  93 -11.733   0.875   1.156
  746    HA   ARG  93           HA       ARG  93 -14.239   1.799   0.035
  747    HB2  ARG  93           HB2      ARG  93 -13.893  -0.454  -0.621
  748    HB3  ARG  93           HB1      ARG  93 -13.298  -0.915   0.958
  749    HG2  ARG  93           HG2      ARG  93 -16.076   0.003   0.918
  750    HG3  ARG  93           HG1      ARG  93 -15.788  -1.515   0.028
  751    HD2  ARG  93           HD2      ARG  93 -14.722  -2.433   2.026
  752    HD3  ARG  93           HD1      ARG  93 -14.937  -0.895   2.844
  753    HE   ARG  93           HE       ARG  93 -17.362  -2.168   1.906
  754   HH11  ARG  93          HH11      ARG  93 -15.094  -1.853   4.592
  755   HH12  ARG  93          HH12      ARG  93 -16.239  -2.167   5.807
  756   HH21  ARG  93          HH21      ARG  93 -18.975  -2.705   3.605
  757   HH22  ARG  93          HH22      ARG  93 -18.502  -2.656   5.219
  758    H    GLU  94           HN       GLU  94 -14.905   3.294   1.313
  759    HA   GLU  94           HA       GLU  94 -15.024   2.667   4.139
  760    HB2  GLU  94           HB3      GLU  94 -15.067   5.380   2.822
  761    HB3  GLU  94           HB2      GLU  94 -15.110   5.073   4.554
  762    HG2  GLU  94           HG3      GLU  94 -12.901   3.930   4.330
  763    HG3  GLU  94           HG2      GLU  94 -12.853   4.480   2.660
  764    H    ASP  95           HN       ASP  95 -16.841   2.863   1.426
  765    HA   ASP  95           HA       ASP  95 -19.271   3.419   2.931
  766    HB2  ASP  95           HB2      ASP  95 -20.453   3.545   0.817
  767    HB3  ASP  95           HB1      ASP  95 -19.006   4.530   0.683
  768    H    LEU  96           HN       LEU  96 -21.100   1.807   1.967
  769    HA   LEU  96           HA       LEU  96 -20.169  -0.752   2.985
  770    HB2  LEU  96           HB2      LEU  96 -22.420  -1.350   3.375
  771    HB3  LEU  96           HB1      LEU  96 -22.209   0.290   3.934
  772    HG   LEU  96           HG       LEU  96 -23.483  -0.471   1.321
  773   HD11  LEU  96          HD11      LEU  96 -24.811  -1.305   3.193
  774   HD12  LEU  96          HD12      LEU  96 -25.632   0.031   2.393
  775   HD13  LEU  96          HD13      LEU  96 -24.803   0.301   3.923
  776   HD21  LEU  96          HD21      LEU  96 -24.424   1.833   1.381
  777   HD22  LEU  96          HD22      LEU  96 -22.675   1.808   1.248
  778   HD23  LEU  96          HD23      LEU  96 -23.434   2.171   2.801
  779    H    VAL  97           HN       VAL  97 -20.608   0.520  -0.110
  780    HA   VAL  97           HA       VAL  97 -21.483  -2.088  -1.116
  781    HB   VAL  97           HB       VAL  97 -21.674   0.633  -2.448
  782   HG11  VAL  97          HG11      VAL  97 -22.540  -2.072  -3.425
  783   HG12  VAL  97          HG12      VAL  97 -21.459  -0.877  -4.194
  784   HG13  VAL  97          HG13      VAL  97 -23.169  -0.554  -4.059
  785   HG21  VAL  97          HG21      VAL  97 -23.813  -1.092  -1.220
  786   HG22  VAL  97          HG22      VAL  97 -24.110   0.352  -2.182
  787   HG23  VAL  97          HG23      VAL  97 -23.256   0.482  -0.644
  788    H    ARG  98           HN       ARG  98 -19.720   0.619  -2.500
  789    HA   ARG  98           HA       ARG  98 -17.221  -0.110  -2.942
  790    HB2  ARG  98           HB2      ARG  98 -17.127  -1.156  -5.201
  791    HB3  ARG  98           HB1      ARG  98 -17.961  -2.237  -4.102
  792    HG2  ARG  98           HG2      ARG  98 -20.073  -1.729  -5.071
  793    HG3  ARG  98           HG1      ARG  98 -19.404  -0.394  -6.033
  794    HD2  ARG  98           HD2      ARG  98 -18.083  -2.064  -7.281
  795    HD3  ARG  98           HD1      ARG  98 -18.793  -3.341  -6.294
  796    HE   ARG  98           HE       ARG  98 -20.954  -2.080  -7.341
  797   HH11  ARG  98          HH11      ARG  98 -18.048  -3.344  -8.918
  798   HH12  ARG  98          HH12      ARG  98 -18.883  -3.903 -10.302
  799   HH21  ARG  98          HH21      ARG  98 -22.075  -2.842  -9.293
  800   HH22  ARG  98          HH22      ARG  98 -21.171  -3.590 -10.519
  801    H    ASP  99           HN       ASP  99 -16.725   0.859  -5.425
  802    HA   ASP  99           HA       ASP  99 -17.619   3.509  -5.485
  803    HB2  ASP  99           HB2      ASP  99 -15.629   2.717  -6.659
  804    HB3  ASP  99           HB1      ASP  99 -16.656   1.716  -7.688
  805    H    THR 100           HN       THR 100 -19.756   4.044  -5.656
  806    HA   THR 100           HA       THR 100 -21.377   2.531  -7.610
  807    HB   THR 100           HB       THR 100 -22.531   3.898  -5.163
  808    HG1  THR 100           HG1      THR 100 -20.798   1.978  -5.074
  809   HG21  THR 100          HG21      THR 100 -24.105   3.169  -6.928
  810   HG22  THR 100          HG22      THR 100 -24.309   2.208  -5.465
  811   HG23  THR 100          HG23      THR 100 -23.440   1.538  -6.845
  812    H    VAL 101           HN       VAL 101 -19.787   5.176  -7.693
  813    HA   VAL 101           HA       VAL 101 -21.971   7.005  -8.251
  814    HB   VAL 101           HB       VAL 101 -20.262   8.727  -8.711
  815   HG11  VAL 101          HG11      VAL 101 -19.782   7.248  -6.134
  816   HG12  VAL 101          HG12      VAL 101 -21.015   8.476  -6.430
  817   HG13  VAL 101          HG13      VAL 101 -19.306   8.914  -6.459
  818   HG21  VAL 101          HG21      VAL 101 -18.524   7.308  -9.658
  819   HG22  VAL 101          HG22      VAL 101 -18.251   6.568  -8.082
  820   HG23  VAL 101          HG23      VAL 101 -17.886   8.277  -8.331
  821    H    GLU 102           HN       GLU 102 -22.132   8.077 -10.329
  822    HA   GLU 102           HA       GLU 102 -21.344   6.239 -12.452
  823    HB2  GLU 102           HB3      GLU 102 -23.756   8.061 -12.312
  824    HB3  GLU 102           HB2      GLU 102 -23.328   7.067 -13.695
  825    HG2  GLU 102           HG3      GLU 102 -23.569   5.054 -12.296
  826    HG3  GLU 102           HG2      GLU 102 -24.062   6.075 -10.946
  Start of MODEL   13
    1    H1   GLY   1           HT1      GLY   1   2.736 -21.645  10.623
    2    H2   GLY   1           HT2      GLY   1   1.711 -21.161  11.898
    3    H3   GLY   1           HT3      GLY   1   2.884 -22.368  12.128
    4    HA2  GLY   1           HA2      GLY   1   3.542 -19.607  11.423
    5    HA3  GLY   1           HA3      GLY   1   3.569 -20.260  13.067
    6    H    HIS   2           HN       HIS   2   5.792 -19.197  11.675
    7    HA   HIS   2           HA       HIS   2   7.953 -19.538  11.193
    8    HB2  HIS   2           HB2      HIS   2   7.603 -21.834  13.128
    9    HB3  HIS   2           HB1      HIS   2   9.156 -21.194  12.611
   10    HD1  HIS   2           HD1      HIS   2  10.074 -19.285  14.023
   11    HD2  HIS   2           HD2      HIS   2   6.014 -19.920  14.615
   12    HE1  HIS   2           HE1      HIS   2   9.411 -17.812  15.939
   13    H    MET   3           HN       MET   3   7.406 -22.972  11.547
   14    HA   MET   3           HA       MET   3   8.884 -23.676   9.242
   15    HB2  MET   3           HB2      MET   3   8.068 -25.962   9.632
   16    HB3  MET   3           HB1      MET   3   8.640 -25.227  11.118
   17    HG2  MET   3           HG2      MET   3   6.272 -24.720  11.704
   18    HG3  MET   3           HG1      MET   3   5.771 -25.613  10.272
   19    HE1  MET   3           HE1      MET   3   7.991 -27.994  10.328
   20    HE2  MET   3           HE2      MET   3   6.288 -28.257   9.948
   21    HE3  MET   3           HE3      MET   3   7.083 -29.237  11.182
   22    H    LEU   4           HN       LEU   4   5.571 -22.956   9.745
   23    HA   LEU   4           HA       LEU   4   5.103 -23.140   6.868
   24    HB2  LEU   4           HB2      LEU   4   3.993 -25.078   7.958
   25    HB3  LEU   4           HB1      LEU   4   3.172 -23.981   9.045
   26    HG   LEU   4           HG       LEU   4   2.020 -22.977   7.075
   27   HD11  LEU   4          HD11      LEU   4   3.583 -23.592   5.334
   28   HD12  LEU   4          HD12      LEU   4   1.980 -24.234   4.979
   29   HD13  LEU   4          HD13      LEU   4   3.236 -25.300   5.602
   30   HD21  LEU   4          HD21      LEU   4   0.921 -24.621   8.468
   31   HD22  LEU   4          HD22      LEU   4   1.617 -25.926   7.510
   32   HD23  LEU   4          HD23      LEU   4   0.450 -24.820   6.783
   33    H    ARG   5           HN       ARG   5   5.276 -20.963   6.624
   34    HA   ARG   5           HA       ARG   5   4.262 -19.168   8.527
   35    HB2  ARG   5           HB2      ARG   5   4.712 -17.392   6.848
   36    HB3  ARG   5           HB1      ARG   5   6.083 -18.446   7.144
   37    HG2  ARG   5           HG2      ARG   5   5.503 -19.675   5.054
   38    HG3  ARG   5           HG1      ARG   5   4.256 -18.467   4.751
   39    HD2  ARG   5           HD2      ARG   5   5.921 -16.711   4.717
   40    HD3  ARG   5           HD1      ARG   5   7.192 -17.869   5.102
   41    HE   ARG   5           HE       ARG   5   5.639 -17.823   2.600
   42   HH11  ARG   5          HH11      ARG   5   8.626 -18.667   4.336
   43   HH12  ARG   5          HH12      ARG   5   9.484 -19.049   2.919
   44   HH21  ARG   5          HH21      ARG   5   6.883 -18.343   0.666
   45   HH22  ARG   5          HH22      ARG   5   8.484 -18.904   0.840
   46    H    THR   6           HN       THR   6   2.378 -18.220   8.781
   47    HA   THR   6           HA       THR   6   0.095 -19.261   7.533
   48    HB   THR   6           HB       THR   6   0.283 -16.697   9.129
   49    HG1  THR   6           HG1      THR   6  -0.175 -18.951  10.607
   50   HG21  THR   6          HG21      THR   6  -1.789 -18.901   9.006
   51   HG22  THR   6          HG22      THR   6  -1.926 -17.337   8.205
   52   HG23  THR   6          HG23      THR   6  -1.906 -17.427   9.968
   53    H    ALA   7           HN       ALA   7  -0.128 -18.826   5.400
   54    HA   ALA   7           HA       ALA   7   0.648 -16.261   4.327
   55    HB1  ALA   7           HB1      ALA   7  -0.424 -18.706   2.917
   56    HB2  ALA   7           HB2      ALA   7   1.274 -18.288   3.123
   57    HB3  ALA   7           HB3      ALA   7   0.228 -17.266   2.138
   58    H    GLY   8           HN       GLY   8  -2.177 -17.669   5.514
   59    HA2  GLY   8           HA3      GLY   8  -3.988 -16.104   3.878
   60    HA3  GLY   8           HA2      GLY   8  -4.432 -17.144   5.229
   61    H    ARG   9           HN       ARG   9  -2.436 -14.282   4.782
   62    HA   ARG   9           HA       ARG   9  -3.480 -13.212   7.304
   63    HB2  ARG   9           HB2      ARG   9  -1.077 -12.450   5.665
   64    HB3  ARG   9           HB1      ARG   9  -1.649 -11.491   7.018
   65    HG2  ARG   9           HG2      ARG   9  -0.748 -14.352   7.149
   66    HG3  ARG   9           HG1      ARG   9   0.190 -12.941   7.649
   67    HD2  ARG   9           HD2      ARG   9  -1.596 -12.387   9.263
   68    HD3  ARG   9           HD1      ARG   9  -2.423 -13.871   8.824
   69    HE   ARG   9           HE       ARG   9   0.315 -14.182   9.657
   70   HH11  ARG   9          HH11      ARG   9  -3.072 -14.246  10.715
   71   HH12  ARG   9          HH12      ARG   9  -2.744 -15.174  12.108
   72   HH21  ARG   9          HH21      ARG   9   0.740 -15.428  11.585
   73   HH22  ARG   9          HH22      ARG   9  -0.552 -15.874  12.602
   74    H    ASP  10           HN       ASP  10  -4.297 -11.179   7.508
   75    HA   ASP  10           HA       ASP  10  -5.615 -10.239   5.166
   76    HB2  ASP  10           HB2      ASP  10  -6.757 -10.206   7.407
   77    HB3  ASP  10           HB1      ASP  10  -5.605  -8.982   7.934
   78    H    GLY  11           HN       GLY  11  -5.194  -8.219   4.209
   79    HA2  GLY  11           HA3      GLY  11  -4.013  -6.185   3.995
   80    HA3  GLY  11           HA2      GLY  11  -2.889  -6.754   5.236
   81    H    LEU  12           HN       LEU  12  -1.825  -8.874   4.561
   82    HA   LEU  12           HA       LEU  12   0.098  -8.355   2.624
   83    HB2  LEU  12           HB2      LEU  12   0.283 -10.068   4.397
   84    HB3  LEU  12           HB1      LEU  12  -0.860 -11.049   3.534
   85    HG   LEU  12           HG       LEU  12   0.708 -11.293   1.653
   86   HD11  LEU  12          HD11      LEU  12   1.979  -9.240   1.873
   87   HD12  LEU  12          HD12      LEU  12   3.062 -10.631   1.917
   88   HD13  LEU  12          HD13      LEU  12   2.649  -9.796   3.405
   89   HD21  LEU  12          HD21      LEU  12   0.646 -12.984   3.402
   90   HD22  LEU  12          HD22      LEU  12   1.843 -12.083   4.331
   91   HD23  LEU  12          HD23      LEU  12   2.283 -12.792   2.776
   92    H    CYS  13           HN       CYS  13  -2.702 -10.493   2.282
   93    HA   CYS  13           HA       CYS  13  -2.148 -11.166  -0.421
   94    HB2  CYS  13           HB2      CYS  13  -4.509 -11.514   1.339
   95    HB3  CYS  13           HB1      CYS  13  -4.359 -12.273  -0.263
   96    HG   CYS  13           HG       CYS  13  -1.911 -13.572   0.636
   97    H    ARG  14           HN       ARG  14  -3.558  -8.484   0.978
   98    HA   ARG  14           HA       ARG  14  -5.268  -7.807  -1.308
   99    HB2  ARG  14           HB2      ARG  14  -6.043  -7.425   1.013
  100    HB3  ARG  14           HB1      ARG  14  -4.660  -6.395   1.302
  101    HG2  ARG  14           HG2      ARG  14  -5.548  -4.774  -0.296
  102    HG3  ARG  14           HG1      ARG  14  -6.925  -5.840  -0.601
  103    HD2  ARG  14           HD2      ARG  14  -6.191  -4.591   2.051
  104    HD3  ARG  14           HD1      ARG  14  -7.537  -4.118   1.010
  105    HE   ARG  14           HE       ARG  14  -8.415  -6.390   1.381
  106   HH11  ARG  14          HH11      ARG  14  -6.340  -4.939   3.912
  107   HH12  ARG  14          HH12      ARG  14  -6.897  -6.021   5.119
  108   HH21  ARG  14          HH21      ARG  14  -9.135  -7.767   3.063
  109   HH22  ARG  14          HH22      ARG  14  -8.487  -7.635   4.642
  110    H    LEU  15           HN       LEU  15  -2.490  -6.829   0.500
  111    HA   LEU  15           HA       LEU  15  -1.636  -4.504  -0.634
  112    HB2  LEU  15           HB2      LEU  15  -0.895  -5.492   1.445
  113    HB3  LEU  15           HB1      LEU  15  -0.164  -6.814   0.581
  114    HG   LEU  15           HG       LEU  15   1.518  -5.288  -0.336
  115   HD11  LEU  15          HD11      LEU  15   0.131  -3.267  -0.378
  116   HD12  LEU  15          HD12      LEU  15   1.648  -3.028   0.487
  117   HD13  LEU  15          HD13      LEU  15   0.150  -3.245   1.388
  118   HD21  LEU  15          HD21      LEU  15   1.148  -5.136   2.639
  119   HD22  LEU  15          HD22      LEU  15   2.648  -4.819   1.770
  120   HD23  LEU  15          HD23      LEU  15   1.941  -6.436   1.749
  121    H    SER  16           HN       SER  16  -0.629  -7.856  -1.419
  122    HA   SER  16           HA       SER  16   1.235  -7.108  -3.367
  123    HB2  SER  16           HB2      SER  16   1.011  -9.569  -3.979
  124    HB3  SER  16           HB1      SER  16   1.446  -9.211  -2.312
  125    HG   SER  16           HG       SER  16  -0.162 -10.553  -2.007
  126    H    THR  17           HN       THR  17  -2.152  -7.892  -3.504
  127    HA   THR  17           HA       THR  17  -2.355  -8.115  -6.309
  128    HB   THR  17           HB       THR  17  -4.525  -7.616  -4.266
  129    HG1  THR  17           HG1      THR  17  -2.780  -9.639  -4.665
  130   HG21  THR  17          HG21      THR  17  -5.917  -8.898  -5.854
  131   HG22  THR  17          HG22      THR  17  -4.548  -9.011  -6.964
  132   HG23  THR  17          HG23      THR  17  -5.273  -7.441  -6.604
  133    H    TYR  18           HN       TYR  18  -2.561  -5.394  -4.096
  134    HA   TYR  18           HA       TYR  18  -3.545  -3.695  -6.223
  135    HB2  TYR  18           HB2      TYR  18  -2.875  -3.157  -3.346
  136    HB3  TYR  18           HB1      TYR  18  -3.078  -1.828  -4.482
  137    HD1  TYR  18           HD2      TYR  18  -5.255  -1.337  -5.443
  138    HD2  TYR  18           HD1      TYR  18  -4.782  -4.482  -2.626
  139    HE1  TYR  18           HE2      TYR  18  -7.689  -1.394  -5.107
  140    HE2  TYR  18           HE1      TYR  18  -7.214  -4.547  -2.285
  141    HH   TYR  18           HH       TYR  18  -9.130  -3.021  -2.530
  142    H    LEU  19           HN       LEU  19  -0.520  -4.338  -4.582
  143    HA   LEU  19           HA       LEU  19   0.919  -2.232  -5.781
  144    HB2  LEU  19           HB2      LEU  19   1.841  -4.829  -4.579
  145    HB3  LEU  19           HB1      LEU  19   2.952  -3.620  -5.193
  146    HG   LEU  19           HG       LEU  19   1.006  -3.174  -2.902
  147   HD11  LEU  19          HD11      LEU  19   3.984  -3.610  -2.900
  148   HD12  LEU  19          HD12      LEU  19   2.764  -4.745  -2.320
  149   HD13  LEU  19          HD13      LEU  19   2.987  -3.200  -1.505
  150   HD21  LEU  19          HD21      LEU  19   2.254  -1.102  -2.575
  151   HD22  LEU  19          HD22      LEU  19   1.507  -1.135  -4.166
  152   HD23  LEU  19          HD23      LEU  19   3.232  -1.451  -3.999
  153    H    GLU  20           HN       GLU  20   0.107  -5.421  -6.929
  154    HA   GLU  20           HA       GLU  20   1.996  -5.441  -9.033
  155    HB2  GLU  20           HB3      GLU  20   0.669  -7.258 -10.035
  156    HB3  GLU  20           HB2      GLU  20   1.025  -7.524  -8.336
  157    HG2  GLU  20           HG3      GLU  20  -1.190  -6.886  -7.726
  158    HG3  GLU  20           HG2      GLU  20  -1.557  -6.457  -9.396
  159    H    GLU  21           HN       GLU  21  -0.871  -3.695  -8.662
  160    HA   GLU  21           HA       GLU  21  -1.255  -3.386 -11.508
  161    HB2  GLU  21           HB3      GLU  21  -2.723  -2.245  -9.142
  162    HB3  GLU  21           HB2      GLU  21  -3.095  -1.818 -10.807
  163    HG2  GLU  21           HG3      GLU  21  -3.229  -4.584  -9.628
  164    HG3  GLU  21           HG2      GLU  21  -4.608  -3.524  -9.936
  165    H    LEU  22           HN       LEU  22   0.846  -2.120  -9.337
  166    HA   LEU  22           HA       LEU  22   0.821   0.572 -10.464
  167    HB2  LEU  22           HB2      LEU  22   2.787  -0.672  -8.531
  168    HB3  LEU  22           HB1      LEU  22   2.783   0.951  -9.186
  169    HG   LEU  22           HG       LEU  22   0.673  -0.194  -7.350
  170   HD11  LEU  22          HD11      LEU  22   2.970   1.687  -6.856
  171   HD12  LEU  22          HD12      LEU  22   2.733   0.079  -6.152
  172   HD13  LEU  22          HD13      LEU  22   1.655   1.406  -5.726
  173   HD21  LEU  22          HD21      LEU  22   1.097   2.607  -8.392
  174   HD22  LEU  22          HD22      LEU  22  -0.077   2.125  -7.171
  175   HD23  LEU  22          HD23      LEU  22  -0.229   1.521  -8.823
  176    H    GLU  23           HN       GLU  23   2.408   1.429 -11.566
  177    HA   GLU  23           HA       GLU  23   3.742  -0.237 -13.447
  178    HB2  GLU  23           HB3      GLU  23   3.006   2.450 -13.100
  179    HB3  GLU  23           HB2      GLU  23   4.758   2.426 -13.198
  180    HG2  GLU  23           HG3      GLU  23   2.869   1.203 -15.076
  181    HG3  GLU  23           HG2      GLU  23   3.657   2.778 -15.331
  182    H    ALA  24           HN       ALA  24   6.132  -0.137 -13.705
  183    HA   ALA  24           HA       ALA  24   7.495  -0.745 -11.301
  184    HB1  ALA  24           HB1      ALA  24   9.523  -0.779 -12.681
  185    HB2  ALA  24           HB2      ALA  24   8.630  -0.029 -14.007
  186    HB3  ALA  24           HB3      ALA  24   8.202  -1.651 -13.462
  187    H    VAL  25           HN       VAL  25   7.200   2.112 -13.289
  188    HA   VAL  25           HA       VAL  25   9.021   3.676 -11.807
  189    HB   VAL  25           HB       VAL  25   8.345   4.381 -14.060
  190   HG11  VAL  25          HG11      VAL  25   6.067   3.683 -14.147
  191   HG12  VAL  25          HG12      VAL  25   6.147   5.412 -14.488
  192   HG13  VAL  25          HG13      VAL  25   5.610   4.846 -12.904
  193   HG21  VAL  25          HG21      VAL  25   7.529   6.405 -11.982
  194   HG22  VAL  25          HG22      VAL  25   7.949   6.770 -13.657
  195   HG23  VAL  25          HG23      VAL  25   9.165   6.108 -12.560
  196    H    GLU  26           HN       GLU  26   5.660   2.880 -11.321
  197    HA   GLU  26           HA       GLU  26   5.233   4.843  -9.275
  198    HB2  GLU  26           HB3      GLU  26   3.676   2.423 -10.108
  199    HB3  GLU  26           HB2      GLU  26   3.128   3.501  -8.824
  200    HG2  GLU  26           HG3      GLU  26   3.126   5.330 -10.477
  201    HG3  GLU  26           HG2      GLU  26   3.575   4.163 -11.717
  202    H    LEU  27           HN       LEU  27   5.994   1.419  -9.382
  203    HA   LEU  27           HA       LEU  27   6.015   0.933  -6.617
  204    HB2  LEU  27           HB2      LEU  27   7.610  -0.341  -8.851
  205    HB3  LEU  27           HB1      LEU  27   7.553  -0.969  -7.219
  206    HG   LEU  27           HG       LEU  27   5.095  -0.681  -8.954
  207   HD11  LEU  27          HD11      LEU  27   6.848  -3.114  -8.555
  208   HD12  LEU  27          HD12      LEU  27   6.581  -2.225 -10.066
  209   HD13  LEU  27          HD13      LEU  27   5.262  -3.103  -9.321
  210   HD21  LEU  27          HD21      LEU  27   4.135  -2.261  -7.355
  211   HD22  LEU  27          HD22      LEU  27   4.677  -0.788  -6.553
  212   HD23  LEU  27          HD23      LEU  27   5.643  -2.261  -6.442
  213    H    LYS  28           HN       LYS  28   8.432   2.137  -8.818
  214    HA   LYS  28           HA       LYS  28  10.612   2.334  -7.087
  215    HB2  LYS  28           HB2      LYS  28  10.703   2.561  -9.540
  216    HB3  LYS  28           HB1      LYS  28   9.826   4.074  -9.427
  217    HG2  LYS  28           HG2      LYS  28  11.716   5.043  -8.190
  218    HG3  LYS  28           HG1      LYS  28  12.596   3.521  -8.394
  219    HD2  LYS  28           HD2      LYS  28  12.391   3.744 -10.830
  220    HD3  LYS  28           HD1      LYS  28  11.555   5.279 -10.608
  221    HE2  LYS  28           HE2      LYS  28  13.551   6.179  -9.496
  222    HE3  LYS  28           HE1      LYS  28  14.368   4.638  -9.772
  223    HZ1  LYS  28           HZ1      LYS  28  13.336   6.446 -11.874
  224    HZ2  LYS  28           HZ2      LYS  28  14.099   4.975 -12.151
  225    HZ3  LYS  28           HZ3      LYS  28  14.956   6.256 -11.462
  226    H    LYS  29           HN       LYS  29   8.014   4.615  -7.867
  227    HA   LYS  29           HA       LYS  29   8.819   6.800  -6.250
  228    HB2  LYS  29           HB2      LYS  29   6.027   5.877  -6.913
  229    HB3  LYS  29           HB1      LYS  29   6.431   7.427  -6.221
  230    HG2  LYS  29           HG2      LYS  29   7.572   8.065  -8.271
  231    HG3  LYS  29           HG1      LYS  29   7.202   6.482  -8.973
  232    HD2  LYS  29           HD2      LYS  29   4.803   6.916  -8.693
  233    HD3  LYS  29           HD1      LYS  29   5.173   8.491  -7.995
  234    HE2  LYS  29           HE2      LYS  29   6.189   9.165 -10.108
  235    HE3  LYS  29           HE1      LYS  29   5.799   7.586 -10.796
  236    HZ1  LYS  29           HZ1      LYS  29   4.163   9.255 -11.406
  237    HZ2  LYS  29           HZ2      LYS  29   3.833   9.575  -9.792
  238    HZ3  LYS  29           HZ3      LYS  29   3.429   8.076 -10.451
  239    H    PHE  30           HN       PHE  30   6.556   4.197  -5.722
  240    HA   PHE  30           HA       PHE  30   5.707   4.700  -3.188
  241    HB2  PHE  30           HB2      PHE  30   4.401   3.133  -4.130
  242    HB3  PHE  30           HB1      PHE  30   5.713   2.474  -5.075
  243    HD1  PHE  30           HD1      PHE  30   4.084   2.343  -1.685
  244    HD2  PHE  30           HD2      PHE  30   6.663   0.474  -4.519
  245    HE1  PHE  30           HE1      PHE  30   4.016   0.324  -0.405
  246    HE2  PHE  30           HE2      PHE  30   6.618  -1.584  -3.191
  247    HZ   PHE  30           HZ       PHE  30   5.292  -1.673  -1.131
  248    H    LYS  31           HN       LYS  31   8.517   2.701  -4.075
  249    HA   LYS  31           HA       LYS  31   9.073   2.246  -1.281
  250    HB2  LYS  31           HB2      LYS  31  11.071   1.009  -2.003
  251    HB3  LYS  31           HB1      LYS  31   9.640   0.461  -2.845
  252    HG2  LYS  31           HG2      LYS  31  11.454   0.462  -4.401
  253    HG3  LYS  31           HG1      LYS  31  10.394   1.797  -4.835
  254    HD2  LYS  31           HD2      LYS  31  11.926   3.379  -3.803
  255    HD3  LYS  31           HD1      LYS  31  12.932   2.058  -3.219
  256    HE2  LYS  31           HE2      LYS  31  12.421   2.689  -6.129
  257    HE3  LYS  31           HE1      LYS  31  13.846   3.180  -5.221
  258    HZ1  LYS  31           HZ1      LYS  31  13.032   0.353  -5.719
  259    HZ2  LYS  31           HZ2      LYS  31  14.409   0.882  -4.873
  260    HZ3  LYS  31           HZ3      LYS  31  14.256   1.204  -6.499
  261    H    LEU  32           HN       LEU  32  10.150   4.689  -3.479
  262    HA   LEU  32           HA       LEU  32  12.168   5.388  -1.546
  263    HB2  LEU  32           HB2      LEU  32  12.718   7.270  -2.931
  264    HB3  LEU  32           HB1      LEU  32  12.595   5.853  -3.937
  265    HG   LEU  32           HG       LEU  32  10.221   6.785  -4.525
  266   HD11  LEU  32          HD11      LEU  32  10.028   9.207  -4.459
  267   HD12  LEU  32          HD12      LEU  32  11.527   9.309  -3.539
  268   HD13  LEU  32          HD13      LEU  32  10.116   8.525  -2.833
  269   HD21  LEU  32          HD21      LEU  32  12.037   6.607  -6.094
  270   HD22  LEU  32          HD22      LEU  32  12.774   8.053  -5.415
  271   HD23  LEU  32          HD23      LEU  32  11.244   8.182  -6.295
  272    H    TYR  33           HN       TYR  33   8.923   6.192  -2.241
  273    HA   TYR  33           HA       TYR  33   8.845   8.462  -0.639
  274    HB2  TYR  33           HB2      TYR  33   7.046   7.876  -2.237
  275    HB3  TYR  33           HB1      TYR  33   6.585   6.528  -1.199
  276    HD1  TYR  33           HD1      TYR  33   6.674  10.160  -1.533
  277    HD2  TYR  33           HD2      TYR  33   5.385   6.903   0.859
  278    HE1  TYR  33           HE1      TYR  33   5.259  11.690  -0.213
  279    HE2  TYR  33           HE2      TYR  33   3.973   8.381   2.170
  280    HH   TYR  33           HH       TYR  33   3.986  10.886   2.727
  281    H    LEU  34           HN       LEU  34   7.536   5.229   0.179
  282    HA   LEU  34           HA       LEU  34   7.540   6.010   2.936
  283    HB2  LEU  34           HB2      LEU  34   6.713   3.707   3.376
  284    HB3  LEU  34           HB1      LEU  34   5.713   4.699   2.340
  285    HG   LEU  34           HG       LEU  34   6.689   3.428   0.383
  286   HD11  LEU  34          HD11      LEU  34   8.660   2.482   1.442
  287   HD12  LEU  34          HD12      LEU  34   7.608   1.210   0.815
  288   HD13  LEU  34          HD13      LEU  34   7.641   1.558   2.543
  289   HD21  LEU  34          HD21      LEU  34   5.208   1.567   0.690
  290   HD22  LEU  34          HD22      LEU  34   4.474   3.076   1.266
  291   HD23  LEU  34          HD23      LEU  34   5.119   1.902   2.421
  292    H    GLY  35           HN       GLY  35   9.902   4.733   1.012
  293    HA2  GLY  35           HA3      GLY  35  11.129   3.343   3.166
  294    HA3  GLY  35           HA2      GLY  35  11.835   3.564   1.553
  295    H    THR  36           HN       THR  36  11.198   6.478   1.795
  296    HA   THR  36           HA       THR  36  13.440   7.176   3.628
  297    HB   THR  36           HB       THR  36  13.951   9.132   2.276
  298    HG1  THR  36           HG1      THR  36  11.886   8.429   0.465
  299   HG21  THR  36          HG21      THR  36  14.860   6.993   1.432
  300   HG22  THR  36          HG22      THR  36  14.511   8.116   0.109
  301   HG23  THR  36          HG23      THR  36  13.418   6.790   0.434
  302    H    ALA  37           HN       ALA  37  10.174   7.449   3.230
  303    HA   ALA  37           HA       ALA  37   9.335   9.952   3.855
  304    HB1  ALA  37           HB1      ALA  37   8.071   7.442   4.879
  305    HB2  ALA  37           HB2      ALA  37   7.786   8.207   3.300
  306    HB3  ALA  37           HB3      ALA  37   7.334   9.038   4.798
  307    H    THR  38           HN       THR  38   9.496  11.319   5.364
  308    HA   THR  38           HA       THR  38  10.619  10.509   7.850
  309    HB   THR  38           HB       THR  38  10.523  13.001   8.288
  310    HG1  THR  38           HG1      THR  38  10.440  13.506   5.590
  311   HG21  THR  38          HG21      THR  38  12.485  13.446   6.849
  312   HG22  THR  38          HG22      THR  38  12.117  11.995   5.920
  313   HG23  THR  38          HG23      THR  38  12.589  11.861   7.613
  314    H    GLU  39           HN       GLU  39   7.526  10.870   6.613
  315    HA   GLU  39           HA       GLU  39   6.229  11.724   9.021
  316    HB2  GLU  39           HB3      GLU  39   4.133  11.147   7.940
  317    HB3  GLU  39           HB2      GLU  39   5.171  11.951   6.778
  318    HG2  GLU  39           HG3      GLU  39   5.781   9.709   5.880
  319    HG3  GLU  39           HG2      GLU  39   4.566   9.013   6.949
  320    H    LEU  40           HN       LEU  40   7.538   8.814   7.935
  321    HA   LEU  40           HA       LEU  40   6.262   7.405  10.132
  322    HB2  LEU  40           HB2      LEU  40   7.111   5.328   9.103
  323    HB3  LEU  40           HB1      LEU  40   5.907   6.257   8.185
  324    HG   LEU  40           HG       LEU  40   7.948   7.084   6.880
  325   HD11  LEU  40          HD11      LEU  40   9.631   6.236   8.372
  326   HD12  LEU  40          HD12      LEU  40   9.777   5.542   6.745
  327   HD13  LEU  40          HD13      LEU  40   9.091   4.578   8.063
  328   HD21  LEU  40          HD21      LEU  40   6.955   4.270   6.669
  329   HD22  LEU  40          HD22      LEU  40   7.810   5.145   5.397
  330   HD23  LEU  40          HD23      LEU  40   6.231   5.712   5.959
  331    H    GLY  41           HN       GLY  41   9.126   8.573   9.005
  332    HA2  GLY  41           HA3      GLY  41  10.293   9.234  11.288
  333    HA3  GLY  41           HA2      GLY  41  10.598   7.505  11.295
  334    H    GLU  42           HN       GLU  42  12.305   6.839  10.387
  335    HA   GLU  42           HA       GLU  42  13.984   8.674   8.847
  336    HB2  GLU  42           HB3      GLU  42  15.059   7.680  10.759
  337    HB3  GLU  42           HB2      GLU  42  14.539   6.075  10.287
  338    HG2  GLU  42           HG3      GLU  42  16.034   6.156   8.363
  339    HG3  GLU  42           HG2      GLU  42  16.534   7.785   8.819
  340    H    GLY  43           HN       GLY  43  12.392   5.575   8.745
  341    HA2  GLY  43           HA3      GLY  43  11.636   5.070   6.379
  342    HA3  GLY  43           HA2      GLY  43  13.355   5.180   6.021
  343    H    LYS  44           HN       LYS  44  10.975   3.089   6.694
  344    HA   LYS  44           HA       LYS  44  12.582   1.296   8.292
  345    HB2  LYS  44           HB2      LYS  44   9.783   1.131   7.252
  346    HB3  LYS  44           HB1      LYS  44  10.611  -0.335   7.727
  347    HG2  LYS  44           HG2      LYS  44   9.335   0.291   9.590
  348    HG3  LYS  44           HG1      LYS  44  10.977   0.769   9.984
  349    HD2  LYS  44           HD2      LYS  44  10.414   3.101   9.406
  350    HD3  LYS  44           HD1      LYS  44   8.764   2.591   9.022
  351    HE2  LYS  44           HE2      LYS  44   8.586   1.688  11.361
  352    HE3  LYS  44           HE1      LYS  44  10.150   2.425  11.688
  353    HZ1  LYS  44           HZ1      LYS  44   7.697   3.911  10.903
  354    HZ2  LYS  44           HZ2      LYS  44   9.171   4.621  11.372
  355    HZ3  LYS  44           HZ3      LYS  44   8.278   3.737  12.450
  356    H    ILE  45           HN       ILE  45  12.533   2.019   5.073
  357    HA   ILE  45           HA       ILE  45  13.114  -0.735   4.309
  358    HB   ILE  45           HB       ILE  45  12.552   1.622   2.501
  359   HG12  ILE  45          HG12      ILE  45  10.549   0.861   3.793
  360   HG13  ILE  45          HG11      ILE  45  10.388   0.606   2.059
  361   HG21  ILE  45          HG21      ILE  45  12.949  -1.314   1.935
  362   HG22  ILE  45          HG22      ILE  45  14.016  -0.011   1.471
  363   HG23  ILE  45          HG23      ILE  45  12.398  -0.129   0.748
  364   HD11  ILE  45          HD11      ILE  45  10.992  -1.711   2.362
  365   HD12  ILE  45          HD12      ILE  45   9.528  -1.291   3.272
  366   HD13  ILE  45          HD13      ILE  45  11.082  -1.477   4.112
  367    HA   PRO  46           HA       PRO  46  17.392   0.578   4.059
  368    HB2  PRO  46           HB2      PRO  46  18.312  -1.801   3.052
  369    HB3  PRO  46           HB1      PRO  46  18.094  -1.454   4.770
  370    HG2  PRO  46           HG2      PRO  46  16.330  -2.958   2.903
  371    HG3  PRO  46           HG1      PRO  46  16.698  -3.260   4.630
  372    HD2  PRO  46           HD2      PRO  46  14.408  -2.149   3.668
  373    HD3  PRO  46           HD1      PRO  46  15.039  -1.813   5.287
  374    H    TRP  47           HN       TRP  47  19.027   0.549   2.407
  375    HA   TRP  47           HA       TRP  47  18.160   1.962   0.180
  376    HB2  TRP  47           HB2      TRP  47  20.891   0.850   0.801
  377    HB3  TRP  47           HB1      TRP  47  20.530   2.158  -0.320
  378    HD1  TRP  47           HD1      TRP  47  20.279   4.566   0.684
  379    HE1  TRP  47           HE1      TRP  47  20.504   5.570   3.041
  380    HE3  TRP  47           HE3      TRP  47  20.475   0.236   3.423
  381    HZ2  TRP  47           HZ2      TRP  47  20.734   4.658   5.702
  382    HZ3  TRP  47           HZ3      TRP  47  20.684   0.385   5.848
  383    HH2  TRP  47           HH2      TRP  47  20.820   2.560   6.978
  384    H    GLY  48           HN       GLY  48  18.840  -1.464   0.448
  385    HA2  GLY  48           HA3      GLY  48  18.561  -1.635  -2.474
  386    HA3  GLY  48           HA2      GLY  48  19.944  -2.400  -1.719
  387    H    SER  49           HN       SER  49  16.619  -2.348  -0.461
  388    HA   SER  49           HA       SER  49  16.590  -5.272  -0.818
  389    HB2  SER  49           HB2      SER  49  14.873  -5.168   0.995
  390    HB3  SER  49           HB1      SER  49  16.463  -4.566   1.486
  391    HG   SER  49           HG       SER  49  14.120  -3.299   1.459
  392    H    MET  50           HN       MET  50  15.545  -2.601  -2.306
  393    HA   MET  50           HA       MET  50  13.037  -3.803  -3.165
  394    HB2  MET  50           HB2      MET  50  12.073  -1.404  -3.076
  395    HB3  MET  50           HB1      MET  50  12.132  -2.367  -1.614
  396    HG2  MET  50           HG2      MET  50  12.755  -0.043  -1.243
  397    HG3  MET  50           HG1      MET  50  14.035  -1.149  -0.821
  398    HE1  MET  50           HE1      MET  50  15.940   2.087  -2.071
  399    HE2  MET  50           HE2      MET  50  15.732   0.951  -0.741
  400    HE3  MET  50           HE3      MET  50  14.411   2.028  -1.191
  401    H    GLU  51           HN       GLU  51  15.673  -3.471  -4.426
  402    HA   GLU  51           HA       GLU  51  15.210  -1.484  -6.489
  403    HB2  GLU  51           HB3      GLU  51  17.365  -3.544  -6.168
  404    HB3  GLU  51           HB2      GLU  51  17.335  -2.330  -7.428
  405    HG2  GLU  51           HG3      GLU  51  17.423  -0.644  -5.585
  406    HG3  GLU  51           HG2      GLU  51  17.720  -2.002  -4.485
  407    H    LYS  52           HN       LYS  52  15.728  -4.988  -6.329
  408    HA   LYS  52           HA       LYS  52  14.424  -5.237  -8.943
  409    HB2  LYS  52           HB2      LYS  52  16.207  -7.215  -7.487
  410    HB3  LYS  52           HB1      LYS  52  15.436  -7.522  -9.031
  411    HG2  LYS  52           HG2      LYS  52  17.584  -6.955  -9.668
  412    HG3  LYS  52           HG1      LYS  52  16.751  -5.409  -9.804
  413    HD2  LYS  52           HD2      LYS  52  17.583  -4.823  -7.554
  414    HD3  LYS  52           HD1      LYS  52  18.519  -6.320  -7.528
  415    HE2  LYS  52           HE2      LYS  52  19.617  -5.544  -9.659
  416    HE3  LYS  52           HE1      LYS  52  18.796  -4.008  -9.432
  417    HZ1  LYS  52           HZ1      LYS  52  21.034  -3.880  -8.608
  418    HZ2  LYS  52           HZ2      LYS  52  20.824  -5.205  -7.634
  419    HZ3  LYS  52           HZ3      LYS  52  20.018  -3.768  -7.260
  420    H    ALA  53           HN       ALA  53  13.219  -4.929  -6.270
  421    HA   ALA  53           HA       ALA  53  11.898  -7.476  -5.808
  422    HB1  ALA  53           HB1      ALA  53  12.648  -6.168  -3.870
  423    HB2  ALA  53           HB2      ALA  53  10.896  -6.372  -3.870
  424    HB3  ALA  53           HB3      ALA  53  11.603  -4.837  -4.372
  425    H    GLY  54           HN       GLY  54   9.863  -7.929  -6.473
  426    HA2  GLY  54           HA3      GLY  54   8.513  -5.860  -7.995
  427    HA3  GLY  54           HA2      GLY  54   8.269  -7.599  -8.145
  428    HA   PRO  55           HA       PRO  55   4.697  -5.574  -5.860
  429    HB2  PRO  55           HB2      PRO  55   3.465  -7.997  -7.072
  430    HB3  PRO  55           HB1      PRO  55   2.842  -6.346  -6.979
  431    HG2  PRO  55           HG2      PRO  55   3.829  -7.265  -9.263
  432    HG3  PRO  55           HG1      PRO  55   4.170  -5.607  -8.741
  433    HD2  PRO  55           HD2      PRO  55   5.993  -7.996  -8.660
  434    HD3  PRO  55           HD1      PRO  55   6.344  -6.301  -8.999
  435    H    LEU  56           HN       LEU  56   5.452  -9.028  -6.036
  436    HA   LEU  56           HA       LEU  56   4.082  -9.627  -3.556
  437    HB2  LEU  56           HB2      LEU  56   5.967 -11.309  -5.221
  438    HB3  LEU  56           HB1      LEU  56   5.284 -11.864  -3.717
  439    HG   LEU  56           HG       LEU  56   3.008 -11.658  -4.736
  440   HD11  LEU  56          HD11      LEU  56   3.457 -10.041  -6.466
  441   HD12  LEU  56          HD12      LEU  56   2.808 -11.527  -7.165
  442   HD13  LEU  56          HD13      LEU  56   4.531 -11.175  -7.282
  443   HD21  LEU  56          HD21      LEU  56   3.204 -13.671  -6.108
  444   HD22  LEU  56          HD22      LEU  56   4.139 -13.796  -4.619
  445   HD23  LEU  56          HD23      LEU  56   4.954 -13.469  -6.150
  446    H    GLU  57           HN       GLU  57   7.414  -9.257  -4.502
  447    HA   GLU  57           HA       GLU  57   8.554  -9.812  -1.985
  448    HB2  GLU  57           HB3      GLU  57   9.534  -8.149  -4.281
  449    HB3  GLU  57           HB2      GLU  57  10.515  -8.587  -2.888
  450    HG2  GLU  57           HG3      GLU  57  10.482 -10.849  -3.438
  451    HG3  GLU  57           HG2      GLU  57   9.162 -10.641  -4.589
  452    H    MET  58           HN       MET  58   7.455  -6.846  -3.484
  453    HA   MET  58           HA       MET  58   8.227  -5.058  -1.441
  454    HB2  MET  58           HB2      MET  58   6.032  -4.946  -3.489
  455    HB3  MET  58           HB1      MET  58   6.386  -3.597  -2.423
  456    HG2  MET  58           HG2      MET  58   8.496  -4.853  -4.074
  457    HG3  MET  58           HG1      MET  58   7.459  -3.659  -4.851
  458    HE1  MET  58           HE1      MET  58   9.180  -1.932  -5.479
  459    HE2  MET  58           HE2      MET  58  10.369  -3.187  -5.149
  460    HE3  MET  58           HE3      MET  58  10.619  -1.555  -4.535
  461    H    ALA  59           HN       ALA  59   5.254  -6.891  -1.986
  462    HA   ALA  59           HA       ALA  59   3.796  -5.854   0.165
  463    HB1  ALA  59           HB1      ALA  59   2.414  -7.868  -0.030
  464    HB2  ALA  59           HB2      ALA  59   3.659  -8.633  -1.015
  465    HB3  ALA  59           HB3      ALA  59   2.799  -7.221  -1.625
  466    H    GLN  60           HN       GLN  60   5.908  -8.660  -0.047
  467    HA   GLN  60           HA       GLN  60   5.623  -9.418   2.664
  468    HB2  GLN  60           HB2      GLN  60   7.865 -10.049   0.746
  469    HB3  GLN  60           HB1      GLN  60   7.540 -10.860   2.277
  470    HG2  GLN  60           HG2      GLN  60   5.406 -11.671   1.408
  471    HG3  GLN  60           HG1      GLN  60   5.704 -10.813  -0.093
  472   HE21  GLN  60          HE21      GLN  60   8.265 -12.457   1.624
  473   HE22  GLN  60          HE22      GLN  60   8.508 -13.682   0.461
  474    H    LEU  61           HN       LEU  61   7.776  -7.284   0.967
  475    HA   LEU  61           HA       LEU  61   9.768  -6.804   2.864
  476    HB2  LEU  61           HB2      LEU  61   9.568  -6.036   0.420
  477    HB3  LEU  61           HB1      LEU  61   8.526  -4.769   1.020
  478    HG   LEU  61           HG       LEU  61  10.458  -3.969   2.413
  479   HD11  LEU  61          HD11      LEU  61  11.937  -5.895   0.655
  480   HD12  LEU  61          HD12      LEU  61  11.752  -6.049   2.406
  481   HD13  LEU  61          HD13      LEU  61  12.688  -4.711   1.721
  482   HD21  LEU  61          HD21      LEU  61  10.792  -4.041  -0.582
  483   HD22  LEU  61          HD22      LEU  61  11.572  -2.901   0.512
  484   HD23  LEU  61          HD23      LEU  61   9.815  -2.888   0.330
  485    H    LEU  62           HN       LEU  62   6.851  -4.898   2.120
  486    HA   LEU  62           HA       LEU  62   6.939  -3.160   4.251
  487    HB2  LEU  62           HB2      LEU  62   4.664  -4.178   2.587
  488    HB3  LEU  62           HB1      LEU  62   4.386  -3.096   3.910
  489    HG   LEU  62           HG       LEU  62   5.427  -1.230   2.729
  490   HD11  LEU  62          HD11      LEU  62   7.371  -2.404   1.931
  491   HD12  LEU  62          HD12      LEU  62   6.570  -1.441   0.675
  492   HD13  LEU  62          HD13      LEU  62   6.370  -3.206   0.725
  493   HD21  LEU  62          HD21      LEU  62   3.901  -2.939   0.818
  494   HD22  LEU  62          HD22      LEU  62   4.149  -1.194   0.716
  495   HD23  LEU  62          HD23      LEU  62   3.198  -1.877   2.037
  496    H    ILE  63           HN       ILE  63   5.302  -6.295   3.957
  497    HA   ILE  63           HA       ILE  63   4.001  -6.197   6.452
  498    HB   ILE  63           HB       ILE  63   3.775  -7.852   4.320
  499   HG12  ILE  63          HG12      ILE  63   2.135  -7.518   6.142
  500   HG13  ILE  63          HG11      ILE  63   2.159  -9.161   5.532
  501   HG21  ILE  63          HG21      ILE  63   5.223  -9.579   6.313
  502   HG22  ILE  63          HG22      ILE  63   5.829  -9.088   4.738
  503   HG23  ILE  63          HG23      ILE  63   4.417 -10.146   4.850
  504   HD11  ILE  63          HD11      ILE  63   3.478  -9.835   7.505
  505   HD12  ILE  63          HD12      ILE  63   1.917  -9.131   7.942
  506   HD13  ILE  63          HD13      ILE  63   3.393  -8.175   8.098
  507    H    THR  64           HN       THR  64   7.249  -7.118   5.627
  508    HA   THR  64           HA       THR  64   7.791  -8.347   8.164
  509    HB   THR  64           HB       THR  64   9.718  -7.419   6.009
  510    HG1  THR  64           HG1      THR  64   8.362  -9.022   5.229
  511   HG21  THR  64          HG21      THR  64  10.829  -7.712   8.194
  512   HG22  THR  64          HG22      THR  64  11.316  -8.976   7.067
  513   HG23  THR  64          HG23      THR  64  10.135  -9.329   8.326
  514    H    HIS  65           HN       HIS  65   8.418  -5.196   6.689
  515    HA   HIS  65           HA       HIS  65   9.894  -4.353   9.024
  516    HB2  HIS  65           HB2      HIS  65   9.158  -2.759   6.561
  517    HB3  HIS  65           HB1      HIS  65  10.159  -2.192   7.896
  518    HD1  HIS  65           HD1      HIS  65  12.537  -3.375   8.165
  519    HD2  HIS  65           HD2      HIS  65  10.430  -4.273   4.712
  520    HE1  HIS  65           HE1      HIS  65  14.193  -4.476   6.604
  521    H    PHE  66           HN       PHE  66   6.890  -3.290   7.469
  522    HA   PHE  66           HA       PHE  66   6.210  -1.630   9.703
  523    HB2  PHE  66           HB2      PHE  66   4.657  -2.375   7.221
  524    HB3  PHE  66           HB1      PHE  66   4.208  -1.118   8.384
  525    HD1  PHE  66           HD1      PHE  66   5.698   0.827   8.677
  526    HD2  PHE  66           HD2      PHE  66   6.208  -1.994   5.567
  527    HE1  PHE  66           HE1      PHE  66   7.139   2.416   7.484
  528    HE2  PHE  66           HE2      PHE  66   7.640  -0.422   4.347
  529    HZ   PHE  66           HZ       PHE  66   8.116   1.777   5.315
  530    H    GLY  67           HN       GLY  67   4.434  -4.332   8.177
  531    HA2  GLY  67           HA3      GLY  67   3.943  -6.080  10.063
  532    HA3  GLY  67           HA2      GLY  67   3.031  -4.714  10.707
  533    HA   PRO  68           HA       PRO  68   0.571  -7.297   7.577
  534    HB2  PRO  68           HB2      PRO  68  -1.661  -7.581   9.171
  535    HB3  PRO  68           HB1      PRO  68  -0.365  -8.771   9.039
  536    HG2  PRO  68           HG2      PRO  68  -0.830  -6.702  11.142
  537    HG3  PRO  68           HG1      PRO  68  -0.237  -8.363  11.313
  538    HD2  PRO  68           HD2      PRO  68   1.404  -6.221  11.417
  539    HD3  PRO  68           HD1      PRO  68   1.931  -7.772  10.737
  540    H    GLU  69           HN       GLU  69  -1.128  -5.087   9.824
  541    HA   GLU  69           HA       GLU  69  -2.709  -4.115   7.615
  542    HB2  GLU  69           HB3      GLU  69  -2.640  -3.282  10.509
  543    HB3  GLU  69           HB2      GLU  69  -3.792  -2.697   9.324
  544    HG2  GLU  69           HG3      GLU  69  -4.647  -4.971   9.039
  545    HG3  GLU  69           HG2      GLU  69  -3.492  -5.547  10.244
  546    H    GLU  70           HN       GLU  70   0.051  -3.224   9.415
  547    HA   GLU  70           HA       GLU  70   0.087  -0.457   8.821
  548    HB2  GLU  70           HB3      GLU  70   1.437  -1.828  10.570
  549    HB3  GLU  70           HB2      GLU  70   2.570  -2.092   9.256
  550    HG2  GLU  70           HG3      GLU  70   3.313  -0.241  10.597
  551    HG3  GLU  70           HG2      GLU  70   2.792   0.366   9.022
  552    H    ALA  71           HN       ALA  71   1.549  -3.300   7.236
  553    HA   ALA  71           HA       ALA  71   2.901  -2.063   5.122
  554    HB1  ALA  71           HB1      ALA  71   1.412  -4.682   5.156
  555    HB2  ALA  71           HB2      ALA  71   3.086  -4.434   5.643
  556    HB3  ALA  71           HB3      ALA  71   2.612  -4.198   3.961
  557    H    TRP  72           HN       TRP  72  -0.423  -3.283   5.270
  558    HA   TRP  72           HA       TRP  72  -1.135  -2.511   2.682
  559    HB2  TRP  72           HB2      TRP  72  -2.530  -4.122   3.774
  560    HB3  TRP  72           HB1      TRP  72  -2.829  -3.040   5.129
  561    HD1  TRP  72           HD1      TRP  72  -5.328  -2.463   5.026
  562    HE1  TRP  72           HE1      TRP  72  -6.937  -1.583   3.237
  563    HE3  TRP  72           HE3      TRP  72  -2.219  -2.624   1.015
  564    HZ2  TRP  72           HZ2      TRP  72  -6.887  -1.039   0.478
  565    HZ3  TRP  72           HZ3      TRP  72  -3.070  -1.918  -1.200
  566    HH2  TRP  72           HH2      TRP  72  -5.362  -1.138  -1.453
  567    H    ARG  73           HN       ARG  73  -1.558  -0.882   5.755
  568    HA   ARG  73           HA       ARG  73  -2.878   1.353   4.901
  569    HB2  ARG  73           HB2      ARG  73  -2.586   0.879   7.230
  570    HB3  ARG  73           HB1      ARG  73  -0.840   0.997   7.096
  571    HG2  ARG  73           HG2      ARG  73  -1.143   3.426   6.584
  572    HG3  ARG  73           HG1      ARG  73  -2.861   3.222   6.955
  573    HD2  ARG  73           HD2      ARG  73  -2.285   2.410   9.183
  574    HD3  ARG  73           HD1      ARG  73  -0.573   2.610   8.817
  575    HE   ARG  73           HE       ARG  73  -2.143   4.981   8.509
  576   HH11  ARG  73          HH11      ARG  73   0.001   3.119  10.630
  577   HH12  ARG  73          HH12      ARG  73   0.074   4.321  11.837
  578   HH21  ARG  73          HH21      ARG  73  -1.973   6.670  10.155
  579   HH22  ARG  73          HH22      ARG  73  -1.058   6.362  11.564
  580    H    LEU  74           HN       LEU  74   0.585   0.798   5.260
  581    HA   LEU  74           HA       LEU  74   1.571   3.213   4.377
  582    HB2  LEU  74           HB2      LEU  74   2.612   0.499   4.702
  583    HB3  LEU  74           HB1      LEU  74   3.463   1.453   3.512
  584    HG   LEU  74           HG       LEU  74   4.502   1.496   5.770
  585   HD11  LEU  74          HD11      LEU  74   4.920   3.260   4.213
  586   HD12  LEU  74          HD12      LEU  74   4.868   3.889   5.853
  587   HD13  LEU  74          HD13      LEU  74   3.497   4.146   4.762
  588   HD21  LEU  74          HD21      LEU  74   3.486   2.815   7.544
  589   HD22  LEU  74          HD22      LEU  74   2.455   1.443   7.127
  590   HD23  LEU  74          HD23      LEU  74   2.043   3.062   6.563
  591    H    ALA  75           HN       ALA  75   0.830   0.335   2.418
  592    HA   ALA  75           HA       ALA  75   1.817   1.472   0.020
  593    HB1  ALA  75           HB1      ALA  75   0.604  -0.253  -1.150
  594    HB2  ALA  75           HB2      ALA  75  -0.227  -0.702   0.345
  595    HB3  ALA  75           HB3      ALA  75   1.527  -0.901   0.198
  596    H    LEU  76           HN       LEU  76  -1.529   1.247   1.274
  597    HA   LEU  76           HA       LEU  76  -2.588   2.548  -0.999
  598    HB2  LEU  76           HB2      LEU  76  -4.700   2.629   0.110
  599    HB3  LEU  76           HB1      LEU  76  -3.949   1.131   0.574
  600    HG   LEU  76           HG       LEU  76  -3.264   2.527   2.724
  601   HD11  LEU  76          HD11      LEU  76  -5.035   4.108   3.374
  602   HD12  LEU  76          HD12      LEU  76  -5.730   3.971   1.754
  603   HD13  LEU  76          HD13      LEU  76  -4.125   4.660   1.966
  604   HD21  LEU  76          HD21      LEU  76  -5.346   1.752   3.804
  605   HD22  LEU  76          HD22      LEU  76  -4.596   0.534   2.777
  606   HD23  LEU  76          HD23      LEU  76  -6.013   1.405   2.201
  607    H    SER  77           HN       SER  77  -1.425   3.693   2.053
  608    HA   SER  77           HA       SER  77  -2.184   6.401   1.617
  609    HB2  SER  77           HB2      SER  77  -0.559   4.922   3.614
  610    HB3  SER  77           HB1      SER  77  -0.793   6.702   3.760
  611    HG   SER  77           HG       SER  77  -2.431   4.488   4.059
  612    H    THR  78           HN       THR  78   0.087   4.602   0.147
  613    HA   THR  78           HA       THR  78   1.761   6.941  -0.294
  614    HB   THR  78           HB       THR  78   2.405   4.008  -0.786
  615    HG1  THR  78           HG1      THR  78   2.618   4.462   1.334
  616   HG21  THR  78          HG21      THR  78   4.677   4.809  -1.335
  617   HG22  THR  78          HG22      THR  78   4.099   6.474  -1.213
  618   HG23  THR  78          HG23      THR  78   3.478   5.417  -2.481
  619    H    PHE  79           HN       PHE  79  -0.432   4.628  -1.727
  620    HA   PHE  79           HA       PHE  79  -0.020   5.005  -4.435
  621    HB2  PHE  79           HB2      PHE  79  -2.632   4.654  -2.944
  622    HB3  PHE  79           HB1      PHE  79  -2.528   4.623  -4.701
  623    HD1  PHE  79           HD1      PHE  79   0.238   2.992  -4.433
  624    HD2  PHE  79           HD2      PHE  79  -3.718   2.541  -2.939
  625    HE1  PHE  79           HE1      PHE  79   0.563   0.574  -4.292
  626    HE2  PHE  79           HE2      PHE  79  -3.390   0.114  -2.787
  627    HZ   PHE  79           HZ       PHE  79  -1.242  -0.876  -3.465
  628    H    GLU  80           HN       GLU  80  -2.185   6.804  -2.300
  629    HA   GLU  80           HA       GLU  80  -3.109   8.786  -4.001
  630    HB2  GLU  80           HB3      GLU  80  -3.324  10.149  -1.840
  631    HB3  GLU  80           HB2      GLU  80  -4.112   8.573  -1.857
  632    HG2  GLU  80           HG3      GLU  80  -2.376   7.588  -0.662
  633    HG3  GLU  80           HG2      GLU  80  -1.372   9.039  -0.785
  634    H    ARG  81           HN       ARG  81  -0.060   8.562  -2.346
  635    HA   ARG  81           HA       ARG  81   0.721  11.310  -2.621
  636    HB2  ARG  81           HB2      ARG  81   2.458   8.941  -1.994
  637    HB3  ARG  81           HB1      ARG  81   2.791  10.631  -1.638
  638    HG2  ARG  81           HG2      ARG  81   0.550   9.021  -0.449
  639    HG3  ARG  81           HG1      ARG  81   2.110   9.356   0.291
  640    HD2  ARG  81           HD2      ARG  81   1.667  11.596   0.569
  641    HD3  ARG  81           HD1      ARG  81   0.347  11.592  -0.610
  642    HE   ARG  81           HE       ARG  81  -1.083  10.701   0.975
  643   HH11  ARG  81          HH11      ARG  81   2.139  10.987   2.426
  644   HH12  ARG  81          HH12      ARG  81   1.611  10.695   4.010
  645   HH21  ARG  81          HH21      ARG  81  -1.813  10.342   3.032
  646   HH22  ARG  81          HH22      ARG  81  -0.742  10.339   4.380
  647    H    ILE  82           HN       ILE  82   1.381   8.263  -4.232
  648    HA   ILE  82           HA       ILE  82   3.330   9.487  -5.986
  649    HB   ILE  82           HB       ILE  82   3.739   7.241  -6.865
  650   HG12  ILE  82          HG12      ILE  82   1.614   6.274  -4.939
  651   HG13  ILE  82          HG11      ILE  82   1.355   6.410  -6.684
  652   HG21  ILE  82          HG21      ILE  82   4.571   6.215  -4.791
  653   HG22  ILE  82          HG22      ILE  82   3.562   7.322  -3.855
  654   HG23  ILE  82          HG23      ILE  82   4.881   7.953  -4.833
  655   HD11  ILE  82          HD11      ILE  82   3.325   4.627  -5.271
  656   HD12  ILE  82          HD12      ILE  82   3.128   4.747  -7.017
  657   HD13  ILE  82          HD13      ILE  82   1.810   4.125  -6.022
  658    H    ASN  83           HN       ASN  83   0.411  10.083  -6.039
  659    HA   ASN  83           HA       ASN  83  -1.091  10.833  -7.507
  660    HB2  ASN  83           HB3      ASN  83   0.999  10.193  -9.600
  661    HB3  ASN  83           HB2      ASN  83  -0.508  11.053  -9.896
  662   HD21  ASN  83          HD21      ASN  83  -0.421  12.594  -7.394
  663   HD22  ASN  83          HD22      ASN  83   0.825  13.743  -7.621
  664    H    ARG  84           HN       ARG  84  -0.910   8.072  -6.713
  665    HA   ARG  84           HA       ARG  84  -2.574   7.008  -8.824
  666    HB2  ARG  84           HB2      ARG  84  -0.627   5.665  -8.465
  667    HB3  ARG  84           HB1      ARG  84  -0.904   5.597  -6.737
  668    HG2  ARG  84           HG2      ARG  84  -1.562   3.485  -7.719
  669    HG3  ARG  84           HG1      ARG  84  -2.978   4.334  -7.105
  670    HD2  ARG  84           HD2      ARG  84  -3.705   3.577  -9.123
  671    HD3  ARG  84           HD1      ARG  84  -3.208   5.214  -9.474
  672    HE   ARG  84           HE       ARG  84  -0.973   4.070 -10.163
  673   HH11  ARG  84          HH11      ARG  84  -4.294   2.808 -10.923
  674   HH12  ARG  84          HH12      ARG  84  -3.702   1.874 -12.198
  675   HH21  ARG  84          HH21      ARG  84  -0.289   2.688 -11.881
  676   HH22  ARG  84          HH22      ARG  84  -1.432   1.768 -12.758
  677    H    LYS  85           HN       LYS  85  -4.156   8.466  -7.845
  678    HA   LYS  85           HA       LYS  85  -5.173   7.750  -5.256
  679    HB2  LYS  85           HB2      LYS  85  -5.147  10.046  -5.785
  680    HB3  LYS  85           HB1      LYS  85  -5.980   9.818  -7.321
  681    HG2  LYS  85           HG2      LYS  85  -8.036   9.296  -6.087
  682    HG3  LYS  85           HG1      LYS  85  -7.141   9.449  -4.568
  683    HD2  LYS  85           HD2      LYS  85  -6.715  11.777  -4.981
  684    HD3  LYS  85           HD1      LYS  85  -7.446  11.673  -6.581
  685    HE2  LYS  85           HE2      LYS  85  -8.909  11.160  -3.990
  686    HE3  LYS  85           HE1      LYS  85  -8.912  12.699  -4.845
  687    HZ1  LYS  85           HZ1      LYS  85  -9.921  11.590  -6.741
  688    HZ2  LYS  85           HZ2      LYS  85 -10.873  11.417  -5.386
  689    HZ3  LYS  85           HZ3      LYS  85  -9.965  10.114  -5.936
  690    H    ASP  86           HN       ASP  86  -5.555   7.008  -8.478
  691    HA   ASP  86           HA       ASP  86  -8.028   5.953  -8.891
  692    HB2  ASP  86           HB2      ASP  86  -6.533   6.084 -10.689
  693    HB3  ASP  86           HB1      ASP  86  -5.282   5.207  -9.823
  694    H    LEU  87           HN       LEU  87  -5.195   4.169  -7.663
  695    HA   LEU  87           HA       LEU  87  -6.866   1.908  -6.964
  696    HB2  LEU  87           HB2      LEU  87  -3.916   2.379  -6.532
  697    HB3  LEU  87           HB1      LEU  87  -4.742   0.929  -6.027
  698    HG   LEU  87           HG       LEU  87  -4.464   1.840  -8.898
  699   HD11  LEU  87          HD11      LEU  87  -3.015  -0.316  -7.374
  700   HD12  LEU  87          HD12      LEU  87  -2.326   1.216  -7.903
  701   HD13  LEU  87          HD13      LEU  87  -2.858   0.031  -9.099
  702   HD21  LEU  87          HD21      LEU  87  -6.443   0.502  -8.550
  703   HD22  LEU  87          HD22      LEU  87  -5.507  -0.714  -7.686
  704   HD23  LEU  87          HD23      LEU  87  -5.223  -0.434  -9.408
  705    H    TRP  88           HN       TRP  88  -5.742   4.706  -5.475
  706    HA   TRP  88           HA       TRP  88  -5.586   3.887  -2.783
  707    HB2  TRP  88           HB2      TRP  88  -4.608   5.938  -3.585
  708    HB3  TRP  88           HB1      TRP  88  -6.160   6.555  -4.057
  709    HD1  TRP  88           HD1      TRP  88  -4.406   5.500  -0.803
  710    HE1  TRP  88           HE1      TRP  88  -5.223   7.017   1.095
  711    HE3  TRP  88           HE3      TRP  88  -7.905   8.147  -3.354
  712    HZ2  TRP  88           HZ2      TRP  88  -7.132   9.048   1.476
  713    HZ3  TRP  88           HZ3      TRP  88  -9.198   9.867  -2.159
  714    HH2  TRP  88           HH2      TRP  88  -8.816  10.303   0.209
  715    H    GLU  89           HN       GLU  89  -8.204   5.403  -4.626
  716    HA   GLU  89           HA       GLU  89 -10.100   5.313  -2.539
  717    HB2  GLU  89           HB3      GLU  89 -10.498   5.466  -5.522
  718    HB3  GLU  89           HB2      GLU  89 -11.765   5.727  -4.325
  719    HG2  GLU  89           HG3      GLU  89 -10.477   7.602  -3.402
  720    HG3  GLU  89           HG2      GLU  89  -9.242   7.318  -4.622
  721    H    ARG  90           HN       ARG  90  -9.015   2.983  -4.724
  722    HA   ARG  90           HA       ARG  90 -11.223   1.151  -4.362
  723    HB2  ARG  90           HB2      ARG  90  -8.468   0.670  -5.520
  724    HB3  ARG  90           HB1      ARG  90  -9.804  -0.475  -5.576
  725    HG2  ARG  90           HG2      ARG  90 -11.089   1.129  -6.920
  726    HG3  ARG  90           HG1      ARG  90  -9.725   2.235  -6.873
  727    HD2  ARG  90           HD2      ARG  90  -8.348   0.611  -8.044
  728    HD3  ARG  90           HD1      ARG  90  -9.689  -0.535  -8.072
  729    HE   ARG  90           HE       ARG  90 -10.780   1.576  -9.233
  730   HH11  ARG  90          HH11      ARG  90  -7.725  -0.095  -9.918
  731   HH12  ARG  90          HH12      ARG  90  -7.674   0.409 -11.539
  732   HH21  ARG  90          HH21      ARG  90 -10.702   2.214 -11.477
  733   HH22  ARG  90          HH22      ARG  90  -9.381   1.732 -12.438
  734    H    GLY  91           HN       GLY  91  -8.185   1.846  -2.873
  735    HA2  GLY  91           HA3      GLY  91  -7.994  -0.591  -1.351
  736    HA3  GLY  91           HA2      GLY  91  -6.988   0.835  -1.219
  737    H    GLN  92           HN       GLN  92  -9.285   2.599  -0.885
  738    HA   GLN  92           HA       GLN  92  -9.436   2.660   1.922
  739    HB2  GLN  92           HB2      GLN  92 -11.369   3.871  -0.055
  740    HB3  GLN  92           HB1      GLN  92 -11.274   4.265   1.648
  741    HG2  GLN  92           HG2      GLN  92  -9.000   5.139   1.290
  742    HG3  GLN  92           HG1      GLN  92  -9.168   4.788  -0.431
  743   HE21  GLN  92          HE21      GLN  92 -10.235   6.781   2.185
  744   HE22  GLN  92          HE22      GLN  92 -10.977   8.006   1.213
  745    H    ARG  93           HN       ARG  93 -10.290   1.233   3.169
  746    HA   ARG  93           HA       ARG  93 -12.486  -0.375   2.292
  747    HB2  ARG  93           HB2      ARG  93 -10.658  -1.163   3.848
  748    HB3  ARG  93           HB1      ARG  93 -11.363  -0.136   5.092
  749    HG2  ARG  93           HG2      ARG  93 -12.096  -2.417   5.403
  750    HG3  ARG  93           HG1      ARG  93 -13.441  -1.382   4.893
  751    HD2  ARG  93           HD2      ARG  93 -13.315  -2.162   2.658
  752    HD3  ARG  93           HD1      ARG  93 -11.829  -3.040   2.984
  753    HE   ARG  93           HE       ARG  93 -13.302  -4.340   4.608
  754   HH11  ARG  93          HH11      ARG  93 -14.644  -2.939   1.626
  755   HH12  ARG  93          HH12      ARG  93 -15.632  -4.274   1.292
  756   HH21  ARG  93          HH21      ARG  93 -14.733  -6.180   4.119
  757   HH22  ARG  93          HH22      ARG  93 -15.709  -6.113   2.719
  758    H    GLU  94           HN       GLU  94 -11.906   2.412   4.239
  759    HA   GLU  94           HA       GLU  94 -14.768   2.711   4.691
  760    HB2  GLU  94           HB3      GLU  94 -12.451   4.322   5.796
  761    HB3  GLU  94           HB2      GLU  94 -14.146   4.534   6.223
  762    HG2  GLU  94           HG3      GLU  94 -14.230   2.411   7.262
  763    HG3  GLU  94           HG2      GLU  94 -12.635   1.995   6.642
  764    H    ASP  95           HN       ASP  95 -15.453   3.386   2.737
  765    HA   ASP  95           HA       ASP  95 -14.010   5.023   0.941
  766    HB2  ASP  95           HB2      ASP  95 -15.694   3.450   0.151
  767    HB3  ASP  95           HB1      ASP  95 -16.941   4.327   1.019
  768    H    LEU  96           HN       LEU  96 -16.436   5.601   3.050
  769    HA   LEU  96           HA       LEU  96 -16.551   8.513   2.528
  770    HB2  LEU  96           HB2      LEU  96 -18.552   8.644   3.764
  771    HB3  LEU  96           HB1      LEU  96 -18.673   7.174   2.834
  772    HG   LEU  96           HG       LEU  96 -17.974   7.324   5.751
  773   HD11  LEU  96          HD11      LEU  96 -20.250   6.423   6.115
  774   HD12  LEU  96          HD12      LEU  96 -20.561   6.590   4.387
  775   HD13  LEU  96          HD13      LEU  96 -20.261   8.024   5.375
  776   HD21  LEU  96          HD21      LEU  96 -18.626   4.938   4.014
  777   HD22  LEU  96          HD22      LEU  96 -18.457   4.885   5.768
  778   HD23  LEU  96          HD23      LEU  96 -17.068   5.299   4.764
  779    H    VAL  97           HN       VAL  97 -14.772   6.541   4.320
  780    HA   VAL  97           HA       VAL  97 -13.450   6.616   6.085
  781    HB   VAL  97           HB       VAL  97 -13.885   9.608   5.963
  782   HG11  VAL  97          HG11      VAL  97 -11.743   9.782   7.212
  783   HG12  VAL  97          HG12      VAL  97 -11.723   8.028   7.385
  784   HG13  VAL  97          HG13      VAL  97 -12.997   8.976   8.151
  785   HG21  VAL  97          HG21      VAL  97 -12.947   8.699   3.911
  786   HG22  VAL  97          HG22      VAL  97 -11.666   7.907   4.829
  787   HG23  VAL  97          HG23      VAL  97 -11.743   9.668   4.763
  788    H    ARG  98           HN       ARG  98 -15.604   9.273   7.129
  789    HA   ARG  98           HA       ARG  98 -16.763   7.586   9.183
  790    HB2  ARG  98           HB2      ARG  98 -15.016   9.966   9.823
  791    HB3  ARG  98           HB1      ARG  98 -16.162   9.274  10.947
  792    HG2  ARG  98           HG2      ARG  98 -14.904   7.218  11.023
  793    HG3  ARG  98           HG1      ARG  98 -13.811   7.804   9.769
  794    HD2  ARG  98           HD2      ARG  98 -13.101   9.625  11.225
  795    HD3  ARG  98           HD1      ARG  98 -14.207   9.062  12.477
  796    HE   ARG  98           HE       ARG  98 -12.793   6.911  12.169
  797   HH11  ARG  98          HH11      ARG  98 -11.548  10.234  12.087
  798   HH12  ARG  98          HH12      ARG  98 -10.089   9.844  12.864
  799   HH21  ARG  98          HH21      ARG  98 -10.751   6.408  13.259
  800   HH22  ARG  98          HH22      ARG  98  -9.634   7.673  13.537
  801    H    ASP  99           HN       ASP  99 -18.470   8.728  10.306
  802    HA   ASP  99           HA       ASP  99 -20.131  10.171  10.702
  803    HB2  ASP  99           HB2      ASP  99 -18.006  11.756  10.641
  804    HB3  ASP  99           HB1      ASP  99 -18.796  12.385   9.201
  805    H    THR 100           HN       THR 100 -21.396  12.053   9.450
  806    HA   THR 100           HA       THR 100 -22.087  11.102   6.765
  807    HB   THR 100           HB       THR 100 -24.010  12.052   8.924
  808    HG1  THR 100           HG1      THR 100 -23.555  10.018   9.441
  809   HG21  THR 100          HG21      THR 100 -24.750  12.648   6.642
  810   HG22  THR 100          HG22      THR 100 -25.783  11.401   7.344
  811   HG23  THR 100          HG23      THR 100 -24.562  10.966   6.148
  812    H    VAL 101           HN       VAL 101 -21.660  13.774   9.048
  813    HA   VAL 101           HA       VAL 101 -22.206  15.612   6.854
  814    HB   VAL 101           HB       VAL 101 -22.536  17.389   8.555
  815   HG11  VAL 101          HG11      VAL 101 -24.471  16.217   7.688
  816   HG12  VAL 101          HG12      VAL 101 -24.715  16.629   9.385
  817   HG13  VAL 101          HG13      VAL 101 -24.301  14.977   8.930
  818   HG21  VAL 101          HG21      VAL 101 -22.829  16.776  10.919
  819   HG22  VAL 101          HG22      VAL 101 -21.180  16.478  10.362
  820   HG23  VAL 101          HG23      VAL 101 -22.304  15.133  10.549
  821    H    GLU 102           HN       GLU 102 -20.856  17.593   6.868
  822    HA   GLU 102           HA       GLU 102 -18.176  17.030   7.855
  823    HB2  GLU 102           HB3      GLU 102 -18.443  16.462   5.394
  824    HB3  GLU 102           HB2      GLU 102 -18.785  18.165   5.121
  825    HG2  GLU 102           HG3      GLU 102 -16.488  17.676   4.567
  826    HG3  GLU 102           HG2      GLU 102 -16.564  18.744   5.966
  Start of MODEL   14
    1    H1   GLY   1           HT1      GLY   1 -11.105 -31.925   2.655
    2    H2   GLY   1           HT2      GLY   1  -9.531 -31.701   2.134
    3    H3   GLY   1           HT3      GLY   1 -10.808 -30.913   1.326
    4    HA2  GLY   1           HA2      GLY   1  -9.616 -29.385   2.739
    5    HA3  GLY   1           HA3      GLY   1 -11.254 -29.637   3.338
    6    H    HIS   2           HN       HIS   2 -10.368 -28.909   5.411
    7    HA   HIS   2           HA       HIS   2  -9.803 -29.238   7.524
    8    HB2  HIS   2           HB2      HIS   2 -10.921 -31.482   7.319
    9    HB3  HIS   2           HB1      HIS   2  -9.392 -32.176   6.813
   10    HD1  HIS   2           HD1      HIS   2 -11.388 -31.350   9.810
   11    HD2  HIS   2           HD2      HIS   2  -7.452 -32.336   8.924
   12    HE1  HIS   2           HE1      HIS   2 -10.332 -32.013  11.986
   13    H    MET   3           HN       MET   3  -7.654 -31.499   5.860
   14    HA   MET   3           HA       MET   3  -5.437 -29.769   6.625
   15    HB2  MET   3           HB2      MET   3  -5.627 -32.744   6.674
   16    HB3  MET   3           HB1      MET   3  -4.079 -32.025   6.260
   17    HG2  MET   3           HG2      MET   3  -5.632 -31.476   8.782
   18    HG3  MET   3           HG1      MET   3  -4.242 -32.554   8.647
   19    HE1  MET   3           HE1      MET   3  -2.979 -31.271  10.601
   20    HE2  MET   3           HE2      MET   3  -4.394 -30.234  10.784
   21    HE3  MET   3           HE3      MET   3  -2.786 -29.519  10.650
   22    H    LEU   4           HN       LEU   4  -5.247 -28.605   4.936
   23    HA   LEU   4           HA       LEU   4  -4.628 -29.956   2.418
   24    HB2  LEU   4           HB2      LEU   4  -5.693 -28.129   1.163
   25    HB3  LEU   4           HB1      LEU   4  -6.840 -29.007   2.143
   26    HG   LEU   4           HG       LEU   4  -5.695 -26.337   3.015
   27   HD11  LEU   4          HD11      LEU   4  -8.198 -26.907   1.447
   28   HD12  LEU   4          HD12      LEU   4  -6.767 -26.074   0.842
   29   HD13  LEU   4          HD13      LEU   4  -7.746 -25.345   2.121
   30   HD21  LEU   4          HD21      LEU   4  -7.708 -26.231   4.387
   31   HD22  LEU   4          HD22      LEU   4  -6.825 -27.718   4.747
   32   HD23  LEU   4          HD23      LEU   4  -8.260 -27.770   3.733
   33    H    ARG   5           HN       ARG   5  -3.461 -28.329   4.850
   34    HA   ARG   5           HA       ARG   5  -1.674 -27.080   5.354
   35    HB2  ARG   5           HB2      ARG   5  -0.580 -28.859   4.000
   36    HB3  ARG   5           HB1      ARG   5  -0.710 -27.820   2.593
   37    HG2  ARG   5           HG2      ARG   5   0.734 -26.179   3.716
   38    HG3  ARG   5           HG1      ARG   5   0.882 -27.282   5.084
   39    HD2  ARG   5           HD2      ARG   5   1.749 -27.799   2.251
   40    HD3  ARG   5           HD1      ARG   5   2.797 -27.536   3.642
   41    HE   ARG   5           HE       ARG   5   1.305 -29.659   4.376
   42   HH11  ARG   5          HH11      ARG   5   3.332 -28.997   1.537
   43   HH12  ARG   5          HH12      ARG   5   3.685 -30.645   1.248
   44   HH21  ARG   5          HH21      ARG   5   1.796 -31.927   3.936
   45   HH22  ARG   5          HH22      ARG   5   2.816 -32.315   2.620
   46    H    THR   6           HN       THR   6  -2.745 -25.139   5.480
   47    HA   THR   6           HA       THR   6  -2.463 -23.431   3.135
   48    HB   THR   6           HB       THR   6  -4.819 -24.103   3.350
   49    HG1  THR   6           HG1      THR   6  -5.605 -22.156   3.087
   50   HG21  THR   6          HG21      THR   6  -6.162 -23.419   5.292
   51   HG22  THR   6          HG22      THR   6  -4.707 -22.819   6.086
   52   HG23  THR   6          HG23      THR   6  -4.886 -24.543   5.766
   53    H    ALA   7           HN       ALA   7  -2.526 -21.189   3.644
   54    HA   ALA   7           HA       ALA   7  -1.976 -20.276   6.329
   55    HB1  ALA   7           HB1      ALA   7   0.276 -20.808   5.478
   56    HB2  ALA   7           HB2      ALA   7   0.058 -19.059   5.548
   57    HB3  ALA   7           HB3      ALA   7  -0.054 -19.900   4.002
   58    H    GLY   8           HN       GLY   8  -4.081 -20.220   4.417
   59    HA2  GLY   8           HA3      GLY   8  -4.085 -17.869   2.838
   60    HA3  GLY   8           HA2      GLY   8  -5.475 -18.866   3.224
   61    H    ARG   9           HN       ARG   9  -3.665 -16.098   4.008
   62    HA   ARG   9           HA       ARG   9  -5.875 -15.099   5.600
   63    HB2  ARG   9           HB2      ARG   9  -3.920 -13.842   6.945
   64    HB3  ARG   9           HB1      ARG   9  -4.515 -15.415   7.442
   65    HG2  ARG   9           HG2      ARG   9  -2.129 -15.460   7.552
   66    HG3  ARG   9           HG1      ARG   9  -2.636 -16.458   6.201
   67    HD2  ARG   9           HD2      ARG   9  -2.261 -14.171   4.890
   68    HD3  ARG   9           HD1      ARG   9  -1.141 -13.903   6.232
   69    HE   ARG   9           HE       ARG   9  -0.981 -16.462   4.957
   70   HH11  ARG   9          HH11      ARG   9   0.417 -13.224   5.191
   71   HH12  ARG   9          HH12      ARG   9   1.819 -13.622   4.291
   72   HH21  ARG   9          HH21      ARG   9   0.934 -16.977   3.673
   73   HH22  ARG   9          HH22      ARG   9   2.081 -15.757   3.376
   74    H    ASP  10           HN       ASP  10  -6.296 -12.912   5.319
   75    HA   ASP  10           HA       ASP  10  -5.050 -11.932   2.886
   76    HB2  ASP  10           HB2      ASP  10  -7.553 -11.996   2.971
   77    HB3  ASP  10           HB1      ASP  10  -7.509 -10.807   4.269
   78    H    GLY  11           HN       GLY  11  -4.706  -9.609   2.729
   79    HA2  GLY  11           HA3      GLY  11  -3.991  -7.614   4.046
   80    HA3  GLY  11           HA2      GLY  11  -3.127  -8.758   5.081
   81    H    LEU  12           HN       LEU  12  -1.579 -10.154   4.050
   82    HA   LEU  12           HA       LEU  12   0.396  -8.844   2.558
   83    HB2  LEU  12           HB2      LEU  12   0.575 -10.907   4.038
   84    HB3  LEU  12           HB1      LEU  12  -0.124 -11.816   2.740
   85    HG   LEU  12           HG       LEU  12   2.351 -12.067   3.003
   86   HD11  LEU  12          HD11      LEU  12   1.342 -12.656   0.878
   87   HD12  LEU  12          HD12      LEU  12   2.926 -11.921   0.623
   88   HD13  LEU  12          HD13      LEU  12   1.461 -10.982   0.340
   89   HD21  LEU  12          HD21      LEU  12   3.800 -10.295   2.204
   90   HD22  LEU  12          HD22      LEU  12   2.852  -9.779   3.602
   91   HD23  LEU  12          HD23      LEU  12   2.403  -9.253   1.981
   92    H    CYS  13           HN       CYS  13  -2.023 -11.190   1.670
   93    HA   CYS  13           HA       CYS  13  -1.532 -11.541  -1.021
   94    HB2  CYS  13           HB2      CYS  13  -4.064 -11.538   0.527
   95    HB3  CYS  13           HB1      CYS  13  -3.854 -12.332  -1.049
   96    HG   CYS  13           HG       CYS  13  -3.422 -13.573   1.947
   97    H    ARG  14           HN       ARG  14  -3.615  -9.217   0.657
   98    HA   ARG  14           HA       ARG  14  -4.836  -8.020  -1.560
   99    HB2  ARG  14           HB2      ARG  14  -5.504  -7.869   0.863
  100    HB3  ARG  14           HB1      ARG  14  -4.183  -6.736   1.082
  101    HG2  ARG  14           HG2      ARG  14  -5.248  -5.242  -0.572
  102    HG3  ARG  14           HG1      ARG  14  -6.603  -6.371  -0.663
  103    HD2  ARG  14           HD2      ARG  14  -5.659  -4.855   1.761
  104    HD3  ARG  14           HD1      ARG  14  -7.169  -4.614   0.883
  105    HE   ARG  14           HE       ARG  14  -7.339  -7.190   1.634
  106   HH11  ARG  14          HH11      ARG  14  -6.633  -4.257   3.502
  107   HH12  ARG  14          HH12      ARG  14  -7.221  -4.896   4.959
  108   HH21  ARG  14          HH21      ARG  14  -8.103  -8.027   3.560
  109   HH22  ARG  14          HH22      ARG  14  -8.107  -7.103   5.013
  110    H    LEU  15           HN       LEU  15  -1.896  -7.285   0.241
  111    HA   LEU  15           HA       LEU  15  -1.107  -4.882  -0.901
  112    HB2  LEU  15           HB2      LEU  15   0.541  -7.231  -0.081
  113    HB3  LEU  15           HB1      LEU  15   1.213  -5.631  -0.418
  114    HG   LEU  15           HG       LEU  15  -0.576  -6.471   1.850
  115   HD11  LEU  15          HD11      LEU  15   2.233  -5.441   1.852
  116   HD12  LEU  15          HD12      LEU  15   1.744  -7.116   2.095
  117   HD13  LEU  15          HD13      LEU  15   1.280  -5.879   3.268
  118   HD21  LEU  15          HD21      LEU  15  -1.224  -4.310   1.132
  119   HD22  LEU  15          HD22      LEU  15   0.451  -3.747   1.132
  120   HD23  LEU  15          HD23      LEU  15  -0.346  -4.176   2.658
  121    H    SER  16           HN       SER  16  -0.357  -8.171  -1.905
  122    HA   SER  16           HA       SER  16   1.208  -7.517  -4.118
  123    HB2  SER  16           HB2      SER  16   1.188  -9.755  -3.064
  124    HB3  SER  16           HB1      SER  16  -0.444 -10.017  -3.671
  125    HG   SER  16           HG       SER  16   1.544 -10.802  -4.867
  126    H    THR  17           HN       THR  17  -2.280  -8.223  -3.880
  127    HA   THR  17           HA       THR  17  -2.856  -8.150  -6.609
  128    HB   THR  17           HB       THR  17  -4.682  -7.468  -4.286
  129    HG1  THR  17           HG1      THR  17  -3.747  -9.888  -5.409
  130   HG21  THR  17          HG21      THR  17  -5.660  -6.986  -6.506
  131   HG22  THR  17          HG22      THR  17  -6.463  -8.355  -5.737
  132   HG23  THR  17          HG23      THR  17  -5.286  -8.632  -7.022
  133    H    TYR  18           HN       TYR  18  -2.345  -5.539  -4.375
  134    HA   TYR  18           HA       TYR  18  -3.425  -3.630  -6.290
  135    HB2  TYR  18           HB2      TYR  18  -2.495  -3.335  -3.450
  136    HB3  TYR  18           HB1      TYR  18  -2.743  -1.929  -4.481
  137    HD1  TYR  18           HD2      TYR  18  -4.527  -5.016  -3.375
  138    HD2  TYR  18           HD1      TYR  18  -4.828  -0.927  -4.492
  139    HE1  TYR  18           HE2      TYR  18  -6.919  -5.053  -2.840
  140    HE2  TYR  18           HE1      TYR  18  -7.210  -0.960  -3.944
  141    HH   TYR  18           HH       TYR  18  -8.641  -3.479  -2.219
  142    H    LEU  19           HN       LEU  19  -0.358  -4.523  -4.829
  143    HA   LEU  19           HA       LEU  19   1.057  -2.423  -6.109
  144    HB2  LEU  19           HB2      LEU  19   2.043  -4.933  -4.764
  145    HB3  LEU  19           HB1      LEU  19   3.099  -3.679  -5.378
  146    HG   LEU  19           HG       LEU  19   1.054  -3.272  -3.165
  147   HD11  LEU  19          HD11      LEU  19   2.868  -4.716  -2.456
  148   HD12  LEU  19          HD12      LEU  19   2.962  -3.128  -1.691
  149   HD13  LEU  19          HD13      LEU  19   4.041  -3.527  -3.029
  150   HD21  LEU  19          HD21      LEU  19   3.213  -1.443  -4.236
  151   HD22  LEU  19          HD22      LEU  19   2.169  -1.115  -2.856
  152   HD23  LEU  19          HD23      LEU  19   1.479  -1.233  -4.466
  153    H    GLU  20           HN       GLU  20   0.054  -5.547  -7.170
  154    HA   GLU  20           HA       GLU  20   1.923  -5.810  -9.301
  155    HB2  GLU  20           HB3      GLU  20   0.369  -7.480 -10.233
  156    HB3  GLU  20           HB2      GLU  20   0.642  -7.745  -8.516
  157    HG2  GLU  20           HG3      GLU  20  -1.447  -6.780  -7.967
  158    HG3  GLU  20           HG2      GLU  20  -1.719  -6.310  -9.645
  159    H    GLU  21           HN       GLU  21  -0.771  -3.813  -8.801
  160    HA   GLU  21           HA       GLU  21  -1.404  -3.364 -11.570
  161    HB2  GLU  21           HB3      GLU  21  -2.194  -1.866  -9.073
  162    HB3  GLU  21           HB2      GLU  21  -2.803  -1.521 -10.681
  163    HG2  GLU  21           HG3      GLU  21  -3.143  -4.142  -9.259
  164    HG3  GLU  21           HG2      GLU  21  -4.338  -2.848  -9.277
  165    H    LEU  22           HN       LEU  22   1.068  -2.438  -9.534
  166    HA   LEU  22           HA       LEU  22   1.374   0.198 -10.751
  167    HB2  LEU  22           HB2      LEU  22   2.837  -1.063  -8.442
  168    HB3  LEU  22           HB1      LEU  22   3.088   0.560  -9.025
  169    HG   LEU  22           HG       LEU  22   0.653  -0.533  -7.649
  170   HD11  LEU  22          HD11      LEU  22   2.487   0.008  -6.183
  171   HD12  LEU  22          HD12      LEU  22   1.194   1.202  -6.009
  172   HD13  LEU  22          HD13      LEU  22   2.642   1.598  -6.931
  173   HD21  LEU  22          HD21      LEU  22  -0.057   0.978  -9.440
  174   HD22  LEU  22          HD22      LEU  22   1.045   2.219  -8.834
  175   HD23  LEU  22          HD23      LEU  22  -0.316   1.677  -7.849
  176    H    GLU  23           HN       GLU  23   2.779   0.528 -12.272
  177    HA   GLU  23           HA       GLU  23   4.566  -1.569 -13.102
  178    HB2  GLU  23           HB3      GLU  23   5.088  -0.100 -15.012
  179    HB3  GLU  23           HB2      GLU  23   3.353  -0.200 -14.715
  180    HG2  GLU  23           HG3      GLU  23   3.302   1.940 -13.756
  181    HG3  GLU  23           HG2      GLU  23   5.060   2.079 -13.842
  182    H    ALA  24           HN       ALA  24   6.866  -0.505 -13.880
  183    HA   ALA  24           HA       ALA  24   8.410  -0.430 -11.602
  184    HB1  ALA  24           HB1      ALA  24   9.272  -0.970 -13.841
  185    HB2  ALA  24           HB2      ALA  24  10.281   0.194 -12.990
  186    HB3  ALA  24           HB3      ALA  24   9.202   0.740 -14.268
  187    H    VAL  25           HN       VAL  25   7.451   2.397 -13.571
  188    HA   VAL  25           HA       VAL  25   8.748   4.245 -11.888
  189    HB   VAL  25           HB       VAL  25   8.101   4.949 -14.161
  190   HG11  VAL  25          HG11      VAL  25   5.787   5.509 -14.705
  191   HG12  VAL  25          HG12      VAL  25   5.278   4.825 -13.159
  192   HG13  VAL  25          HG13      VAL  25   5.994   3.782 -14.395
  193   HG21  VAL  25          HG21      VAL  25   6.673   6.550 -12.080
  194   HG22  VAL  25          HG22      VAL  25   7.175   7.148 -13.666
  195   HG23  VAL  25          HG23      VAL  25   8.393   6.691 -12.458
  196    H    GLU  26           HN       GLU  26   5.554   2.832 -11.702
  197    HA   GLU  26           HA       GLU  26   4.588   4.657  -9.752
  198    HB2  GLU  26           HB3      GLU  26   3.681   1.857 -10.355
  199    HB3  GLU  26           HB2      GLU  26   2.802   3.087  -9.425
  200    HG2  GLU  26           HG3      GLU  26   3.595   3.303 -12.301
  201    HG3  GLU  26           HG2      GLU  26   1.974   2.820 -11.768
  202    H    LEU  27           HN       LEU  27   6.049   1.462  -9.620
  203    HA   LEU  27           HA       LEU  27   6.009   1.228  -6.816
  204    HB2  LEU  27           HB2      LEU  27   7.870  -0.014  -8.847
  205    HB3  LEU  27           HB1      LEU  27   7.849  -0.452  -7.156
  206    HG   LEU  27           HG       LEU  27   5.531  -0.833  -9.059
  207   HD11  LEU  27          HD11      LEU  27   7.501  -2.825  -7.945
  208   HD12  LEU  27          HD12      LEU  27   7.414  -2.278  -9.622
  209   HD13  LEU  27          HD13      LEU  27   6.086  -3.207  -8.924
  210   HD21  LEU  27          HD21      LEU  27   4.818  -0.536  -6.736
  211   HD22  LEU  27          HD22      LEU  27   5.964  -1.773  -6.221
  212   HD23  LEU  27          HD23      LEU  27   4.601  -2.210  -7.249
  213    H    LYS  28           HN       LYS  28   8.313   2.571  -9.057
  214    HA   LYS  28           HA       LYS  28  10.440   3.178  -7.391
  215    HB2  LYS  28           HB2      LYS  28  10.457   3.355  -9.822
  216    HB3  LYS  28           HB1      LYS  28   9.313   4.672  -9.750
  217    HG2  LYS  28           HG2      LYS  28  10.997   6.081  -8.685
  218    HG3  LYS  28           HG1      LYS  28  12.151   4.738  -8.755
  219    HD2  LYS  28           HD2      LYS  28  11.981   4.677 -11.177
  220    HD3  LYS  28           HD1      LYS  28  10.768   5.949 -11.147
  221    HE2  LYS  28           HE2      LYS  28  12.913   6.845 -11.775
  222    HE3  LYS  28           HE1      LYS  28  12.419   7.484 -10.209
  223    HZ1  LYS  28           HZ1      LYS  28  14.336   5.252 -10.599
  224    HZ2  LYS  28           HZ2      LYS  28  13.959   5.984  -9.138
  225    HZ3  LYS  28           HZ3      LYS  28  14.768   6.844 -10.328
  226    H    LYS  29           HN       LYS  29   7.559   5.092  -8.135
  227    HA   LYS  29           HA       LYS  29   8.203   7.352  -6.555
  228    HB2  LYS  29           HB2      LYS  29   5.532   6.287  -7.422
  229    HB3  LYS  29           HB1      LYS  29   5.763   7.868  -6.699
  230    HG2  LYS  29           HG2      LYS  29   7.212   8.489  -8.670
  231    HG3  LYS  29           HG1      LYS  29   6.819   6.925  -9.365
  232    HD2  LYS  29           HD2      LYS  29   4.745   9.001  -8.633
  233    HD3  LYS  29           HD1      LYS  29   5.419   8.796 -10.251
  234    HE2  LYS  29           HE2      LYS  29   4.574   6.542 -10.345
  235    HE3  LYS  29           HE1      LYS  29   3.945   6.661  -8.701
  236    HZ1  LYS  29           HZ1      LYS  29   2.375   8.340  -9.476
  237    HZ2  LYS  29           HZ2      LYS  29   2.254   6.938 -10.443
  238    HZ3  LYS  29           HZ3      LYS  29   3.043   8.289 -11.023
  239    H    PHE  30           HN       PHE  30   6.137   4.564  -5.949
  240    HA   PHE  30           HA       PHE  30   5.338   5.237  -3.353
  241    HB2  PHE  30           HB2      PHE  30   3.928   3.604  -4.012
  242    HB3  PHE  30           HB1      PHE  30   5.048   3.033  -5.223
  243    HD1  PHE  30           HD1      PHE  30   6.496   1.190  -4.761
  244    HD2  PHE  30           HD2      PHE  30   3.722   2.540  -1.842
  245    HE1  PHE  30           HE1      PHE  30   6.748  -0.942  -3.547
  246    HE2  PHE  30           HE2      PHE  30   3.968   0.422  -0.622
  247    HZ   PHE  30           HZ       PHE  30   5.484  -1.325  -1.483
  248    H    LYS  31           HN       LYS  31   8.080   3.456  -4.514
  249    HA   LYS  31           HA       LYS  31   9.057   2.533  -2.039
  250    HB2  LYS  31           HB2      LYS  31   9.681   1.517  -4.133
  251    HB3  LYS  31           HB1      LYS  31  10.339   3.034  -4.707
  252    HG2  LYS  31           HG2      LYS  31  12.185   2.858  -3.172
  253    HG3  LYS  31           HG1      LYS  31  11.480   1.413  -2.440
  254    HD2  LYS  31           HD2      LYS  31  13.227   0.776  -4.015
  255    HD3  LYS  31           HD1      LYS  31  11.659   0.236  -4.597
  256    HE2  LYS  31           HE2      LYS  31  12.861   1.108  -6.455
  257    HE3  LYS  31           HE1      LYS  31  11.597   2.260  -6.071
  258    HZ1  LYS  31           HZ1      LYS  31  13.661   3.425  -6.493
  259    HZ2  LYS  31           HZ2      LYS  31  14.465   2.443  -5.401
  260    HZ3  LYS  31           HZ3      LYS  31  13.350   3.558  -4.840
  261    H    LEU  32           HN       LEU  32   9.766   5.491  -3.921
  262    HA   LEU  32           HA       LEU  32  11.787   6.292  -2.091
  263    HB2  LEU  32           HB2      LEU  32  11.880   8.408  -3.291
  264    HB3  LEU  32           HB1      LEU  32  11.851   7.075  -4.412
  265    HG   LEU  32           HG       LEU  32   9.286   7.653  -4.577
  266   HD11  LEU  32          HD11      LEU  32   8.778  10.005  -4.335
  267   HD12  LEU  32          HD12      LEU  32  10.361  10.277  -3.608
  268   HD13  LEU  32          HD13      LEU  32   9.180   9.254  -2.791
  269   HD21  LEU  32          HD21      LEU  32  10.850   7.816  -6.424
  270   HD22  LEU  32          HD22      LEU  32  11.437   9.362  -5.812
  271   HD23  LEU  32          HD23      LEU  32   9.781   9.220  -6.406
  272    H    TYR  33           HN       TYR  33   8.388   6.557  -2.109
  273    HA   TYR  33           HA       TYR  33   8.336   8.779  -0.357
  274    HB2  TYR  33           HB2      TYR  33   6.441   8.347  -1.871
  275    HB3  TYR  33           HB1      TYR  33   6.090   6.856  -1.002
  276    HD1  TYR  33           HD1      TYR  33   6.006  10.510  -0.828
  277    HD2  TYR  33           HD2      TYR  33   5.037   6.903   1.191
  278    HE1  TYR  33           HE1      TYR  33   4.677  11.784   0.804
  279    HE2  TYR  33           HE2      TYR  33   3.705   8.134   2.817
  280    HH   TYR  33           HH       TYR  33   3.855  10.608   3.693
  281    H    LEU  34           HN       LEU  34   8.517   5.324   0.105
  282    HA   LEU  34           HA       LEU  34   8.160   5.876   2.968
  283    HB2  LEU  34           HB2      LEU  34   7.215   3.604   3.254
  284    HB3  LEU  34           HB1      LEU  34   6.278   4.704   2.272
  285    HG   LEU  34           HG       LEU  34   7.168   3.517   0.240
  286   HD11  LEU  34          HD11      LEU  34   9.076   2.369   1.204
  287   HD12  LEU  34          HD12      LEU  34   7.931   1.213   0.518
  288   HD13  LEU  34          HD13      LEU  34   8.005   1.454   2.264
  289   HD21  LEU  34          HD21      LEU  34   5.488   1.945   2.173
  290   HD22  LEU  34          HD22      LEU  34   5.539   1.743   0.420
  291   HD23  LEU  34          HD23      LEU  34   4.929   3.244   1.123
  292    H    GLY  35           HN       GLY  35  10.305   4.403   0.722
  293    HA2  GLY  35           HA3      GLY  35  11.405   2.782   2.789
  294    HA3  GLY  35           HA2      GLY  35  11.973   2.802   1.121
  295    H    THR  36           HN       THR  36  12.477   5.592   0.962
  296    HA   THR  36           HA       THR  36  14.824   5.796   2.732
  297    HB   THR  36           HB       THR  36  15.466   5.395   0.390
  298    HG1  THR  36           HG1      THR  36  15.855   8.102   1.054
  299   HG21  THR  36          HG21      THR  36  13.855   7.864  -0.284
  300   HG22  THR  36          HG22      THR  36  13.466   6.207  -0.743
  301   HG23  THR  36          HG23      THR  36  14.896   6.994  -1.408
  302    H    ALA  37           HN       ALA  37  12.050   6.714   3.044
  303    HA   ALA  37           HA       ALA  37  11.939   9.537   2.576
  304    HB1  ALA  37           HB1      ALA  37   9.968   8.187   2.423
  305    HB2  ALA  37           HB2      ALA  37   9.799   9.394   3.707
  306    HB3  ALA  37           HB3      ALA  37  10.164   7.710   4.103
  307    H    THR  38           HN       THR  38  12.250  11.119   3.931
  308    HA   THR  38           HA       THR  38  13.669  10.720   6.342
  309    HB   THR  38           HB       THR  38  12.438  13.247   5.211
  310    HG1  THR  38           HG1      THR  38  14.999  12.077   4.775
  311   HG21  THR  38          HG21      THR  38  14.845  12.809   6.996
  312   HG22  THR  38          HG22      THR  38  13.288  13.437   7.531
  313   HG23  THR  38          HG23      THR  38  14.274  14.368   6.405
  314    H    GLU  39           HN       GLU  39  10.411  11.177   5.445
  315    HA   GLU  39           HA       GLU  39   9.485  11.973   8.051
  316    HB2  GLU  39           HB3      GLU  39   7.197  11.737   7.169
  317    HB3  GLU  39           HB2      GLU  39   8.213  12.746   6.159
  318    HG2  GLU  39           HG3      GLU  39   8.459  10.900   4.585
  319    HG3  GLU  39           HG2      GLU  39   7.443   9.887   5.614
  320    H    LEU  40           HN       LEU  40  10.576   9.126   7.022
  321    HA   LEU  40           HA       LEU  40   8.907   7.543   8.837
  322    HB2  LEU  40           HB2      LEU  40  10.681   6.949   6.543
  323    HB3  LEU  40           HB1      LEU  40  10.603   5.782   7.845
  324    HG   LEU  40           HG       LEU  40   9.101   5.205   5.970
  325   HD11  LEU  40          HD11      LEU  40   7.070   4.808   7.230
  326   HD12  LEU  40          HD12      LEU  40   7.609   5.936   8.473
  327   HD13  LEU  40          HD13      LEU  40   8.509   4.445   8.181
  328   HD21  LEU  40          HD21      LEU  40   7.081   6.519   5.519
  329   HD22  LEU  40          HD22      LEU  40   8.532   7.457   5.171
  330   HD23  LEU  40          HD23      LEU  40   7.627   7.747   6.657
  331    H    GLY  41           HN       GLY  41  11.168   9.535   9.155
  332    HA2  GLY  41           HA3      GLY  41  12.486   9.843  11.122
  333    HA3  GLY  41           HA2      GLY  41  12.659   8.088  11.242
  334    H    GLU  42           HN       GLU  42  13.557   7.174   9.207
  335    HA   GLU  42           HA       GLU  42  15.640   8.777   7.926
  336    HB2  GLU  42           HB3      GLU  42  16.817   7.704   9.765
  337    HB3  GLU  42           HB2      GLU  42  16.088   6.157   9.382
  338    HG2  GLU  42           HG3      GLU  42  17.267   6.167   7.227
  339    HG3  GLU  42           HG2      GLU  42  18.080   7.653   7.714
  340    H    GLY  43           HN       GLY  43  14.073   5.658   8.270
  341    HA2  GLY  43           HA3      GLY  43  12.797   5.260   6.026
  342    HA3  GLY  43           HA2      GLY  43  14.465   5.037   5.481
  343    H    LYS  44           HN       LYS  44  11.885   3.452   6.599
  344    HA   LYS  44           HA       LYS  44  13.225   1.745   8.498
  345    HB2  LYS  44           HB2      LYS  44  10.443   1.557   7.352
  346    HB3  LYS  44           HB1      LYS  44  11.075   0.563   8.658
  347    HG2  LYS  44           HG2      LYS  44  10.714   3.552   8.721
  348    HG3  LYS  44           HG1      LYS  44   9.695   2.355   9.526
  349    HD2  LYS  44           HD2      LYS  44  11.627   1.636  10.875
  350    HD3  LYS  44           HD1      LYS  44  12.629   2.830  10.063
  351    HE2  LYS  44           HE2      LYS  44  11.909   3.631  12.226
  352    HE3  LYS  44           HE1      LYS  44  11.237   4.626  10.933
  353    HZ1  LYS  44           HZ1      LYS  44   9.796   2.493  12.412
  354    HZ2  LYS  44           HZ2      LYS  44   9.141   3.448  11.186
  355    HZ3  LYS  44           HZ3      LYS  44   9.621   4.152  12.629
  356    H    ILE  45           HN       ILE  45  13.187   1.823   5.238
  357    HA   ILE  45           HA       ILE  45  13.218  -1.076   4.988
  358    HB   ILE  45           HB       ILE  45  13.205   1.033   2.820
  359   HG12  ILE  45          HG12      ILE  45  11.096   0.983   4.159
  360   HG13  ILE  45          HG11      ILE  45  10.859   0.515   2.481
  361   HG21  ILE  45          HG21      ILE  45  12.925  -1.958   2.753
  362   HG22  ILE  45          HG22      ILE  45  14.199  -0.983   2.001
  363   HG23  ILE  45          HG23      ILE  45  12.512  -0.885   1.432
  364   HD11  ILE  45          HD11      ILE  45   9.569  -0.897   3.961
  365   HD12  ILE  45          HD12      ILE  45  11.043  -1.351   4.835
  366   HD13  ILE  45          HD13      ILE  45  10.843  -1.793   3.130
  367    HA   PRO  46           HA       PRO  46  17.672  -0.825   4.930
  368    HB2  PRO  46           HB2      PRO  46  18.154  -3.327   3.937
  369    HB3  PRO  46           HB1      PRO  46  17.774  -2.989   5.628
  370    HG2  PRO  46           HG2      PRO  46  15.980  -3.924   3.431
  371    HG3  PRO  46           HG1      PRO  46  16.057  -4.481   5.117
  372    HD2  PRO  46           HD2      PRO  46  14.164  -2.793   4.260
  373    HD3  PRO  46           HD1      PRO  46  14.856  -2.660   5.889
  374    H    TRP  47           HN       TRP  47  18.325   0.521   3.487
  375    HA   TRP  47           HA       TRP  47  18.996   1.541   1.598
  376    HB2  TRP  47           HB2      TRP  47  20.690  -0.937   1.612
  377    HB3  TRP  47           HB1      TRP  47  21.111   0.649   0.972
  378    HD1  TRP  47           HD1      TRP  47  21.549   2.623   2.768
  379    HE1  TRP  47           HE1      TRP  47  22.265   2.522   5.241
  380    HE3  TRP  47           HE3      TRP  47  20.503  -2.282   3.735
  381    HZ2  TRP  47           HZ2      TRP  47  22.362   0.623   7.318
  382    HZ3  TRP  47           HZ3      TRP  47  20.936  -3.162   5.989
  383    HH2  TRP  47           HH2      TRP  47  21.848  -1.734   7.743
  384    H    GLY  48           HN       GLY  48  19.003  -1.803   0.526
  385    HA2  GLY  48           HA3      GLY  48  17.932  -0.847  -2.056
  386    HA3  GLY  48           HA2      GLY  48  19.407  -1.794  -2.038
  387    H    SER  49           HN       SER  49  17.079  -2.696   0.296
  388    HA   SER  49           HA       SER  49  16.801  -5.276  -0.813
  389    HB2  SER  49           HB2      SER  49  16.634  -4.762   1.611
  390    HB3  SER  49           HB1      SER  49  15.114  -3.918   1.314
  391    HG   SER  49           HG       SER  49  15.551  -6.619   0.622
  392    H    MET  50           HN       MET  50  14.846  -2.387  -0.969
  393    HA   MET  50           HA       MET  50  12.721  -3.748  -2.372
  394    HB2  MET  50           HB2      MET  50  11.862  -1.268  -2.580
  395    HB3  MET  50           HB1      MET  50  11.678  -2.189  -1.098
  396    HG2  MET  50           HG2      MET  50  12.404   0.102  -0.658
  397    HG3  MET  50           HG1      MET  50  13.565  -1.113  -0.151
  398    HE1  MET  50           HE1      MET  50  15.286   0.863   0.195
  399    HE2  MET  50           HE2      MET  50  14.138   2.043  -0.437
  400    HE3  MET  50           HE3      MET  50  15.777   1.966  -1.087
  401    H    GLU  51           HN       GLU  51  15.575  -2.437  -3.222
  402    HA   GLU  51           HA       GLU  51  14.950  -1.232  -5.721
  403    HB2  GLU  51           HB3      GLU  51  17.375  -2.369  -4.476
  404    HB3  GLU  51           HB2      GLU  51  17.392  -1.806  -6.139
  405    HG2  GLU  51           HG3      GLU  51  16.702  -0.166  -3.688
  406    HG3  GLU  51           HG2      GLU  51  18.239  -0.102  -4.552
  407    H    LYS  52           HN       LYS  52  15.605  -4.382  -4.614
  408    HA   LYS  52           HA       LYS  52  15.519  -5.512  -7.345
  409    HB2  LYS  52           HB2      LYS  52  16.439  -6.828  -4.780
  410    HB3  LYS  52           HB1      LYS  52  16.625  -7.428  -6.414
  411    HG2  LYS  52           HG2      LYS  52  17.967  -4.899  -5.496
  412    HG3  LYS  52           HG1      LYS  52  18.684  -6.482  -5.236
  413    HD2  LYS  52           HD2      LYS  52  19.693  -5.615  -7.201
  414    HD3  LYS  52           HD1      LYS  52  18.534  -6.816  -7.741
  415    HE2  LYS  52           HE2      LYS  52  16.986  -5.076  -8.416
  416    HE3  LYS  52           HE1      LYS  52  18.039  -3.835  -7.731
  417    HZ1  LYS  52           HZ1      LYS  52  18.719  -5.667  -9.948
  418    HZ2  LYS  52           HZ2      LYS  52  19.697  -4.420  -9.360
  419    HZ3  LYS  52           HZ3      LYS  52  18.255  -4.059 -10.147
  420    H    ALA  53           HN       ALA  53  13.246  -4.619  -5.619
  421    HA   ALA  53           HA       ALA  53  11.958  -7.215  -5.109
  422    HB1  ALA  53           HB1      ALA  53  12.317  -5.870  -3.097
  423    HB2  ALA  53           HB2      ALA  53  10.594  -6.087  -3.434
  424    HB3  ALA  53           HB3      ALA  53  11.384  -4.560  -3.815
  425    H    GLY  54           HN       GLY  54   9.842  -7.541  -5.747
  426    HA2  GLY  54           HA3      GLY  54   8.741  -5.576  -7.620
  427    HA3  GLY  54           HA2      GLY  54   8.576  -7.325  -7.825
  428    HA   PRO  55           HA       PRO  55   4.790  -5.424  -5.748
  429    HB2  PRO  55           HB2      PRO  55   3.113  -7.439  -6.730
  430    HB3  PRO  55           HB1      PRO  55   3.313  -5.828  -7.416
  431    HG2  PRO  55           HG2      PRO  55   4.511  -8.409  -8.258
  432    HG3  PRO  55           HG1      PRO  55   4.056  -7.010  -9.235
  433    HD2  PRO  55           HD2      PRO  55   6.625  -7.582  -8.644
  434    HD3  PRO  55           HD1      PRO  55   6.054  -5.917  -8.833
  435    H    LEU  56           HN       LEU  56   5.429  -8.865  -6.021
  436    HA   LEU  56           HA       LEU  56   4.066  -9.461  -3.526
  437    HB2  LEU  56           HB2      LEU  56   4.660 -11.756  -3.793
  438    HB3  LEU  56           HB1      LEU  56   4.134 -11.153  -5.340
  439    HG   LEU  56           HG       LEU  56   7.028 -11.618  -4.577
  440   HD11  LEU  56          HD11      LEU  56   5.143 -13.318  -6.194
  441   HD12  LEU  56          HD12      LEU  56   5.800 -13.704  -4.600
  442   HD13  LEU  56          HD13      LEU  56   6.871 -13.607  -6.000
  443   HD21  LEU  56          HD21      LEU  56   7.408 -11.520  -7.015
  444   HD22  LEU  56          HD22      LEU  56   6.833  -9.994  -6.365
  445   HD23  LEU  56          HD23      LEU  56   5.722 -11.052  -7.250
  446    H    GLU  57           HN       GLU  57   7.333  -8.843  -4.424
  447    HA   GLU  57           HA       GLU  57   8.381  -9.739  -1.928
  448    HB2  GLU  57           HB3      GLU  57   9.617  -7.934  -4.001
  449    HB3  GLU  57           HB2      GLU  57  10.477  -8.669  -2.655
  450    HG2  GLU  57           HG3      GLU  57   9.160 -10.117  -4.938
  451    HG3  GLU  57           HG2      GLU  57  10.896  -9.904  -4.689
  452    H    MET  58           HN       MET  58   7.380  -6.691  -3.307
  453    HA   MET  58           HA       MET  58   8.054  -4.976  -1.183
  454    HB2  MET  58           HB2      MET  58   5.852  -4.861  -3.228
  455    HB3  MET  58           HB1      MET  58   6.140  -3.551  -2.090
  456    HG2  MET  58           HG2      MET  58   8.252  -4.617  -3.894
  457    HG3  MET  58           HG1      MET  58   7.173  -3.347  -4.468
  458    HE1  MET  58           HE1      MET  58  10.105  -2.858  -4.787
  459    HE2  MET  58           HE2      MET  58  10.350  -1.290  -4.018
  460    HE3  MET  58           HE3      MET  58   8.907  -1.582  -4.983
  461    H    ALA  59           HN       ALA  59   5.103  -6.794  -1.873
  462    HA   ALA  59           HA       ALA  59   3.515  -6.088   0.289
  463    HB1  ALA  59           HB1      ALA  59   2.794  -7.561  -1.543
  464    HB2  ALA  59           HB2      ALA  59   2.485  -8.300   0.028
  465    HB3  ALA  59           HB3      ALA  59   3.863  -8.830  -0.941
  466    H    GLN  60           HN       GLN  60   6.009  -8.578   0.116
  467    HA   GLN  60           HA       GLN  60   5.694  -9.354   2.862
  468    HB2  GLN  60           HB2      GLN  60   7.872 -10.100   0.907
  469    HB3  GLN  60           HB1      GLN  60   7.472 -10.936   2.408
  470    HG2  GLN  60           HG2      GLN  60   5.257 -11.486   1.514
  471    HG3  GLN  60           HG1      GLN  60   5.655 -10.610   0.060
  472   HE21  GLN  60          HE21      GLN  60   7.010 -11.496  -1.438
  473   HE22  GLN  60          HE22      GLN  60   7.519 -13.131  -1.439
  474    H    LEU  61           HN       LEU  61   7.227  -6.834   1.382
  475    HA   LEU  61           HA       LEU  61   9.509  -6.533   3.137
  476    HB2  LEU  61           HB2      LEU  61   9.299  -5.711   0.713
  477    HB3  LEU  61           HB1      LEU  61   8.194  -4.512   1.355
  478    HG   LEU  61           HG       LEU  61  10.075  -3.702   2.799
  479   HD11  LEU  61          HD11      LEU  61  11.651  -5.395   0.890
  480   HD12  LEU  61          HD12      LEU  61  11.513  -5.664   2.630
  481   HD13  LEU  61          HD13      LEU  61  12.338  -4.225   2.016
  482   HD21  LEU  61          HD21      LEU  61  10.312  -3.531  -0.193
  483   HD22  LEU  61          HD22      LEU  61  11.056  -2.421   0.958
  484   HD23  LEU  61          HD23      LEU  61   9.300  -2.518   0.837
  485    H    LEU  62           HN       LEU  62   6.560  -4.611   2.436
  486    HA   LEU  62           HA       LEU  62   6.806  -2.992   4.681
  487    HB2  LEU  62           HB2      LEU  62   4.304  -3.607   3.092
  488    HB3  LEU  62           HB1      LEU  62   4.410  -2.375   4.319
  489    HG   LEU  62           HG       LEU  62   4.509  -1.186   2.355
  490   HD11  LEU  62          HD11      LEU  62   6.724  -0.301   2.060
  491   HD12  LEU  62          HD12      LEU  62   7.362  -1.595   3.078
  492   HD13  LEU  62          HD13      LEU  62   6.222  -0.420   3.744
  493   HD21  LEU  62          HD21      LEU  62   4.699  -3.031   0.804
  494   HD22  LEU  62          HD22      LEU  62   6.399  -3.200   1.215
  495   HD23  LEU  62          HD23      LEU  62   5.835  -1.734   0.406
  496    H    ILE  63           HN       ILE  63   5.151  -6.087   4.219
  497    HA   ILE  63           HA       ILE  63   3.598  -5.991   6.563
  498    HB   ILE  63           HB       ILE  63   3.618  -7.610   4.434
  499   HG12  ILE  63          HG12      ILE  63   1.881  -7.461   6.164
  500   HG13  ILE  63          HG11      ILE  63   2.033  -9.075   5.514
  501   HG21  ILE  63          HG21      ILE  63   4.414  -9.883   4.948
  502   HG22  ILE  63          HG22      ILE  63   5.123  -9.273   6.439
  503   HG23  ILE  63          HG23      ILE  63   5.728  -8.702   4.889
  504   HD11  ILE  63          HD11      ILE  63   3.303  -9.712   7.547
  505   HD12  ILE  63          HD12      ILE  63   1.665  -9.154   7.899
  506   HD13  ILE  63          HD13      ILE  63   3.040  -8.085   8.178
  507    H    THR  64           HN       THR  64   6.933  -6.773   6.053
  508    HA   THR  64           HA       THR  64   7.192  -8.083   8.585
  509    HB   THR  64           HB       THR  64   9.284  -7.316   6.539
  510    HG1  THR  64           HG1      THR  64   8.288  -8.941   5.546
  511   HG21  THR  64          HG21      THR  64   9.447  -9.221   8.903
  512   HG22  THR  64          HG22      THR  64  10.262  -7.663   8.792
  513   HG23  THR  64          HG23      THR  64  10.710  -8.970   7.697
  514    H    HIS  65           HN       HIS  65   8.101  -4.952   7.217
  515    HA   HIS  65           HA       HIS  65   9.430  -4.220   9.671
  516    HB2  HIS  65           HB2      HIS  65   8.870  -2.580   7.195
  517    HB3  HIS  65           HB1      HIS  65   9.758  -1.984   8.592
  518    HD1  HIS  65           HD1      HIS  65  12.154  -3.130   9.030
  519    HD2  HIS  65           HD2      HIS  65  10.291  -4.143   5.453
  520    HE1  HIS  65           HE1      HIS  65  13.926  -4.135   7.579
  521    H    PHE  66           HN       PHE  66   6.455  -3.258   8.038
  522    HA   PHE  66           HA       PHE  66   5.732  -1.534  10.241
  523    HB2  PHE  66           HB2      PHE  66   4.300  -2.210   7.682
  524    HB3  PHE  66           HB1      PHE  66   3.824  -0.946   8.816
  525    HD1  PHE  66           HD2      PHE  66   5.245   1.003   9.137
  526    HD2  PHE  66           HD1      PHE  66   6.113  -1.929   6.222
  527    HE1  PHE  66           HE2      PHE  66   6.906   2.522   8.088
  528    HE2  PHE  66           HE1      PHE  66   7.751  -0.474   5.181
  529    HZ   PHE  66           HZ       PHE  66   8.167   1.742   6.104
  530    H    GLY  67           HN       GLY  67   4.056  -4.201   8.615
  531    HA2  GLY  67           HA3      GLY  67   3.355  -5.913  10.472
  532    HA3  GLY  67           HA2      GLY  67   2.368  -4.515  10.945
  533    HA   PRO  68           HA       PRO  68   0.448  -6.824   7.322
  534    HB2  PRO  68           HB2      PRO  68  -1.860  -7.332   9.009
  535    HB3  PRO  68           HB1      PRO  68  -0.903  -8.477   8.067
  536    HG2  PRO  68           HG2      PRO  68  -0.878  -8.358  10.789
  537    HG3  PRO  68           HG1      PRO  68   0.489  -8.956   9.826
  538    HD2  PRO  68           HD2      PRO  68   0.104  -6.349  11.212
  539    HD3  PRO  68           HD1      PRO  68   1.597  -7.274  10.944
  540    H    GLU  69           HN       GLU  69  -1.588  -5.230   9.755
  541    HA   GLU  69           HA       GLU  69  -3.261  -3.945   7.876
  542    HB2  GLU  69           HB3      GLU  69  -2.710  -2.941  10.659
  543    HB3  GLU  69           HB2      GLU  69  -4.095  -2.567   9.653
  544    HG2  GLU  69           HG3      GLU  69  -4.973  -4.089  11.055
  545    HG3  GLU  69           HG2      GLU  69  -4.492  -5.105   9.716
  546    H    GLU  70           HN       GLU  70  -0.394  -2.953   9.610
  547    HA   GLU  70           HA       GLU  70  -0.397  -0.243   8.802
  548    HB2  GLU  70           HB3      GLU  70   0.840  -1.317  10.754
  549    HB3  GLU  70           HB2      GLU  70   2.049  -1.797   9.571
  550    HG2  GLU  70           HG3      GLU  70   2.702   0.271  10.672
  551    HG3  GLU  70           HG2      GLU  70   2.379   0.556   8.961
  552    H    ALA  71           HN       ALA  71   1.187  -3.133   7.463
  553    HA   ALA  71           HA       ALA  71   2.581  -1.917   5.374
  554    HB1  ALA  71           HB1      ALA  71   2.407  -4.054   4.187
  555    HB2  ALA  71           HB2      ALA  71   1.183  -4.591   5.340
  556    HB3  ALA  71           HB3      ALA  71   2.829  -4.272   5.882
  557    H    TRP  72           HN       TRP  72  -0.748  -3.062   5.523
  558    HA   TRP  72           HA       TRP  72  -1.359  -2.432   2.877
  559    HB2  TRP  72           HB2      TRP  72  -2.789  -3.958   4.094
  560    HB3  TRP  72           HB1      TRP  72  -3.180  -2.718   5.277
  561    HD1  TRP  72           HD1      TRP  72  -5.673  -2.239   4.914
  562    HE1  TRP  72           HE1      TRP  72  -7.140  -1.605   2.884
  563    HE3  TRP  72           HE3      TRP  72  -2.225  -2.734   1.182
  564    HZ2  TRP  72           HZ2      TRP  72  -6.851  -1.326   0.148
  565    HZ3  TRP  72           HZ3      TRP  72  -2.888  -2.277  -1.113
  566    HH2  TRP  72           HH2      TRP  72  -5.170  -1.580  -1.638
  567    H    ARG  73           HN       ARG  73  -1.690  -0.587   5.809
  568    HA   ARG  73           HA       ARG  73  -2.847   1.614   4.552
  569    HB2  ARG  73           HB2      ARG  73  -3.100   1.328   6.906
  570    HB3  ARG  73           HB1      ARG  73  -1.366   1.350   7.158
  571    HG2  ARG  73           HG2      ARG  73  -1.239   3.650   6.836
  572    HG3  ARG  73           HG1      ARG  73  -2.840   3.720   6.086
  573    HD2  ARG  73           HD2      ARG  73  -2.753   4.550   8.445
  574    HD3  ARG  73           HD1      ARG  73  -3.914   3.259   8.157
  575    HE   ARG  73           HE       ARG  73  -1.247   2.718   9.314
  576   HH11  ARG  73          HH11      ARG  73  -4.828   2.291   9.383
  577   HH12  ARG  73          HH12      ARG  73  -4.784   1.406  10.824
  578   HH21  ARG  73          HH21      ARG  73  -1.281   1.437  11.293
  579   HH22  ARG  73          HH22      ARG  73  -2.793   0.912  11.920
  580    H    LEU  74           HN       LEU  74   0.512   0.783   5.246
  581    HA   LEU  74           HA       LEU  74   1.746   3.108   4.249
  582    HB2  LEU  74           HB2      LEU  74   2.581   0.421   5.028
  583    HB3  LEU  74           HB1      LEU  74   3.522   1.047   3.697
  584    HG   LEU  74           HG       LEU  74   4.545   1.399   5.939
  585   HD11  LEU  74          HD11      LEU  74   5.252   2.798   4.115
  586   HD12  LEU  74          HD12      LEU  74   5.178   3.743   5.585
  587   HD13  LEU  74          HD13      LEU  74   3.896   3.894   4.378
  588   HD21  LEU  74          HD21      LEU  74   2.505   1.823   7.216
  589   HD22  LEU  74          HD22      LEU  74   2.263   3.338   6.344
  590   HD23  LEU  74          HD23      LEU  74   3.664   3.138   7.400
  591    H    ALA  75           HN       ALA  75   0.328   0.420   2.631
  592    HA   ALA  75           HA       ALA  75   1.570   1.133   0.123
  593    HB1  ALA  75           HB1      ALA  75   1.081  -1.231   0.520
  594    HB2  ALA  75           HB2      ALA  75   0.198  -0.612  -0.876
  595    HB3  ALA  75           HB3      ALA  75  -0.644  -0.850   0.655
  596    H    LEU  76           HN       LEU  76  -1.793   1.105   1.377
  597    HA   LEU  76           HA       LEU  76  -2.782   2.346  -0.936
  598    HB2  LEU  76           HB2      LEU  76  -4.929   2.496   0.110
  599    HB3  LEU  76           HB1      LEU  76  -4.206   0.991   0.604
  600    HG   LEU  76           HG       LEU  76  -3.580   2.363   2.769
  601   HD11  LEU  76          HD11      LEU  76  -5.304   4.000   3.367
  602   HD12  LEU  76          HD12      LEU  76  -5.971   3.867   1.735
  603   HD13  LEU  76          HD13      LEU  76  -4.353   4.518   1.971
  604   HD21  LEU  76          HD21      LEU  76  -5.023   0.413   2.744
  605   HD22  LEU  76          HD22      LEU  76  -6.369   1.406   2.187
  606   HD23  LEU  76          HD23      LEU  76  -5.690   1.662   3.795
  607    H    SER  77           HN       SER  77  -1.791   3.744   2.153
  608    HA   SER  77           HA       SER  77  -2.573   6.294   1.257
  609    HB2  SER  77           HB2      SER  77  -1.467   5.168   3.707
  610    HB3  SER  77           HB1      SER  77  -1.292   6.937   3.483
  611    HG   SER  77           HG       SER  77  -3.578   6.823   2.971
  612    H    THR  78           HN       THR  78  -0.008   4.514   0.393
  613    HA   THR  78           HA       THR  78   1.533   6.934  -0.055
  614    HB   THR  78           HB       THR  78   2.265   4.025  -0.543
  615    HG1  THR  78           HG1      THR  78   2.867   4.128   1.428
  616   HG21  THR  78          HG21      THR  78   3.397   5.500  -2.151
  617   HG22  THR  78          HG22      THR  78   4.552   4.892  -0.956
  618   HG23  THR  78          HG23      THR  78   3.922   6.536  -0.828
  619    H    PHE  79           HN       PHE  79  -0.520   4.591  -1.571
  620    HA   PHE  79           HA       PHE  79  -0.007   5.081  -4.246
  621    HB2  PHE  79           HB2      PHE  79  -2.650   4.490  -2.890
  622    HB3  PHE  79           HB1      PHE  79  -2.449   4.477  -4.644
  623    HD1  PHE  79           HD1      PHE  79   0.424   3.077  -4.222
  624    HD2  PHE  79           HD2      PHE  79  -3.554   2.304  -2.922
  625    HE1  PHE  79           HE1      PHE  79   0.951   0.699  -4.014
  626    HE2  PHE  79           HE2      PHE  79  -3.026  -0.086  -2.713
  627    HZ   PHE  79           HZ       PHE  79  -0.769  -0.890  -3.260
  628    H    GLU  80           HN       GLU  80  -2.265   6.673  -2.017
  629    HA   GLU  80           HA       GLU  80  -3.299   8.649  -3.701
  630    HB2  GLU  80           HB3      GLU  80  -3.796   9.900  -1.570
  631    HB3  GLU  80           HB2      GLU  80  -4.358   8.232  -1.590
  632    HG2  GLU  80           HG3      GLU  80  -2.538   7.523  -0.278
  633    HG3  GLU  80           HG2      GLU  80  -1.768   9.099  -0.376
  634    H    ARG  81           HN       ARG  81  -0.201   8.496  -2.179
  635    HA   ARG  81           HA       ARG  81   0.306  11.346  -2.218
  636    HB2  ARG  81           HB2      ARG  81   2.232   9.086  -1.723
  637    HB3  ARG  81           HB1      ARG  81   2.485  10.785  -1.342
  638    HG2  ARG  81           HG2      ARG  81   0.332   9.068  -0.137
  639    HG3  ARG  81           HG1      ARG  81   1.902   9.411   0.581
  640    HD2  ARG  81           HD2      ARG  81   1.387  11.532   1.080
  641    HD3  ARG  81           HD1      ARG  81   0.238  11.713  -0.254
  642    HE   ARG  81           HE       ARG  81  -1.401  10.623   1.033
  643   HH11  ARG  81          HH11      ARG  81   1.556  11.060   3.009
  644   HH12  ARG  81          HH12      ARG  81   0.693  10.860   4.465
  645   HH21  ARG  81          HH21      ARG  81  -2.463  10.335   2.970
  646   HH22  ARG  81          HH22      ARG  81  -1.622  10.420   4.468
  647    H    ILE  82           HN       ILE  82   1.127   8.528  -4.107
  648    HA   ILE  82           HA       ILE  82   3.006  10.014  -5.766
  649    HB   ILE  82           HB       ILE  82   3.524   7.863  -6.803
  650   HG12  ILE  82          HG12      ILE  82   1.431   6.678  -4.963
  651   HG13  ILE  82          HG11      ILE  82   1.225   6.910  -6.695
  652   HG21  ILE  82          HG21      ILE  82   4.387   6.697  -4.850
  653   HG22  ILE  82          HG22      ILE  82   3.386   7.704  -3.792
  654   HG23  ILE  82          HG23      ILE  82   4.686   8.433  -4.754
  655   HD11  ILE  82          HD11      ILE  82   3.265   5.134  -5.380
  656   HD12  ILE  82          HD12      ILE  82   3.034   5.332  -7.120
  657   HD13  ILE  82          HD13      ILE  82   1.766   4.600  -6.139
  658    H    ASN  83           HN       ASN  83   0.026  10.448  -5.822
  659    HA   ASN  83           HA       ASN  83  -1.658  10.790  -7.210
  660    HB2  ASN  83           HB3      ASN  83   0.614  10.956  -9.152
  661    HB3  ASN  83           HB2      ASN  83  -1.047  10.985  -9.739
  662   HD21  ASN  83          HD21      ASN  83  -2.122  12.407  -7.460
  663   HD22  ASN  83          HD22      ASN  83  -1.528  14.013  -7.555
  664    H    ARG  84           HN       ARG  84  -1.202   8.232  -6.446
  665    HA   ARG  84           HA       ARG  84  -2.412   6.780  -8.662
  666    HB2  ARG  84           HB2      ARG  84  -0.212   5.883  -8.007
  667    HB3  ARG  84           HB1      ARG  84  -0.728   5.787  -6.333
  668    HG2  ARG  84           HG2      ARG  84  -0.634   3.637  -7.556
  669    HG3  ARG  84           HG1      ARG  84  -2.197   3.992  -6.815
  670    HD2  ARG  84           HD2      ARG  84  -2.500   3.103  -9.029
  671    HD3  ARG  84           HD1      ARG  84  -3.036   4.778  -8.902
  672    HE   ARG  84           HE       ARG  84  -0.363   4.769  -9.829
  673   HH11  ARG  84          HH11      ARG  84  -3.564   3.874 -11.072
  674   HH12  ARG  84          HH12      ARG  84  -3.100   4.060 -12.685
  675   HH21  ARG  84          HH21      ARG  84   0.213   5.043 -11.945
  676   HH22  ARG  84          HH22      ARG  84  -0.886   4.735 -13.234
  677    H    LYS  85           HN       LYS  85  -3.901   8.485  -7.365
  678    HA   LYS  85           HA       LYS  85  -5.076   7.681  -4.922
  679    HB2  LYS  85           HB2      LYS  85  -4.948  10.001  -5.594
  680    HB3  LYS  85           HB1      LYS  85  -5.842   9.675  -7.068
  681    HG2  LYS  85           HG2      LYS  85  -7.844   9.205  -5.721
  682    HG3  LYS  85           HG1      LYS  85  -6.899   9.527  -4.263
  683    HD2  LYS  85           HD2      LYS  85  -6.533  11.808  -4.922
  684    HD3  LYS  85           HD1      LYS  85  -7.327  11.522  -6.470
  685    HE2  LYS  85           HE2      LYS  85  -8.674  11.246  -3.787
  686    HE3  LYS  85           HE1      LYS  85  -8.749  12.691  -4.786
  687    HZ1  LYS  85           HZ1      LYS  85 -10.689  11.200  -5.054
  688    HZ2  LYS  85           HZ2      LYS  85  -9.705  10.017  -5.760
  689    HZ3  LYS  85           HZ3      LYS  85  -9.888  11.509  -6.472
  690    H    ASP  86           HN       ASP  86  -5.407   7.037  -8.214
  691    HA   ASP  86           HA       ASP  86  -7.995   6.246  -8.557
  692    HB2  ASP  86           HB2      ASP  86  -6.562   6.591 -10.426
  693    HB3  ASP  86           HB1      ASP  86  -5.439   5.359  -9.875
  694    H    LEU  87           HN       LEU  87  -5.152   4.443  -7.552
  695    HA   LEU  87           HA       LEU  87  -6.505   1.907  -7.301
  696    HB2  LEU  87           HB2      LEU  87  -4.100   2.222  -7.972
  697    HB3  LEU  87           HB1      LEU  87  -3.805   2.763  -6.326
  698    HG   LEU  87           HG       LEU  87  -4.337   0.598  -5.487
  699   HD11  LEU  87          HD11      LEU  87  -4.645  -0.132  -8.399
  700   HD12  LEU  87          HD12      LEU  87  -5.941  -0.098  -7.206
  701   HD13  LEU  87          HD13      LEU  87  -4.638  -1.283  -7.061
  702   HD21  LEU  87          HD21      LEU  87  -2.377  -0.550  -6.403
  703   HD22  LEU  87          HD22      LEU  87  -2.079   1.171  -6.090
  704   HD23  LEU  87          HD23      LEU  87  -2.362   0.612  -7.736
  705    H    TRP  88           HN       TRP  88  -5.412   4.546  -5.342
  706    HA   TRP  88           HA       TRP  88  -5.610   3.539  -2.762
  707    HB2  TRP  88           HB2      TRP  88  -4.534   5.604  -3.293
  708    HB3  TRP  88           HB1      TRP  88  -5.995   6.270  -3.934
  709    HD1  TRP  88           HD1      TRP  88  -4.763   5.040  -0.493
  710    HE1  TRP  88           HE1      TRP  88  -5.798   6.545   1.331
  711    HE3  TRP  88           HE3      TRP  88  -7.703   7.947  -3.430
  712    HZ2  TRP  88           HZ2      TRP  88  -7.639   8.667   1.498
  713    HZ3  TRP  88           HZ3      TRP  88  -9.085   9.701  -2.373
  714    HH2  TRP  88           HH2      TRP  88  -9.047  10.048   0.037
  715    H    GLU  89           HN       GLU  89  -8.025   5.092  -4.791
  716    HA   GLU  89           HA       GLU  89 -10.121   5.030  -2.932
  717    HB2  GLU  89           HB3      GLU  89 -10.061   5.305  -5.903
  718    HB3  GLU  89           HB2      GLU  89 -11.568   5.296  -4.994
  719    HG2  GLU  89           HG3      GLU  89 -10.860   7.227  -3.719
  720    HG3  GLU  89           HG2      GLU  89  -9.271   7.161  -4.470
  721    H    ARG  90           HN       ARG  90  -8.798   2.498  -4.701
  722    HA   ARG  90           HA       ARG  90 -11.179   0.798  -4.490
  723    HB2  ARG  90           HB2      ARG  90  -8.339   0.005  -5.032
  724    HB3  ARG  90           HB1      ARG  90  -9.725  -1.050  -5.188
  725    HG2  ARG  90           HG2      ARG  90 -10.373   0.427  -7.152
  726    HG3  ARG  90           HG1      ARG  90  -8.764   1.171  -6.983
  727    HD2  ARG  90           HD2      ARG  90  -7.902  -1.255  -6.842
  728    HD3  ARG  90           HD1      ARG  90  -9.454  -1.694  -7.521
  729    HE   ARG  90           HE       ARG  90  -8.391   0.152  -9.257
  730   HH11  ARG  90          HH11      ARG  90  -7.519  -3.030  -7.934
  731   HH12  ARG  90          HH12      ARG  90  -6.512  -3.485  -9.209
  732   HH21  ARG  90          HH21      ARG  90  -6.903  -0.453 -11.034
  733   HH22  ARG  90          HH22      ARG  90  -6.129  -1.988 -10.995
  734    H    GLY  91           HN       GLY  91  -8.357   1.674  -2.677
  735    HA2  GLY  91           HA3      GLY  91  -8.353  -0.812  -1.163
  736    HA3  GLY  91           HA2      GLY  91  -7.086   0.399  -1.182
  737    H    GLN  92           HN       GLN  92 -10.107   1.786  -0.742
  738    HA   GLN  92           HA       GLN  92  -9.415   2.342   2.009
  739    HB2  GLN  92           HB2      GLN  92 -11.819   3.259   0.408
  740    HB3  GLN  92           HB1      GLN  92 -11.380   3.837   2.013
  741    HG2  GLN  92           HG2      GLN  92  -9.318   4.775   1.142
  742    HG3  GLN  92           HG1      GLN  92  -9.689   4.145  -0.459
  743   HE21  GLN  92          HE21      GLN  92  -9.636   6.168  -1.365
  744   HE22  GLN  92          HE22      GLN  92 -10.905   7.321  -1.106
  745    H    ARG  93           HN       ARG  93  -9.454   0.462   2.903
  746    HA   ARG  93           HA       ARG  93 -12.058  -0.864   3.099
  747    HB2  ARG  93           HB2      ARG  93 -10.173  -2.087   1.990
  748    HB3  ARG  93           HB1      ARG  93  -9.344  -2.095   3.528
  749    HG2  ARG  93           HG2      ARG  93 -10.467  -4.221   3.056
  750    HG3  ARG  93           HG1      ARG  93 -11.095  -3.446   4.514
  751    HD2  ARG  93           HD2      ARG  93 -13.005  -2.632   3.324
  752    HD3  ARG  93           HD1      ARG  93 -12.364  -3.209   1.794
  753    HE   ARG  93           HE       ARG  93 -12.536  -5.499   2.822
  754   HH11  ARG  93          HH11      ARG  93 -14.810  -2.912   3.759
  755   HH12  ARG  93          HH12      ARG  93 -16.023  -3.975   4.248
  756   HH21  ARG  93          HH21      ARG  93 -14.244  -6.957   3.448
  757   HH22  ARG  93          HH22      ARG  93 -15.711  -6.326   4.062
  758    H    GLU  94           HN       GLU  94  -9.534   0.664   5.004
  759    HA   GLU  94           HA       GLU  94 -10.468  -0.656   7.358
  760    HB2  GLU  94           HB3      GLU  94  -8.860   0.655   8.643
  761    HB3  GLU  94           HB2      GLU  94  -8.094  -0.189   7.312
  762    HG2  GLU  94           HG3      GLU  94  -7.884   1.893   6.091
  763    HG3  GLU  94           HG2      GLU  94  -8.793   2.746   7.341
  764    H    ASP  95           HN       ASP  95 -10.848   0.828   9.348
  765    HA   ASP  95           HA       ASP  95 -13.184   2.397   8.549
  766    HB2  ASP  95           HB2      ASP  95 -13.527   0.384   9.967
  767    HB3  ASP  95           HB1      ASP  95 -12.500   1.098  11.199
  768    H    LEU  96           HN       LEU  96 -13.717   4.085  10.372
  769    HA   LEU  96           HA       LEU  96 -11.904   6.194  10.254
  770    HB2  LEU  96           HB2      LEU  96 -14.287   6.499  10.611
  771    HB3  LEU  96           HB1      LEU  96 -14.185   5.686  12.155
  772    HG   LEU  96           HG       LEU  96 -12.770   7.551  13.002
  773   HD11  LEU  96          HD11      LEU  96 -13.454   8.859  10.382
  774   HD12  LEU  96          HD12      LEU  96 -11.847   8.352  10.909
  775   HD13  LEU  96          HD13      LEU  96 -12.689   9.647  11.759
  776   HD21  LEU  96          HD21      LEU  96 -15.163   7.510  13.437
  777   HD22  LEU  96          HD22      LEU  96 -15.465   8.350  11.912
  778   HD23  LEU  96          HD23      LEU  96 -14.598   9.165  13.209
  779    H    VAL  97           HN       VAL  97 -10.266   6.820  11.458
  780    HA   VAL  97           HA       VAL  97  -8.965   5.250  13.372
  781    HB   VAL  97           HB       VAL  97  -8.807   8.273  13.010
  782   HG11  VAL  97          HG11      VAL  97  -6.840   6.389  14.314
  783   HG12  VAL  97          HG12      VAL  97  -7.833   7.591  15.138
  784   HG13  VAL  97          HG13      VAL  97  -6.574   8.107  14.015
  785   HG21  VAL  97          HG21      VAL  97  -8.314   7.102  10.945
  786   HG22  VAL  97          HG22      VAL  97  -7.146   6.077  11.776
  787   HG23  VAL  97          HG23      VAL  97  -6.843   7.807  11.611
  788    H    ARG  98           HN       ARG  98  -9.070   5.187  15.569
  789    HA   ARG  98           HA       ARG  98 -11.513   6.109  16.731
  790    HB2  ARG  98           HB2      ARG  98  -9.288   4.403  17.774
  791    HB3  ARG  98           HB1      ARG  98 -10.617   4.952  18.779
  792    HG2  ARG  98           HG2      ARG  98 -10.913   3.359  16.269
  793    HG3  ARG  98           HG1      ARG  98 -10.949   2.685  17.913
  794    HD2  ARG  98           HD2      ARG  98 -12.897   4.611  16.635
  795    HD3  ARG  98           HD1      ARG  98 -13.191   2.968  17.194
  796    HE   ARG  98           HE       ARG  98 -12.308   4.382  19.389
  797   HH11  ARG  98          HH11      ARG  98 -15.154   4.385  17.269
  798   HH12  ARG  98          HH12      ARG  98 -16.158   5.166  18.401
  799   HH21  ARG  98          HH21      ARG  98 -13.644   5.415  20.900
  800   HH22  ARG  98          HH22      ARG  98 -15.286   5.765  20.551
  801    H    ASP  99           HN       ASP  99 -11.806   7.817  17.711
  802    HA   ASP  99           HA       ASP  99  -9.698   8.959  19.349
  803    HB2  ASP  99           HB2      ASP  99 -10.457  11.278  18.857
  804    HB3  ASP  99           HB1      ASP  99  -9.924  10.473  17.397
  805    H    THR 100           HN       THR 100 -10.695   7.486  20.749
  806    HA   THR 100           HA       THR 100 -13.383   7.761  21.665
  807    HB   THR 100           HB       THR 100 -11.097   6.548  23.095
  808    HG1  THR 100           HG1      THR 100 -10.888   5.327  21.329
  809   HG21  THR 100          HG21      THR 100 -14.018   5.765  22.935
  810   HG22  THR 100          HG22      THR 100 -13.212   6.530  24.304
  811   HG23  THR 100          HG23      THR 100 -12.794   4.879  23.844
  812    H    VAL 101           HN       VAL 101 -14.057   8.741  23.563
  813    HA   VAL 101           HA       VAL 101 -12.048  10.351  24.945
  814    HB   VAL 101           HB       VAL 101 -13.858  12.032  25.371
  815   HG11  VAL 101          HG11      VAL 101 -13.213  11.324  22.519
  816   HG12  VAL 101          HG12      VAL 101 -12.225  12.315  23.580
  817   HG13  VAL 101          HG13      VAL 101 -13.808  12.910  23.031
  818   HG21  VAL 101          HG21      VAL 101 -15.788  10.550  25.045
  819   HG22  VAL 101          HG22      VAL 101 -15.334  10.351  23.355
  820   HG23  VAL 101          HG23      VAL 101 -15.872  11.932  23.939
  821    H    GLU 102           HN       GLU 102 -14.678   8.117  25.262
  822    HA   GLU 102           HA       GLU 102 -13.908   7.554  27.889
  823    HB2  GLU 102           HB3      GLU 102 -16.122   7.948  28.976
  824    HB3  GLU 102           HB2      GLU 102 -15.279   9.425  28.550
  825    HG2  GLU 102           HG3      GLU 102 -16.758   9.772  26.672
  826    HG3  GLU 102           HG2      GLU 102 -17.502   8.196  26.940
  Start of MODEL   15
    1    H1   GLY   1           HT1      GLY   1 -23.587  -8.152  17.454
    2    H2   GLY   1           HT2      GLY   1 -21.986  -8.015  16.944
    3    H3   GLY   1           HT3      GLY   1 -22.385  -7.693  18.532
    4    HA2  GLY   1           HA2      GLY   1 -21.320  -9.840  18.316
    5    HA3  GLY   1           HA3      GLY   1 -22.955  -9.965  18.947
    6    H    HIS   2           HN       HIS   2 -24.666 -10.326  17.222
    7    HA   HIS   2           HA       HIS   2 -23.743 -12.474  15.564
    8    HB2  HIS   2           HB2      HIS   2 -26.175 -12.798  14.928
    9    HB3  HIS   2           HB1      HIS   2 -25.848 -12.925  16.645
   10    HD1  HIS   2           HD1      HIS   2 -27.735 -10.838  14.136
   11    HD2  HIS   2           HD2      HIS   2 -26.981 -10.913  18.222
   12    HE1  HIS   2           HE1      HIS   2 -29.367  -9.234  15.174
   13    H    MET   3           HN       MET   3 -22.347 -11.107  14.354
   14    HA   MET   3           HA       MET   3 -23.526 -10.511  11.823
   15    HB2  MET   3           HB2      MET   3 -22.667  -8.235  11.624
   16    HB3  MET   3           HB1      MET   3 -23.787  -8.330  12.974
   17    HG2  MET   3           HG2      MET   3 -21.935  -8.371  14.544
   18    HG3  MET   3           HG1      MET   3 -20.780  -8.370  13.214
   19    HE1  MET   3           HE1      MET   3 -21.320  -4.780  11.688
   20    HE2  MET   3           HE2      MET   3 -22.165  -6.238  11.186
   21    HE3  MET   3           HE3      MET   3 -20.440  -6.302  11.548
   22    H    LEU   4           HN       LEU   4 -21.867 -10.266  10.216
   23    HA   LEU   4           HA       LEU   4 -19.324 -11.428  11.070
   24    HB2  LEU   4           HB2      LEU   4 -20.634 -12.644   9.330
   25    HB3  LEU   4           HB1      LEU   4 -20.547 -11.232   8.305
   26    HG   LEU   4           HG       LEU   4 -18.088 -11.495   8.176
   27   HD11  LEU   4          HD11      LEU   4 -17.058 -13.576   8.963
   28   HD12  LEU   4          HD12      LEU   4 -18.575 -14.036   9.730
   29   HD13  LEU   4          HD13      LEU   4 -17.692 -12.614  10.295
   30   HD21  LEU   4          HD21      LEU   4 -19.674 -13.944   7.403
   31   HD22  LEU   4          HD22      LEU   4 -18.107 -13.479   6.742
   32   HD23  LEU   4          HD23      LEU   4 -19.520 -12.462   6.459
   33    H    ARG   5           HN       ARG   5 -17.748 -10.021  11.272
   34    HA   ARG   5           HA       ARG   5 -18.076  -7.315  10.439
   35    HB2  ARG   5           HB2      ARG   5 -15.832  -8.729  11.850
   36    HB3  ARG   5           HB1      ARG   5 -15.768  -7.032  11.422
   37    HG2  ARG   5           HG2      ARG   5 -17.556  -6.504  12.871
   38    HG3  ARG   5           HG1      ARG   5 -17.969  -8.205  13.089
   39    HD2  ARG   5           HD2      ARG   5 -16.749  -7.231  15.023
   40    HD3  ARG   5           HD1      ARG   5 -15.946  -8.615  14.291
   41    HE   ARG   5           HE       ARG   5 -15.009  -6.105  13.265
   42   HH11  ARG   5          HH11      ARG   5 -14.688  -8.426  15.909
   43   HH12  ARG   5          HH12      ARG   5 -13.078  -8.032  16.265
   44   HH21  ARG   5          HH21      ARG   5 -12.739  -5.540  13.757
   45   HH22  ARG   5          HH22      ARG   5 -11.943  -6.362  15.012
   46    H    THR   6           HN       THR   6 -14.878  -8.704  10.029
   47    HA   THR   6           HA       THR   6 -14.999  -7.848   7.222
   48    HB   THR   6           HB       THR   6 -12.518  -7.983   8.980
   49    HG1  THR   6           HG1      THR   6 -12.863  -5.651   9.166
   50   HG21  THR   6          HG21      THR   6 -11.626  -6.367   7.333
   51   HG22  THR   6          HG22      THR   6 -13.149  -6.432   6.445
   52   HG23  THR   6          HG23      THR   6 -12.125  -7.863   6.542
   53    H    ALA   7           HN       ALA   7 -15.129 -10.436   9.117
   54    HA   ALA   7           HA       ALA   7 -14.971 -12.645   8.880
   55    HB1  ALA   7           HB1      ALA   7 -14.252 -12.088   5.996
   56    HB2  ALA   7           HB2      ALA   7 -15.890 -12.257   6.621
   57    HB3  ALA   7           HB3      ALA   7 -14.786 -13.633   6.658
   58    H    GLY   8           HN       GLY   8 -12.598 -10.944   9.520
   59    HA2  GLY   8           HA3      GLY   8 -10.755 -12.545  10.371
   60    HA3  GLY   8           HA2      GLY   8 -10.441 -12.694   8.640
   61    H    ARG   9           HN       ARG   9  -9.037 -11.303   7.783
   62    HA   ARG   9           HA       ARG   9  -8.907  -8.593   8.705
   63    HB2  ARG   9           HB2      ARG   9  -6.474  -8.663   9.128
   64    HB3  ARG   9           HB1      ARG   9  -7.364  -9.639  10.287
   65    HG2  ARG   9           HG2      ARG   9  -6.703 -11.665   9.167
   66    HG3  ARG   9           HG1      ARG   9  -5.959 -10.743   7.862
   67    HD2  ARG   9           HD2      ARG   9  -4.262 -11.576   9.382
   68    HD3  ARG   9           HD1      ARG   9  -4.337  -9.823   9.457
   69    HE   ARG   9           HE       ARG   9  -5.936 -11.079  11.466
   70   HH11  ARG   9          HH11      ARG   9  -2.666 -10.012  10.669
   71   HH12  ARG   9          HH12      ARG   9  -2.137  -9.958  12.288
   72   HH21  ARG   9          HH21      ARG   9  -5.183 -11.036  13.701
   73   HH22  ARG   9          HH22      ARG   9  -3.571 -10.585  14.033
   74    H    ASP  10           HN       ASP  10  -8.016  -7.258   7.113
   75    HA   ASP  10           HA       ASP  10  -7.226  -8.634   4.640
   76    HB2  ASP  10           HB2      ASP  10  -8.113  -6.820   3.344
   77    HB3  ASP  10           HB1      ASP  10  -9.349  -7.184   4.533
   78    H    GLY  11           HN       GLY  11  -5.386  -7.916   3.598
   79    HA2  GLY  11           HA3      GLY  11  -3.873  -5.699   4.266
   80    HA3  GLY  11           HA2      GLY  11  -3.372  -6.978   5.360
   81    H    LEU  12           HN       LEU  12  -2.248  -8.711   4.588
   82    HA   LEU  12           HA       LEU  12  -0.305  -8.124   2.715
   83    HB2  LEU  12           HB2      LEU  12  -0.016  -9.708   4.567
   84    HB3  LEU  12           HB1      LEU  12  -1.101 -10.827   3.806
   85    HG   LEU  12           HG       LEU  12   1.356 -11.420   3.738
   86   HD11  LEU  12          HD11      LEU  12  -0.021 -11.252   1.074
   87   HD12  LEU  12          HD12      LEU  12  -0.169 -12.548   2.265
   88   HD13  LEU  12          HD13      LEU  12   1.373 -12.264   1.461
   89   HD21  LEU  12          HD21      LEU  12   1.496  -9.218   1.678
   90   HD22  LEU  12          HD22      LEU  12   2.783 -10.366   2.057
   91   HD23  LEU  12          HD23      LEU  12   2.259  -9.199   3.264
   92    H    CYS  13           HN       CYS  13  -3.139 -10.196   2.171
   93    HA   CYS  13           HA       CYS  13  -2.316 -10.926  -0.455
   94    HB2  CYS  13           HB2      CYS  13  -3.908 -12.285   0.866
   95    HB3  CYS  13           HB1      CYS  13  -5.099 -10.997   0.739
   96    HG   CYS  13           HG       CYS  13  -3.893 -12.095  -2.195
   97    H    ARG  14           HN       ARG  14  -4.528  -8.510   0.803
   98    HA   ARG  14           HA       ARG  14  -5.453  -7.478  -1.646
   99    HB2  ARG  14           HB2      ARG  14  -6.340  -7.203   0.748
  100    HB3  ARG  14           HB1      ARG  14  -5.127  -5.952   0.937
  101    HG2  ARG  14           HG2      ARG  14  -6.174  -4.642  -0.763
  102    HG3  ARG  14           HG1      ARG  14  -7.306  -5.954  -1.120
  103    HD2  ARG  14           HD2      ARG  14  -8.087  -5.815   1.250
  104    HD3  ARG  14           HD1      ARG  14  -7.095  -4.365   1.428
  105    HE   ARG  14           HE       ARG  14  -8.927  -4.402  -0.771
  106   HH11  ARG  14          HH11      ARG  14  -8.614  -3.630   2.694
  107   HH12  ARG  14          HH12      ARG  14  -9.733  -2.340   2.629
  108   HH21  ARG  14          HH21      ARG  14 -10.418  -2.587  -0.829
  109   HH22  ARG  14          HH22      ARG  14 -10.713  -1.691   0.582
  110    H    LEU  15           HN       LEU  15  -2.807  -6.626   0.494
  111    HA   LEU  15           HA       LEU  15  -1.704  -4.403  -0.688
  112    HB2  LEU  15           HB2      LEU  15  -1.134  -5.282   1.494
  113    HB3  LEU  15           HB1      LEU  15  -0.468  -6.724   0.770
  114    HG   LEU  15           HG       LEU  15   1.347  -5.355  -0.201
  115   HD11  LEU  15          HD11      LEU  15   0.112  -3.167   1.439
  116   HD12  LEU  15          HD12      LEU  15   0.160  -3.229  -0.324
  117   HD13  LEU  15          HD13      LEU  15   1.655  -3.086   0.601
  118   HD21  LEU  15          HD21      LEU  15   2.496  -4.973   1.908
  119   HD22  LEU  15          HD22      LEU  15   1.628  -6.508   1.912
  120   HD23  LEU  15          HD23      LEU  15   0.968  -5.115   2.771
  121    H    SER  16           HN       SER  16  -0.877  -7.837  -1.174
  122    HA   SER  16           HA       SER  16   1.062  -7.499  -3.144
  123    HB2  SER  16           HB2      SER  16  -0.837  -9.841  -2.784
  124    HB3  SER  16           HB1      SER  16   0.696  -9.879  -3.655
  125    HG   SER  16           HG       SER  16   0.285  -9.468  -0.867
  126    H    THR  17           HN       THR  17  -2.422  -7.988  -3.412
  127    HA   THR  17           HA       THR  17  -2.593  -8.179  -6.196
  128    HB   THR  17           HB       THR  17  -4.713  -7.174  -4.267
  129    HG1  THR  17           HG1      THR  17  -3.973  -9.221  -3.615
  130   HG21  THR  17          HG21      THR  17  -4.958  -8.500  -6.985
  131   HG22  THR  17          HG22      THR  17  -5.275  -6.801  -6.644
  132   HG23  THR  17          HG23      THR  17  -6.306  -8.049  -5.940
  133    H    TYR  18           HN       TYR  18  -2.903  -5.317  -4.066
  134    HA   TYR  18           HA       TYR  18  -3.435  -3.628  -6.292
  135    HB2  TYR  18           HB2      TYR  18  -3.023  -3.055  -3.389
  136    HB3  TYR  18           HB1      TYR  18  -3.060  -1.739  -4.565
  137    HD1  TYR  18           HD1      TYR  18  -5.024  -1.606  -6.103
  138    HD2  TYR  18           HD2      TYR  18  -5.051  -3.955  -2.584
  139    HE1  TYR  18           HE1      TYR  18  -7.466  -1.645  -6.170
  140    HE2  TYR  18           HE2      TYR  18  -7.502  -4.003  -2.621
  141    HH   TYR  18           HH       TYR  18  -9.392  -2.616  -3.609
  142    H    LEU  19           HN       LEU  19  -0.517  -4.455  -4.606
  143    HA   LEU  19           HA       LEU  19   0.978  -2.375  -5.831
  144    HB2  LEU  19           HB2      LEU  19   1.837  -4.927  -4.486
  145    HB3  LEU  19           HB1      LEU  19   2.977  -3.774  -5.149
  146    HG   LEU  19           HG       LEU  19   0.986  -3.101  -2.952
  147   HD11  LEU  19          HD11      LEU  19   2.589  -4.721  -2.171
  148   HD12  LEU  19          HD12      LEU  19   2.890  -3.136  -1.467
  149   HD13  LEU  19          HD13      LEU  19   3.921  -3.733  -2.775
  150   HD21  LEU  19          HD21      LEU  19   1.677  -1.189  -4.330
  151   HD22  LEU  19          HD22      LEU  19   3.365  -1.596  -4.036
  152   HD23  LEU  19          HD23      LEU  19   2.331  -1.099  -2.699
  153    H    GLU  20           HN       GLU  20  -0.128  -5.422  -6.940
  154    HA   GLU  20           HA       GLU  20   1.726  -5.746  -9.073
  155    HB2  GLU  20           HB3      GLU  20  -1.085  -6.771  -8.728
  156    HB3  GLU  20           HB2      GLU  20  -0.061  -7.177 -10.094
  157    HG2  GLU  20           HG3      GLU  20   1.571  -8.147  -8.522
  158    HG3  GLU  20           HG2      GLU  20   0.444  -7.821  -7.207
  159    H    GLU  21           HN       GLU  21  -0.927  -3.674  -8.582
  160    HA   GLU  21           HA       GLU  21  -1.325  -3.198 -11.392
  161    HB2  GLU  21           HB3      GLU  21  -2.663  -2.137  -8.929
  162    HB3  GLU  21           HB2      GLU  21  -3.005  -1.501 -10.534
  163    HG2  GLU  21           HG3      GLU  21  -3.325  -4.375  -9.707
  164    HG3  GLU  21           HG2      GLU  21  -4.636  -3.197  -9.835
  165    H    LEU  22           HN       LEU  22   0.983  -2.269  -9.374
  166    HA   LEU  22           HA       LEU  22   1.166   0.414 -10.523
  167    HB2  LEU  22           HB2      LEU  22   2.772  -0.862  -8.301
  168    HB3  LEU  22           HB1      LEU  22   3.056   0.731  -8.940
  169    HG   LEU  22           HG       LEU  22   0.637  -0.180  -7.399
  170   HD11  LEU  22          HD11      LEU  22   2.889   1.712  -6.758
  171   HD12  LEU  22          HD12      LEU  22   2.586   0.135  -6.022
  172   HD13  LEU  22          HD13      LEU  22   1.458   1.464  -5.765
  173   HD21  LEU  22          HD21      LEU  22   1.258   2.531  -8.592
  174   HD22  LEU  22          HD22      LEU  22  -0.072   2.178  -7.491
  175   HD23  LEU  22          HD23      LEU  22  -0.044   1.447  -9.094
  176    H    GLU  23           HN       GLU  23   2.852   0.959 -11.826
  177    HA   GLU  23           HA       GLU  23   4.165  -1.175 -13.216
  178    HB2  GLU  23           HB3      GLU  23   4.732   1.795 -13.356
  179    HB3  GLU  23           HB2      GLU  23   5.212   0.569 -14.509
  180    HG2  GLU  23           HG3      GLU  23   2.410   1.452 -13.934
  181    HG3  GLU  23           HG2      GLU  23   3.389   1.874 -15.340
  182    H    ALA  24           HN       ALA  24   6.630  -1.008 -13.510
  183    HA   ALA  24           HA       ALA  24   7.899  -1.377 -11.030
  184    HB1  ALA  24           HB1      ALA  24   8.709  -2.384 -13.135
  185    HB2  ALA  24           HB2      ALA  24   9.986  -1.503 -12.298
  186    HB3  ALA  24           HB3      ALA  24   9.197  -0.785 -13.702
  187    H    VAL  25           HN       VAL  25   7.761   1.354 -13.197
  188    HA   VAL  25           HA       VAL  25   9.479   3.067 -11.776
  189    HB   VAL  25           HB       VAL  25   8.868   3.565 -14.100
  190   HG11  VAL  25          HG11      VAL  25   6.554   2.758 -14.084
  191   HG12  VAL  25          HG12      VAL  25   6.661   4.409 -14.710
  192   HG13  VAL  25          HG13      VAL  25   6.105   4.125 -13.061
  193   HG21  VAL  25          HG21      VAL  25   9.545   5.458 -12.741
  194   HG22  VAL  25          HG22      VAL  25   7.866   5.666 -12.218
  195   HG23  VAL  25          HG23      VAL  25   8.295   5.936 -13.904
  196    H    GLU  26           HN       GLU  26   6.066   2.374 -11.438
  197    HA   GLU  26           HA       GLU  26   5.486   4.529  -9.656
  198    HB2  GLU  26           HB3      GLU  26   4.010   1.961 -10.175
  199    HB3  GLU  26           HB2      GLU  26   3.357   3.326  -9.273
  200    HG2  GLU  26           HG3      GLU  26   4.150   3.299 -12.168
  201    HG3  GLU  26           HG2      GLU  26   2.498   3.235 -11.544
  202    H    LEU  27           HN       LEU  27   6.264   1.137  -9.339
  203    HA   LEU  27           HA       LEU  27   6.031   0.885  -6.555
  204    HB2  LEU  27           HB2      LEU  27   7.844  -0.537  -8.503
  205    HB3  LEU  27           HB1      LEU  27   7.607  -1.022  -6.840
  206    HG   LEU  27           HG       LEU  27   5.413  -0.963  -8.911
  207   HD11  LEU  27          HD11      LEU  27   7.121  -2.610  -9.477
  208   HD12  LEU  27          HD12      LEU  27   5.638  -3.384  -8.935
  209   HD13  LEU  27          HD13      LEU  27   7.023  -3.279  -7.847
  210   HD21  LEU  27          HD21      LEU  27   4.204  -2.322  -7.258
  211   HD22  LEU  27          HD22      LEU  27   4.604  -0.730  -6.620
  212   HD23  LEU  27          HD23      LEU  27   5.550  -2.138  -6.131
  213    H    LYS  28           HN       LYS  28   8.616   1.990  -8.613
  214    HA   LYS  28           HA       LYS  28  10.659   2.222  -6.686
  215    HB2  LYS  28           HB2      LYS  28  10.894   2.314  -9.198
  216    HB3  LYS  28           HB1      LYS  28  10.244   3.941  -9.136
  217    HG2  LYS  28           HG2      LYS  28  12.135   4.613  -7.725
  218    HG3  LYS  28           HG1      LYS  28  12.802   2.988  -7.871
  219    HD2  LYS  28           HD2      LYS  28  12.660   3.356 -10.400
  220    HD3  LYS  28           HD1      LYS  28  12.428   5.057 -10.015
  221    HE2  LYS  28           HE2      LYS  28  14.771   4.668 -10.441
  222    HE3  LYS  28           HE1      LYS  28  14.551   5.009  -8.725
  223    HZ1  LYS  28           HZ1      LYS  28  16.033   3.123  -9.011
  224    HZ2  LYS  28           HZ2      LYS  28  14.905   2.329  -9.954
  225    HZ3  LYS  28           HZ3      LYS  28  14.592   2.567  -8.332
  226    H    LYS  29           HN       LYS  29   8.184   4.435  -7.853
  227    HA   LYS  29           HA       LYS  29   8.862   6.763  -6.380
  228    HB2  LYS  29           HB2      LYS  29   6.163   5.761  -7.233
  229    HB3  LYS  29           HB1      LYS  29   6.496   7.388  -6.684
  230    HG2  LYS  29           HG2      LYS  29   7.950   7.757  -8.649
  231    HG3  LYS  29           HG1      LYS  29   7.570   6.127  -9.200
  232    HD2  LYS  29           HD2      LYS  29   5.258   6.653  -9.441
  233    HD3  LYS  29           HD1      LYS  29   5.466   8.212  -8.661
  234    HE2  LYS  29           HE2      LYS  29   6.670   7.388 -11.304
  235    HE3  LYS  29           HE1      LYS  29   5.243   8.402 -11.080
  236    HZ1  LYS  29           HZ1      LYS  29   8.048   9.067 -10.341
  237    HZ2  LYS  29           HZ2      LYS  29   6.744   9.939  -9.805
  238    HZ3  LYS  29           HZ3      LYS  29   7.059   9.876 -11.449
  239    H    PHE  30           HN       PHE  30   6.528   4.222  -5.851
  240    HA   PHE  30           HA       PHE  30   5.499   4.835  -3.397
  241    HB2  PHE  30           HB2      PHE  30   4.375   3.171  -4.520
  242    HB3  PHE  30           HB1      PHE  30   5.847   2.387  -5.047
  243    HD1  PHE  30           HD1      PHE  30   3.839   2.969  -1.981
  244    HD2  PHE  30           HD2      PHE  30   6.425   0.428  -4.140
  245    HE1  PHE  30           HE1      PHE  30   3.527   1.201  -0.267
  246    HE2  PHE  30           HE2      PHE  30   6.131  -1.345  -2.451
  247    HZ   PHE  30           HZ       PHE  30   4.669  -0.947  -0.512
  248    H    LYS  31           HN       LYS  31   8.302   2.829  -4.120
  249    HA   LYS  31           HA       LYS  31   9.106   2.152  -1.530
  250    HB2  LYS  31           HB2      LYS  31  10.102   1.094  -3.457
  251    HB3  LYS  31           HB1      LYS  31  10.707   2.638  -4.038
  252    HG2  LYS  31           HG2      LYS  31  11.904   2.661  -1.691
  253    HG3  LYS  31           HG1      LYS  31  11.719   0.917  -1.851
  254    HD2  LYS  31           HD2      LYS  31  12.916   0.927  -3.933
  255    HD3  LYS  31           HD1      LYS  31  12.953   2.695  -3.944
  256    HE2  LYS  31           HE2      LYS  31  14.218   2.583  -1.789
  257    HE3  LYS  31           HE1      LYS  31  14.337   0.840  -2.026
  258    HZ1  LYS  31           HZ1      LYS  31  16.312   1.877  -2.859
  259    HZ2  LYS  31           HZ2      LYS  31  15.410   2.965  -3.762
  260    HZ3  LYS  31           HZ3      LYS  31  15.415   1.352  -4.204
  261    H    LEU  32           HN       LEU  32  10.194   4.894  -3.535
  262    HA   LEU  32           HA       LEU  32  11.981   5.725  -1.523
  263    HB2  LEU  32           HB2      LEU  32  12.486   7.632  -2.892
  264    HB3  LEU  32           HB1      LEU  32  12.385   6.204  -3.882
  265    HG   LEU  32           HG       LEU  32   9.955   7.090  -4.395
  266   HD11  LEU  32          HD11      LEU  32  11.356   9.604  -3.581
  267   HD12  LEU  32          HD12      LEU  32   9.985   8.861  -2.766
  268   HD13  LEU  32          HD13      LEU  32   9.793   9.506  -4.404
  269   HD21  LEU  32          HD21      LEU  32  12.464   8.317  -5.509
  270   HD22  LEU  32          HD22      LEU  32  10.883   8.337  -6.300
  271   HD23  LEU  32          HD23      LEU  32  11.726   6.806  -6.032
  272    H    TYR  33           HN       TYR  33   8.664   6.395  -2.063
  273    HA   TYR  33           HA       TYR  33   8.556   8.753  -0.535
  274    HB2  TYR  33           HB2      TYR  33   6.724   8.109  -2.079
  275    HB3  TYR  33           HB1      TYR  33   6.337   6.746  -1.027
  276    HD1  TYR  33           HD1      TYR  33   6.319  10.364  -1.347
  277    HD2  TYR  33           HD2      TYR  33   5.182   7.077   1.059
  278    HE1  TYR  33           HE1      TYR  33   4.969  11.876   0.066
  279    HE2  TYR  33           HE2      TYR  33   3.835   8.519   2.474
  280    HH   TYR  33           HH       TYR  33   3.996  11.067   3.060
  281    H    LEU  34           HN       LEU  34   8.543   5.390   0.338
  282    HA   LEU  34           HA       LEU  34   8.053   6.234   3.093
  283    HB2  LEU  34           HB2      LEU  34   7.249   3.894   3.503
  284    HB3  LEU  34           HB1      LEU  34   6.296   4.901   2.436
  285    HG   LEU  34           HG       LEU  34   7.408   3.696   0.508
  286   HD11  LEU  34          HD11      LEU  34   8.158   1.424   0.932
  287   HD12  LEU  34          HD12      LEU  34   8.074   1.717   2.670
  288   HD13  LEU  34          HD13      LEU  34   9.221   2.619   1.678
  289   HD21  LEU  34          HD21      LEU  34   5.757   1.940   0.598
  290   HD22  LEU  34          HD22      LEU  34   5.098   3.466   1.212
  291   HD23  LEU  34          HD23      LEU  34   5.570   2.187   2.334
  292    H    GLY  35           HN       GLY  35  10.300   4.479   1.143
  293    HA2  GLY  35           HA3      GLY  35  11.554   3.413   3.468
  294    HA3  GLY  35           HA2      GLY  35  12.094   3.150   1.809
  295    H    THR  36           HN       THR  36  12.428   5.786   0.964
  296    HA   THR  36           HA       THR  36  14.882   6.468   2.394
  297    HB   THR  36           HB       THR  36  15.331   7.999   0.468
  298    HG1  THR  36           HG1      THR  36  12.745   7.908   0.080
  299   HG21  THR  36          HG21      THR  36  15.540   6.327  -1.289
  300   HG22  THR  36          HG22      THR  36  14.470   5.249  -0.410
  301   HG23  THR  36          HG23      THR  36  16.061   5.655   0.262
  302    H    ALA  37           HN       ALA  37  12.079   7.083   3.355
  303    HA   ALA  37           HA       ALA  37  11.969   9.977   3.176
  304    HB1  ALA  37           HB1      ALA  37   9.994   8.057   4.312
  305    HB2  ALA  37           HB2      ALA  37   9.998   8.654   2.657
  306    HB3  ALA  37           HB3      ALA  37   9.753   9.776   3.999
  307    H    THR  38           HN       THR  38  12.191  11.294   4.836
  308    HA   THR  38           HA       THR  38  13.147  10.263   7.342
  309    HB   THR  38           HB       THR  38  12.660  13.157   6.546
  310    HG1  THR  38           HG1      THR  38  15.233  12.448   6.437
  311   HG21  THR  38          HG21      THR  38  13.072  12.760   8.948
  312   HG22  THR  38          HG22      THR  38  14.419  13.622   8.201
  313   HG23  THR  38          HG23      THR  38  14.559  11.899   8.546
  314    H    GLU  39           HN       GLU  39  10.222  11.234   5.946
  315    HA   GLU  39           HA       GLU  39   8.858  11.971   8.355
  316    HB2  GLU  39           HB3      GLU  39   6.760  11.883   7.050
  317    HB3  GLU  39           HB2      GLU  39   7.999  12.813   6.238
  318    HG2  GLU  39           HG3      GLU  39   8.453  10.904   4.778
  319    HG3  GLU  39           HG2      GLU  39   7.152  10.001   5.567
  320    H    LEU  40           HN       LEU  40   9.921   9.078   7.238
  321    HA   LEU  40           HA       LEU  40   8.061   7.543   8.910
  322    HB2  LEU  40           HB2      LEU  40   9.956   6.823   6.737
  323    HB3  LEU  40           HB1      LEU  40   9.630   5.662   8.004
  324    HG   LEU  40           HG       LEU  40   8.248   5.172   6.093
  325   HD11  LEU  40          HD11      LEU  40   6.545   6.376   8.252
  326   HD12  LEU  40          HD12      LEU  40   7.255   4.764   8.250
  327   HD13  LEU  40          HD13      LEU  40   6.036   5.192   7.050
  328   HD21  LEU  40          HD21      LEU  40   8.199   7.347   5.026
  329   HD22  LEU  40          HD22      LEU  40   7.163   7.972   6.318
  330   HD23  LEU  40          HD23      LEU  40   6.568   6.710   5.232
  331    H    GLY  41           HN       GLY  41  10.487   9.336   9.385
  332    HA2  GLY  41           HA3      GLY  41  11.708   9.594  11.341
  333    HA3  GLY  41           HA2      GLY  41  11.412   7.901  11.721
  334    H    GLU  42           HN       GLU  42  12.617   6.384  10.801
  335    HA   GLU  42           HA       GLU  42  15.295   7.243   9.949
  336    HB2  GLU  42           HB3      GLU  42  14.527   4.364  10.386
  337    HB3  GLU  42           HB2      GLU  42  16.102   5.108  10.539
  338    HG2  GLU  42           HG3      GLU  42  15.567   4.646  12.723
  339    HG3  GLU  42           HG2      GLU  42  15.020   6.317  12.584
  340    H    GLY  43           HN       GLY  43  12.410   5.807   8.860
  341    HA2  GLY  43           HA3      GLY  43  11.813   5.055   6.724
  342    HA3  GLY  43           HA2      GLY  43  13.510   5.224   6.224
  343    H    LYS  44           HN       LYS  44  11.161   3.067   7.327
  344    HA   LYS  44           HA       LYS  44  12.861   1.368   8.872
  345    HB2  LYS  44           HB2      LYS  44  10.192   0.586   7.730
  346    HB3  LYS  44           HB1      LYS  44  10.983  -0.047   9.159
  347    HG2  LYS  44           HG2      LYS  44   9.846   2.732   8.845
  348    HG3  LYS  44           HG1      LYS  44   9.120   1.400   9.728
  349    HD2  LYS  44           HD2      LYS  44  11.772   2.676  10.426
  350    HD3  LYS  44           HD1      LYS  44  10.240   3.104  11.172
  351    HE2  LYS  44           HE2      LYS  44  10.038   0.677  11.854
  352    HE3  LYS  44           HE1      LYS  44  11.712   0.483  11.334
  353    HZ1  LYS  44           HZ1      LYS  44  10.687   2.271  13.452
  354    HZ2  LYS  44           HZ2      LYS  44  12.269   2.346  12.924
  355    HZ3  LYS  44           HZ3      LYS  44  11.689   0.943  13.681
  356    H    ILE  45           HN       ILE  45  12.643   1.741   5.580
  357    HA   ILE  45           HA       ILE  45  13.143  -1.076   4.987
  358    HB   ILE  45           HB       ILE  45  12.523   1.225   3.130
  359   HG12  ILE  45          HG12      ILE  45  10.554   0.510   4.426
  360   HG13  ILE  45          HG11      ILE  45  10.377   0.095   2.727
  361   HG21  ILE  45          HG21      ILE  45  12.361  -0.457   1.348
  362   HG22  ILE  45          HG22      ILE  45  12.931  -1.688   2.482
  363   HG23  ILE  45          HG23      ILE  45  13.987  -0.364   2.029
  364   HD11  ILE  45          HD11      ILE  45  11.014  -2.221   3.258
  365   HD12  ILE  45          HD12      ILE  45   9.571  -1.699   4.122
  366   HD13  ILE  45          HD13      ILE  45  11.117  -1.779   4.963
  367    HA   PRO  46           HA       PRO  46  17.447   0.012   4.290
  368    HB2  PRO  46           HB2      PRO  46  17.976  -2.378   2.926
  369    HB3  PRO  46           HB1      PRO  46  18.261  -2.086   4.642
  370    HG2  PRO  46           HG2      PRO  46  16.106  -3.562   3.309
  371    HG3  PRO  46           HG1      PRO  46  16.735  -3.691   4.977
  372    HD2  PRO  46           HD2      PRO  46  14.333  -2.551   4.200
  373    HD3  PRO  46           HD1      PRO  46  15.148  -2.251   5.741
  374    H    TRP  47           HN       TRP  47  18.271   0.978   2.733
  375    HA   TRP  47           HA       TRP  47  16.981   2.214   0.738
  376    HB2  TRP  47           HB2      TRP  47  19.935   1.639   0.739
  377    HB3  TRP  47           HB1      TRP  47  19.113   3.032   0.046
  378    HD1  TRP  47           HD1      TRP  47  18.672   5.074   1.639
  379    HE1  TRP  47           HE1      TRP  47  19.194   5.564   4.112
  380    HE3  TRP  47           HE3      TRP  47  20.138   0.397   3.124
  381    HZ2  TRP  47           HZ2      TRP  47  20.095   4.144   6.393
  382    HZ3  TRP  47           HZ3      TRP  47  20.800   0.047   5.447
  383    HH2  TRP  47           HH2      TRP  47  20.790   1.881   7.050
  384    H    GLY  48           HN       GLY  48  18.811  -0.812   0.321
  385    HA2  GLY  48           HA3      GLY  48  18.182  -0.654  -2.544
  386    HA3  GLY  48           HA2      GLY  48  19.553  -1.519  -1.876
  387    H    SER  49           HN       SER  49  17.059  -2.220   0.162
  388    HA   SER  49           HA       SER  49  16.988  -4.869  -0.780
  389    HB2  SER  49           HB2      SER  49  16.831  -4.276   1.589
  390    HB3  SER  49           HB1      SER  49  15.252  -3.537   1.314
  391    HG   SER  49           HG       SER  49  16.004  -6.258   1.267
  392    H    MET  50           HN       MET  50  14.846  -2.160  -1.279
  393    HA   MET  50           HA       MET  50  12.824  -3.911  -2.438
  394    HB2  MET  50           HB2      MET  50  12.798  -0.902  -2.117
  395    HB3  MET  50           HB1      MET  50  11.495  -1.835  -2.843
  396    HG2  MET  50           HG2      MET  50  11.151  -3.008  -0.749
  397    HG3  MET  50           HG1      MET  50  12.478  -2.116  -0.019
  398    HE1  MET  50           HE1      MET  50   9.564  -0.891  -2.442
  399    HE2  MET  50           HE2      MET  50   8.418  -0.270  -1.256
  400    HE3  MET  50           HE3      MET  50   8.785  -1.996  -1.312
  401    H    GLU  51           HN       GLU  51  15.620  -2.866  -3.569
  402    HA   GLU  51           HA       GLU  51  14.875  -1.893  -6.173
  403    HB2  GLU  51           HB3      GLU  51  17.416  -2.988  -5.061
  404    HB3  GLU  51           HB2      GLU  51  17.288  -2.369  -6.702
  405    HG2  GLU  51           HG3      GLU  51  16.849  -0.827  -4.150
  406    HG3  GLU  51           HG2      GLU  51  18.274  -0.718  -5.189
  407    H    LYS  52           HN       LYS  52  15.906  -4.870  -4.778
  408    HA   LYS  52           HA       LYS  52  15.832  -6.416  -7.241
  409    HB2  LYS  52           HB2      LYS  52  16.570  -8.246  -5.765
  410    HB3  LYS  52           HB1      LYS  52  17.581  -6.819  -5.578
  411    HG2  LYS  52           HG2      LYS  52  16.305  -6.208  -3.551
  412    HG3  LYS  52           HG1      LYS  52  15.358  -7.675  -3.731
  413    HD2  LYS  52           HD2      LYS  52  17.381  -9.013  -3.440
  414    HD3  LYS  52           HD1      LYS  52  18.339  -7.537  -3.273
  415    HE2  LYS  52           HE2      LYS  52  16.971  -6.900  -1.321
  416    HE3  LYS  52           HE1      LYS  52  16.080  -8.410  -1.472
  417    HZ1  LYS  52           HZ1      LYS  52  18.150  -9.606  -1.049
  418    HZ2  LYS  52           HZ2      LYS  52  17.753  -8.546   0.204
  419    HZ3  LYS  52           HZ3      LYS  52  18.970  -8.126  -0.867
  420    H    ALA  53           HN       ALA  53  13.363  -5.228  -5.726
  421    HA   ALA  53           HA       ALA  53  11.925  -7.747  -5.281
  422    HB1  ALA  53           HB1      ALA  53  10.634  -6.563  -3.569
  423    HB2  ALA  53           HB2      ALA  53  11.586  -5.106  -3.885
  424    HB3  ALA  53           HB3      ALA  53  12.366  -6.532  -3.218
  425    H    GLY  54           HN       GLY  54   9.990  -8.000  -6.290
  426    HA2  GLY  54           HA3      GLY  54   9.067  -5.849  -8.024
  427    HA3  GLY  54           HA2      GLY  54   8.605  -7.551  -8.094
  428    HA   PRO  55           HA       PRO  55   5.080  -5.021  -6.262
  429    HB2  PRO  55           HB2      PRO  55   3.621  -7.267  -7.517
  430    HB3  PRO  55           HB1      PRO  55   3.306  -5.535  -7.600
  431    HG2  PRO  55           HG2      PRO  55   4.360  -6.925  -9.665
  432    HG3  PRO  55           HG1      PRO  55   4.746  -5.226  -9.366
  433    HD2  PRO  55           HD2      PRO  55   6.427  -7.647  -8.911
  434    HD3  PRO  55           HD1      PRO  55   6.894  -5.975  -9.250
  435    H    LEU  56           HN       LEU  56   5.378  -8.540  -6.457
  436    HA   LEU  56           HA       LEU  56   3.722  -9.056  -4.148
  437    HB2  LEU  56           HB2      LEU  56   3.948 -10.621  -6.090
  438    HB3  LEU  56           HB1      LEU  56   5.618 -10.871  -5.672
  439    HG   LEU  56           HG       LEU  56   3.338 -11.715  -3.861
  440   HD11  LEU  56          HD11      LEU  56   3.684 -13.958  -4.781
  441   HD12  LEU  56          HD12      LEU  56   4.854 -13.305  -5.931
  442   HD13  LEU  56          HD13      LEU  56   3.160 -12.834  -6.036
  443   HD21  LEU  56          HD21      LEU  56   5.536 -11.540  -2.778
  444   HD22  LEU  56          HD22      LEU  56   6.235 -12.548  -4.035
  445   HD23  LEU  56          HD23      LEU  56   5.036 -13.228  -2.927
  446    H    GLU  57           HN       GLU  57   7.145  -8.975  -4.823
  447    HA   GLU  57           HA       GLU  57   7.953  -9.881  -2.281
  448    HB2  GLU  57           HB3      GLU  57   9.460  -8.258  -4.316
  449    HB3  GLU  57           HB2      GLU  57  10.180  -9.063  -2.922
  450    HG2  GLU  57           HG3      GLU  57   9.500 -11.214  -3.775
  451    HG3  GLU  57           HG2      GLU  57   8.688 -10.441  -5.133
  452    H    MET  58           HN       MET  58   7.414  -6.649  -3.613
  453    HA   MET  58           HA       MET  58   8.345  -5.214  -1.398
  454    HB2  MET  58           HB2      MET  58   6.261  -4.557  -3.447
  455    HB3  MET  58           HB1      MET  58   6.675  -3.400  -2.193
  456    HG2  MET  58           HG2      MET  58   9.064  -3.579  -3.001
  457    HG3  MET  58           HG1      MET  58   8.462  -4.569  -4.323
  458    HE1  MET  58           HE1      MET  58   9.629  -2.936  -6.074
  459    HE2  MET  58           HE2      MET  58  10.238  -2.044  -4.688
  460    HE3  MET  58           HE3      MET  58   9.457  -1.177  -6.003
  461    H    ALA  59           HN       ALA  59   5.178  -6.567  -2.087
  462    HA   ALA  59           HA       ALA  59   3.785  -5.601   0.098
  463    HB1  ALA  59           HB1      ALA  59   2.759  -6.846  -1.747
  464    HB2  ALA  59           HB2      ALA  59   2.321  -7.537  -0.185
  465    HB3  ALA  59           HB3      ALA  59   3.542  -8.321  -1.187
  466    H    GLN  60           HN       GLN  60   5.902  -8.405  -0.153
  467    HA   GLN  60           HA       GLN  60   5.385  -9.234   2.527
  468    HB2  GLN  60           HB2      GLN  60   7.701 -10.094   0.811
  469    HB3  GLN  60           HB1      GLN  60   7.006 -10.937   2.196
  470    HG2  GLN  60           HG2      GLN  60   4.871 -11.085   0.871
  471    HG3  GLN  60           HG1      GLN  60   5.799 -10.519  -0.500
  472   HE21  GLN  60          HE21      GLN  60   4.481 -13.043  -0.196
  473   HE22  GLN  60          HE22      GLN  60   5.688 -14.270  -0.329
  474    H    LEU  61           HN       LEU  61   7.721  -7.172   1.014
  475    HA   LEU  61           HA       LEU  61   9.457  -7.036   3.239
  476    HB2  LEU  61           HB2      LEU  61   9.169  -5.508   0.731
  477    HB3  LEU  61           HB1      LEU  61   9.947  -4.639   2.028
  478    HG   LEU  61           HG       LEU  61  11.663  -6.421   2.173
  479   HD11  LEU  61          HD11      LEU  61  10.401  -8.322   1.398
  480   HD12  LEU  61          HD12      LEU  61  11.857  -8.105   0.423
  481   HD13  LEU  61          HD13      LEU  61  10.285  -7.613  -0.210
  482   HD21  LEU  61          HD21      LEU  61  12.087  -4.481   0.796
  483   HD22  LEU  61          HD22      LEU  61  11.308  -5.261  -0.579
  484   HD23  LEU  61          HD23      LEU  61  12.808  -5.918   0.075
  485    H    LEU  62           HN       LEU  62   6.843  -4.795   2.186
  486    HA   LEU  62           HA       LEU  62   7.088  -3.141   4.426
  487    HB2  LEU  62           HB2      LEU  62   4.661  -3.685   2.708
  488    HB3  LEU  62           HB1      LEU  62   4.655  -2.546   4.017
  489    HG   LEU  62           HG       LEU  62   4.845  -1.334   1.993
  490   HD11  LEU  62          HD11      LEU  62   7.519  -1.389   3.292
  491   HD12  LEU  62          HD12      LEU  62   6.118  -0.444   3.795
  492   HD13  LEU  62          HD13      LEU  62   6.897  -0.117   2.244
  493   HD21  LEU  62          HD21      LEU  62   7.225  -3.001   1.350
  494   HD22  LEU  62          HD22      LEU  62   6.648  -1.610   0.404
  495   HD23  LEU  62          HD23      LEU  62   5.645  -3.066   0.579
  496    H    ILE  63           HN       ILE  63   5.260  -6.110   3.953
  497    HA   ILE  63           HA       ILE  63   3.825  -5.964   6.370
  498    HB   ILE  63           HB       ILE  63   3.567  -7.547   4.222
  499   HG12  ILE  63          HG12      ILE  63   1.974  -7.266   6.056
  500   HG13  ILE  63          HG11      ILE  63   1.950  -8.884   5.372
  501   HG21  ILE  63          HG21      ILE  63   4.989  -9.398   6.119
  502   HG22  ILE  63          HG22      ILE  63   5.596  -8.836   4.565
  503   HG23  ILE  63          HG23      ILE  63   4.167  -9.874   4.629
  504   HD11  ILE  63          HD11      ILE  63   3.262  -9.684   7.304
  505   HD12  ILE  63          HD12      ILE  63   1.722  -8.965   7.784
  506   HD13  ILE  63          HD13      ILE  63   3.223  -8.055   7.980
  507    H    THR  64           HN       THR  64   7.042  -7.137   5.664
  508    HA   THR  64           HA       THR  64   7.326  -8.408   8.210
  509    HB   THR  64           HB       THR  64   9.416  -7.770   6.112
  510    HG1  THR  64           HG1      THR  64   8.100  -9.237   5.214
  511   HG21  THR  64          HG21      THR  64  10.415  -8.156   8.341
  512   HG22  THR  64          HG22      THR  64  10.777  -9.479   7.236
  513   HG23  THR  64          HG23      THR  64   9.529  -9.676   8.466
  514    H    HIS  65           HN       HIS  65   8.277  -5.299   6.860
  515    HA   HIS  65           HA       HIS  65   9.794  -4.666   9.237
  516    HB2  HIS  65           HB2      HIS  65   9.132  -2.971   6.820
  517    HB3  HIS  65           HB1      HIS  65  10.104  -2.405   8.169
  518    HD1  HIS  65           HD1      HIS  65  12.599  -3.052   8.139
  519    HD2  HIS  65           HD2      HIS  65  10.348  -4.991   5.246
  520    HE1  HIS  65           HE1      HIS  65  14.238  -4.211   6.658
  521    H    PHE  66           HN       PHE  66   6.990  -3.161   7.676
  522    HA   PHE  66           HA       PHE  66   6.321  -1.669   9.993
  523    HB2  PHE  66           HB2      PHE  66   4.811  -2.180   7.432
  524    HB3  PHE  66           HB1      PHE  66   4.359  -0.996   8.663
  525    HD1  PHE  66           HD2      PHE  66   6.814  -1.887   6.123
  526    HD2  PHE  66           HD1      PHE  66   5.545   1.059   8.898
  527    HE1  PHE  66           HE2      PHE  66   8.334  -0.300   5.097
  528    HE2  PHE  66           HE1      PHE  66   7.081   2.678   7.872
  529    HZ   PHE  66           HZ       PHE  66   8.484   1.985   5.964
  530    H    GLY  67           HN       GLY  67   4.344  -4.118   8.320
  531    HA2  GLY  67           HA3      GLY  67   3.809  -5.909  10.181
  532    HA3  GLY  67           HA2      GLY  67   2.885  -4.537  10.790
  533    HA   PRO  68           HA       PRO  68   0.572  -7.120   7.534
  534    HB2  PRO  68           HB2      PRO  68  -1.667  -7.473   9.130
  535    HB3  PRO  68           HB1      PRO  68  -0.364  -8.652   8.940
  536    HG2  PRO  68           HG2      PRO  68  -0.849  -6.682  11.130
  537    HG3  PRO  68           HG1      PRO  68  -0.220  -8.333  11.230
  538    HD2  PRO  68           HD2      PRO  68   1.382  -6.176  11.423
  539    HD3  PRO  68           HD1      PRO  68   1.933  -7.673  10.665
  540    H    GLU  69           HN       GLU  69  -0.924  -4.888   9.838
  541    HA   GLU  69           HA       GLU  69  -2.802  -3.981   7.831
  542    HB2  GLU  69           HB3      GLU  69  -2.335  -2.964  10.637
  543    HB3  GLU  69           HB2      GLU  69  -3.745  -2.673   9.633
  544    HG2  GLU  69           HG3      GLU  69  -4.385  -4.993   9.765
  545    HG3  GLU  69           HG2      GLU  69  -2.905  -5.387  10.634
  546    H    GLU  70           HN       GLU  70   0.110  -3.011   9.389
  547    HA   GLU  70           HA       GLU  70   0.083  -0.260   8.795
  548    HB2  GLU  70           HB3      GLU  70   1.522  -1.589  10.487
  549    HB3  GLU  70           HB2      GLU  70   2.567  -1.908   9.116
  550    HG2  GLU  70           HG3      GLU  70   3.385  -0.027  10.396
  551    HG3  GLU  70           HG2      GLU  70   2.858   0.506   8.794
  552    H    ALA  71           HN       ALA  71   1.682  -3.027   7.236
  553    HA   ALA  71           HA       ALA  71   2.917  -1.850   5.046
  554    HB1  ALA  71           HB1      ALA  71   2.628  -3.992   3.941
  555    HB2  ALA  71           HB2      ALA  71   1.432  -4.464   5.155
  556    HB3  ALA  71           HB3      ALA  71   3.111  -4.188   5.624
  557    H    TRP  72           HN       TRP  72  -0.437  -2.916   5.359
  558    HA   TRP  72           HA       TRP  72  -1.148  -2.284   2.720
  559    HB2  TRP  72           HB2      TRP  72  -2.506  -3.867   3.899
  560    HB3  TRP  72           HB1      TRP  72  -2.816  -2.722   5.201
  561    HD1  TRP  72           HD1      TRP  72  -5.288  -2.153   5.093
  562    HE1  TRP  72           HE1      TRP  72  -6.950  -1.422   3.246
  563    HE3  TRP  72           HE3      TRP  72  -2.256  -2.582   1.033
  564    HZ2  TRP  72           HZ2      TRP  72  -6.950  -1.075   0.518
  565    HZ3  TRP  72           HZ3      TRP  72  -3.183  -2.042  -1.210
  566    HH2  TRP  72           HH2      TRP  72  -5.483  -1.304  -1.451
  567    H    ARG  73           HN       ARG  73  -1.466  -0.505   5.741
  568    HA   ARG  73           HA       ARG  73  -2.752   1.671   4.591
  569    HB2  ARG  73           HB2      ARG  73  -2.816   1.390   6.984
  570    HB3  ARG  73           HB1      ARG  73  -1.069   1.525   7.104
  571    HG2  ARG  73           HG2      ARG  73  -1.122   3.844   6.608
  572    HG3  ARG  73           HG1      ARG  73  -2.808   3.763   6.111
  573    HD2  ARG  73           HD2      ARG  73  -2.578   4.781   8.310
  574    HD3  ARG  73           HD1      ARG  73  -3.482   3.277   8.393
  575    HE   ARG  73           HE       ARG  73  -0.785   2.716   8.956
  576   HH11  ARG  73          HH11      ARG  73  -3.448   4.529  10.453
  577   HH12  ARG  73          HH12      ARG  73  -2.916   4.217  12.045
  578   HH21  ARG  73          HH21      ARG  73  -0.095   2.366  11.050
  579   HH22  ARG  73          HH22      ARG  73  -0.940   2.981  12.417
  580    H    LEU  74           HN       LEU  74   0.669   1.032   5.126
  581    HA   LEU  74           HA       LEU  74   1.777   3.380   4.163
  582    HB2  LEU  74           HB2      LEU  74   2.687   0.579   4.406
  583    HB3  LEU  74           HB1      LEU  74   3.555   1.550   3.245
  584    HG   LEU  74           HG       LEU  74   4.652   1.397   5.481
  585   HD11  LEU  74          HD11      LEU  74   5.194   3.256   4.034
  586   HD12  LEU  74          HD12      LEU  74   5.193   3.758   5.705
  587   HD13  LEU  74          HD13      LEU  74   3.831   4.184   4.659
  588   HD21  LEU  74          HD21      LEU  74   2.323   3.071   6.415
  589   HD22  LEU  74          HD22      LEU  74   3.762   2.665   7.352
  590   HD23  LEU  74          HD23      LEU  74   2.639   1.395   6.865
  591    H    ALA  75           HN       ALA  75   0.808   0.492   2.327
  592    HA   ALA  75           HA       ALA  75   1.695   1.629  -0.138
  593    HB1  ALA  75           HB1      ALA  75   1.584  -0.786   0.103
  594    HB2  ALA  75           HB2      ALA  75   0.615  -0.202  -1.249
  595    HB3  ALA  75           HB3      ALA  75  -0.177  -0.687   0.250
  596    H    LEU  76           HN       LEU  76  -1.591   1.258   1.220
  597    HA   LEU  76           HA       LEU  76  -2.787   2.345  -1.076
  598    HB2  LEU  76           HB2      LEU  76  -4.864   2.444   0.100
  599    HB3  LEU  76           HB1      LEU  76  -4.029   1.025   0.662
  600    HG   LEU  76           HG       LEU  76  -3.321   2.609   2.637
  601   HD11  LEU  76          HD11      LEU  76  -4.297   4.653   1.771
  602   HD12  LEU  76          HD12      LEU  76  -5.133   4.174   3.252
  603   HD13  LEU  76          HD13      LEU  76  -5.885   3.887   1.685
  604   HD21  LEU  76          HD21      LEU  76  -4.594   0.591   2.924
  605   HD22  LEU  76          HD22      LEU  76  -6.053   1.388   2.358
  606   HD23  LEU  76          HD23      LEU  76  -5.319   1.879   3.889
  607    H    SER  77           HN       SER  77  -1.669   3.894   1.859
  608    HA   SER  77           HA       SER  77  -2.589   6.456   1.059
  609    HB2  SER  77           HB2      SER  77  -0.962   5.342   3.263
  610    HB3  SER  77           HB1      SER  77  -1.029   7.123   3.078
  611    HG   SER  77           HG       SER  77  -3.385   6.689   3.084
  612    H    THR  78           HN       THR  78   0.192   4.632   0.190
  613    HA   THR  78           HA       THR  78   1.571   7.053  -0.560
  614    HB   THR  78           HB       THR  78   2.392   4.147  -0.884
  615    HG1  THR  78           HG1      THR  78   2.604   4.639   1.190
  616   HG21  THR  78          HG21      THR  78   3.988   6.671  -1.390
  617   HG22  THR  78          HG22      THR  78   3.438   5.539  -2.628
  618   HG23  THR  78          HG23      THR  78   4.630   5.030  -1.428
  619    H    PHE  79           HN       PHE  79  -0.525   4.681  -1.932
  620    HA   PHE  79           HA       PHE  79   0.003   4.902  -4.636
  621    HB2  PHE  79           HB2      PHE  79  -2.656   4.611  -3.232
  622    HB3  PHE  79           HB1      PHE  79  -2.495   4.483  -4.988
  623    HD1  PHE  79           HD2      PHE  79   0.288   2.902  -4.471
  624    HD2  PHE  79           HD1      PHE  79  -3.744   2.497  -3.168
  625    HE1  PHE  79           HE2      PHE  79   0.641   0.509  -4.108
  626    HE2  PHE  79           HE1      PHE  79  -3.391   0.097  -2.810
  627    HZ   PHE  79           HZ       PHE  79  -1.193  -0.905  -3.283
  628    H    GLU  80           HN       GLU  80  -2.166   6.908  -2.674
  629    HA   GLU  80           HA       GLU  80  -2.924   8.690  -4.715
  630    HB2  GLU  80           HB3      GLU  80  -3.605  10.221  -2.872
  631    HB3  GLU  80           HB2      GLU  80  -4.203   8.579  -2.665
  632    HG2  GLU  80           HG3      GLU  80  -2.699   8.108  -1.008
  633    HG3  GLU  80           HG2      GLU  80  -1.660   9.469  -1.425
  634    H    ARG  81           HN       ARG  81  -0.062   8.573  -2.752
  635    HA   ARG  81           HA       ARG  81   0.734  11.306  -3.020
  636    HB2  ARG  81           HB2      ARG  81   2.495   8.931  -2.427
  637    HB3  ARG  81           HB1      ARG  81   2.843  10.619  -2.070
  638    HG2  ARG  81           HG2      ARG  81   0.612   9.011  -0.865
  639    HG3  ARG  81           HG1      ARG  81   2.171   9.365  -0.118
  640    HD2  ARG  81           HD2      ARG  81   1.661  11.571   0.228
  641    HD3  ARG  81           HD1      ARG  81   0.455  11.604  -1.064
  642    HE   ARG  81           HE       ARG  81  -1.020  10.347   0.355
  643   HH11  ARG  81          HH11      ARG  81   1.786  11.571   2.152
  644   HH12  ARG  81          HH12      ARG  81   0.911  11.742   3.590
  645   HH21  ARG  81          HH21      ARG  81  -2.144  10.540   2.239
  646   HH22  ARG  81          HH22      ARG  81  -1.405  11.114   3.686
  647    H    ILE  82           HN       ILE  82   1.352   8.318  -4.707
  648    HA   ILE  82           HA       ILE  82   3.144   9.635  -6.555
  649    HB   ILE  82           HB       ILE  82   3.553   7.434  -7.520
  650   HG12  ILE  82          HG12      ILE  82   1.405   6.396  -5.636
  651   HG13  ILE  82          HG11      ILE  82   1.222   6.559  -7.375
  652   HG21  ILE  82          HG21      ILE  82   3.442   7.353  -4.502
  653   HG22  ILE  82          HG22      ILE  82   4.750   8.017  -5.476
  654   HG23  ILE  82          HG23      ILE  82   4.422   6.281  -5.505
  655   HD11  ILE  82          HD11      ILE  82   2.978   4.899  -7.709
  656   HD12  ILE  82          HD12      ILE  82   1.653   4.259  -6.732
  657   HD13  ILE  82          HD13      ILE  82   3.163   4.746  -5.962
  658    H    ASN  83           HN       ASN  83   0.159  10.000  -6.200
  659    HA   ASN  83           HA       ASN  83  -1.509  10.832  -7.386
  660    HB2  ASN  83           HB3      ASN  83   0.405  10.667  -9.719
  661    HB3  ASN  83           HB2      ASN  83  -1.194  11.406  -9.780
  662   HD21  ASN  83          HD21      ASN  83  -1.095  12.619  -7.139
  663   HD22  ASN  83          HD22      ASN  83   0.049  13.887  -7.236
  664    H    ARG  84           HN       ARG  84  -1.225   8.047  -6.948
  665    HA   ARG  84           HA       ARG  84  -3.043   7.127  -9.021
  666    HB2  ARG  84           HB2      ARG  84  -1.069   5.768  -8.783
  667    HB3  ARG  84           HB1      ARG  84  -1.310   5.626  -7.057
  668    HG2  ARG  84           HG2      ARG  84  -1.968   3.568  -8.261
  669    HG3  ARG  84           HG1      ARG  84  -3.299   4.298  -7.358
  670    HD2  ARG  84           HD2      ARG  84  -4.088   3.601  -9.492
  671    HD3  ARG  84           HD1      ARG  84  -4.072   5.354  -9.400
  672    HE   ARG  84           HE       ARG  84  -1.637   4.571 -10.502
  673   HH11  ARG  84          HH11      ARG  84  -5.010   4.851 -11.503
  674   HH12  ARG  84          HH12      ARG  84  -4.689   4.535 -13.141
  675   HH21  ARG  84          HH21      ARG  84  -1.196   4.236 -12.714
  676   HH22  ARG  84          HH22      ARG  84  -2.476   4.207 -13.860
  677    H    LYS  85           HN       LYS  85  -4.850   8.155  -8.156
  678    HA   LYS  85           HA       LYS  85  -5.480   7.748  -5.363
  679    HB2  LYS  85           HB2      LYS  85  -5.592   9.980  -6.316
  680    HB3  LYS  85           HB1      LYS  85  -6.802   9.456  -7.490
  681    HG2  LYS  85           HG2      LYS  85  -7.627   8.769  -4.890
  682    HG3  LYS  85           HG1      LYS  85  -7.183  10.489  -4.885
  683    HD2  LYS  85           HD2      LYS  85  -8.704  10.745  -6.875
  684    HD3  LYS  85           HD1      LYS  85  -9.197   9.065  -6.640
  685    HE2  LYS  85           HE2      LYS  85  -9.910   9.635  -4.347
  686    HE3  LYS  85           HE1      LYS  85  -9.510  11.321  -4.666
  687    HZ1  LYS  85           HZ1      LYS  85 -11.824  11.021  -4.952
  688    HZ2  LYS  85           HZ2      LYS  85 -11.629   9.670  -5.905
  689    HZ3  LYS  85           HZ3      LYS  85 -11.191  11.202  -6.513
  690    H    ASP  86           HN       ASP  86  -6.257   6.565  -8.466
  691    HA   ASP  86           HA       ASP  86  -8.857   5.673  -8.264
  692    HB2  ASP  86           HB2      ASP  86  -6.679   3.966  -9.476
  693    HB3  ASP  86           HB1      ASP  86  -8.360   4.081  -9.962
  694    H    LEU  87           HN       LEU  87  -5.928   3.826  -7.689
  695    HA   LEU  87           HA       LEU  87  -7.245   1.527  -6.601
  696    HB2  LEU  87           HB2      LEU  87  -4.337   2.320  -6.382
  697    HB3  LEU  87           HB1      LEU  87  -4.987   0.745  -5.984
  698    HG   LEU  87           HG       LEU  87  -4.971   1.977  -8.737
  699   HD11  LEU  87          HD11      LEU  87  -2.731   1.442  -7.959
  700   HD12  LEU  87          HD12      LEU  87  -3.237   0.322  -9.224
  701   HD13  LEU  87          HD13      LEU  87  -3.253  -0.186  -7.535
  702   HD21  LEU  87          HD21      LEU  87  -5.626  -0.251  -9.500
  703   HD22  LEU  87          HD22      LEU  87  -6.831   0.409  -8.392
  704   HD23  LEU  87          HD23      LEU  87  -5.700  -0.816  -7.835
  705    H    TRP  88           HN       TRP  88  -6.126   4.446  -5.280
  706    HA   TRP  88           HA       TRP  88  -5.814   3.737  -2.578
  707    HB2  TRP  88           HB2      TRP  88  -4.895   5.753  -3.496
  708    HB3  TRP  88           HB1      TRP  88  -6.452   6.306  -4.021
  709    HD1  TRP  88           HD1      TRP  88  -4.533   5.705  -0.781
  710    HE1  TRP  88           HE1      TRP  88  -5.430   7.340   1.031
  711    HE3  TRP  88           HE3      TRP  88  -8.378   7.717  -3.380
  712    HZ2  TRP  88           HZ2      TRP  88  -7.509   9.210   1.284
  713    HZ3  TRP  88           HZ3      TRP  88  -9.779   9.413  -2.318
  714    HH2  TRP  88           HH2      TRP  88  -9.360  10.148  -0.035
  715    H    GLU  89           HN       GLU  89  -8.496   5.066  -4.443
  716    HA   GLU  89           HA       GLU  89 -10.501   5.080  -2.429
  717    HB2  GLU  89           HB3      GLU  89 -10.907   4.674  -5.391
  718    HB3  GLU  89           HB2      GLU  89 -12.089   5.256  -4.236
  719    HG2  GLU  89           HG3      GLU  89 -10.740   7.261  -3.893
  720    HG3  GLU  89           HG2      GLU  89  -9.593   6.667  -5.095
  721    H    ARG  90           HN       ARG  90  -9.231   2.666  -4.479
  722    HA   ARG  90           HA       ARG  90 -11.324   0.704  -4.104
  723    HB2  ARG  90           HB2      ARG  90  -8.624   0.691  -5.411
  724    HB3  ARG  90           HB1      ARG  90  -9.447  -0.815  -5.100
  725    HG2  ARG  90           HG2      ARG  90  -9.659   0.082  -7.420
  726    HG3  ARG  90           HG1      ARG  90 -11.174  -0.299  -6.635
  727    HD2  ARG  90           HD2      ARG  90 -11.612   2.048  -6.263
  728    HD3  ARG  90           HD1      ARG  90  -9.990   2.467  -6.806
  729    HE   ARG  90           HE       ARG  90 -11.417   1.073  -8.805
  730   HH11  ARG  90          HH11      ARG  90 -11.134   4.301  -7.342
  731   HH12  ARG  90          HH12      ARG  90 -11.654   5.129  -8.720
  732   HH21  ARG  90          HH21      ARG  90 -12.095   2.255 -10.746
  733   HH22  ARG  90          HH22      ARG  90 -12.183   3.944 -10.705
  734    H    GLY  91           HN       GLY  91  -8.774   1.827  -2.253
  735    HA2  GLY  91           HA3      GLY  91  -8.364  -0.721  -0.879
  736    HA3  GLY  91           HA2      GLY  91  -7.348   0.711  -0.748
  737    H    GLN  92           HN       GLN  92  -7.752   2.186   0.759
  738    HA   GLN  92           HA       GLN  92  -8.552   3.152   2.652
  739    HB2  GLN  92           HB2      GLN  92 -11.197   1.969   1.773
  740    HB3  GLN  92           HB1      GLN  92 -11.003   3.227   2.987
  741    HG2  GLN  92           HG2      GLN  92 -10.237   4.799   1.349
  742    HG3  GLN  92           HG1      GLN  92 -10.123   3.542   0.127
  743   HE21  GLN  92          HE21      GLN  92 -12.643   2.320   0.836
  744   HE22  GLN  92          HE22      GLN  92 -13.880   3.348   0.236
  745    H    ARG  93           HN       ARG  93 -10.386   2.285   4.660
  746    HA   ARG  93           HA       ARG  93  -8.725   0.181   5.616
  747    HB2  ARG  93           HB2      ARG  93  -8.854   2.194   6.981
  748    HB3  ARG  93           HB1      ARG  93 -10.607   2.089   7.015
  749    HG2  ARG  93           HG2      ARG  93  -9.735   1.278   9.106
  750    HG3  ARG  93           HG1      ARG  93 -10.429  -0.036   8.140
  751    HD2  ARG  93           HD2      ARG  93  -8.237  -0.722   7.420
  752    HD3  ARG  93           HD1      ARG  93  -7.496   0.582   8.341
  753    HE   ARG  93           HE       ARG  93  -8.869  -0.666  10.244
  754   HH11  ARG  93          HH11      ARG  93  -6.781  -2.127   7.764
  755   HH12  ARG  93          HH12      ARG  93  -6.239  -3.378   8.779
  756   HH21  ARG  93          HH21      ARG  93  -8.156  -2.428  11.581
  757   HH22  ARG  93          HH22      ARG  93  -6.968  -3.516  11.026
  758    H    GLU  94           HN       GLU  94  -9.419  -1.704   5.525
  759    HA   GLU  94           HA       GLU  94 -10.552  -3.540   5.523
  760    HB2  GLU  94           HB3      GLU  94 -12.856  -2.046   6.755
  761    HB3  GLU  94           HB2      GLU  94 -12.605  -3.787   6.768
  762    HG2  GLU  94           HG3      GLU  94 -10.394  -3.219   7.935
  763    HG3  GLU  94           HG2      GLU  94 -11.174  -1.652   8.155
  764    H    ASP  95           HN       ASP  95 -13.323  -4.063   5.127
  765    HA   ASP  95           HA       ASP  95 -13.592  -3.220   2.359
  766    HB2  ASP  95           HB2      ASP  95 -14.967  -5.118   1.999
  767    HB3  ASP  95           HB1      ASP  95 -13.659  -5.708   3.016
  768    H    LEU  96           HN       LEU  96 -15.895  -3.130   1.769
  769    HA   LEU  96           HA       LEU  96 -17.852  -2.178   3.652
  770    HB2  LEU  96           HB2      LEU  96 -16.529  -0.111   2.871
  771    HB3  LEU  96           HB1      LEU  96 -17.016  -0.504   1.236
  772    HG   LEU  96           HG       LEU  96 -19.371  -0.081   1.833
  773   HD11  LEU  96          HD11      LEU  96 -19.292  -0.700   4.192
  774   HD12  LEU  96          HD12      LEU  96 -19.912   0.939   3.991
  775   HD13  LEU  96          HD13      LEU  96 -18.252   0.686   4.524
  776   HD21  LEU  96          HD21      LEU  96 -17.997   1.736   0.955
  777   HD22  LEU  96          HD22      LEU  96 -17.484   2.142   2.590
  778   HD23  LEU  96          HD23      LEU  96 -19.173   2.337   2.126
  779    H    VAL  97           HN       VAL  97 -16.767  -2.407   0.403
  780    HA   VAL  97           HA       VAL  97 -18.555  -4.663  -0.061
  781    HB   VAL  97           HB       VAL  97 -18.870  -2.774  -1.750
  782   HG11  VAL  97          HG11      VAL  97 -15.958  -3.212  -2.376
  783   HG12  VAL  97          HG12      VAL  97 -16.661  -1.778  -1.623
  784   HG13  VAL  97          HG13      VAL  97 -17.066  -2.183  -3.289
  785   HG21  VAL  97          HG21      VAL  97 -17.506  -5.215  -2.881
  786   HG22  VAL  97          HG22      VAL  97 -18.522  -4.103  -3.796
  787   HG23  VAL  97          HG23      VAL  97 -19.218  -5.070  -2.492
  788    H    ARG  98           HN       ARG  98 -17.202  -6.523  -0.879
  789    HA   ARG  98           HA       ARG  98 -14.555  -6.176   0.235
  790    HB2  ARG  98           HB2      ARG  98 -15.900  -8.669  -0.745
  791    HB3  ARG  98           HB1      ARG  98 -14.310  -8.622  -0.008
  792    HG2  ARG  98           HG2      ARG  98 -15.334  -7.752   2.062
  793    HG3  ARG  98           HG1      ARG  98 -16.922  -7.910   1.312
  794    HD2  ARG  98           HD2      ARG  98 -16.412 -10.321   0.936
  795    HD3  ARG  98           HD1      ARG  98 -14.939 -10.091   1.877
  796    HE   ARG  98           HE       ARG  98 -17.198  -9.213   3.313
  797   HH11  ARG  98          HH11      ARG  98 -15.267 -12.035   2.533
  798   HH12  ARG  98          HH12      ARG  98 -16.054 -13.082   3.614
  799   HH21  ARG  98          HH21      ARG  98 -18.292 -10.636   4.834
  800   HH22  ARG  98          HH22      ARG  98 -17.830 -12.282   4.939
  801    H    ASP  99           HN       ASP  99 -12.856  -7.616  -0.987
  802    HA   ASP  99           HA       ASP  99 -12.372  -6.212  -3.404
  803    HB2  ASP  99           HB2      ASP  99 -10.895  -8.570  -2.226
  804    HB3  ASP  99           HB1      ASP  99 -10.354  -7.626  -3.611
  805    H    THR 100           HN       THR 100 -14.178  -6.758  -4.613
  806    HA   THR 100           HA       THR 100 -14.458  -9.418  -5.622
  807    HB   THR 100           HB       THR 100 -16.152  -8.077  -7.074
  808    HG1  THR 100           HG1      THR 100 -16.545  -6.073  -6.404
  809   HG21  THR 100          HG21      THR 100 -16.464  -8.207  -4.060
  810   HG22  THR 100          HG22      THR 100 -16.774  -9.543  -5.164
  811   HG23  THR 100          HG23      THR 100 -17.782  -8.098  -5.228
  812    H    VAL 101           HN       VAL 101 -13.160  -6.345  -6.546
  813    HA   VAL 101           HA       VAL 101 -12.492  -7.348  -9.161
  814    HB   VAL 101           HB       VAL 101 -13.421  -5.153  -9.240
  815   HG11  VAL 101          HG11      VAL 101 -12.452  -3.205  -8.067
  816   HG12  VAL 101          HG12      VAL 101 -11.408  -4.327  -7.173
  817   HG13  VAL 101          HG13      VAL 101 -13.155  -4.432  -7.014
  818   HG21  VAL 101          HG21      VAL 101 -10.433  -4.899  -9.619
  819   HG22  VAL 101          HG22      VAL 101 -11.641  -3.791 -10.274
  820   HG23  VAL 101          HG23      VAL 101 -11.596  -5.468 -10.816
  821    H    GLU 102           HN       GLU 102 -10.985  -8.802  -8.852
  822    HA   GLU 102           HA       GLU 102  -8.365  -7.898  -7.889
  823    HB2  GLU 102           HB3      GLU 102  -9.490 -10.701  -7.690
  824    HB3  GLU 102           HB2      GLU 102  -7.915 -10.172  -7.137
  825    HG2  GLU 102           HG3      GLU 102  -9.022  -8.724  -5.471
  826    HG3  GLU 102           HG2      GLU 102 -10.580  -9.364  -5.996
  Start of MODEL   16
    1    H1   GLY   1           HT1      GLY   1   8.080 -22.508   2.473
    2    H2   GLY   1           HT2      GLY   1   9.110 -21.566   3.399
    3    H3   GLY   1           HT3      GLY   1   9.590 -23.132   2.938
    4    HA2  GLY   1           HA2      GLY   1  10.688 -21.487   1.585
    5    HA3  GLY   1           HA3      GLY   1   9.536 -22.390   0.608
    6    H    HIS   2           HN       HIS   2   9.838 -20.292  -0.687
    7    HA   HIS   2           HA       HIS   2   7.912 -18.413   0.363
    8    HB2  HIS   2           HB2      HIS   2  10.553 -17.747  -0.808
    9    HB3  HIS   2           HB1      HIS   2   9.212 -16.635  -1.065
   10    HD1  HIS   2           HD1      HIS   2  11.739 -17.576   1.439
   11    HD2  HIS   2           HD2      HIS   2   8.052 -15.666   1.372
   12    HE1  HIS   2           HE1      HIS   2  11.562 -16.320   3.610
   13    H    MET   3           HN       MET   3   6.527 -19.855  -0.777
   14    HA   MET   3           HA       MET   3   6.111 -18.812  -3.481
   15    HB2  MET   3           HB2      MET   3   4.834 -21.187  -2.056
   16    HB3  MET   3           HB1      MET   3   4.420 -20.653  -3.674
   17    HG2  MET   3           HG2      MET   3   6.687 -21.190  -4.429
   18    HG3  MET   3           HG1      MET   3   7.091 -21.733  -2.806
   19    HE1  MET   3           HE1      MET   3   4.383 -23.252  -1.947
   20    HE2  MET   3           HE2      MET   3   6.011 -23.856  -1.644
   21    HE3  MET   3           HE3      MET   3   4.809 -24.900  -2.404
   22    H    LEU   4           HN       LEU   4   4.981 -16.996  -3.283
   23    HA   LEU   4           HA       LEU   4   3.666 -15.363  -2.427
   24    HB2  LEU   4           HB2      LEU   4   2.129 -17.735  -1.278
   25    HB3  LEU   4           HB1      LEU   4   1.594 -16.090  -1.084
   26    HG   LEU   4           HG       LEU   4   1.325 -15.953  -3.578
   27   HD11  LEU   4          HD11      LEU   4   1.175 -18.015  -4.860
   28   HD12  LEU   4          HD12      LEU   4   1.759 -18.930  -3.470
   29   HD13  LEU   4          HD13      LEU   4   2.814 -17.756  -4.258
   30   HD21  LEU   4          HD21      LEU   4  -0.753 -17.198  -3.589
   31   HD22  LEU   4          HD22      LEU   4  -0.539 -16.335  -2.067
   32   HD23  LEU   4          HD23      LEU   4  -0.254 -18.073  -2.144
   33    H    ARG   5           HN       ARG   5   2.420 -15.438   0.251
   34    HA   ARG   5           HA       ARG   5   4.722 -15.978   1.944
   35    HB2  ARG   5           HB2      ARG   5   4.622 -13.527   1.592
   36    HB3  ARG   5           HB1      ARG   5   2.945 -13.521   2.108
   37    HG2  ARG   5           HG2      ARG   5   4.388 -12.697   3.872
   38    HG3  ARG   5           HG1      ARG   5   3.638 -14.217   4.354
   39    HD2  ARG   5           HD2      ARG   5   5.704 -15.413   3.795
   40    HD3  ARG   5           HD1      ARG   5   6.457 -13.896   3.303
   41    HE   ARG   5           HE       ARG   5   5.564 -13.489   5.860
   42   HH11  ARG   5          HH11      ARG   5   7.880 -15.741   4.366
   43   HH12  ARG   5          HH12      ARG   5   8.815 -15.878   5.773
   44   HH21  ARG   5          HH21      ARG   5   6.882 -13.685   7.739
   45   HH22  ARG   5          HH22      ARG   5   8.251 -14.693   7.738
   46    H    THR   6           HN       THR   6   3.876 -17.831   2.699
   47    HA   THR   6           HA       THR   6   1.151 -18.247   3.229
   48    HB   THR   6           HB       THR   6   3.505 -19.793   4.325
   49    HG1  THR   6           HG1      THR   6   2.119 -19.986   1.845
   50   HG21  THR   6          HG21      THR   6   1.311 -20.414   5.270
   51   HG22  THR   6          HG22      THR   6   1.937 -21.695   4.231
   52   HG23  THR   6          HG23      THR   6   0.670 -20.621   3.642
   53    H    ALA   7           HN       ALA   7   3.902 -17.689   5.424
   54    HA   ALA   7           HA       ALA   7   2.168 -17.547   7.703
   55    HB1  ALA   7           HB1      ALA   7   4.451 -18.420   7.925
   56    HB2  ALA   7           HB2      ALA   7   4.196 -17.017   8.963
   57    HB3  ALA   7           HB3      ALA   7   5.090 -16.846   7.453
   58    H    GLY   8           HN       GLY   8   0.808 -15.922   7.592
   59    HA2  GLY   8           HA3      GLY   8   0.261 -13.699   8.153
   60    HA3  GLY   8           HA2      GLY   8   1.911 -13.223   7.754
   61    H    ARG   9           HN       ARG   9  -0.667 -14.892   5.998
   62    HA   ARG   9           HA       ARG   9  -0.076 -13.285   3.667
   63    HB2  ARG   9           HB2      ARG   9  -1.763 -14.722   2.486
   64    HB3  ARG   9           HB1      ARG   9  -0.424 -15.611   3.173
   65    HG2  ARG   9           HG2      ARG   9  -2.352 -16.915   3.548
   66    HG3  ARG   9           HG1      ARG   9  -1.950 -16.188   5.098
   67    HD2  ARG   9           HD2      ARG   9  -3.677 -14.459   4.682
   68    HD3  ARG   9           HD1      ARG   9  -4.105 -15.274   3.185
   69    HE   ARG   9           HE       ARG   9  -4.416 -17.240   4.926
   70   HH11  ARG   9          HH11      ARG   9  -5.502 -13.870   5.146
   71   HH12  ARG   9          HH12      ARG   9  -6.914 -14.215   6.016
   72   HH21  ARG   9          HH21      ARG   9  -6.374 -17.715   6.138
   73   HH22  ARG   9          HH22      ARG   9  -7.413 -16.450   6.613
   74    H    ASP  10           HN       ASP  10  -2.073 -13.169   6.291
   75    HA   ASP  10           HA       ASP  10  -4.416 -12.034   5.141
   76    HB2  ASP  10           HB2      ASP  10  -4.362 -13.215   7.335
   77    HB3  ASP  10           HB1      ASP  10  -3.480 -11.845   8.002
   78    H    GLY  11           HN       GLY  11  -4.342 -10.206   4.128
   79    HA2  GLY  11           HA3      GLY  11  -4.336  -7.834   4.215
   80    HA3  GLY  11           HA2      GLY  11  -3.069  -7.915   5.441
   81    H    LEU  12           HN       LEU  12  -1.545  -9.862   4.221
   82    HA   LEU  12           HA       LEU  12   0.193  -8.381   2.586
   83    HB2  LEU  12           HB2      LEU  12   0.806 -10.300   4.070
   84    HB3  LEU  12           HB1      LEU  12  -0.016 -11.369   2.967
   85    HG   LEU  12           HG       LEU  12   2.486 -11.429   2.857
   86   HD11  LEU  12          HD11      LEU  12   1.140 -10.642   0.286
   87   HD12  LEU  12          HD12      LEU  12   1.227 -12.266   0.966
   88   HD13  LEU  12          HD13      LEU  12   2.698 -11.456   0.429
   89   HD21  LEU  12          HD21      LEU  12   3.645  -9.630   1.690
   90   HD22  LEU  12          HD22      LEU  12   2.919  -9.090   3.207
   91   HD23  LEU  12          HD23      LEU  12   2.150  -8.699   1.670
   92    H    CYS  13           HN       CYS  13  -2.089 -11.004   1.841
   93    HA   CYS  13           HA       CYS  13  -1.556 -11.075  -0.919
   94    HB2  CYS  13           HB2      CYS  13  -2.631 -12.929   0.288
   95    HB3  CYS  13           HB1      CYS  13  -4.044 -11.942   0.595
   96    HG   CYS  13           HG       CYS  13  -3.225 -12.332  -2.626
   97    H    ARG  14           HN       ARG  14  -3.929  -9.304   0.967
   98    HA   ARG  14           HA       ARG  14  -5.333  -8.000  -1.102
   99    HB2  ARG  14           HB2      ARG  14  -6.066  -8.012   1.215
  100    HB3  ARG  14           HB1      ARG  14  -4.636  -7.131   1.708
  101    HG2  ARG  14           HG2      ARG  14  -5.440  -5.190   0.391
  102    HG3  ARG  14           HG1      ARG  14  -6.924  -6.092   0.047
  103    HD2  ARG  14           HD2      ARG  14  -7.197  -4.570   1.966
  104    HD3  ARG  14           HD1      ARG  14  -7.396  -6.263   2.438
  105    HE   ARG  14           HE       ARG  14  -4.761  -5.100   2.733
  106   HH11  ARG  14          HH11      ARG  14  -7.771  -5.990   4.399
  107   HH12  ARG  14          HH12      ARG  14  -7.068  -6.012   5.951
  108   HH21  ARG  14          HH21      ARG  14  -3.803  -5.137   4.907
  109   HH22  ARG  14          HH22      ARG  14  -4.753  -5.496   6.251
  110    H    LEU  15           HN       LEU  15  -2.410  -7.175   0.665
  111    HA   LEU  15           HA       LEU  15  -1.876  -4.649  -0.367
  112    HB2  LEU  15           HB2      LEU  15  -0.963  -5.501   1.687
  113    HB3  LEU  15           HB1      LEU  15  -0.162  -6.799   0.840
  114    HG   LEU  15           HG       LEU  15   1.374  -5.184  -0.183
  115   HD11  LEU  15          HD11      LEU  15   1.385  -2.900   0.568
  116   HD12  LEU  15          HD12      LEU  15  -0.052  -3.192   1.543
  117   HD13  LEU  15          HD13      LEU  15  -0.148  -3.270  -0.223
  118   HD21  LEU  15          HD21      LEU  15   1.947  -6.248   1.927
  119   HD22  LEU  15          HD22      LEU  15   1.125  -4.955   2.802
  120   HD23  LEU  15          HD23      LEU  15   2.567  -4.600   1.853
  121    H    SER  16           HN       SER  16  -0.494  -7.848  -1.244
  122    HA   SER  16           HA       SER  16   1.190  -6.865  -3.216
  123    HB2  SER  16           HB2      SER  16   1.295  -9.291  -3.924
  124    HB3  SER  16           HB1      SER  16   1.667  -8.971  -2.231
  125    HG   SER  16           HG       SER  16  -0.499 -10.282  -3.368
  126    H    THR  17           HN       THR  17  -2.122  -7.990  -3.367
  127    HA   THR  17           HA       THR  17  -2.384  -8.229  -6.116
  128    HB   THR  17           HB       THR  17  -4.529  -7.350  -4.148
  129    HG1  THR  17           HG1      THR  17  -3.908  -9.308  -3.452
  130   HG21  THR  17          HG21      THR  17  -4.750  -8.658  -6.865
  131   HG22  THR  17          HG22      THR  17  -5.176  -6.991  -6.483
  132   HG23  THR  17          HG23      THR  17  -6.095  -8.321  -5.777
  133    H    TYR  18           HN       TYR  18  -2.821  -5.305  -4.093
  134    HA   TYR  18           HA       TYR  18  -3.456  -3.741  -6.408
  135    HB2  TYR  18           HB2      TYR  18  -3.011  -2.962  -3.537
  136    HB3  TYR  18           HB1      TYR  18  -3.247  -1.764  -4.808
  137    HD1  TYR  18           HD1      TYR  18  -5.344  -1.881  -6.193
  138    HD2  TYR  18           HD2      TYR  18  -4.870  -4.048  -2.571
  139    HE1  TYR  18           HE1      TYR  18  -7.773  -2.157  -6.053
  140    HE2  TYR  18           HE2      TYR  18  -7.298  -4.329  -2.416
  141    HH   TYR  18           HH       TYR  18  -9.339  -3.251  -3.257
  142    H    LEU  19           HN       LEU  19  -0.570  -4.508  -4.719
  143    HA   LEU  19           HA       LEU  19   0.938  -2.436  -5.936
  144    HB2  LEU  19           HB2      LEU  19   1.754  -4.981  -4.549
  145    HB3  LEU  19           HB1      LEU  19   2.923  -3.871  -5.234
  146    HG   LEU  19           HG       LEU  19   0.954  -3.083  -3.048
  147   HD11  LEU  19          HD11      LEU  19   2.857  -3.161  -1.566
  148   HD12  LEU  19          HD12      LEU  19   3.856  -3.834  -2.861
  149   HD13  LEU  19          HD13      LEU  19   2.484  -4.750  -2.225
  150   HD21  LEU  19          HD21      LEU  19   1.722  -1.229  -4.461
  151   HD22  LEU  19          HD22      LEU  19   3.390  -1.714  -4.180
  152   HD23  LEU  19          HD23      LEU  19   2.404  -1.135  -2.842
  153    H    GLU  20           HN       GLU  20  -0.064  -5.616  -6.955
  154    HA   GLU  20           HA       GLU  20   1.718  -5.776  -9.199
  155    HB2  GLU  20           HB3      GLU  20  -0.918  -7.170  -8.692
  156    HB3  GLU  20           HB2      GLU  20   0.129  -7.512 -10.055
  157    HG2  GLU  20           HG3      GLU  20   1.883  -8.237  -8.510
  158    HG3  GLU  20           HG2      GLU  20   0.807  -7.906  -7.152
  159    H    GLU  21           HN       GLU  21  -0.955  -3.897  -8.532
  160    HA   GLU  21           HA       GLU  21  -1.879  -3.609 -11.260
  161    HB2  GLU  21           HB3      GLU  21  -2.626  -2.165  -8.719
  162    HB3  GLU  21           HB2      GLU  21  -3.424  -1.953 -10.269
  163    HG2  GLU  21           HG3      GLU  21  -3.300  -4.537  -8.736
  164    HG3  GLU  21           HG2      GLU  21  -4.644  -3.401  -8.679
  165    H    LEU  22           HN       LEU  22   0.575  -2.371  -9.329
  166    HA   LEU  22           HA       LEU  22   0.574   0.278 -10.483
  167    HB2  LEU  22           HB2      LEU  22   2.497  -1.035  -8.550
  168    HB3  LEU  22           HB1      LEU  22   2.668   0.579  -9.163
  169    HG   LEU  22           HG       LEU  22   0.457  -0.419  -7.382
  170   HD11  LEU  22          HD11      LEU  22   2.571  -0.178  -6.258
  171   HD12  LEU  22          HD12      LEU  22   1.494   1.143  -5.790
  172   HD13  LEU  22          HD13      LEU  22   2.790   1.429  -6.949
  173   HD21  LEU  22          HD21      LEU  22   0.968   2.351  -8.484
  174   HD22  LEU  22          HD22      LEU  22  -0.247   1.920  -7.284
  175   HD23  LEU  22          HD23      LEU  22  -0.374   1.296  -8.926
  176    H    GLU  23           HN       GLU  23   2.187   1.095 -11.714
  177    HA   GLU  23           HA       GLU  23   3.481  -0.691 -13.588
  178    HB2  GLU  23           HB3      GLU  23   3.890   2.277 -13.234
  179    HB3  GLU  23           HB2      GLU  23   4.224   1.311 -14.655
  180    HG2  GLU  23           HG3      GLU  23   1.494   1.884 -13.559
  181    HG3  GLU  23           HG2      GLU  23   2.260   2.745 -14.889
  182    H    ALA  24           HN       ALA  24   5.863  -0.259 -14.005
  183    HA   ALA  24           HA       ALA  24   7.405  -0.743 -11.720
  184    HB1  ALA  24           HB1      ALA  24   9.351  -0.456 -13.160
  185    HB2  ALA  24           HB2      ALA  24   8.343   0.295 -14.395
  186    HB3  ALA  24           HB3      ALA  24   8.106  -1.403 -13.975
  187    H    VAL  25           HN       VAL  25   6.896   2.223 -13.606
  188    HA   VAL  25           HA       VAL  25   8.554   3.896 -12.092
  189    HB   VAL  25           HB       VAL  25   7.648   4.606 -14.285
  190   HG11  VAL  25          HG11      VAL  25   5.345   5.407 -14.496
  191   HG12  VAL  25          HG12      VAL  25   5.046   4.886 -12.841
  192   HG13  VAL  25          HG13      VAL  25   5.397   3.680 -14.090
  193   HG21  VAL  25          HG21      VAL  25   8.414   6.348 -12.747
  194   HG22  VAL  25          HG22      VAL  25   6.779   6.429 -12.069
  195   HG23  VAL  25          HG23      VAL  25   7.060   6.911 -13.739
  196    H    GLU  26           HN       GLU  26   5.265   2.883 -11.574
  197    HA   GLU  26           HA       GLU  26   4.604   4.718  -9.514
  198    HB2  GLU  26           HB3      GLU  26   3.512   2.001 -10.177
  199    HB3  GLU  26           HB2      GLU  26   2.758   3.146  -9.063
  200    HG2  GLU  26           HG3      GLU  26   3.284   3.711 -11.962
  201    HG3  GLU  26           HG2      GLU  26   1.760   3.025 -11.381
  202    H    LEU  27           HN       LEU  27   5.650   1.334  -9.543
  203    HA   LEU  27           HA       LEU  27   5.848   0.946  -6.778
  204    HB2  LEU  27           HB2      LEU  27   7.397  -0.313  -9.049
  205    HB3  LEU  27           HB1      LEU  27   7.409  -0.904  -7.402
  206    HG   LEU  27           HG       LEU  27   4.904  -0.765  -9.081
  207   HD11  LEU  27          HD11      LEU  27   6.504  -2.267 -10.136
  208   HD12  LEU  27          HD12      LEU  27   5.182  -3.170  -9.406
  209   HD13  LEU  27          HD13      LEU  27   6.755  -3.104  -8.600
  210   HD21  LEU  27          HD21      LEU  27   4.553  -0.805  -6.661
  211   HD22  LEU  27          HD22      LEU  27   5.574  -2.237  -6.531
  212   HD23  LEU  27          HD23      LEU  27   4.045  -2.321  -7.405
  213    H    LYS  28           HN       LYS  28   8.135   2.096  -9.143
  214    HA   LYS  28           HA       LYS  28  10.425   2.344  -7.590
  215    HB2  LYS  28           HB2      LYS  28  10.279   2.452 -10.074
  216    HB3  LYS  28           HB1      LYS  28   9.490   4.003  -9.947
  217    HG2  LYS  28           HG2      LYS  28  12.292   3.531  -8.969
  218    HG3  LYS  28           HG1      LYS  28  11.934   3.959 -10.637
  219    HD2  LYS  28           HD2      LYS  28  10.784   5.994  -9.785
  220    HD3  LYS  28           HD1      LYS  28  11.349   5.581  -8.165
  221    HE2  LYS  28           HE2      LYS  28  12.881   7.179  -9.125
  222    HE3  LYS  28           HE1      LYS  28  13.672   5.607  -9.031
  223    HZ1  LYS  28           HZ1      LYS  28  13.152   5.285 -11.412
  224    HZ2  LYS  28           HZ2      LYS  28  14.115   6.630 -11.145
  225    HZ3  LYS  28           HZ3      LYS  28  12.495   6.837 -11.462
  226    H    LYS  29           HN       LYS  29   7.777   4.623  -8.140
  227    HA   LYS  29           HA       LYS  29   8.890   6.751  -6.579
  228    HB2  LYS  29           HB2      LYS  29   6.062   6.144  -7.338
  229    HB3  LYS  29           HB1      LYS  29   6.564   7.653  -6.595
  230    HG2  LYS  29           HG2      LYS  29   8.051   8.081  -8.619
  231    HG3  LYS  29           HG1      LYS  29   7.351   6.642  -9.327
  232    HD2  LYS  29           HD2      LYS  29   5.702   9.007  -8.442
  233    HD3  LYS  29           HD1      LYS  29   6.316   8.790 -10.082
  234    HE2  LYS  29           HE2      LYS  29   5.104   6.680 -10.257
  235    HE3  LYS  29           HE1      LYS  29   4.499   6.882  -8.615
  236    HZ1  LYS  29           HZ1      LYS  29   3.939   8.791 -10.818
  237    HZ2  LYS  29           HZ2      LYS  29   3.123   8.707  -9.326
  238    HZ3  LYS  29           HZ3      LYS  29   2.998   7.462 -10.464
  239    H    PHE  30           HN       PHE  30   6.449   4.311  -6.025
  240    HA   PHE  30           HA       PHE  30   5.664   4.976  -3.478
  241    HB2  PHE  30           HB2      PHE  30   4.188   3.482  -4.294
  242    HB3  PHE  30           HB1      PHE  30   5.383   2.721  -5.316
  243    HD1  PHE  30           HD1      PHE  30   3.924   2.746  -1.913
  244    HD2  PHE  30           HD2      PHE  30   6.323   0.728  -4.746
  245    HE1  PHE  30           HE1      PHE  30   3.867   0.720  -0.500
  246    HE2  PHE  30           HE2      PHE  30   6.296  -1.311  -3.335
  247    HZ   PHE  30           HZ       PHE  30   5.057  -1.300  -1.212
  248    H    LYS  31           HN       LYS  31   8.272   2.731  -4.409
  249    HA   LYS  31           HA       LYS  31   8.879   2.101  -1.668
  250    HB2  LYS  31           HB2      LYS  31  10.820   0.934  -2.482
  251    HB3  LYS  31           HB1      LYS  31   9.451   0.533  -3.507
  252    HG2  LYS  31           HG2      LYS  31  10.274   1.961  -5.256
  253    HG3  LYS  31           HG1      LYS  31  11.557   2.574  -4.212
  254    HD2  LYS  31           HD2      LYS  31  12.518   0.323  -4.082
  255    HD3  LYS  31           HD1      LYS  31  11.237  -0.281  -5.129
  256    HE2  LYS  31           HE2      LYS  31  12.015   1.130  -6.936
  257    HE3  LYS  31           HE1      LYS  31  13.245   1.835  -5.891
  258    HZ1  LYS  31           HZ1      LYS  31  14.098   0.093  -7.363
  259    HZ2  LYS  31           HZ2      LYS  31  13.103  -1.044  -6.625
  260    HZ3  LYS  31           HZ3      LYS  31  14.340  -0.271  -5.747
  261    H    LEU  32           HN       LEU  32  10.113   4.607  -3.788
  262    HA   LEU  32           HA       LEU  32  12.146   5.103  -1.848
  263    HB2  LEU  32           HB2      LEU  32  12.784   7.049  -3.126
  264    HB3  LEU  32           HB1      LEU  32  12.570   5.679  -4.180
  265    HG   LEU  32           HG       LEU  32  10.242   6.754  -4.702
  266   HD11  LEU  32          HD11      LEU  32  10.193   9.177  -4.561
  267   HD12  LEU  32          HD12      LEU  32  11.711   9.172  -3.664
  268   HD13  LEU  32          HD13      LEU  32  10.263   8.453  -2.955
  269   HD21  LEU  32          HD21      LEU  32  12.820   7.963  -5.577
  270   HD22  LEU  32          HD22      LEU  32  11.281   8.090  -6.450
  271   HD23  LEU  32          HD23      LEU  32  12.076   6.519  -6.254
  272    H    TYR  33           HN       TYR  33   8.946   6.230  -2.449
  273    HA   TYR  33           HA       TYR  33   9.063   8.490  -0.815
  274    HB2  TYR  33           HB2      TYR  33   7.211   8.113  -2.392
  275    HB3  TYR  33           HB1      TYR  33   6.638   6.780  -1.389
  276    HD1  TYR  33           HD2      TYR  33   7.037  10.393  -1.617
  277    HD2  TYR  33           HD1      TYR  33   5.540   7.189   0.725
  278    HE1  TYR  33           HE2      TYR  33   5.846  11.995  -0.194
  279    HE2  TYR  33           HE1      TYR  33   4.363   8.728   2.151
  280    HH   TYR  33           HH       TYR  33   4.640  11.161   2.795
  281    H    LEU  34           HN       LEU  34   8.173   5.172  -0.032
  282    HA   LEU  34           HA       LEU  34   8.028   6.054   2.729
  283    HB2  LEU  34           HB2      LEU  34   7.115   3.739   3.168
  284    HB3  LEU  34           HB1      LEU  34   6.130   4.868   2.278
  285    HG   LEU  34           HG       LEU  34   6.817   3.685   0.177
  286   HD11  LEU  34          HD11      LEU  34   8.802   2.561   0.869
  287   HD12  LEU  34          HD12      LEU  34   7.597   1.348   0.416
  288   HD13  LEU  34          HD13      LEU  34   7.930   1.688   2.118
  289   HD21  LEU  34          HD21      LEU  34   4.688   3.406   1.231
  290   HD22  LEU  34          HD22      LEU  34   5.339   2.130   2.267
  291   HD23  LEU  34          HD23      LEU  34   5.236   1.889   0.517
  292    H    GLY  35           HN       GLY  35  10.119   4.168   0.732
  293    HA2  GLY  35           HA3      GLY  35  11.235   2.756   2.897
  294    HA3  GLY  35           HA2      GLY  35  11.901   2.840   1.265
  295    H    THR  36           HN       THR  36  12.185   5.658   1.132
  296    HA   THR  36           HA       THR  36  14.506   5.897   2.928
  297    HB   THR  36           HB       THR  36  15.351   7.649   1.439
  298    HG1  THR  36           HG1      THR  36  14.136   8.594  -0.055
  299   HG21  THR  36          HG21      THR  36  15.730   5.336   0.667
  300   HG22  THR  36          HG22      THR  36  15.509   6.445  -0.697
  301   HG23  THR  36          HG23      THR  36  14.196   5.394  -0.208
  302    H    ALA  37           HN       ALA  37  11.479   6.539   3.304
  303    HA   ALA  37           HA       ALA  37  11.093   9.290   3.586
  304    HB1  ALA  37           HB1      ALA  37   9.618   7.096   4.970
  305    HB2  ALA  37           HB2      ALA  37   9.288   7.721   3.349
  306    HB3  ALA  37           HB3      ALA  37   9.077   8.757   4.760
  307    H    THR  38           HN       THR  38  12.030  10.633   4.882
  308    HA   THR  38           HA       THR  38  13.022   9.999   7.451
  309    HB   THR  38           HB       THR  38  12.347  12.705   6.230
  310    HG1  THR  38           HG1      THR  38  14.748  11.184   6.195
  311   HG21  THR  38          HG21      THR  38  14.070  13.567   7.798
  312   HG22  THR  38          HG22      THR  38  14.215  11.950   8.498
  313   HG23  THR  38          HG23      THR  38  12.704  12.839   8.638
  314    H    GLU  39           HN       GLU  39  10.097  11.137   6.092
  315    HA   GLU  39           HA       GLU  39   8.788  12.081   8.409
  316    HB2  GLU  39           HB3      GLU  39   6.656  11.870   7.147
  317    HB3  GLU  39           HB2      GLU  39   7.906  12.710   6.252
  318    HG2  GLU  39           HG3      GLU  39   8.327  10.707   4.933
  319    HG3  GLU  39           HG2      GLU  39   7.088   9.835   5.840
  320    H    LEU  40           HN       LEU  40   9.294   8.852   7.321
  321    HA   LEU  40           HA       LEU  40   7.262   7.773   9.110
  322    HB2  LEU  40           HB2      LEU  40   9.305   6.404   7.400
  323    HB3  LEU  40           HB1      LEU  40   8.111   5.589   8.381
  324    HG   LEU  40           HG       LEU  40   7.595   7.336   5.972
  325   HD11  LEU  40          HD11      LEU  40   6.797   5.281   4.965
  326   HD12  LEU  40          HD12      LEU  40   7.236   4.393   6.427
  327   HD13  LEU  40          HD13      LEU  40   8.487   5.153   5.449
  328   HD21  LEU  40          HD21      LEU  40   5.791   7.622   7.597
  329   HD22  LEU  40          HD22      LEU  40   5.622   5.867   7.725
  330   HD23  LEU  40          HD23      LEU  40   5.254   6.683   6.204
  331    H    GLY  41           HN       GLY  41  10.435   8.706   9.257
  332    HA2  GLY  41           HA3      GLY  41  11.556   8.776  11.396
  333    HA3  GLY  41           HA2      GLY  41  10.804   7.231  11.778
  334    H    GLU  42           HN       GLU  42  13.123   8.794   9.662
  335    HA   GLU  42           HA       GLU  42  15.085   8.241   8.788
  336    HB2  GLU  42           HB3      GLU  42  15.029   6.067  10.846
  337    HB3  GLU  42           HB2      GLU  42  16.446   6.469   9.880
  338    HG2  GLU  42           HG3      GLU  42  15.021   8.279  11.825
  339    HG3  GLU  42           HG2      GLU  42  16.569   7.479  12.083
  340    H    GLY  43           HN       GLY  43  12.520   6.326   8.216
  341    HA2  GLY  43           HA3      GLY  43  12.125   5.056   6.294
  342    HA3  GLY  43           HA2      GLY  43  13.859   5.044   5.983
  343    H    LYS  44           HN       LYS  44  11.289   3.238   7.016
  344    HA   LYS  44           HA       LYS  44  12.692   1.615   8.892
  345    HB2  LYS  44           HB2      LYS  44   9.941   1.513   7.781
  346    HB3  LYS  44           HB1      LYS  44  10.592   0.049   8.509
  347    HG2  LYS  44           HG2      LYS  44   9.315   1.312  10.129
  348    HG3  LYS  44           HG1      LYS  44  11.012   1.276  10.583
  349    HD2  LYS  44           HD2      LYS  44  11.218   3.541   9.469
  350    HD3  LYS  44           HD1      LYS  44   9.455   3.549   9.379
  351    HE2  LYS  44           HE2      LYS  44  10.170   4.742  11.329
  352    HE3  LYS  44           HE1      LYS  44   9.368   3.232  11.812
  353    HZ1  LYS  44           HZ1      LYS  44  12.306   3.662  11.686
  354    HZ2  LYS  44           HZ2      LYS  44  11.538   2.256  12.204
  355    HZ3  LYS  44           HZ3      LYS  44  11.385   3.664  13.093
  356    H    ILE  45           HN       ILE  45  12.669   1.687   5.579
  357    HA   ILE  45           HA       ILE  45  13.162  -1.174   5.304
  358    HB   ILE  45           HB       ILE  45  12.819   0.959   3.171
  359   HG12  ILE  45          HG12      ILE  45  10.716   0.524   4.401
  360   HG13  ILE  45          HG11      ILE  45  10.614  -0.025   2.734
  361   HG21  ILE  45          HG21      ILE  45  12.988  -2.037   2.888
  362   HG22  ILE  45          HG22      ILE  45  14.221  -0.873   2.399
  363   HG23  ILE  45          HG23      ILE  45  12.652  -0.893   1.589
  364   HD11  ILE  45          HD11      ILE  45   9.558  -1.610   4.225
  365   HD12  ILE  45          HD12      ILE  45  11.035  -1.752   5.172
  366   HD13  ILE  45          HD13      ILE  45  10.996  -2.331   3.504
  367    HA   PRO  46           HA       PRO  46  17.595  -0.338   5.204
  368    HB2  PRO  46           HB2      PRO  46  18.253  -2.556   3.646
  369    HB3  PRO  46           HB1      PRO  46  18.146  -2.542   5.405
  370    HG2  PRO  46           HG2      PRO  46  16.157  -3.445   3.387
  371    HG3  PRO  46           HG1      PRO  46  16.522  -4.137   4.980
  372    HD2  PRO  46           HD2      PRO  46  14.334  -2.671   4.527
  373    HD3  PRO  46           HD1      PRO  46  15.200  -2.578   6.076
  374    H    TRP  47           HN       TRP  47  19.132   0.339   3.792
  375    HA   TRP  47           HA       TRP  47  18.726   2.174   2.000
  376    HB2  TRP  47           HB2      TRP  47  21.007   1.867   1.147
  377    HB3  TRP  47           HB1      TRP  47  20.916   1.684   2.891
  378    HD1  TRP  47           HD1      TRP  47  21.908  -0.153  -0.252
  379    HE1  TRP  47           HE1      TRP  47  22.832  -2.481   0.336
  380    HE3  TRP  47           HE3      TRP  47  20.668  -0.299   4.714
  381    HZ2  TRP  47           HZ2      TRP  47  23.021  -4.150   2.599
  382    HZ3  TRP  47           HZ3      TRP  47  21.255  -2.296   6.006
  383    HH2  TRP  47           HH2      TRP  47  22.407  -4.180   4.972
  384    H    GLY  48           HN       GLY  48  19.051  -1.187   0.845
  385    HA2  GLY  48           HA3      GLY  48  17.601  -0.440  -1.547
  386    HA3  GLY  48           HA2      GLY  48  19.273  -0.929  -1.798
  387    H    SER  49           HN       SER  49  16.540  -2.070   0.148
  388    HA   SER  49           HA       SER  49  17.209  -4.785  -0.734
  389    HB2  SER  49           HB2      SER  49  17.036  -4.282   1.709
  390    HB3  SER  49           HB1      SER  49  15.344  -3.853   1.475
  391    HG   SER  49           HG       SER  49  15.631  -6.239   0.438
  392    H    MET  50           HN       MET  50  15.391  -2.335  -1.820
  393    HA   MET  50           HA       MET  50  12.967  -3.926  -2.424
  394    HB2  MET  50           HB2      MET  50  13.356  -0.931  -2.502
  395    HB3  MET  50           HB1      MET  50  11.864  -1.792  -2.846
  396    HG2  MET  50           HG2      MET  50  11.651  -2.475  -0.589
  397    HG3  MET  50           HG1      MET  50  13.250  -1.837  -0.201
  398    HE1  MET  50           HE1      MET  50  13.292   0.955  -1.781
  399    HE2  MET  50           HE2      MET  50  13.847   0.739  -0.123
  400    HE3  MET  50           HE3      MET  50  12.714   2.032  -0.513
  401    H    GLU  51           HN       GLU  51  15.666  -3.806  -3.851
  402    HA   GLU  51           HA       GLU  51  15.058  -2.332  -6.260
  403    HB2  GLU  51           HB3      GLU  51  17.457  -4.030  -5.585
  404    HB3  GLU  51           HB2      GLU  51  17.316  -2.889  -6.914
  405    HG2  GLU  51           HG3      GLU  51  17.258  -2.207  -3.979
  406    HG3  GLU  51           HG2      GLU  51  18.602  -1.939  -5.078
  407    H    LYS  52           HN       LYS  52  15.923  -5.644  -5.443
  408    HA   LYS  52           HA       LYS  52  14.909  -6.643  -7.967
  409    HB2  LYS  52           HB2      LYS  52  16.103  -8.022  -5.558
  410    HB3  LYS  52           HB1      LYS  52  15.544  -8.862  -6.995
  411    HG2  LYS  52           HG2      LYS  52  17.705  -6.768  -6.983
  412    HG3  LYS  52           HG1      LYS  52  18.000  -8.500  -6.890
  413    HD2  LYS  52           HD2      LYS  52  16.486  -7.204  -9.169
  414    HD3  LYS  52           HD1      LYS  52  18.225  -7.416  -9.180
  415    HE2  LYS  52           HE2      LYS  52  17.231  -9.223 -10.442
  416    HE3  LYS  52           HE1      LYS  52  17.883  -9.885  -8.954
  417    HZ1  LYS  52           HZ1      LYS  52  15.001  -9.259  -9.406
  418    HZ2  LYS  52           HZ2      LYS  52  15.653 -10.139  -8.095
  419    HZ3  LYS  52           HZ3      LYS  52  15.705 -10.751  -9.632
  420    H    ALA  53           HN       ALA  53  13.325  -5.489  -5.571
  421    HA   ALA  53           HA       ALA  53  11.580  -7.699  -4.924
  422    HB1  ALA  53           HB1      ALA  53  10.519  -6.134  -3.385
  423    HB2  ALA  53           HB2      ALA  53  11.509  -4.824  -4.023
  424    HB3  ALA  53           HB3      ALA  53  12.269  -6.156  -3.149
  425    H    GLY  54           HN       GLY  54   9.942  -8.175  -6.212
  426    HA2  GLY  54           HA3      GLY  54   8.778  -6.247  -8.006
  427    HA3  GLY  54           HA2      GLY  54   8.344  -7.952  -7.791
  428    HA   PRO  55           HA       PRO  55   5.076  -5.155  -5.876
  429    HB2  PRO  55           HB2      PRO  55   3.039  -6.834  -6.755
  430    HB3  PRO  55           HB1      PRO  55   3.560  -5.349  -7.555
  431    HG2  PRO  55           HG2      PRO  55   4.261  -8.180  -8.169
  432    HG3  PRO  55           HG1      PRO  55   3.983  -6.829  -9.280
  433    HD2  PRO  55           HD2      PRO  55   6.445  -7.722  -8.708
  434    HD3  PRO  55           HD1      PRO  55   6.149  -6.000  -8.980
  435    H    LEU  56           HN       LEU  56   5.377  -8.658  -5.993
  436    HA   LEU  56           HA       LEU  56   3.876  -9.115  -3.543
  437    HB2  LEU  56           HB2      LEU  56   3.884 -10.778  -5.331
  438    HB3  LEU  56           HB1      LEU  56   5.625 -10.904  -5.218
  439    HG   LEU  56           HG       LEU  56   5.384 -11.811  -2.944
  440   HD11  LEU  56          HD11      LEU  56   2.451 -11.833  -3.610
  441   HD12  LEU  56          HD12      LEU  56   3.239 -10.885  -2.348
  442   HD13  LEU  56          HD13      LEU  56   3.195 -12.646  -2.231
  443   HD21  LEU  56          HD21      LEU  56   5.693 -13.219  -4.860
  444   HD22  LEU  56          HD22      LEU  56   3.960 -13.270  -5.142
  445   HD23  LEU  56          HD23      LEU  56   4.641 -14.019  -3.689
  446    H    GLU  57           HN       GLU  57   7.214  -9.064  -4.556
  447    HA   GLU  57           HA       GLU  57   8.353  -9.815  -2.098
  448    HB2  GLU  57           HB3      GLU  57   9.451  -8.089  -4.305
  449    HB3  GLU  57           HB2      GLU  57  10.404  -8.739  -2.981
  450    HG2  GLU  57           HG3      GLU  57   8.890 -10.435  -4.948
  451    HG3  GLU  57           HG2      GLU  57  10.584  -9.984  -5.124
  452    H    MET  58           HN       MET  58   7.651  -6.624  -3.513
  453    HA   MET  58           HA       MET  58   8.556  -5.021  -1.411
  454    HB2  MET  58           HB2      MET  58   6.354  -4.577  -3.414
  455    HB3  MET  58           HB1      MET  58   6.805  -3.334  -2.263
  456    HG2  MET  58           HG2      MET  58   9.107  -3.386  -3.201
  457    HG3  MET  58           HG1      MET  58   8.563  -4.595  -4.360
  458    HE1  MET  58           HE1      MET  58  10.070  -1.972  -5.105
  459    HE2  MET  58           HE2      MET  58   9.164  -1.356  -6.482
  460    HE3  MET  58           HE3      MET  58   9.518  -3.084  -6.356
  461    H    ALA  59           HN       ALA  59   5.339  -6.359  -1.992
  462    HA   ALA  59           HA       ALA  59   3.998  -5.388   0.194
  463    HB1  ALA  59           HB1      ALA  59   2.539  -7.329  -0.014
  464    HB2  ALA  59           HB2      ALA  59   3.770  -8.167  -0.955
  465    HB3  ALA  59           HB3      ALA  59   2.985  -6.734  -1.616
  466    H    GLN  60           HN       GLN  60   6.055  -8.247  -0.004
  467    HA   GLN  60           HA       GLN  60   5.656  -9.048   2.671
  468    HB2  GLN  60           HB2      GLN  60   7.894  -9.741   0.774
  469    HB3  GLN  60           HB1      GLN  60   7.552 -10.568   2.290
  470    HG2  GLN  60           HG2      GLN  60   5.313 -11.196   1.393
  471    HG3  GLN  60           HG1      GLN  60   5.746 -10.392  -0.094
  472   HE21  GLN  60          HE21      GLN  60   5.463 -12.243  -1.215
  473   HE22  GLN  60          HE22      GLN  60   6.620 -13.519  -1.236
  474    H    LEU  61           HN       LEU  61   8.006  -6.973   1.124
  475    HA   LEU  61           HA       LEU  61   9.687  -6.696   3.364
  476    HB2  LEU  61           HB2      LEU  61   9.356  -5.306   0.809
  477    HB3  LEU  61           HB1      LEU  61  10.069  -4.298   2.030
  478    HG   LEU  61           HG       LEU  61  11.839  -6.034   2.344
  479   HD11  LEU  61          HD11      LEU  61  10.661  -7.992   1.527
  480   HD12  LEU  61          HD12      LEU  61  12.159  -7.734   0.636
  481   HD13  LEU  61          HD13      LEU  61  10.612  -7.301  -0.094
  482   HD21  LEU  61          HD21      LEU  61  12.210  -4.088   0.984
  483   HD22  LEU  61          HD22      LEU  61  11.515  -4.909  -0.415
  484   HD23  LEU  61          HD23      LEU  61  13.023  -5.492   0.292
  485    H    LEU  62           HN       LEU  62   6.935  -4.643   2.299
  486    HA   LEU  62           HA       LEU  62   7.128  -2.927   4.497
  487    HB2  LEU  62           HB2      LEU  62   4.742  -3.645   2.795
  488    HB3  LEU  62           HB1      LEU  62   4.651  -2.497   4.104
  489    HG   LEU  62           HG       LEU  62   4.765  -1.261   2.119
  490   HD11  LEU  62          HD11      LEU  62   7.489  -1.230   3.308
  491   HD12  LEU  62          HD12      LEU  62   6.071  -0.333   3.862
  492   HD13  LEU  62          HD13      LEU  62   6.777   0.011   2.278
  493   HD21  LEU  62          HD21      LEU  62   6.539  -1.473   0.463
  494   HD22  LEU  62          HD22      LEU  62   5.529  -2.923   0.630
  495   HD23  LEU  62          HD23      LEU  62   7.136  -2.890   1.345
  496    H    ILE  63           HN       ILE  63   5.397  -5.963   4.071
  497    HA   ILE  63           HA       ILE  63   4.023  -5.863   6.537
  498    HB   ILE  63           HB       ILE  63   3.771  -7.450   4.363
  499   HG12  ILE  63          HG12      ILE  63   2.122  -7.115   6.150
  500   HG13  ILE  63          HG11      ILE  63   2.113  -8.757   5.522
  501   HG21  ILE  63          HG21      ILE  63   4.323  -9.789   4.843
  502   HG22  ILE  63          HG22      ILE  63   5.130  -9.287   6.326
  503   HG23  ILE  63          HG23      ILE  63   5.771  -8.782   4.765
  504   HD11  ILE  63          HD11      ILE  63   1.829  -8.749   7.934
  505   HD12  ILE  63          HD12      ILE  63   3.322  -7.828   8.123
  506   HD13  ILE  63          HD13      ILE  63   3.381  -9.480   7.510
  507    H    THR  64           HN       THR  64   7.249  -6.911   5.728
  508    HA   THR  64           HA       THR  64   7.717  -8.338   8.146
  509    HB   THR  64           HB       THR  64   9.688  -7.266   6.103
  510    HG1  THR  64           HG1      THR  64   8.338  -8.786   5.225
  511   HG21  THR  64          HG21      THR  64  11.280  -8.902   7.059
  512   HG22  THR  64          HG22      THR  64  10.093  -9.319   8.298
  513   HG23  THR  64          HG23      THR  64  10.797  -7.705   8.262
  514    H    HIS  65           HN       HIS  65   8.234  -4.999   7.165
  515    HA   HIS  65           HA       HIS  65   9.619  -4.557   9.702
  516    HB2  HIS  65           HB2      HIS  65   9.413  -2.725   7.305
  517    HB3  HIS  65           HB1      HIS  65  10.232  -2.302   8.803
  518    HD1  HIS  65           HD1      HIS  65  12.519  -3.637   9.315
  519    HD2  HIS  65           HD2      HIS  65  10.803  -4.344   5.591
  520    HE1  HIS  65           HE1      HIS  65  14.286  -4.758   7.945
  521    H    PHE  66           HN       PHE  66   6.922  -3.112   7.870
  522    HA   PHE  66           HA       PHE  66   6.098  -1.563  10.110
  523    HB2  PHE  66           HB2      PHE  66   4.760  -2.144   7.478
  524    HB3  PHE  66           HB1      PHE  66   4.213  -0.956   8.659
  525    HD1  PHE  66           HD1      PHE  66   5.447   1.084   9.035
  526    HD2  PHE  66           HD2      PHE  66   6.728  -1.781   6.173
  527    HE1  PHE  66           HE1      PHE  66   6.995   2.730   8.062
  528    HE2  PHE  66           HE2      PHE  66   8.247  -0.149   5.205
  529    HZ   PHE  66           HZ       PHE  66   8.404   2.067   6.137
  530    H    GLY  67           HN       GLY  67   4.280  -4.108   8.354
  531    HA2  GLY  67           HA3      GLY  67   3.538  -5.886  10.137
  532    HA3  GLY  67           HA2      GLY  67   2.647  -4.497  10.757
  533    HA   PRO  68           HA       PRO  68   0.339  -6.875   7.323
  534    HB2  PRO  68           HB2      PRO  68  -1.995  -7.193   8.783
  535    HB3  PRO  68           HB1      PRO  68  -0.729  -8.413   8.620
  536    HG2  PRO  68           HG2      PRO  68  -1.253  -6.505  10.851
  537    HG3  PRO  68           HG1      PRO  68  -0.684  -8.183  10.918
  538    HD2  PRO  68           HD2      PRO  68   0.973  -6.075  11.270
  539    HD3  PRO  68           HD1      PRO  68   1.518  -7.574  10.508
  540    H    GLU  69           HN       GLU  69  -1.342  -4.699   9.609
  541    HA   GLU  69           HA       GLU  69  -2.906  -3.620   7.457
  542    HB2  GLU  69           HB3      GLU  69  -2.772  -2.813  10.346
  543    HB3  GLU  69           HB2      GLU  69  -3.921  -2.201   9.168
  544    HG2  GLU  69           HG3      GLU  69  -3.692  -5.021  10.193
  545    HG3  GLU  69           HG2      GLU  69  -4.980  -3.833  10.422
  546    H    GLU  70           HN       GLU  70  -0.139  -2.844   9.307
  547    HA   GLU  70           HA       GLU  70   0.017  -0.080   8.766
  548    HB2  GLU  70           HB3      GLU  70   1.251  -1.403  10.557
  549    HB3  GLU  70           HB2      GLU  70   2.355  -1.910   9.290
  550    HG2  GLU  70           HG3      GLU  70   3.327  -0.065  10.455
  551    HG3  GLU  70           HG2      GLU  70   2.846   0.481   8.847
  552    H    ALA  71           HN       ALA  71   1.570  -2.901   7.240
  553    HA   ALA  71           HA       ALA  71   2.907  -1.617   5.122
  554    HB1  ALA  71           HB1      ALA  71   1.569  -4.313   5.173
  555    HB2  ALA  71           HB2      ALA  71   3.218  -3.971   5.696
  556    HB3  ALA  71           HB3      ALA  71   2.770  -3.778   4.000
  557    H    TRP  72           HN       TRP  72  -0.381  -2.687   5.523
  558    HA   TRP  72           HA       TRP  72  -1.182  -2.313   2.871
  559    HB2  TRP  72           HB2      TRP  72  -2.474  -3.735   4.338
  560    HB3  TRP  72           HB1      TRP  72  -2.794  -2.388   5.425
  561    HD1  TRP  72           HD1      TRP  72  -5.314  -1.970   5.231
  562    HE1  TRP  72           HE1      TRP  72  -6.960  -1.589   3.283
  563    HE3  TRP  72           HE3      TRP  72  -2.183  -2.816   1.303
  564    HZ2  TRP  72           HZ2      TRP  72  -6.917  -1.590   0.519
  565    HZ3  TRP  72           HZ3      TRP  72  -3.069  -2.615  -0.986
  566    HH2  TRP  72           HH2      TRP  72  -5.405  -2.018  -1.364
  567    H    ARG  73           HN       ARG  73  -1.522  -0.265   5.728
  568    HA   ARG  73           HA       ARG  73  -2.698   1.837   4.357
  569    HB2  ARG  73           HB2      ARG  73  -2.712   1.767   6.809
  570    HB3  ARG  73           HB1      ARG  73  -0.970   1.990   6.839
  571    HG2  ARG  73           HG2      ARG  73  -1.275   4.196   5.713
  572    HG3  ARG  73           HG1      ARG  73  -3.010   3.992   5.884
  573    HD2  ARG  73           HD2      ARG  73  -2.090   5.417   7.626
  574    HD3  ARG  73           HD1      ARG  73  -2.791   3.964   8.309
  575    HE   ARG  73           HE       ARG  73  -0.565   3.105   8.627
  576   HH11  ARG  73          HH11      ARG  73  -0.716   6.598   7.919
  577   HH12  ARG  73          HH12      ARG  73   0.804   6.906   8.609
  578   HH21  ARG  73          HH21      ARG  73   1.382   3.572   9.600
  579   HH22  ARG  73          HH22      ARG  73   2.010   5.182   9.690
  580    H    LEU  74           HN       LEU  74   0.660   1.134   5.142
  581    HA   LEU  74           HA       LEU  74   1.897   3.370   4.125
  582    HB2  LEU  74           HB2      LEU  74   2.724   0.635   4.744
  583    HB3  LEU  74           HB1      LEU  74   3.712   1.417   3.533
  584    HG   LEU  74           HG       LEU  74   4.650   1.626   5.804
  585   HD11  LEU  74          HD11      LEU  74   5.208   3.294   4.164
  586   HD12  LEU  74          HD12      LEU  74   5.063   4.027   5.753
  587   HD13  LEU  74          HD13      LEU  74   3.768   4.227   4.571
  588   HD21  LEU  74          HD21      LEU  74   2.548   1.716   7.075
  589   HD22  LEU  74          HD22      LEU  74   2.213   3.311   6.396
  590   HD23  LEU  74          HD23      LEU  74   3.605   3.077   7.453
  591    H    ALA  75           HN       ALA  75   0.885   0.499   2.338
  592    HA   ALA  75           HA       ALA  75   2.053   1.489  -0.069
  593    HB1  ALA  75           HB1      ALA  75  -0.049  -0.633   0.276
  594    HB2  ALA  75           HB2      ALA  75   1.710  -0.874   0.173
  595    HB3  ALA  75           HB3      ALA  75   0.825  -0.258  -1.208
  596    H    LEU  76           HN       LEU  76  -1.390   1.265   0.941
  597    HA   LEU  76           HA       LEU  76  -2.227   2.584  -1.410
  598    HB2  LEU  76           HB2      LEU  76  -4.450   2.686  -0.493
  599    HB3  LEU  76           HB1      LEU  76  -3.740   1.137  -0.120
  600    HG   LEU  76           HG       LEU  76  -3.233   2.299   2.208
  601   HD11  LEU  76          HD11      LEU  76  -5.622   3.839   1.243
  602   HD12  LEU  76          HD12      LEU  76  -4.027   4.502   1.587
  603   HD13  LEU  76          HD13      LEU  76  -4.995   3.810   2.891
  604   HD21  LEU  76          HD21      LEU  76  -5.935   1.340   1.373
  605   HD22  LEU  76          HD22      LEU  76  -5.325   1.457   3.021
  606   HD23  LEU  76          HD23      LEU  76  -4.575   0.338   1.880
  607    H    SER  77           HN       SER  77  -1.515   3.848   1.782
  608    HA   SER  77           HA       SER  77  -2.322   6.443   1.012
  609    HB2  SER  77           HB2      SER  77  -1.296   5.148   3.427
  610    HB3  SER  77           HB1      SER  77  -1.176   6.935   3.377
  611    HG   SER  77           HG       SER  77  -3.505   6.573   2.638
  612    H    THR  78           HN       THR  78   0.281   4.729   0.135
  613    HA   THR  78           HA       THR  78   1.805   7.171  -0.256
  614    HB   THR  78           HB       THR  78   2.632   4.266  -0.494
  615    HG1  THR  78           HG1      THR  78   3.044   4.624   1.461
  616   HG21  THR  78          HG21      THR  78   4.903   5.089  -1.023
  617   HG22  THR  78          HG22      THR  78   4.279   6.742  -1.069
  618   HG23  THR  78          HG23      THR  78   3.744   5.566  -2.266
  619    H    PHE  79           HN       PHE  79  -0.064   4.670  -1.823
  620    HA   PHE  79           HA       PHE  79   0.492   5.095  -4.487
  621    HB2  PHE  79           HB2      PHE  79  -2.228   4.656  -3.208
  622    HB3  PHE  79           HB1      PHE  79  -1.958   4.601  -4.939
  623    HD1  PHE  79           HD1      PHE  79   0.873   3.078  -3.998
  624    HD2  PHE  79           HD2      PHE  79  -3.325   2.476  -3.673
  625    HE1  PHE  79           HE1      PHE  79   1.229   0.667  -3.785
  626    HE2  PHE  79           HE2      PHE  79  -2.972   0.060  -3.456
  627    HZ   PHE  79           HZ       PHE  79  -0.691  -0.853  -3.509
  628    H    GLU  80           HN       GLU  80  -1.949   6.684  -2.465
  629    HA   GLU  80           HA       GLU  80  -2.799   8.690  -4.208
  630    HB2  GLU  80           HB3      GLU  80  -3.456   9.931  -2.109
  631    HB3  GLU  80           HB2      GLU  80  -4.060   8.277  -2.225
  632    HG2  GLU  80           HG3      GLU  80  -2.588   7.477  -0.716
  633    HG3  GLU  80           HG2      GLU  80  -1.494   8.856  -0.856
  634    H    ARG  81           HN       ARG  81   0.062   8.561  -2.203
  635    HA   ARG  81           HA       ARG  81   0.676  11.352  -2.268
  636    HB2  ARG  81           HB2      ARG  81   2.456   8.995  -1.704
  637    HB3  ARG  81           HB1      ARG  81   2.925  10.667  -1.507
  638    HG2  ARG  81           HG2      ARG  81   0.799   9.205   0.045
  639    HG3  ARG  81           HG1      ARG  81   2.410   9.664   0.598
  640    HD2  ARG  81           HD2      ARG  81   1.144  11.327   1.519
  641    HD3  ARG  81           HD1      ARG  81   1.636  12.044  -0.017
  642    HE   ARG  81           HE       ARG  81  -0.992  10.752   0.334
  643   HH11  ARG  81          HH11      ARG  81   0.885  13.558  -0.798
  644   HH12  ARG  81          HH12      ARG  81  -0.491  14.439  -1.242
  645   HH21  ARG  81          HH21      ARG  81  -2.800  11.922  -0.260
  646   HH22  ARG  81          HH22      ARG  81  -2.674  13.503  -0.933
  647    H    ILE  82           HN       ILE  82   1.529   8.532  -4.154
  648    HA   ILE  82           HA       ILE  82   3.356  10.097  -5.765
  649    HB   ILE  82           HB       ILE  82   3.979   8.003  -6.858
  650   HG12  ILE  82          HG12      ILE  82   1.908   6.684  -5.073
  651   HG13  ILE  82          HG11      ILE  82   1.704   6.948  -6.797
  652   HG21  ILE  82          HG21      ILE  82   4.894   6.838  -4.863
  653   HG22  ILE  82          HG22      ILE  82   3.829   7.822  -3.844
  654   HG23  ILE  82          HG23      ILE  82   5.093   8.593  -4.786
  655   HD11  ILE  82          HD11      ILE  82   2.320   4.651  -6.281
  656   HD12  ILE  82          HD12      ILE  82   3.811   5.222  -5.524
  657   HD13  ILE  82          HD13      ILE  82   3.556   5.450  -7.251
  658    H    ASN  83           HN       ASN  83   0.303  10.168  -5.671
  659    HA   ASN  83           HA       ASN  83  -1.259  10.974  -6.970
  660    HB2  ASN  83           HB3      ASN  83   0.793  10.884  -9.153
  661    HB3  ASN  83           HB2      ASN  83  -0.873  11.405  -9.400
  662   HD21  ASN  83          HD21      ASN  83  -1.163  12.735  -6.830
  663   HD22  ASN  83          HD22      ASN  83  -0.168  14.139  -6.928
  664    H    ARG  84           HN       ARG  84  -0.711   8.101  -6.632
  665    HA   ARG  84           HA       ARG  84  -2.449   7.219  -8.772
  666    HB2  ARG  84           HB2      ARG  84  -0.405   5.972  -8.432
  667    HB3  ARG  84           HB1      ARG  84  -0.865   5.603  -6.780
  668    HG2  ARG  84           HG2      ARG  84  -1.314   3.697  -8.299
  669    HG3  ARG  84           HG1      ARG  84  -2.782   4.310  -7.532
  670    HD2  ARG  84           HD2      ARG  84  -3.141   3.864  -9.885
  671    HD3  ARG  84           HD1      ARG  84  -3.324   5.570  -9.483
  672    HE   ARG  84           HE       ARG  84  -0.640   5.095 -10.255
  673   HH11  ARG  84          HH11      ARG  84  -3.820   5.519 -11.881
  674   HH12  ARG  84          HH12      ARG  84  -3.068   5.814 -13.379
  675   HH21  ARG  84          HH21      ARG  84   0.234   5.580 -12.187
  676   HH22  ARG  84          HH22      ARG  84  -0.705   5.874 -13.598
  677    H    LYS  85           HN       LYS  85  -4.278   8.174  -7.935
  678    HA   LYS  85           HA       LYS  85  -5.100   7.404  -5.275
  679    HB2  LYS  85           HB2      LYS  85  -5.116   9.748  -6.010
  680    HB3  LYS  85           HB1      LYS  85  -6.372   9.366  -7.193
  681    HG2  LYS  85           HG2      LYS  85  -7.844   8.732  -5.330
  682    HG3  LYS  85           HG1      LYS  85  -6.556   9.141  -4.193
  683    HD2  LYS  85           HD2      LYS  85  -7.978  11.028  -4.233
  684    HD3  LYS  85           HD1      LYS  85  -6.593  11.468  -5.230
  685    HE2  LYS  85           HE2      LYS  85  -8.486  12.185  -6.422
  686    HE3  LYS  85           HE1      LYS  85  -7.971  10.702  -7.222
  687    HZ1  LYS  85           HZ1      LYS  85 -10.245  11.071  -5.374
  688    HZ2  LYS  85           HZ2      LYS  85  -9.700   9.555  -5.731
  689    HZ3  LYS  85           HZ3      LYS  85 -10.305  10.536  -6.971
  690    H    ASP  86           HN       ASP  86  -5.613   6.640  -8.565
  691    HA   ASP  86           HA       ASP  86  -8.223   5.720  -8.779
  692    HB2  ASP  86           HB2      ASP  86  -5.795   4.297  -9.923
  693    HB3  ASP  86           HB1      ASP  86  -7.450   4.070 -10.449
  694    H    LEU  87           HN       LEU  87  -5.406   3.875  -7.835
  695    HA   LEU  87           HA       LEU  87  -6.936   1.528  -7.163
  696    HB2  LEU  87           HB2      LEU  87  -4.018   2.133  -6.738
  697    HB3  LEU  87           HB1      LEU  87  -4.770   0.557  -6.576
  698    HG   LEU  87           HG       LEU  87  -4.644   2.124  -9.151
  699   HD11  LEU  87          HD11      LEU  87  -2.983  -0.180  -8.183
  700   HD12  LEU  87          HD12      LEU  87  -2.438   1.478  -8.442
  701   HD13  LEU  87          HD13      LEU  87  -2.952   0.493  -9.813
  702   HD21  LEU  87          HD21      LEU  87  -6.534   0.578  -9.057
  703   HD22  LEU  87          HD22      LEU  87  -5.454  -0.730  -8.573
  704   HD23  LEU  87          HD23      LEU  87  -5.303  -0.009 -10.175
  705    H    TRP  88           HN       TRP  88  -5.792   4.269  -5.583
  706    HA   TRP  88           HA       TRP  88  -5.615   3.362  -2.925
  707    HB2  TRP  88           HB2      TRP  88  -4.578   5.399  -3.661
  708    HB3  TRP  88           HB1      TRP  88  -6.082   6.044  -4.216
  709    HD1  TRP  88           HD1      TRP  88  -4.316   5.224  -0.961
  710    HE1  TRP  88           HE1      TRP  88  -5.297   6.725   0.921
  711    HE3  TRP  88           HE3      TRP  88  -8.115   7.365  -3.549
  712    HZ2  TRP  88           HZ2      TRP  88  -7.396   8.531   1.225
  713    HZ3  TRP  88           HZ3      TRP  88  -9.556   8.959  -2.413
  714    HH2  TRP  88           HH2      TRP  88  -9.212   9.540  -0.068
  715    H    GLU  89           HN       GLU  89  -8.134   4.910  -4.813
  716    HA   GLU  89           HA       GLU  89 -10.271   5.058  -3.068
  717    HB2  GLU  89           HB3      GLU  89 -10.351   4.257  -5.982
  718    HB3  GLU  89           HB2      GLU  89 -11.723   4.816  -5.045
  719    HG2  GLU  89           HG3      GLU  89  -9.258   6.431  -5.635
  720    HG3  GLU  89           HG2      GLU  89 -10.752   6.541  -6.548
  721    H    ARG  90           HN       ARG  90  -9.220   2.382  -5.051
  722    HA   ARG  90           HA       ARG  90 -11.289   0.543  -4.350
  723    HB2  ARG  90           HB2      ARG  90  -8.565  -0.097  -5.470
  724    HB3  ARG  90           HB1      ARG  90  -9.994  -1.109  -5.527
  725    HG2  ARG  90           HG2      ARG  90 -11.063   0.570  -7.014
  726    HG3  ARG  90           HG1      ARG  90  -9.559   1.488  -6.979
  727    HD2  ARG  90           HD2      ARG  90  -8.360  -0.471  -7.875
  728    HD3  ARG  90           HD1      ARG  90  -9.891  -1.333  -7.986
  729    HE   ARG  90           HE       ARG  90 -10.066   1.116  -9.357
  730   HH11  ARG  90          HH11      ARG  90  -8.614  -2.099  -9.684
  731   HH12  ARG  90          HH12      ARG  90  -8.583  -2.067 -11.379
  732   HH21  ARG  90          HH21      ARG  90  -9.964   1.186 -11.666
  733   HH22  ARG  90          HH22      ARG  90  -9.372  -0.143 -12.552
  734    H    GLY  91           HN       GLY  91  -8.202   1.349  -3.036
  735    HA2  GLY  91           HA3      GLY  91  -7.668  -1.037  -1.653
  736    HA3  GLY  91           HA2      GLY  91  -6.940   0.524  -1.332
  737    H    GLN  92           HN       GLN  92  -8.348   2.069  -0.119
  738    HA   GLN  92           HA       GLN  92  -9.322   2.672   1.884
  739    HB2  GLN  92           HB2      GLN  92 -10.845   0.045   1.702
  740    HB3  GLN  92           HB1      GLN  92 -11.194   1.372   2.797
  741    HG2  GLN  92           HG2      GLN  92 -11.743   2.773   0.852
  742    HG3  GLN  92           HG1      GLN  92 -11.473   1.385  -0.200
  743   HE21  GLN  92          HE21      GLN  92 -13.566   1.307  -0.939
  744   HE22  GLN  92          HE22      GLN  92 -14.914   0.859   0.048
  745    H    ARG  93           HN       ARG  93  -7.998   2.806   3.445
  746    HA   ARG  93           HA       ARG  93  -6.423   0.666   4.521
  747    HB2  ARG  93           HB2      ARG  93  -5.910   2.271   6.344
  748    HB3  ARG  93           HB1      ARG  93  -5.708   2.994   4.754
  749    HG2  ARG  93           HG2      ARG  93  -7.777   4.144   4.933
  750    HG3  ARG  93           HG1      ARG  93  -8.187   3.273   6.406
  751    HD2  ARG  93           HD2      ARG  93  -7.504   5.481   6.929
  752    HD3  ARG  93           HD1      ARG  93  -6.315   4.301   7.514
  753    HE   ARG  93           HE       ARG  93  -5.622   5.393   4.966
  754   HH11  ARG  93          HH11      ARG  93  -5.515   6.051   8.464
  755   HH12  ARG  93          HH12      ARG  93  -4.219   7.136   8.368
  756   HH21  ARG  93          HH21      ARG  93  -3.780   6.846   4.852
  757   HH22  ARG  93          HH22      ARG  93  -3.244   7.626   6.282
  758    H    GLU  94           HN       GLU  94  -9.588   1.638   4.929
  759    HA   GLU  94           HA       GLU  94 -10.049  -0.164   7.133
  760    HB2  GLU  94           HB3      GLU  94 -11.617   1.597   8.057
  761    HB3  GLU  94           HB2      GLU  94  -9.913   2.022   8.171
  762    HG2  GLU  94           HG3      GLU  94 -10.236   3.360   6.047
  763    HG3  GLU  94           HG2      GLU  94 -11.957   3.072   6.231
  764    H    ASP  95           HN       ASP  95 -11.576  -1.527   6.444
  765    HA   ASP  95           HA       ASP  95 -12.980  -1.100   3.983
  766    HB2  ASP  95           HB2      ASP  95 -13.259  -3.148   6.126
  767    HB3  ASP  95           HB1      ASP  95 -14.241  -3.161   4.669
  768    H    LEU  96           HN       LEU  96 -14.285   0.444   4.039
  769    HA   LEU  96           HA       LEU  96 -16.284   0.587   6.194
  770    HB2  LEU  96           HB2      LEU  96 -14.486   2.079   6.649
  771    HB3  LEU  96           HB1      LEU  96 -14.638   2.817   5.073
  772    HG   LEU  96           HG       LEU  96 -16.963   3.563   5.766
  773   HD11  LEU  96          HD11      LEU  96 -17.415   3.708   8.170
  774   HD12  LEU  96          HD12      LEU  96 -15.979   2.742   8.487
  775   HD13  LEU  96          HD13      LEU  96 -17.332   2.043   7.598
  776   HD21  LEU  96          HD21      LEU  96 -15.088   5.098   5.689
  777   HD22  LEU  96          HD22      LEU  96 -14.608   4.623   7.316
  778   HD23  LEU  96          HD23      LEU  96 -16.137   5.466   7.056
  779    H    VAL  97           HN       VAL  97 -15.468   2.293   3.251
  780    HA   VAL  97           HA       VAL  97 -18.271   2.643   2.848
  781    HB   VAL  97           HB       VAL  97 -16.908   4.610   2.489
  782   HG11  VAL  97          HG11      VAL  97 -14.855   3.671   1.689
  783   HG12  VAL  97          HG12      VAL  97 -15.440   4.881   0.540
  784   HG13  VAL  97          HG13      VAL  97 -15.638   3.162   0.196
  785   HG21  VAL  97          HG21      VAL  97 -17.791   5.314   0.261
  786   HG22  VAL  97          HG22      VAL  97 -18.982   4.572   1.326
  787   HG23  VAL  97          HG23      VAL  97 -18.298   3.639   0.001
  788    H    ARG  98           HN       ARG  98 -18.948   0.709   2.536
  789    HA   ARG  98           HA       ARG  98 -19.930  -0.939   1.394
  790    HB2  ARG  98           HB2      ARG  98 -19.432   0.829  -1.004
  791    HB3  ARG  98           HB1      ARG  98 -20.518  -0.556  -0.980
  792    HG2  ARG  98           HG2      ARG  98 -20.788   1.891   0.764
  793    HG3  ARG  98           HG1      ARG  98 -21.709   1.589  -0.708
  794    HD2  ARG  98           HD2      ARG  98 -22.740  -0.339   0.262
  795    HD3  ARG  98           HD1      ARG  98 -21.715  -0.254   1.688
  796    HE   ARG  98           HE       ARG  98 -22.881   2.065   1.866
  797   HH11  ARG  98          HH11      ARG  98 -24.395  -0.965   0.872
  798   HH12  ARG  98          HH12      ARG  98 -25.859  -0.651   1.682
  799   HH21  ARG  98          HH21      ARG  98 -24.903   2.470   3.005
  800   HH22  ARG  98          HH22      ARG  98 -26.139   1.306   2.927
  801    H    ASP  99           HN       ASP  99 -17.800  -0.307  -1.314
  802    HA   ASP  99           HA       ASP  99 -15.893  -2.302  -0.932
  803    HB2  ASP  99           HB2      ASP  99 -17.819  -3.863  -0.946
  804    HB3  ASP  99           HB1      ASP  99 -18.320  -3.232  -2.502
  805    H    THR 100           HN       THR 100 -18.128  -1.768  -3.579
  806    HA   THR 100           HA       THR 100 -15.982  -1.095  -5.381
  807    HB   THR 100           HB       THR 100 -18.925  -1.227  -5.975
  808    HG1  THR 100           HG1      THR 100 -17.140  -3.276  -5.248
  809   HG21  THR 100          HG21      THR 100 -18.103  -2.017  -8.164
  810   HG22  THR 100          HG22      THR 100 -16.441  -1.897  -7.576
  811   HG23  THR 100          HG23      THR 100 -17.419  -0.445  -7.752
  812    H    VAL 101           HN       VAL 101 -15.396   0.985  -4.911
  813    HA   VAL 101           HA       VAL 101 -17.375   3.041  -5.445
  814    HB   VAL 101           HB       VAL 101 -15.336   3.315  -3.197
  815   HG11  VAL 101          HG11      VAL 101 -17.632   5.106  -3.987
  816   HG12  VAL 101          HG12      VAL 101 -15.927   5.417  -4.289
  817   HG13  VAL 101          HG13      VAL 101 -16.532   5.373  -2.633
  818   HG21  VAL 101          HG21      VAL 101 -18.318   2.922  -2.947
  819   HG22  VAL 101          HG22      VAL 101 -17.185   3.198  -1.619
  820   HG23  VAL 101          HG23      VAL 101 -17.091   1.716  -2.572
  821    H    GLU 102           HN       GLU 102 -16.418   2.944  -7.456
  822    HA   GLU 102           HA       GLU 102 -14.107   4.646  -7.648
  823    HB2  GLU 102           HB3      GLU 102 -13.309   3.249  -9.638
  824    HB3  GLU 102           HB2      GLU 102 -13.028   2.549  -8.054
  825    HG2  GLU 102           HG3      GLU 102 -14.778   0.981  -8.343
  826    HG3  GLU 102           HG2      GLU 102 -15.391   1.832  -9.758
  Start of MODEL   17
    1    H1   GLY   1           HT1      GLY   1   5.927 -21.494   5.151
    2    H2   GLY   1           HT2      GLY   1   4.978 -22.245   3.970
    3    H3   GLY   1           HT3      GLY   1   6.172 -23.127   4.803
    4    HA2  GLY   1           HA2      GLY   1   3.936 -23.598   5.608
    5    HA3  GLY   1           HA3      GLY   1   4.983 -22.912   6.844
    6    H    HIS   2           HN       HIS   2   2.336 -22.691   7.236
    7    HA   HIS   2           HA       HIS   2   1.704 -19.978   6.308
    8    HB2  HIS   2           HB2      HIS   2  -0.677 -20.468   6.633
    9    HB3  HIS   2           HB1      HIS   2   0.052 -21.639   5.550
   10    HD1  HIS   2           HD1      HIS   2  -2.235 -21.487   8.296
   11    HD2  HIS   2           HD2      HIS   2   0.752 -24.133   7.121
   12    HE1  HIS   2           HE1      HIS   2  -2.732 -23.671   9.447
   13    H    MET   3           HN       MET   3   2.698 -21.640   9.008
   14    HA   MET   3           HA       MET   3   1.422 -19.690  10.775
   15    HB2  MET   3           HB2      MET   3   2.503 -22.425  11.434
   16    HB3  MET   3           HB1      MET   3   1.963 -21.270  12.646
   17    HG2  MET   3           HG2      MET   3  -0.266 -21.254  11.602
   18    HG3  MET   3           HG1      MET   3   0.280 -22.474  10.459
   19    HE1  MET   3           HE1      MET   3  -0.567 -21.653  14.188
   20    HE2  MET   3           HE2      MET   3   1.102 -22.208  14.356
   21    HE3  MET   3           HE3      MET   3  -0.220 -23.176  15.003
   22    H    LEU   4           HN       LEU   4   3.939 -19.536   9.158
   23    HA   LEU   4           HA       LEU   4   5.812 -18.862  11.307
   24    HB2  LEU   4           HB2      LEU   4   6.211 -18.987   8.298
   25    HB3  LEU   4           HB1      LEU   4   7.431 -18.419   9.409
   26    HG   LEU   4           HG       LEU   4   8.028 -20.602   8.752
   27   HD11  LEU   4          HD11      LEU   4   8.059 -21.856  10.828
   28   HD12  LEU   4          HD12      LEU   4   6.863 -20.753  11.505
   29   HD13  LEU   4          HD13      LEU   4   8.462 -20.156  11.055
   30   HD21  LEU   4          HD21      LEU   4   6.599 -22.575   9.020
   31   HD22  LEU   4          HD22      LEU   4   5.894 -21.394   7.915
   32   HD23  LEU   4          HD23      LEU   4   5.281 -21.533   9.563
   33    H    ARG   5           HN       ARG   5   5.111 -17.001  12.109
   34    HA   ARG   5           HA       ARG   5   4.395 -14.911  12.320
   35    HB2  ARG   5           HB2      ARG   5   6.104 -14.583   9.866
   36    HB3  ARG   5           HB1      ARG   5   5.237 -13.221  10.562
   37    HG2  ARG   5           HG2      ARG   5   7.205 -14.921  12.073
   38    HG3  ARG   5           HG1      ARG   5   7.611 -13.399  11.272
   39    HD2  ARG   5           HD2      ARG   5   5.579 -13.759  13.488
   40    HD3  ARG   5           HD1      ARG   5   7.182 -13.046  13.653
   41    HE   ARG   5           HE       ARG   5   6.176 -11.488  11.801
   42   HH11  ARG   5          HH11      ARG   5   4.594 -12.620  14.780
   43   HH12  ARG   5          HH12      ARG   5   3.640 -11.236  14.958
   44   HH21  ARG   5          HH21      ARG   5   4.803  -9.583  12.042
   45   HH22  ARG   5          HH22      ARG   5   3.734  -9.469  13.353
   46    H    THR   6           HN       THR   6   2.338 -15.751  12.083
   47    HA   THR   6           HA       THR   6   0.921 -15.610   9.653
   48    HB   THR   6           HB       THR   6  -1.071 -15.764  11.236
   49    HG1  THR   6           HG1      THR   6   0.434 -14.869  12.964
   50   HG21  THR   6          HG21      THR   6   1.120 -17.820  11.484
   51   HG22  THR   6          HG22      THR   6  -0.070 -17.747  10.183
   52   HG23  THR   6          HG23      THR   6  -0.584 -18.102  11.834
   53    H    ALA   7           HN       ALA   7   0.576 -13.721   8.687
   54    HA   ALA   7           HA       ALA   7   0.151 -11.294  10.168
   55    HB1  ALA   7           HB1      ALA   7   1.198 -11.214   7.944
   56    HB2  ALA   7           HB2      ALA   7  -0.338 -10.344   7.925
   57    HB3  ALA   7           HB3      ALA   7  -0.235 -11.962   7.235
   58    H    GLY   8           HN       GLY   8  -1.995 -10.135   9.953
   59    HA2  GLY   8           HA3      GLY   8  -4.121 -11.966  10.527
   60    HA3  GLY   8           HA2      GLY   8  -4.253 -10.220  10.461
   61    H    ARG   9           HN       ARG   9  -3.043 -12.089   7.783
   62    HA   ARG   9           HA       ARG   9  -3.701 -12.572   5.687
   63    HB2  ARG   9           HB2      ARG   9  -5.568 -13.683   6.873
   64    HB3  ARG   9           HB1      ARG   9  -6.520 -12.224   6.693
   65    HG2  ARG   9           HG2      ARG   9  -6.417 -12.459   4.260
   66    HG3  ARG   9           HG1      ARG   9  -5.483 -13.945   4.443
   67    HD2  ARG   9           HD2      ARG   9  -8.319 -13.417   5.311
   68    HD3  ARG   9           HD1      ARG   9  -7.752 -14.575   4.108
   69    HE   ARG   9           HE       ARG   9  -6.590 -15.096   6.637
   70   HH11  ARG   9          HH11      ARG   9  -9.481 -15.702   4.723
   71   HH12  ARG   9          HH12      ARG   9 -10.106 -16.876   5.792
   72   HH21  ARG   9          HH21      ARG   9  -7.454 -16.683   8.118
   73   HH22  ARG   9          HH22      ARG   9  -8.910 -17.456   7.770
   74    H    ASP  10           HN       ASP  10  -5.509  -9.945   7.021
   75    HA   ASP  10           HA       ASP  10  -6.322  -8.643   4.661
   76    HB2  ASP  10           HB2      ASP  10  -6.962  -8.497   7.252
   77    HB3  ASP  10           HB1      ASP  10  -5.872  -7.123   7.166
   78    H    GLY  11           HN       GLY  11  -3.384  -8.597   6.410
   79    HA2  GLY  11           HA3      GLY  11  -2.470  -6.106   5.226
   80    HA3  GLY  11           HA2      GLY  11  -1.575  -7.088   6.372
   81    H    LEU  12           HN       LEU  12  -2.682  -9.193   3.977
   82    HA   LEU  12           HA       LEU  12  -0.524  -8.676   2.215
   83    HB2  LEU  12           HB2      LEU  12  -1.046 -11.008   3.935
   84    HB3  LEU  12           HB1      LEU  12  -0.615 -11.331   2.275
   85    HG   LEU  12           HG       LEU  12   1.019  -9.798   4.311
   86   HD11  LEU  12          HD11      LEU  12   0.991 -12.174   4.775
   87   HD12  LEU  12          HD12      LEU  12   2.581 -11.694   4.168
   88   HD13  LEU  12          HD13      LEU  12   1.441 -12.523   3.107
   89   HD21  LEU  12          HD21      LEU  12   2.835  -9.878   2.600
   90   HD22  LEU  12          HD22      LEU  12   1.464  -8.895   2.111
   91   HD23  LEU  12          HD23      LEU  12   1.659 -10.513   1.448
   92    H    CYS  13           HN       CYS  13  -0.952 -10.566   0.531
   93    HA   CYS  13           HA       CYS  13  -2.137 -11.298  -1.189
   94    HB2  CYS  13           HB2      CYS  13  -3.478 -12.507   0.522
   95    HB3  CYS  13           HB1      CYS  13  -4.549 -11.123   0.649
   96    HG   CYS  13           HG       CYS  13  -5.285 -11.403  -2.185
   97    H    ARG  14           HN       ARG  14  -4.397  -9.007   0.325
   98    HA   ARG  14           HA       ARG  14  -5.353  -7.791  -2.029
   99    HB2  ARG  14           HB2      ARG  14  -6.432  -7.617   0.184
  100    HB3  ARG  14           HB1      ARG  14  -5.086  -6.640   0.751
  101    HG2  ARG  14           HG2      ARG  14  -5.668  -4.978  -1.038
  102    HG3  ARG  14           HG1      ARG  14  -7.127  -5.917  -1.337
  103    HD2  ARG  14           HD2      ARG  14  -6.328  -4.599   1.246
  104    HD3  ARG  14           HD1      ARG  14  -7.615  -4.080   0.164
  105    HE   ARG  14           HE       ARG  14  -8.583  -6.338   0.643
  106   HH11  ARG  14          HH11      ARG  14  -6.699  -4.478   3.038
  107   HH12  ARG  14          HH12      ARG  14  -7.370  -5.285   4.377
  108   HH21  ARG  14          HH21      ARG  14  -9.527  -7.385   2.532
  109   HH22  ARG  14          HH22      ARG  14  -8.988  -6.941   4.095
  110    H    LEU  15           HN       LEU  15  -2.740  -7.043   0.186
  111    HA   LEU  15           HA       LEU  15  -1.882  -4.612  -0.790
  112    HB2  LEU  15           HB2      LEU  15  -1.169  -5.625   1.325
  113    HB3  LEU  15           HB1      LEU  15  -0.344  -6.896   0.457
  114    HG   LEU  15           HG       LEU  15   1.295  -5.268  -0.376
  115   HD11  LEU  15          HD11      LEU  15  -0.168  -3.300  -0.412
  116   HD12  LEU  15          HD12      LEU  15   1.316  -3.012   0.498
  117   HD13  LEU  15          HD13      LEU  15  -0.192  -3.318   1.352
  118   HD21  LEU  15          HD21      LEU  15   1.724  -6.445   1.709
  119   HD22  LEU  15          HD22      LEU  15   0.878  -5.181   2.603
  120   HD23  LEU  15          HD23      LEU  15   2.380  -4.807   1.760
  121    H    SER  16           HN       SER  16  -0.786  -7.901  -1.624
  122    HA   SER  16           HA       SER  16   1.015  -7.279  -3.610
  123    HB2  SER  16           HB2      SER  16  -0.738  -9.722  -3.499
  124    HB3  SER  16           HB1      SER  16   0.957  -9.605  -3.990
  125    HG   SER  16           HG       SER  16   0.936 -10.416  -1.930
  126    H    THR  17           HN       THR  17  -2.495  -7.963  -3.738
  127    HA   THR  17           HA       THR  17  -2.853  -7.997  -6.525
  128    HB   THR  17           HB       THR  17  -4.861  -7.118  -4.418
  129    HG1  THR  17           HG1      THR  17  -3.662  -9.498  -4.748
  130   HG21  THR  17          HG21      THR  17  -5.271  -8.351  -7.149
  131   HG22  THR  17          HG22      THR  17  -5.621  -6.683  -6.705
  132   HG23  THR  17          HG23      THR  17  -6.548  -7.999  -5.986
  133    H    TYR  18           HN       TYR  18  -2.720  -5.334  -4.259
  134    HA   TYR  18           HA       TYR  18  -3.571  -3.411  -6.228
  135    HB2  TYR  18           HB2      TYR  18  -2.729  -3.200  -3.351
  136    HB3  TYR  18           HB1      TYR  18  -2.869  -1.758  -4.349
  137    HD1  TYR  18           HD2      TYR  18  -4.919  -4.839  -3.857
  138    HD2  TYR  18           HD1      TYR  18  -4.821  -0.614  -3.969
  139    HE1  TYR  18           HE2      TYR  18  -7.357  -4.782  -3.505
  140    HE2  TYR  18           HE1      TYR  18  -7.229  -0.531  -3.624
  141    HH   TYR  18           HH       TYR  18  -9.048  -3.217  -2.667
  142    H    LEU  19           HN       LEU  19  -0.561  -4.223  -4.588
  143    HA   LEU  19           HA       LEU  19   0.948  -2.235  -5.870
  144    HB2  LEU  19           HB2      LEU  19   1.748  -4.776  -4.482
  145    HB3  LEU  19           HB1      LEU  19   2.920  -3.648  -5.138
  146    HG   LEU  19           HG       LEU  19   0.907  -2.922  -2.969
  147   HD11  LEU  19          HD11      LEU  19   2.799  -2.973  -1.475
  148   HD12  LEU  19          HD12      LEU  19   3.823  -3.620  -2.766
  149   HD13  LEU  19          HD13      LEU  19   2.458  -4.559  -2.151
  150   HD21  LEU  19          HD21      LEU  19   1.641  -1.051  -4.382
  151   HD22  LEU  19          HD22      LEU  19   3.319  -1.467  -4.050
  152   HD23  LEU  19          HD23      LEU  19   2.267  -0.933  -2.745
  153    H    GLU  20           HN       GLU  20  -0.069  -5.355  -6.985
  154    HA   GLU  20           HA       GLU  20   1.903  -5.526  -9.014
  155    HB2  GLU  20           HB3      GLU  20   0.551  -7.335 -10.011
  156    HB3  GLU  20           HB2      GLU  20   0.772  -7.547  -8.282
  157    HG2  GLU  20           HG3      GLU  20  -1.414  -6.844  -7.831
  158    HG3  GLU  20           HG2      GLU  20  -1.661  -6.366  -9.510
  159    H    GLU  21           HN       GLU  21  -0.789  -3.482  -8.750
  160    HA   GLU  21           HA       GLU  21  -1.006  -3.191 -11.618
  161    HB2  GLU  21           HB3      GLU  21  -2.473  -1.854  -9.361
  162    HB3  GLU  21           HB2      GLU  21  -2.548  -1.213 -10.993
  163    HG2  GLU  21           HG3      GLU  21  -3.372  -3.462 -11.739
  164    HG3  GLU  21           HG2      GLU  21  -3.465  -3.899 -10.033
  165    H    LEU  22           HN       LEU  22   1.109  -2.161  -9.360
  166    HA   LEU  22           HA       LEU  22   1.505   0.440 -10.588
  167    HB2  LEU  22           HB2      LEU  22   2.999  -0.911  -8.350
  168    HB3  LEU  22           HB1      LEU  22   3.338   0.695  -8.947
  169    HG   LEU  22           HG       LEU  22   0.872  -0.216  -7.471
  170   HD11  LEU  22          HD11      LEU  22   2.773   0.101  -6.044
  171   HD12  LEU  22          HD12      LEU  22   1.651   1.453  -5.828
  172   HD13  LEU  22          HD13      LEU  22   3.113   1.663  -6.783
  173   HD21  LEU  22          HD21      LEU  22   1.507   2.494  -8.638
  174   HD22  LEU  22          HD22      LEU  22   0.167   2.127  -7.555
  175   HD23  LEU  22          HD23      LEU  22   0.216   1.408  -9.166
  176    H    GLU  23           HN       GLU  23   3.074   0.888 -11.978
  177    HA   GLU  23           HA       GLU  23   4.562  -1.176 -13.276
  178    HB2  GLU  23           HB3      GLU  23   5.008   1.818 -13.308
  179    HB3  GLU  23           HB2      GLU  23   5.677   0.663 -14.442
  180    HG2  GLU  23           HG3      GLU  23   2.768   1.313 -14.103
  181    HG3  GLU  23           HG2      GLU  23   3.847   1.910 -15.367
  182    H    ALA  24           HN       ALA  24   7.027  -1.015 -13.409
  183    HA   ALA  24           HA       ALA  24   8.149  -1.278 -10.850
  184    HB1  ALA  24           HB1      ALA  24   9.085  -2.364 -12.860
  185    HB2  ALA  24           HB2      ALA  24  10.300  -1.445 -11.977
  186    HB3  ALA  24           HB3      ALA  24   9.607  -0.787 -13.458
  187    H    VAL  25           HN       VAL  25   8.077   1.388 -13.116
  188    HA   VAL  25           HA       VAL  25   9.708   3.147 -11.648
  189    HB   VAL  25           HB       VAL  25   9.182   3.548 -14.033
  190   HG11  VAL  25          HG11      VAL  25   6.415   4.242 -13.102
  191   HG12  VAL  25          HG12      VAL  25   6.849   2.829 -14.069
  192   HG13  VAL  25          HG13      VAL  25   7.028   4.456 -14.741
  193   HG21  VAL  25          HG21      VAL  25   9.912   5.455 -12.735
  194   HG22  VAL  25          HG22      VAL  25   8.239   5.729 -12.229
  195   HG23  VAL  25          HG23      VAL  25   8.686   5.951 -13.922
  196    H    GLU  26           HN       GLU  26   6.260   2.477 -11.517
  197    HA   GLU  26           HA       GLU  26   5.612   4.613  -9.745
  198    HB2  GLU  26           HB3      GLU  26   4.111   2.079 -10.408
  199    HB3  GLU  26           HB2      GLU  26   3.454   3.410  -9.464
  200    HG2  GLU  26           HG3      GLU  26   4.389   3.607 -12.315
  201    HG3  GLU  26           HG2      GLU  26   2.711   3.412 -11.820
  202    H    LEU  27           HN       LEU  27   6.322   1.191  -9.385
  203    HA   LEU  27           HA       LEU  27   6.002   0.983  -6.605
  204    HB2  LEU  27           HB2      LEU  27   7.822  -0.491  -8.509
  205    HB3  LEU  27           HB1      LEU  27   7.683  -0.904  -6.816
  206    HG   LEU  27           HG       LEU  27   5.364  -0.989  -8.755
  207   HD11  LEU  27          HD11      LEU  27   7.165  -3.213  -7.785
  208   HD12  LEU  27          HD12      LEU  27   7.044  -2.594  -9.439
  209   HD13  LEU  27          HD13      LEU  27   5.675  -3.419  -8.705
  210   HD21  LEU  27          HD21      LEU  27   5.740  -2.114  -5.976
  211   HD22  LEU  27          HD22      LEU  27   4.327  -2.349  -6.999
  212   HD23  LEU  27          HD23      LEU  27   4.727  -0.736  -6.407
  213    H    LYS  28           HN       LYS  28   8.714   1.928  -8.612
  214    HA   LYS  28           HA       LYS  28  10.657   2.207  -6.606
  215    HB2  LYS  28           HB2      LYS  28  10.901   2.190  -9.157
  216    HB3  LYS  28           HB1      LYS  28  10.463   3.883  -9.095
  217    HG2  LYS  28           HG2      LYS  28  12.430   4.345  -7.719
  218    HG3  LYS  28           HG1      LYS  28  12.866   2.631  -7.778
  219    HD2  LYS  28           HD2      LYS  28  12.921   2.780 -10.251
  220    HD3  LYS  28           HD1      LYS  28  12.634   4.510 -10.128
  221    HE2  LYS  28           HE2      LYS  28  14.960   4.199 -10.450
  222    HE3  LYS  28           HE1      LYS  28  14.727   4.663  -8.766
  223    HZ1  LYS  28           HZ1      LYS  28  15.035   2.305  -8.124
  224    HZ2  LYS  28           HZ2      LYS  28  16.312   2.841  -9.029
  225    HZ3  LYS  28           HZ3      LYS  28  15.135   1.898  -9.756
  226    H    LYS  29           HN       LYS  29   8.272   4.469  -7.851
  227    HA   LYS  29           HA       LYS  29   9.013   6.735  -6.309
  228    HB2  LYS  29           HB2      LYS  29   6.323   5.886  -7.337
  229    HB3  LYS  29           HB1      LYS  29   6.702   7.502  -6.760
  230    HG2  LYS  29           HG2      LYS  29   8.305   7.796  -8.615
  231    HG3  LYS  29           HG1      LYS  29   7.935   6.166  -9.158
  232    HD2  LYS  29           HD2      LYS  29   5.640   6.779  -9.588
  233    HD3  LYS  29           HD1      LYS  29   5.929   8.398  -8.953
  234    HE2  LYS  29           HE2      LYS  29   7.484   8.867 -10.722
  235    HE3  LYS  29           HE1      LYS  29   7.362   7.215 -11.319
  236    HZ1  LYS  29           HZ1      LYS  29   5.148   9.188 -11.252
  237    HZ2  LYS  29           HZ2      LYS  29   5.061   7.586 -11.798
  238    HZ3  LYS  29           HZ3      LYS  29   6.012   8.704 -12.635
  239    H    PHE  30           HN       PHE  30   6.573   4.250  -5.870
  240    HA   PHE  30           HA       PHE  30   5.533   5.017  -3.434
  241    HB2  PHE  30           HB2      PHE  30   4.176   3.448  -4.333
  242    HB3  PHE  30           HB1      PHE  30   5.491   2.668  -5.180
  243    HD1  PHE  30           HD2      PHE  30   3.634   2.804  -1.972
  244    HD2  PHE  30           HD1      PHE  30   6.458   0.735  -4.361
  245    HE1  PHE  30           HE2      PHE  30   3.482   0.856  -0.469
  246    HE2  PHE  30           HE1      PHE  30   6.307  -1.220  -2.862
  247    HZ   PHE  30           HZ       PHE  30   4.808  -1.142  -0.913
  248    H    LYS  31           HN       LYS  31   8.198   2.757  -4.044
  249    HA   LYS  31           HA       LYS  31   8.532   2.291  -1.260
  250    HB2  LYS  31           HB2      LYS  31  10.462   0.916  -1.857
  251    HB3  LYS  31           HB1      LYS  31   9.042   0.515  -2.809
  252    HG2  LYS  31           HG2      LYS  31   9.986   1.860  -4.663
  253    HG3  LYS  31           HG1      LYS  31  11.455   2.075  -3.704
  254    HD2  LYS  31           HD2      LYS  31  11.687  -0.375  -3.585
  255    HD3  LYS  31           HD1      LYS  31  10.281  -0.547  -4.632
  256    HE2  LYS  31           HE2      LYS  31  12.416  -0.778  -5.812
  257    HE3  LYS  31           HE1      LYS  31  11.479   0.552  -6.459
  258    HZ1  LYS  31           HZ1      LYS  31  12.874   2.082  -5.144
  259    HZ2  LYS  31           HZ2      LYS  31  13.895   1.108  -6.058
  260    HZ3  LYS  31           HZ3      LYS  31  13.645   0.780  -4.456
  261    H    LEU  32           HN       LEU  32   9.749   4.781  -3.311
  262    HA   LEU  32           HA       LEU  32  11.926   5.246  -1.507
  263    HB2  LEU  32           HB2      LEU  32  12.468   7.215  -2.804
  264    HB3  LEU  32           HB1      LEU  32  12.187   5.878  -3.881
  265    HG   LEU  32           HG       LEU  32   9.818   6.970  -4.191
  266   HD11  LEU  32          HD11      LEU  32   9.967   8.612  -2.430
  267   HD12  LEU  32          HD12      LEU  32   9.788   9.383  -4.005
  268   HD13  LEU  32          HD13      LEU  32  11.362   9.354  -3.212
  269   HD21  LEU  32          HD21      LEU  32  11.491   6.766  -5.944
  270   HD22  LEU  32          HD22      LEU  32  12.317   8.201  -5.339
  271   HD23  LEU  32          HD23      LEU  32  10.695   8.339  -6.015
  272    H    TYR  33           HN       TYR  33   8.686   6.336  -1.981
  273    HA   TYR  33           HA       TYR  33   8.726   8.561  -0.281
  274    HB2  TYR  33           HB2      TYR  33   6.937   8.265  -1.889
  275    HB3  TYR  33           HB1      TYR  33   6.423   6.778  -1.096
  276    HD1  TYR  33           HD2      TYR  33   6.585  10.413  -0.794
  277    HD2  TYR  33           HD1      TYR  33   5.084   6.838   0.894
  278    HE1  TYR  33           HE2      TYR  33   5.134  11.736   0.712
  279    HE2  TYR  33           HE1      TYR  33   3.647   8.114   2.397
  280    HH   TYR  33           HH       TYR  33   3.579  10.342   3.371
  281    H    LEU  34           HN       LEU  34   7.913   5.186   0.352
  282    HA   LEU  34           HA       LEU  34   7.728   5.903   3.185
  283    HB2  LEU  34           HB2      LEU  34   6.554   3.680   3.427
  284    HB3  LEU  34           HB1      LEU  34   5.696   4.975   2.626
  285    HG   LEU  34           HG       LEU  34   6.132   3.892   0.437
  286   HD11  LEU  34          HD11      LEU  34   8.195   2.696   0.941
  287   HD12  LEU  34          HD12      LEU  34   6.952   1.590   0.342
  288   HD13  LEU  34          HD13      LEU  34   7.320   1.661   2.068
  289   HD21  LEU  34          HD21      LEU  34   4.094   3.440   1.668
  290   HD22  LEU  34          HD22      LEU  34   4.899   2.080   2.472
  291   HD23  LEU  34          HD23      LEU  34   4.627   2.041   0.731
  292    H    GLY  35           HN       GLY  35   9.902   4.492   1.155
  293    HA2  GLY  35           HA3      GLY  35  10.623   2.500   3.110
  294    HA3  GLY  35           HA2      GLY  35  11.318   2.607   1.488
  295    H    THR  36           HN       THR  36  12.420   4.920   1.279
  296    HA   THR  36           HA       THR  36  14.495   4.869   3.310
  297    HB   THR  36           HB       THR  36  15.168   4.800   0.913
  298    HG1  THR  36           HG1      THR  36  15.913   7.191   2.252
  299   HG21  THR  36          HG21      THR  36  13.982   7.573   0.745
  300   HG22  THR  36          HG22      THR  36  13.355   6.134  -0.053
  301   HG23  THR  36          HG23      THR  36  14.925   6.788  -0.519
  302    H    ALA  37           HN       ALA  37  11.675   6.135   3.345
  303    HA   ALA  37           HA       ALA  37  11.809   8.899   3.422
  304    HB1  ALA  37           HB1      ALA  37   9.684   7.741   3.373
  305    HB2  ALA  37           HB2      ALA  37   9.794   8.814   4.774
  306    HB3  ALA  37           HB3      ALA  37  10.013   7.075   4.975
  307    H    THR  38           HN       THR  38  13.078  10.062   4.613
  308    HA   THR  38           HA       THR  38  14.129   9.297   7.091
  309    HB   THR  38           HB       THR  38  14.656  11.802   7.143
  310    HG1  THR  38           HG1      THR  38  14.545  12.674   4.983
  311   HG21  THR  38          HG21      THR  38  16.464  11.512   5.491
  312   HG22  THR  38          HG22      THR  38  15.635  10.090   4.855
  313   HG23  THR  38          HG23      THR  38  16.278  10.072   6.497
  314    H    GLU  39           HN       GLU  39  11.242  10.729   6.112
  315    HA   GLU  39           HA       GLU  39  10.419  12.258   8.326
  316    HB2  GLU  39           HB3      GLU  39   8.697  10.622   6.472
  317    HB3  GLU  39           HB2      GLU  39   8.151  11.940   7.497
  318    HG2  GLU  39           HG3      GLU  39   9.440  13.517   6.243
  319    HG3  GLU  39           HG2      GLU  39  10.156  12.222   5.286
  320    H    LEU  40           HN       LEU  40  10.294   8.835   7.696
  321    HA   LEU  40           HA       LEU  40   8.593   8.128   9.910
  322    HB2  LEU  40           HB2      LEU  40  10.537   6.400   8.411
  323    HB3  LEU  40           HB1      LEU  40   9.196   5.864   9.391
  324    HG   LEU  40           HG       LEU  40   9.042   7.295   6.759
  325   HD11  LEU  40          HD11      LEU  40   8.117   5.172   5.950
  326   HD12  LEU  40          HD12      LEU  40   8.408   4.458   7.538
  327   HD13  LEU  40          HD13      LEU  40   9.765   5.001   6.552
  328   HD21  LEU  40          HD21      LEU  40   6.827   6.216   8.493
  329   HD22  LEU  40          HD22      LEU  40   6.627   6.848   6.862
  330   HD23  LEU  40          HD23      LEU  40   7.148   7.922   8.167
  331    H    GLY  41           HN       GLY  41  11.866   8.789   9.400
  332    HA2  GLY  41           HA3      GLY  41  13.393   9.072  11.205
  333    HA3  GLY  41           HA2      GLY  41  12.556   7.760  12.049
  334    H    GLU  42           HN       GLU  42  15.038   8.594   9.952
  335    HA   GLU  42           HA       GLU  42  16.742   7.569   9.023
  336    HB2  GLU  42           HB3      GLU  42  15.730   5.123  10.428
  337    HB3  GLU  42           HB2      GLU  42  17.231   5.156   9.509
  338    HG2  GLU  42           HG3      GLU  42  17.931   5.367  11.713
  339    HG3  GLU  42           HG2      GLU  42  17.886   7.035  11.167
  340    H    GLY  43           HN       GLY  43  13.900   5.522   8.762
  341    HA2  GLY  43           HA3      GLY  43  13.024   5.173   6.490
  342    HA3  GLY  43           HA2      GLY  43  14.694   4.834   6.015
  343    H    LYS  44           HN       LYS  44  11.959   3.357   6.734
  344    HA   LYS  44           HA       LYS  44  12.888   1.400   8.636
  345    HB2  LYS  44           HB2      LYS  44  10.392   1.406   6.937
  346    HB3  LYS  44           HB1      LYS  44  10.716   0.312   8.273
  347    HG2  LYS  44           HG2      LYS  44  10.457   3.306   8.500
  348    HG3  LYS  44           HG1      LYS  44   9.200   2.137   8.903
  349    HD2  LYS  44           HD2      LYS  44  10.617   1.189  10.636
  350    HD3  LYS  44           HD1      LYS  44  11.923   2.299  10.211
  351    HE2  LYS  44           HE2      LYS  44  10.535   4.188  10.855
  352    HE3  LYS  44           HE1      LYS  44   9.200   3.093  11.209
  353    HZ1  LYS  44           HZ1      LYS  44  10.508   2.091  12.951
  354    HZ2  LYS  44           HZ2      LYS  44  10.394   3.741  13.212
  355    HZ3  LYS  44           HZ3      LYS  44  11.820   3.088  12.615
  356    H    ILE  45           HN       ILE  45  12.861   1.743   5.259
  357    HA   ILE  45           HA       ILE  45  13.310  -1.077   4.816
  358    HB   ILE  45           HB       ILE  45  12.983   1.261   2.933
  359   HG12  ILE  45          HG12      ILE  45  10.914   0.531   4.012
  360   HG13  ILE  45          HG11      ILE  45  10.878   0.166   2.291
  361   HG21  ILE  45          HG21      ILE  45  14.536  -0.309   1.917
  362   HG22  ILE  45          HG22      ILE  45  12.988  -0.311   1.073
  363   HG23  ILE  45          HG23      ILE  45  13.389  -1.628   2.170
  364   HD11  ILE  45          HD11      ILE  45  11.442  -2.148   2.796
  365   HD12  ILE  45          HD12      ILE  45   9.936  -1.645   3.570
  366   HD13  ILE  45          HD13      ILE  45  11.413  -1.788   4.526
  367    HA   PRO  46           HA       PRO  46  17.717  -0.659   5.022
  368    HB2  PRO  46           HB2      PRO  46  18.278  -2.703   3.200
  369    HB3  PRO  46           HB1      PRO  46  18.044  -2.910   4.936
  370    HG2  PRO  46           HG2      PRO  46  16.114  -3.317   2.702
  371    HG3  PRO  46           HG1      PRO  46  16.315  -4.244   4.199
  372    HD2  PRO  46           HD2      PRO  46  14.316  -2.533   3.887
  373    HD3  PRO  46           HD1      PRO  46  15.126  -2.716   5.455
  374    H    TRP  47           HN       TRP  47  19.531  -0.282   3.638
  375    HA   TRP  47           HA       TRP  47  19.598   1.899   2.262
  376    HB2  TRP  47           HB2      TRP  47  21.692   1.221   1.144
  377    HB3  TRP  47           HB1      TRP  47  21.621   0.704   2.815
  378    HD1  TRP  47           HD1      TRP  47  22.194  -0.572  -0.649
  379    HE1  TRP  47           HE1      TRP  47  22.544  -3.124  -0.616
  380    HE3  TRP  47           HE3      TRP  47  20.726  -1.581   4.141
  381    HZ2  TRP  47           HZ2      TRP  47  22.256  -5.246   1.152
  382    HZ3  TRP  47           HZ3      TRP  47  20.799  -3.914   4.926
  383    HH2  TRP  47           HH2      TRP  47  21.548  -5.708   3.457
  384    H    GLY  48           HN       GLY  48  19.321  -1.045   0.220
  385    HA2  GLY  48           HA3      GLY  48  17.458   0.294  -1.492
  386    HA3  GLY  48           HA2      GLY  48  19.064   0.215  -2.203
  387    H    SER  49           HN       SER  49  17.584  -2.175  -0.094
  388    HA   SER  49           HA       SER  49  18.323  -4.335  -1.727
  389    HB2  SER  49           HB2      SER  49  16.243  -4.278   0.444
  390    HB3  SER  49           HB1      SER  49  17.317  -5.605  -0.018
  391    HG   SER  49           HG       SER  49  18.768  -4.829   1.237
  392    H    MET  50           HN       MET  50  15.619  -2.266  -1.626
  393    HA   MET  50           HA       MET  50  13.814  -4.149  -2.854
  394    HB2  MET  50           HB2      MET  50  12.166  -2.190  -2.703
  395    HB3  MET  50           HB1      MET  50  12.668  -3.014  -1.245
  396    HG2  MET  50           HG2      MET  50  12.531  -0.581  -0.973
  397    HG3  MET  50           HG1      MET  50  14.127  -1.218  -0.639
  398    HE1  MET  50           HE1      MET  50  15.136   1.235  -0.718
  399    HE2  MET  50           HE2      MET  50  13.528   1.889  -1.034
  400    HE3  MET  50           HE3      MET  50  14.890   2.364  -2.050
  401    H    GLU  51           HN       GLU  51  16.135  -2.394  -4.187
  402    HA   GLU  51           HA       GLU  51  14.819  -0.995  -6.270
  403    HB2  GLU  51           HB3      GLU  51  17.535  -2.066  -5.857
  404    HB3  GLU  51           HB2      GLU  51  17.115  -1.375  -7.424
  405    HG2  GLU  51           HG3      GLU  51  16.806   0.101  -4.813
  406    HG3  GLU  51           HG2      GLU  51  18.280   0.168  -5.781
  407    H    LYS  52           HN       LYS  52  15.983  -4.279  -6.002
  408    HA   LYS  52           HA       LYS  52  15.078  -4.869  -8.708
  409    HB2  LYS  52           HB2      LYS  52  16.201  -7.061  -8.402
  410    HB3  LYS  52           HB1      LYS  52  17.275  -5.699  -8.161
  411    HG2  LYS  52           HG2      LYS  52  17.899  -7.133  -6.438
  412    HG3  LYS  52           HG1      LYS  52  16.758  -6.051  -5.649
  413    HD2  LYS  52           HD2      LYS  52  14.998  -7.714  -5.857
  414    HD3  LYS  52           HD1      LYS  52  16.098  -8.792  -6.712
  415    HE2  LYS  52           HE2      LYS  52  15.943  -9.510  -4.427
  416    HE3  LYS  52           HE1      LYS  52  17.544  -8.832  -4.699
  417    HZ1  LYS  52           HZ1      LYS  52  16.773  -6.764  -3.584
  418    HZ2  LYS  52           HZ2      LYS  52  16.626  -8.119  -2.612
  419    HZ3  LYS  52           HZ3      LYS  52  15.272  -7.487  -3.338
  420    H    ALA  53           HN       ALA  53  13.402  -4.500  -6.158
  421    HA   ALA  53           HA       ALA  53  12.219  -7.111  -5.779
  422    HB1  ALA  53           HB1      ALA  53  12.715  -5.705  -3.879
  423    HB2  ALA  53           HB2      ALA  53  10.969  -6.011  -3.971
  424    HB3  ALA  53           HB3      ALA  53  11.647  -4.458  -4.496
  425    H    GLY  54           HN       GLY  54  10.273  -7.772  -6.513
  426    HA2  GLY  54           HA3      GLY  54   8.789  -5.990  -8.260
  427    HA3  GLY  54           HA2      GLY  54   8.615  -7.742  -8.130
  428    HA   PRO  55           HA       PRO  55   5.208  -5.352  -5.876
  429    HB2  PRO  55           HB2      PRO  55   3.220  -7.105  -6.721
  430    HB3  PRO  55           HB1      PRO  55   3.609  -5.555  -7.468
  431    HG2  PRO  55           HG2      PRO  55   4.402  -8.306  -8.286
  432    HG3  PRO  55           HG1      PRO  55   4.025  -6.899  -9.292
  433    HD2  PRO  55           HD2      PRO  55   6.565  -7.733  -8.870
  434    HD3  PRO  55           HD1      PRO  55   6.163  -6.022  -9.080
  435    H    LEU  56           HN       LEU  56   5.761  -8.803  -6.117
  436    HA   LEU  56           HA       LEU  56   4.318  -9.448  -3.692
  437    HB2  LEU  56           HB2      LEU  56   5.090 -11.707  -3.923
  438    HB3  LEU  56           HB1      LEU  56   4.616 -11.129  -5.498
  439    HG   LEU  56           HG       LEU  56   7.488 -11.376  -4.572
  440   HD11  LEU  56          HD11      LEU  56   5.824 -13.233  -6.251
  441   HD12  LEU  56          HD12      LEU  56   6.465 -13.549  -4.639
  442   HD13  LEU  56          HD13      LEU  56   7.562 -13.362  -6.009
  443   HD21  LEU  56          HD21      LEU  56   7.987 -11.255  -7.006
  444   HD22  LEU  56          HD22      LEU  56   7.301  -9.776  -6.375
  445   HD23  LEU  56          HD23      LEU  56   6.288 -10.883  -7.314
  446    H    GLU  57           HN       GLU  57   7.630  -8.862  -4.516
  447    HA   GLU  57           HA       GLU  57   8.692  -9.599  -1.988
  448    HB2  GLU  57           HB3      GLU  57   9.809  -7.878  -4.193
  449    HB3  GLU  57           HB2      GLU  57  10.727  -8.502  -2.825
  450    HG2  GLU  57           HG3      GLU  57  10.429 -10.750  -3.563
  451    HG3  GLU  57           HG2      GLU  57   9.302 -10.234  -4.819
  452    H    MET  58           HN       MET  58   7.611  -6.671  -3.529
  453    HA   MET  58           HA       MET  58   8.286  -4.874  -1.493
  454    HB2  MET  58           HB2      MET  58   6.134  -4.830  -3.595
  455    HB3  MET  58           HB1      MET  58   6.365  -3.481  -2.494
  456    HG2  MET  58           HG2      MET  58   8.765  -4.448  -3.875
  457    HG3  MET  58           HG1      MET  58   7.578  -3.705  -4.941
  458    HE1  MET  58           HE1      MET  58   8.403  -2.766  -1.149
  459    HE2  MET  58           HE2      MET  58   9.654  -1.545  -1.389
  460    HE3  MET  58           HE3      MET  58   9.962  -3.225  -1.835
  461    H    ALA  59           HN       ALA  59   5.221  -6.563  -2.160
  462    HA   ALA  59           HA       ALA  59   3.736  -5.662  -0.027
  463    HB1  ALA  59           HB1      ALA  59   2.408  -7.693  -0.277
  464    HB2  ALA  59           HB2      ALA  59   3.706  -8.435  -1.216
  465    HB3  ALA  59           HB3      ALA  59   2.848  -7.034  -1.853
  466    H    GLN  60           HN       GLN  60   5.920  -8.449  -0.101
  467    HA   GLN  60           HA       GLN  60   5.420  -9.056   2.634
  468    HB2  GLN  60           HB2      GLN  60   7.595 -10.084   0.821
  469    HB3  GLN  60           HB1      GLN  60   7.164 -10.739   2.396
  470    HG2  GLN  60           HG2      GLN  60   4.904 -11.258   1.510
  471    HG3  GLN  60           HG1      GLN  60   5.441 -10.677  -0.054
  472   HE21  GLN  60          HE21      GLN  60   4.569 -13.353   0.745
  473   HE22  GLN  60          HE22      GLN  60   5.851 -14.405   0.312
  474    H    LEU  61           HN       LEU  61   7.464  -6.800   1.103
  475    HA   LEU  61           HA       LEU  61   9.579  -6.828   3.027
  476    HB2  LEU  61           HB2      LEU  61   9.487  -5.871   0.551
  477    HB3  LEU  61           HB1      LEU  61   8.887  -4.444   1.382
  478    HG   LEU  61           HG       LEU  61  10.948  -4.441   2.758
  479   HD11  LEU  61          HD11      LEU  61  11.773  -6.508   0.754
  480   HD12  LEU  61          HD12      LEU  61  11.606  -6.770   2.498
  481   HD13  LEU  61          HD13      LEU  61  12.878  -5.707   1.867
  482   HD21  LEU  61          HD21      LEU  61  11.312  -4.254  -0.220
  483   HD22  LEU  61          HD22      LEU  61  12.377  -3.535   0.988
  484   HD23  LEU  61          HD23      LEU  61  10.708  -2.973   0.829
  485    H    LEU  62           HN       LEU  62   6.835  -4.643   2.276
  486    HA   LEU  62           HA       LEU  62   7.254  -3.041   4.527
  487    HB2  LEU  62           HB2      LEU  62   4.704  -3.399   2.934
  488    HB3  LEU  62           HB1      LEU  62   4.937  -2.185   4.162
  489    HG   LEU  62           HG       LEU  62   5.161  -1.002   2.208
  490   HD11  LEU  62          HD11      LEU  62   6.976  -0.435   3.575
  491   HD12  LEU  62          HD12      LEU  62   7.494  -0.403   1.882
  492   HD13  LEU  62          HD13      LEU  62   7.944  -1.754   2.918
  493   HD21  LEU  62          HD21      LEU  62   6.443  -1.685   0.255
  494   HD22  LEU  62          HD22      LEU  62   5.109  -2.778   0.655
  495   HD23  LEU  62          HD23      LEU  62   6.766  -3.231   1.047
  496    H    ILE  63           HN       ILE  63   5.384  -5.991   4.038
  497    HA   ILE  63           HA       ILE  63   3.937  -5.814   6.436
  498    HB   ILE  63           HB       ILE  63   3.669  -7.389   4.296
  499   HG12  ILE  63          HG12      ILE  63   2.111  -7.089   6.161
  500   HG13  ILE  63          HG11      ILE  63   2.023  -8.694   5.468
  501   HG21  ILE  63          HG21      ILE  63   5.094  -9.252   6.183
  502   HG22  ILE  63          HG22      ILE  63   5.709  -8.680   4.640
  503   HG23  ILE  63          HG23      ILE  63   4.278  -9.717   4.688
  504   HD11  ILE  63          HD11      ILE  63   3.376  -9.531   7.368
  505   HD12  ILE  63          HD12      ILE  63   1.844  -8.803   7.870
  506   HD13  ILE  63          HD13      ILE  63   3.349  -7.901   8.043
  507    H    THR  64           HN       THR  64   7.150  -6.962   5.746
  508    HA   THR  64           HA       THR  64   7.485  -8.274   8.261
  509    HB   THR  64           HB       THR  64   9.617  -7.356   6.301
  510    HG1  THR  64           HG1      THR  64   8.383  -8.821   5.223
  511   HG21  THR  64          HG21      THR  64  11.014  -9.083   7.370
  512   HG22  THR  64          HG22      THR  64   9.708  -9.434   8.505
  513   HG23  THR  64          HG23      THR  64  10.509  -7.864   8.542
  514    H    HIS  65           HN       HIS  65   8.603  -5.186   6.916
  515    HA   HIS  65           HA       HIS  65   9.867  -4.457   9.381
  516    HB2  HIS  65           HB2      HIS  65   9.349  -2.818   6.889
  517    HB3  HIS  65           HB1      HIS  65  10.233  -2.216   8.285
  518    HD1  HIS  65           HD1      HIS  65  12.705  -2.973   8.518
  519    HD2  HIS  65           HD2      HIS  65  10.680  -4.807   5.386
  520    HE1  HIS  65           HE1      HIS  65  14.440  -4.204   7.193
  521    H    PHE  66           HN       PHE  66   7.115  -2.967   7.664
  522    HA   PHE  66           HA       PHE  66   6.357  -1.434   9.924
  523    HB2  PHE  66           HB2      PHE  66   4.837  -2.094   7.392
  524    HB3  PHE  66           HB1      PHE  66   4.375  -0.863   8.565
  525    HD1  PHE  66           HD2      PHE  66   6.997  -1.845   6.176
  526    HD2  PHE  66           HD1      PHE  66   5.321   1.288   8.493
  527    HE1  PHE  66           HE2      PHE  66   8.439  -0.257   5.032
  528    HE2  PHE  66           HE1      PHE  66   6.774   2.905   7.350
  529    HZ   PHE  66           HZ       PHE  66   8.345   2.112   5.614
  530    H    GLY  67           HN       GLY  67   4.405  -3.929   8.289
  531    HA2  GLY  67           HA3      GLY  67   3.886  -5.722  10.182
  532    HA3  GLY  67           HA2      GLY  67   2.962  -4.318  10.745
  533    HA   PRO  68           HA       PRO  68   0.637  -6.705   7.379
  534    HB2  PRO  68           HB2      PRO  68  -1.480  -6.979   9.380
  535    HB3  PRO  68           HB1      PRO  68  -0.756  -8.211   8.356
  536    HG2  PRO  68           HG2      PRO  68  -0.326  -8.035  11.036
  537    HG3  PRO  68           HG1      PRO  68   0.840  -8.754   9.910
  538    HD2  PRO  68           HD2      PRO  68   0.878  -6.115  11.278
  539    HD3  PRO  68           HD1      PRO  68   2.230  -7.142  10.761
  540    H    GLU  69           HN       GLU  69  -1.095  -4.954   9.940
  541    HA   GLU  69           HA       GLU  69  -2.891  -3.712   8.187
  542    HB2  GLU  69           HB3      GLU  69  -2.111  -2.805  10.952
  543    HB3  GLU  69           HB2      GLU  69  -3.574  -2.377  10.080
  544    HG2  GLU  69           HG3      GLU  69  -4.410  -3.991  11.400
  545    HG3  GLU  69           HG2      GLU  69  -3.896  -4.977  10.047
  546    H    GLU  70           HN       GLU  70   0.170  -2.787   9.551
  547    HA   GLU  70           HA       GLU  70  -0.029  -0.070   8.818
  548    HB2  GLU  70           HB3      GLU  70   1.389  -1.004  10.675
  549    HB3  GLU  70           HB2      GLU  70   2.520  -1.534   9.446
  550    HG2  GLU  70           HG3      GLU  70   2.978   0.705   8.771
  551    HG3  GLU  70           HG2      GLU  70   1.661   1.326   9.758
  552    H    ALA  71           HN       ALA  71   1.658  -2.845   7.353
  553    HA   ALA  71           HA       ALA  71   2.892  -1.564   5.185
  554    HB1  ALA  71           HB1      ALA  71   2.783  -3.711   4.037
  555    HB2  ALA  71           HB2      ALA  71   1.611  -4.295   5.220
  556    HB3  ALA  71           HB3      ALA  71   3.255  -3.919   5.722
  557    H    TRP  72           HN       TRP  72  -0.335  -2.991   5.396
  558    HA   TRP  72           HA       TRP  72  -1.080  -2.335   2.807
  559    HB2  TRP  72           HB2      TRP  72  -2.363  -4.005   3.941
  560    HB3  TRP  72           HB1      TRP  72  -2.755  -2.905   5.260
  561    HD1  TRP  72           HD1      TRP  72  -5.277  -2.473   5.116
  562    HE1  TRP  72           HE1      TRP  72  -6.925  -1.785   3.255
  563    HE3  TRP  72           HE3      TRP  72  -2.138  -2.680   1.095
  564    HZ2  TRP  72           HZ2      TRP  72  -6.879  -1.350   0.517
  565    HZ3  TRP  72           HZ3      TRP  72  -3.025  -2.112  -1.126
  566    HH2  TRP  72           HH2      TRP  72  -5.356  -1.469  -1.409
  567    H    ARG  73           HN       ARG  73  -1.570  -0.535   5.801
  568    HA   ARG  73           HA       ARG  73  -3.063   1.518   4.608
  569    HB2  ARG  73           HB2      ARG  73  -2.929   1.121   7.055
  570    HB3  ARG  73           HB1      ARG  73  -1.281   1.734   7.036
  571    HG2  ARG  73           HG2      ARG  73  -2.149   3.902   6.208
  572    HG3  ARG  73           HG1      ARG  73  -3.788   3.271   6.392
  573    HD2  ARG  73           HD2      ARG  73  -1.734   3.632   8.567
  574    HD3  ARG  73           HD1      ARG  73  -3.194   4.587   8.318
  575    HE   ARG  73           HE       ARG  73  -4.285   2.234   8.627
  576   HH11  ARG  73          HH11      ARG  73  -1.628   3.664  10.455
  577   HH12  ARG  73          HH12      ARG  73  -1.957   2.828  11.901
  578   HH21  ARG  73          HH21      ARG  73  -4.780   1.078  10.627
  579   HH22  ARG  73          HH22      ARG  73  -3.798   1.321  11.992
  580    H    LEU  74           HN       LEU  74   0.379   1.162   5.279
  581    HA   LEU  74           HA       LEU  74   1.302   3.618   4.377
  582    HB2  LEU  74           HB2      LEU  74   2.466   0.975   4.896
  583    HB3  LEU  74           HB1      LEU  74   3.342   1.920   3.716
  584    HG   LEU  74           HG       LEU  74   4.222   2.085   6.053
  585   HD11  LEU  74          HD11      LEU  74   4.747   3.784   4.445
  586   HD12  LEU  74          HD12      LEU  74   4.531   4.503   6.035
  587   HD13  LEU  74          HD13      LEU  74   3.258   4.657   4.815
  588   HD21  LEU  74          HD21      LEU  74   3.041   3.482   7.671
  589   HD22  LEU  74          HD22      LEU  74   2.078   2.062   7.256
  590   HD23  LEU  74          HD23      LEU  74   1.676   3.631   6.567
  591    H    ALA  75           HN       ALA  75   0.790   0.613   2.549
  592    HA   ALA  75           HA       ALA  75   1.794   1.653   0.108
  593    HB1  ALA  75           HB1      ALA  75   0.684  -0.183  -0.986
  594    HB2  ALA  75           HB2      ALA  75  -0.183  -0.583   0.499
  595    HB3  ALA  75           HB3      ALA  75   1.582  -0.742   0.417
  596    H    LEU  76           HN       LEU  76  -1.555   1.358   1.302
  597    HA   LEU  76           HA       LEU  76  -2.601   2.496  -1.036
  598    HB2  LEU  76           HB2      LEU  76  -4.754   2.658   0.086
  599    HB3  LEU  76           HB1      LEU  76  -4.004   1.128   0.450
  600    HG   LEU  76           HG       LEU  76  -3.299   2.357   2.677
  601   HD11  LEU  76          HD11      LEU  76  -4.969   3.923   3.460
  602   HD12  LEU  76          HD12      LEU  76  -5.728   3.906   1.866
  603   HD13  LEU  76          HD13      LEU  76  -4.095   4.548   2.059
  604   HD21  LEU  76          HD21      LEU  76  -6.093   1.409   2.135
  605   HD22  LEU  76          HD22      LEU  76  -5.349   1.574   3.726
  606   HD23  LEU  76          HD23      LEU  76  -4.707   0.406   2.570
  607    H    SER  77           HN       SER  77  -1.667   3.959   1.999
  608    HA   SER  77           HA       SER  77  -2.451   6.520   1.111
  609    HB2  SER  77           HB2      SER  77  -1.347   5.328   3.532
  610    HB3  SER  77           HB1      SER  77  -1.123   7.103   3.365
  611    HG   SER  77           HG       SER  77  -3.393   7.062   2.869
  612    H    THR  78           HN       THR  78   0.012   4.768   0.074
  613    HA   THR  78           HA       THR  78   1.603   7.150  -0.459
  614    HB   THR  78           HB       THR  78   2.290   4.214  -0.849
  615    HG1  THR  78           HG1      THR  78   2.491   4.691   1.244
  616   HG21  THR  78          HG21      THR  78   4.556   4.996  -1.418
  617   HG22  THR  78          HG22      THR  78   4.006   6.668  -1.317
  618   HG23  THR  78          HG23      THR  78   3.372   5.606  -2.574
  619    H    PHE  79           HN       PHE  79  -0.528   4.764  -1.816
  620    HA   PHE  79           HA       PHE  79  -0.075   5.111  -4.536
  621    HB2  PHE  79           HB2      PHE  79  -2.671   4.569  -3.072
  622    HB3  PHE  79           HB1      PHE  79  -2.530   4.484  -4.830
  623    HD1  PHE  79           HD2      PHE  79   0.359   3.108  -4.429
  624    HD2  PHE  79           HD1      PHE  79  -3.574   2.388  -2.984
  625    HE1  PHE  79           HE2      PHE  79   0.905   0.750  -4.108
  626    HE2  PHE  79           HE1      PHE  79  -3.027   0.018  -2.661
  627    HZ   PHE  79           HZ       PHE  79  -0.781  -0.806  -3.229
  628    H    GLU  80           HN       GLU  80  -2.197   6.822  -2.288
  629    HA   GLU  80           HA       GLU  80  -3.270   8.700  -4.089
  630    HB2  GLU  80           HB3      GLU  80  -3.840  10.037  -2.033
  631    HB3  GLU  80           HB2      GLU  80  -4.349   8.356  -1.947
  632    HG2  GLU  80           HG3      GLU  80  -2.459   7.813  -0.622
  633    HG3  GLU  80           HG2      GLU  80  -1.853   9.472  -0.721
  634    H    ARG  81           HN       ARG  81  -0.215   8.613  -2.476
  635    HA   ARG  81           HA       ARG  81   0.429  11.386  -2.724
  636    HB2  ARG  81           HB2      ARG  81   2.203   9.013  -2.249
  637    HB3  ARG  81           HB1      ARG  81   2.745  10.678  -2.212
  638    HG2  ARG  81           HG2      ARG  81   0.675   9.490  -0.375
  639    HG3  ARG  81           HG1      ARG  81   2.385   9.695  -0.008
  640    HD2  ARG  81           HD2      ARG  81   1.348  11.529   1.014
  641    HD3  ARG  81           HD1      ARG  81   2.035  12.147  -0.485
  642    HE   ARG  81           HE       ARG  81  -0.135  12.331  -1.396
  643   HH11  ARG  81          HH11      ARG  81  -0.106  11.499   2.044
  644   HH12  ARG  81          HH12      ARG  81  -1.752  11.847   2.270
  645   HH21  ARG  81          HH21      ARG  81  -2.438  12.801  -1.043
  646   HH22  ARG  81          HH22      ARG  81  -3.104  12.511   0.495
  647    H    ILE  82           HN       ILE  82   1.261   8.477  -4.527
  648    HA   ILE  82           HA       ILE  82   2.891   9.973  -6.404
  649    HB   ILE  82           HB       ILE  82   3.349   7.781  -7.444
  650   HG12  ILE  82          HG12      ILE  82   1.499   6.667  -5.301
  651   HG13  ILE  82          HG11      ILE  82   1.127   6.744  -7.016
  652   HG21  ILE  82          HG21      ILE  82   3.617   7.837  -4.437
  653   HG22  ILE  82          HG22      ILE  82   4.738   8.538  -5.601
  654   HG23  ILE  82          HG23      ILE  82   4.539   6.786  -5.515
  655   HD11  ILE  82          HD11      ILE  82   2.941   5.177  -7.478
  656   HD12  ILE  82          HD12      ILE  82   1.788   4.510  -6.317
  657   HD13  ILE  82          HD13      ILE  82   3.338   5.136  -5.758
  658    H    ASN  83           HN       ASN  83  -0.106  10.152  -6.134
  659    HA   ASN  83           HA       ASN  83  -1.923  10.380  -7.279
  660    HB2  ASN  83           HB3      ASN  83  -0.042  10.957  -9.563
  661    HB3  ASN  83           HB2      ASN  83  -1.790  11.142  -9.681
  662   HD21  ASN  83          HD21      ASN  83  -2.807  12.681  -8.356
  663   HD22  ASN  83          HD22      ASN  83  -1.965  14.027  -7.703
  664    H    ARG  84           HN       ARG  84  -2.071   8.248  -6.702
  665    HA   ARG  84           HA       ARG  84  -3.075   6.723  -8.932
  666    HB2  ARG  84           HB2      ARG  84  -0.836   5.782  -8.469
  667    HB3  ARG  84           HB1      ARG  84  -1.218   5.657  -6.764
  668    HG2  ARG  84           HG2      ARG  84  -1.266   3.520  -8.130
  669    HG3  ARG  84           HG1      ARG  84  -2.669   3.849  -7.113
  670    HD2  ARG  84           HD2      ARG  84  -3.326   3.048  -9.315
  671    HD3  ARG  84           HD1      ARG  84  -3.866   4.699  -8.980
  672    HE   ARG  84           HE       ARG  84  -1.385   4.796 -10.259
  673   HH11  ARG  84          HH11      ARG  84  -4.668   3.771 -11.191
  674   HH12  ARG  84          HH12      ARG  84  -4.494   4.307 -12.787
  675   HH21  ARG  84          HH21      ARG  84  -1.172   5.480 -12.417
  676   HH22  ARG  84          HH22      ARG  84  -2.450   5.288 -13.532
  677    H    LYS  85           HN       LYS  85  -4.618   8.249  -7.675
  678    HA   LYS  85           HA       LYS  85  -5.521   7.381  -5.127
  679    HB2  LYS  85           HB2      LYS  85  -5.533   9.709  -5.823
  680    HB3  LYS  85           HB1      LYS  85  -6.705   9.370  -7.101
  681    HG2  LYS  85           HG2      LYS  85  -8.366   8.855  -5.360
  682    HG3  LYS  85           HG1      LYS  85  -7.123   9.127  -4.129
  683    HD2  LYS  85           HD2      LYS  85  -8.447  11.104  -4.238
  684    HD3  LYS  85           HD1      LYS  85  -6.891  11.465  -4.969
  685    HE2  LYS  85           HE2      LYS  85  -8.548  12.465  -6.357
  686    HE3  LYS  85           HE1      LYS  85  -7.979  11.044  -7.223
  687    HZ1  LYS  85           HZ1      LYS  85 -10.372  11.223  -7.309
  688    HZ2  LYS  85           HZ2      LYS  85 -10.475  11.252  -5.639
  689    HZ3  LYS  85           HZ3      LYS  85  -9.974   9.842  -6.420
  690    H    ASP  86           HN       ASP  86  -6.077   6.744  -8.390
  691    HA   ASP  86           HA       ASP  86  -8.537   5.620  -8.603
  692    HB2  ASP  86           HB2      ASP  86  -7.459   5.753 -10.608
  693    HB3  ASP  86           HB1      ASP  86  -5.922   5.223  -9.945
  694    H    LEU  87           HN       LEU  87  -5.601   4.262  -7.332
  695    HA   LEU  87           HA       LEU  87  -6.734   1.613  -6.957
  696    HB2  LEU  87           HB2      LEU  87  -4.426   2.150  -7.840
  697    HB3  LEU  87           HB1      LEU  87  -4.047   2.714  -6.229
  698    HG   LEU  87           HG       LEU  87  -4.279   0.474  -5.374
  699   HD11  LEU  87          HD11      LEU  87  -4.569  -1.409  -6.957
  700   HD12  LEU  87          HD12      LEU  87  -4.841  -0.239  -8.258
  701   HD13  LEU  87          HD13      LEU  87  -5.986  -0.359  -6.928
  702   HD21  LEU  87          HD21      LEU  87  -2.333  -0.483  -6.519
  703   HD22  LEU  87          HD22      LEU  87  -2.146   1.246  -6.192
  704   HD23  LEU  87          HD23      LEU  87  -2.549   0.699  -7.814
  705    H    TRP  88           HN       TRP  88  -5.704   4.445  -5.229
  706    HA   TRP  88           HA       TRP  88  -5.660   3.557  -2.591
  707    HB2  TRP  88           HB2      TRP  88  -4.709   5.650  -3.316
  708    HB3  TRP  88           HB1      TRP  88  -6.267   6.247  -3.784
  709    HD1  TRP  88           HD1      TRP  88  -4.533   5.170  -0.525
  710    HE1  TRP  88           HE1      TRP  88  -5.427   6.615   1.406
  711    HE3  TRP  88           HE3      TRP  88  -8.063   7.795  -3.048
  712    HZ2  TRP  88           HZ2      TRP  88  -7.378   8.589   1.814
  713    HZ3  TRP  88           HZ3      TRP  88  -9.412   9.449  -1.828
  714    HH2  TRP  88           HH2      TRP  88  -9.078   9.833   0.559
  715    H    GLU  89           HN       GLU  89  -8.281   5.091  -4.399
  716    HA   GLU  89           HA       GLU  89 -10.167   5.160  -2.328
  717    HB2  GLU  89           HB3      GLU  89 -10.540   5.189  -5.306
  718    HB3  GLU  89           HB2      GLU  89 -11.834   5.480  -4.151
  719    HG2  GLU  89           HG3      GLU  89 -10.581   7.403  -3.260
  720    HG3  GLU  89           HG2      GLU  89  -9.302   7.062  -4.424
  721    H    ARG  90           HN       ARG  90  -9.208   2.565  -4.263
  722    HA   ARG  90           HA       ARG  90 -11.626   0.997  -3.885
  723    HB2  ARG  90           HB2      ARG  90  -8.930  -0.139  -4.527
  724    HB3  ARG  90           HB1      ARG  90 -10.503  -0.780  -4.938
  725    HG2  ARG  90           HG2      ARG  90 -10.795   1.029  -6.565
  726    HG3  ARG  90           HG1      ARG  90  -9.188   1.637  -6.145
  727    HD2  ARG  90           HD2      ARG  90  -8.393  -0.751  -6.615
  728    HD3  ARG  90           HD1      ARG  90  -9.931  -0.942  -7.444
  729    HE   ARG  90           HE       ARG  90  -8.772   1.339  -8.436
  730   HH11  ARG  90          HH11      ARG  90  -8.298  -2.154  -8.401
  731   HH12  ARG  90          HH12      ARG  90  -7.138  -2.171  -9.647
  732   HH21  ARG  90          HH21      ARG  90  -7.172   1.307 -10.283
  733   HH22  ARG  90          HH22      ARG  90  -6.557  -0.227 -10.734
  734    H    GLY  91           HN       GLY  91  -8.382   1.258  -2.539
  735    HA2  GLY  91           HA3      GLY  91  -8.607  -0.894  -0.680
  736    HA3  GLY  91           HA2      GLY  91  -7.371   0.367  -0.694
  737    H    GLN  92           HN       GLN  92  -9.430   2.409  -0.694
  738    HA   GLN  92           HA       GLN  92  -9.804   2.787   2.103
  739    HB2  GLN  92           HB2      GLN  92 -10.806   4.212  -0.338
  740    HB3  GLN  92           HB1      GLN  92 -11.295   4.666   1.287
  741    HG2  GLN  92           HG2      GLN  92  -8.470   4.587   0.298
  742    HG3  GLN  92           HG1      GLN  92  -9.467   6.039   0.408
  743   HE21  GLN  92          HE21      GLN  92 -10.140   6.718   2.446
  744   HE22  GLN  92          HE22      GLN  92  -9.236   6.347   3.868
  745    H    ARG  93           HN       ARG  93 -11.050   1.537   3.153
  746    HA   ARG  93           HA       ARG  93 -13.438   0.480   2.114
  747    HB2  ARG  93           HB2      ARG  93 -14.009   0.058   4.577
  748    HB3  ARG  93           HB1      ARG  93 -12.597  -0.746   3.919
  749    HG2  ARG  93           HG2      ARG  93 -11.122   0.653   5.076
  750    HG3  ARG  93           HG1      ARG  93 -12.378   1.845   5.411
  751    HD2  ARG  93           HD2      ARG  93 -11.814   0.556   7.369
  752    HD3  ARG  93           HD1      ARG  93 -13.493   0.320   6.852
  753    HE   ARG  93           HE       ARG  93 -11.416  -1.631   6.153
  754   HH11  ARG  93          HH11      ARG  93 -14.583  -0.911   7.637
  755   HH12  ARG  93          HH12      ARG  93 -14.862  -2.481   8.190
  756   HH21  ARG  93          HH21      ARG  93 -11.794  -3.851   6.885
  757   HH22  ARG  93          HH22      ARG  93 -13.200  -4.248   7.725
  758    H    GLU  94           HN       GLU  94 -12.817   3.176   4.347
  759    HA   GLU  94           HA       GLU  94 -14.194   4.641   5.280
  760    HB2  GLU  94           HB3      GLU  94 -14.387   5.299   2.340
  761    HB3  GLU  94           HB2      GLU  94 -14.987   6.374   3.599
  762    HG2  GLU  94           HG3      GLU  94 -12.740   6.434   4.602
  763    HG3  GLU  94           HG2      GLU  94 -12.147   5.411   3.302
  764    H    ASP  95           HN       ASP  95 -15.560   3.517   6.300
  765    HA   ASP  95           HA       ASP  95 -17.881   2.286   5.170
  766    HB2  ASP  95           HB2      ASP  95 -16.954   2.625   8.015
  767    HB3  ASP  95           HB1      ASP  95 -18.404   1.754   7.541
  768    H    LEU  96           HN       LEU  96 -17.521   5.284   5.310
  769    HA   LEU  96           HA       LEU  96 -18.737   7.149   5.413
  770    HB2  LEU  96           HB2      LEU  96 -20.527   5.816   4.456
  771    HB3  LEU  96           HB1      LEU  96 -21.017   5.274   6.044
  772    HG   LEU  96           HG       LEU  96 -21.625   7.643   6.600
  773   HD11  LEU  96          HD11      LEU  96 -21.897   9.245   4.773
  774   HD12  LEU  96          HD12      LEU  96 -21.126   8.109   3.666
  775   HD13  LEU  96          HD13      LEU  96 -20.208   8.795   5.006
  776   HD21  LEU  96          HD21      LEU  96 -23.016   6.435   4.217
  777   HD22  LEU  96          HD22      LEU  96 -23.695   7.656   5.297
  778   HD23  LEU  96          HD23      LEU  96 -23.317   6.047   5.908
  779    H    VAL  97           HN       VAL  97 -19.489   8.675   6.949
  780    HA   VAL  97           HA       VAL  97 -18.656   8.137   9.606
  781    HB   VAL  97           HB       VAL  97 -20.323  10.467   8.591
  782   HG11  VAL  97          HG11      VAL  97 -19.503  11.656  10.570
  783   HG12  VAL  97          HG12      VAL  97 -18.654  10.198  11.092
  784   HG13  VAL  97          HG13      VAL  97 -20.412  10.211  11.018
  785   HG21  VAL  97          HG21      VAL  97 -18.209  10.326   7.377
  786   HG22  VAL  97          HG22      VAL  97 -17.325  10.239   8.899
  787   HG23  VAL  97          HG23      VAL  97 -18.202  11.710   8.472
  788    H    ARG  98           HN       ARG  98 -19.762   6.725  10.739
  789    HA   ARG  98           HA       ARG  98 -22.602   6.505  10.387
  790    HB2  ARG  98           HB2      ARG  98 -20.750   4.881  12.135
  791    HB3  ARG  98           HB1      ARG  98 -22.462   4.558  11.880
  792    HG2  ARG  98           HG2      ARG  98 -20.492   4.742   9.668
  793    HG3  ARG  98           HG1      ARG  98 -20.900   3.188  10.444
  794    HD2  ARG  98           HD2      ARG  98 -23.196   3.455   9.736
  795    HD3  ARG  98           HD1      ARG  98 -22.874   5.078   9.135
  796    HE   ARG  98           HE       ARG  98 -21.184   3.393   7.780
  797   HH11  ARG  98          HH11      ARG  98 -24.695   3.785   8.134
  798   HH12  ARG  98          HH12      ARG  98 -25.043   3.240   6.567
  799   HH21  ARG  98          HH21      ARG  98 -21.683   2.670   5.625
  800   HH22  ARG  98          HH22      ARG  98 -23.289   2.596   5.097
  801    H    ASP  99           HN       ASP  99 -22.984   8.426  10.973
  802    HA   ASP  99           HA       ASP  99 -22.900   9.129  13.807
  803    HB2  ASP  99           HB2      ASP  99 -22.082  10.831  12.280
  804    HB3  ASP  99           HB1      ASP  99 -23.563  10.751  11.343
  805    H    THR 100           HN       THR 100 -24.440   7.632  14.431
  806    HA   THR 100           HA       THR 100 -27.184   8.077  13.529
  807    HB   THR 100           HB       THR 100 -26.031   5.910  15.324
  808    HG1  THR 100           HG1      THR 100 -26.084   4.628  13.500
  809   HG21  THR 100          HG21      THR 100 -28.706   6.082  13.909
  810   HG22  THR 100          HG22      THR 100 -28.453   6.272  15.641
  811   HG23  THR 100          HG23      THR 100 -28.134   4.721  14.866
  812    H    VAL 101           HN       VAL 101 -25.380   7.533  16.490
  813    HA   VAL 101           HA       VAL 101 -25.599   8.141  18.620
  814    HB   VAL 101           HB       VAL 101 -26.039  10.913  17.487
  815   HG11  VAL 101          HG11      VAL 101 -26.148  10.711  19.939
  816   HG12  VAL 101          HG12      VAL 101 -24.752  11.657  19.416
  817   HG13  VAL 101          HG13      VAL 101 -24.544   9.983  19.926
  818   HG21  VAL 101          HG21      VAL 101 -24.260   9.806  16.237
  819   HG22  VAL 101          HG22      VAL 101 -23.449   9.382  17.745
  820   HG23  VAL 101          HG23      VAL 101 -23.605  11.074  17.274
  821    H    GLU 102           HN       GLU 102 -27.747   6.947  18.435
  822    HA   GLU 102           HA       GLU 102 -29.531   7.912  20.246
  823    HB2  GLU 102           HB3      GLU 102 -30.285   9.507  18.467
  824    HB3  GLU 102           HB2      GLU 102 -30.614   8.150  17.405
  825    HG2  GLU 102           HG3      GLU 102 -32.673   8.965  18.361
  826    HG3  GLU 102           HG2      GLU 102 -32.328   7.359  18.991
  Start of MODEL   18
    1    H1   GLY   1           HT1      GLY   1  -5.570 -13.334  25.344
    2    H2   GLY   1           HT2      GLY   1  -5.010 -11.857  24.794
    3    H3   GLY   1           HT3      GLY   1  -4.441 -13.300  24.098
    4    HA2  GLY   1           HA2      GLY   1  -7.199 -12.218  23.960
    5    HA3  GLY   1           HA3      GLY   1  -6.039 -12.295  22.635
    6    H    HIS   2           HN       HIS   2  -8.701 -13.512  22.888
    7    HA   HIS   2           HA       HIS   2  -8.391 -16.301  23.368
    8    HB2  HIS   2           HB2      HIS   2 -10.586 -15.242  23.595
    9    HB3  HIS   2           HB1      HIS   2 -10.569 -14.783  21.901
   10    HD1  HIS   2           HD1      HIS   2 -12.255 -16.234  20.690
   11    HD2  HIS   2           HD2      HIS   2 -10.172 -18.342  23.603
   12    HE1  HIS   2           HE1      HIS   2 -13.023 -18.622  20.514
   13    H    MET   3           HN       MET   3  -8.182 -14.246  20.578
   14    HA   MET   3           HA       MET   3  -7.545 -14.504  18.480
   15    HB2  MET   3           HB2      MET   3  -5.530 -15.637  19.254
   16    HB3  MET   3           HB1      MET   3  -6.398 -17.156  19.403
   17    HG2  MET   3           HG2      MET   3  -4.984 -17.114  17.414
   18    HG3  MET   3           HG1      MET   3  -6.689 -17.251  16.991
   19    HE1  MET   3           HE1      MET   3  -6.175 -16.609  14.518
   20    HE2  MET   3           HE2      MET   3  -4.461 -16.519  14.914
   21    HE3  MET   3           HE3      MET   3  -5.237 -15.196  14.033
   22    H    LEU   4           HN       LEU   4  -9.629 -14.419  17.858
   23    HA   LEU   4           HA       LEU   4 -10.916 -16.955  17.175
   24    HB2  LEU   4           HB2      LEU   4 -12.233 -15.334  18.509
   25    HB3  LEU   4           HB1      LEU   4 -12.034 -14.145  17.240
   26    HG   LEU   4           HG       LEU   4 -13.318 -15.621  15.710
   27   HD11  LEU   4          HD11      LEU   4 -14.623 -17.462  16.650
   28   HD12  LEU   4          HD12      LEU   4 -13.785 -17.269  18.190
   29   HD13  LEU   4          HD13      LEU   4 -12.891 -17.763  16.753
   30   HD21  LEU   4          HD21      LEU   4 -15.502 -15.180  16.717
   31   HD22  LEU   4          HD22      LEU   4 -14.420 -13.798  16.885
   32   HD23  LEU   4          HD23      LEU   4 -14.728 -14.854  18.265
   33    H    ARG   5           HN       ARG   5 -11.360 -17.438  15.071
   34    HA   ARG   5           HA       ARG   5 -11.231 -17.506  12.875
   35    HB2  ARG   5           HB2      ARG   5 -12.273 -15.246  12.773
   36    HB3  ARG   5           HB1      ARG   5 -10.688 -14.520  12.951
   37    HG2  ARG   5           HG2      ARG   5 -10.003 -15.379  10.796
   38    HG3  ARG   5           HG1      ARG   5 -11.536 -16.236  10.628
   39    HD2  ARG   5           HD2      ARG   5 -11.214 -13.243  10.844
   40    HD3  ARG   5           HD1      ARG   5 -11.521 -14.131   9.356
   41    HE   ARG   5           HE       ARG   5 -13.504 -14.829  11.157
   42   HH11  ARG   5          HH11      ARG   5 -12.485 -11.907   9.410
   43   HH12  ARG   5          HH12      ARG   5 -14.026 -11.194   9.409
   44   HH21  ARG   5          HH21      ARG   5 -15.631 -13.816  11.158
   45   HH22  ARG   5          HH22      ARG   5 -15.857 -12.304  10.411
   46    H    THR   6           HN       THR   6  -9.626 -18.805  12.633
   47    HA   THR   6           HA       THR   6  -6.965 -18.056  13.250
   48    HB   THR   6           HB       THR   6  -7.991 -20.590  11.940
   49    HG1  THR   6           HG1      THR   6  -8.142 -21.362  14.031
   50   HG21  THR   6          HG21      THR   6  -5.430 -20.009  13.455
   51   HG22  THR   6          HG22      THR   6  -5.551 -20.238  11.708
   52   HG23  THR   6          HG23      THR   6  -5.915 -21.574  12.799
   53    H    ALA   7           HN       ALA   7  -6.499 -16.392  11.917
   54    HA   ALA   7           HA       ALA   7  -5.163 -17.004   9.523
   55    HB1  ALA   7           HB1      ALA   7  -7.412 -16.795   8.525
   56    HB2  ALA   7           HB2      ALA   7  -6.445 -15.380   8.108
   57    HB3  ALA   7           HB3      ALA   7  -7.660 -15.271   9.379
   58    H    GLY   8           HN       GLY   8  -4.509 -14.593   8.681
   59    HA2  GLY   8           HA3      GLY   8  -3.741 -13.186  11.130
   60    HA3  GLY   8           HA2      GLY   8  -3.016 -12.970   9.532
   61    H    ARG   9           HN       ARG   9  -4.432 -12.176   7.870
   62    HA   ARG   9           HA       ARG   9  -6.860 -10.960   8.112
   63    HB2  ARG   9           HB2      ARG   9  -5.723  -9.302   9.667
   64    HB3  ARG   9           HB1      ARG   9  -4.592  -8.925   8.368
   65    HG2  ARG   9           HG2      ARG   9  -6.623  -8.336   6.966
   66    HG3  ARG   9           HG1      ARG   9  -7.547  -8.407   8.459
   67    HD2  ARG   9           HD2      ARG   9  -6.232  -6.591   9.384
   68    HD3  ARG   9           HD1      ARG   9  -5.173  -6.664   7.962
   69    HE   ARG   9           HE       ARG   9  -7.707  -6.301   6.997
   70   HH11  ARG   9          HH11      ARG   9  -5.823  -4.380   9.289
   71   HH12  ARG   9          HH12      ARG   9  -6.148  -2.886   8.535
   72   HH21  ARG   9          HH21      ARG   9  -8.250  -4.166   6.006
   73   HH22  ARG   9          HH22      ARG   9  -7.549  -2.779   6.659
   74    H    ASP  10           HN       ASP  10  -7.327  -9.944   6.056
   75    HA   ASP  10           HA       ASP  10  -5.466 -10.714   4.016
   76    HB2  ASP  10           HB2      ASP  10  -8.120  -9.272   3.760
   77    HB3  ASP  10           HB1      ASP  10  -7.133  -9.778   2.400
   78    H    GLY  11           HN       GLY  11  -3.860  -9.316   5.023
   79    HA2  GLY  11           HA3      GLY  11  -4.071  -6.508   4.200
   80    HA3  GLY  11           HA2      GLY  11  -2.862  -7.171   5.299
   81    H    LEU  12           HN       LEU  12  -1.510  -8.899   4.331
   82    HA   LEU  12           HA       LEU  12   0.121  -7.971   2.247
   83    HB2  LEU  12           HB2      LEU  12   0.452  -9.777   4.122
   84    HB3  LEU  12           HB1      LEU  12  -0.241 -10.860   2.972
   85    HG   LEU  12           HG       LEU  12   2.337  -9.354   2.411
   86   HD11  LEU  12          HD11      LEU  12   3.483 -11.446   2.902
   87   HD12  LEU  12          HD12      LEU  12   1.954 -12.179   3.379
   88   HD13  LEU  12          HD13      LEU  12   2.621 -10.844   4.319
   89   HD21  LEU  12          HD21      LEU  12   2.660 -11.031   0.657
   90   HD22  LEU  12          HD22      LEU  12   1.152 -10.149   0.395
   91   HD23  LEU  12          HD23      LEU  12   1.115 -11.778   1.067
   92    H    CYS  13           HN       CYS  13  -2.560 -10.135   2.379
   93    HA   CYS  13           HA       CYS  13  -2.533 -11.312  -0.090
   94    HB2  CYS  13           HB2      CYS  13  -4.875 -10.512   1.588
   95    HB3  CYS  13           HB1      CYS  13  -4.823 -11.883   0.451
   96    HG   CYS  13           HG       CYS  13  -3.466 -13.532   1.989
   97    H    ARG  14           HN       ARG  14  -4.283  -8.341   0.928
   98    HA   ARG  14           HA       ARG  14  -5.084  -7.937  -1.812
   99    HB2  ARG  14           HB2      ARG  14  -6.349  -6.019  -1.068
  100    HB3  ARG  14           HB1      ARG  14  -6.609  -7.311   0.083
  101    HG2  ARG  14           HG2      ARG  14  -5.012  -6.246   1.613
  102    HG3  ARG  14           HG1      ARG  14  -4.794  -4.936   0.449
  103    HD2  ARG  14           HD2      ARG  14  -6.365  -4.124   2.006
  104    HD3  ARG  14           HD1      ARG  14  -7.309  -4.588   0.593
  105    HE   ARG  14           HE       ARG  14  -7.018  -6.529   2.731
  106   HH11  ARG  14          HH11      ARG  14  -9.163  -4.227   1.038
  107   HH12  ARG  14          HH12      ARG  14 -10.541  -4.690   1.911
  108   HH21  ARG  14          HH21      ARG  14  -8.988  -7.118   3.945
  109   HH22  ARG  14          HH22      ARG  14 -10.443  -6.349   3.551
  110    H    LEU  15           HN       LEU  15  -2.616  -6.895   0.327
  111    HA   LEU  15           HA       LEU  15  -1.607  -4.614  -0.845
  112    HB2  LEU  15           HB2      LEU  15  -0.961  -5.579   1.316
  113    HB3  LEU  15           HB1      LEU  15  -0.214  -6.917   0.484
  114    HG   LEU  15           HG       LEU  15   1.500  -5.422  -0.406
  115   HD11  LEU  15          HD11      LEU  15   1.621  -3.141   0.386
  116   HD12  LEU  15          HD12      LEU  15   0.085  -3.340   1.227
  117   HD13  LEU  15          HD13      LEU  15   0.143  -3.400  -0.536
  118   HD21  LEU  15          HD21      LEU  15   2.595  -4.924   1.718
  119   HD22  LEU  15          HD22      LEU  15   1.868  -6.531   1.720
  120   HD23  LEU  15          HD23      LEU  15   1.072  -5.203   2.564
  121    H    SER  16           HN       SER  16  -0.753  -8.035  -1.453
  122    HA   SER  16           HA       SER  16   1.088  -7.406  -3.516
  123    HB2  SER  16           HB2      SER  16   0.981  -9.908  -3.915
  124    HB3  SER  16           HB1      SER  16   1.448  -9.412  -2.286
  125    HG   SER  16           HG       SER  16  -0.455 -10.060  -1.516
  126    H    THR  17           HN       THR  17  -2.276  -7.557  -3.453
  127    HA   THR  17           HA       THR  17  -2.587  -8.264  -6.219
  128    HB   THR  17           HB       THR  17  -4.607  -7.207  -4.206
  129    HG1  THR  17           HG1      THR  17  -4.073  -9.251  -3.476
  130   HG21  THR  17          HG21      THR  17  -5.017  -8.585  -6.876
  131   HG22  THR  17          HG22      THR  17  -5.295  -6.877  -6.562
  132   HG23  THR  17          HG23      THR  17  -6.293  -8.096  -5.760
  133    H    TYR  18           HN       TYR  18  -2.981  -5.332  -4.218
  134    HA   TYR  18           HA       TYR  18  -3.523  -3.644  -6.431
  135    HB2  TYR  18           HB2      TYR  18  -2.798  -3.056  -3.576
  136    HB3  TYR  18           HB1      TYR  18  -3.020  -1.770  -4.761
  137    HD1  TYR  18           HD1      TYR  18  -4.682  -4.394  -2.818
  138    HD2  TYR  18           HD2      TYR  18  -5.191  -1.280  -5.647
  139    HE1  TYR  18           HE1      TYR  18  -7.101  -4.493  -2.468
  140    HE2  TYR  18           HE2      TYR  18  -7.617  -1.362  -5.315
  141    HH   TYR  18           HH       TYR  18  -9.056  -2.855  -2.759
  142    H    LEU  19           HN       LEU  19  -0.553  -4.445  -4.746
  143    HA   LEU  19           HA       LEU  19   0.964  -2.457  -6.085
  144    HB2  LEU  19           HB2      LEU  19   1.848  -4.970  -4.665
  145    HB3  LEU  19           HB1      LEU  19   2.952  -3.769  -5.297
  146    HG   LEU  19           HG       LEU  19   0.927  -3.260  -3.075
  147   HD11  LEU  19          HD11      LEU  19   2.698  -4.746  -2.378
  148   HD12  LEU  19          HD12      LEU  19   2.841  -3.159  -1.627
  149   HD13  LEU  19          HD13      LEU  19   3.907  -3.599  -2.964
  150   HD21  LEU  19          HD21      LEU  19   3.120  -1.501  -4.189
  151   HD22  LEU  19          HD22      LEU  19   2.095  -1.138  -2.805
  152   HD23  LEU  19          HD23      LEU  19   1.391  -1.245  -4.404
  153    H    GLU  20           HN       GLU  20  -0.269  -5.449  -7.106
  154    HA   GLU  20           HA       GLU  20   1.626  -5.982  -9.188
  155    HB2  GLU  20           HB3      GLU  20  -0.989  -7.077  -8.339
  156    HB3  GLU  20           HB2      GLU  20  -0.595  -7.251 -10.041
  157    HG2  GLU  20           HG3      GLU  20   1.294  -8.119  -7.880
  158    HG3  GLU  20           HG2      GLU  20   0.013  -9.167  -8.493
  159    H    GLU  21           HN       GLU  21  -1.062  -3.857  -8.826
  160    HA   GLU  21           HA       GLU  21  -1.255  -3.493 -11.697
  161    HB2  GLU  21           HB3      GLU  21  -2.978  -2.380  -9.457
  162    HB3  GLU  21           HB2      GLU  21  -3.218  -2.019 -11.163
  163    HG2  GLU  21           HG3      GLU  21  -3.490  -4.469 -11.569
  164    HG3  GLU  21           HG2      GLU  21  -3.438  -4.709  -9.832
  165    H    LEU  22           HN       LEU  22   0.930  -2.599  -9.766
  166    HA   LEU  22           HA       LEU  22   1.079   0.203 -10.637
  167    HB2  LEU  22           HB2      LEU  22   2.657  -1.267  -8.523
  168    HB3  LEU  22           HB1      LEU  22   2.969   0.371  -9.019
  169    HG   LEU  22           HG       LEU  22   0.564  -0.656  -7.542
  170   HD11  LEU  22          HD11      LEU  22   1.376   0.911  -5.844
  171   HD12  LEU  22          HD12      LEU  22   2.793   1.239  -6.841
  172   HD13  LEU  22          HD13      LEU  22   2.525  -0.380  -6.188
  173   HD21  LEU  22          HD21      LEU  22  -0.166   1.653  -7.471
  174   HD22  LEU  22          HD22      LEU  22  -0.166   1.034  -9.123
  175   HD23  LEU  22          HD23      LEU  22   1.117   2.122  -8.585
  176    H    GLU  23           HN       GLU  23   2.476   0.689 -12.186
  177    HA   GLU  23           HA       GLU  23   4.104  -1.410 -13.298
  178    HB2  GLU  23           HB3      GLU  23   4.607   0.158 -15.091
  179    HB3  GLU  23           HB2      GLU  23   2.887   0.180 -14.727
  180    HG2  GLU  23           HG3      GLU  23   3.024   2.236 -13.633
  181    HG3  GLU  23           HG2      GLU  23   4.790   2.195 -13.625
  182    H    ALA  24           HN       ALA  24   6.357  -0.315 -14.164
  183    HA   ALA  24           HA       ALA  24   8.137  -0.546 -12.093
  184    HB1  ALA  24           HB1      ALA  24   9.827   0.243 -13.599
  185    HB2  ALA  24           HB2      ALA  24   8.617   1.020 -14.611
  186    HB3  ALA  24           HB3      ALA  24   8.671  -0.740 -14.500
  187    H    VAL  25           HN       VAL  25   7.082   2.511 -13.605
  188    HA   VAL  25           HA       VAL  25   8.614   4.093 -11.848
  189    HB   VAL  25           HB       VAL  25   7.884   5.034 -14.005
  190   HG11  VAL  25          HG11      VAL  25   5.146   5.071 -12.783
  191   HG12  VAL  25          HG12      VAL  25   5.653   4.066 -14.151
  192   HG13  VAL  25          HG13      VAL  25   5.590   5.827 -14.311
  193   HG21  VAL  25          HG21      VAL  25   6.745   6.519 -11.691
  194   HG22  VAL  25          HG22      VAL  25   7.201   7.227 -13.245
  195   HG23  VAL  25          HG23      VAL  25   8.445   6.556 -12.168
  196    H    GLU  26           HN       GLU  26   5.335   2.903 -11.628
  197    HA   GLU  26           HA       GLU  26   4.512   4.581  -9.519
  198    HB2  GLU  26           HB3      GLU  26   3.582   1.805 -10.224
  199    HB3  GLU  26           HB2      GLU  26   2.748   2.972  -9.182
  200    HG2  GLU  26           HG3      GLU  26   3.420   3.529 -12.030
  201    HG3  GLU  26           HG2      GLU  26   1.898   2.722 -11.599
  202    H    LEU  27           HN       LEU  27   5.873   1.306  -9.598
  203    HA   LEU  27           HA       LEU  27   5.980   0.945  -6.802
  204    HB2  LEU  27           HB2      LEU  27   7.623  -0.307  -9.002
  205    HB3  LEU  27           HB1      LEU  27   7.691  -0.824  -7.335
  206    HG   LEU  27           HG       LEU  27   5.212  -0.964  -9.065
  207   HD11  LEU  27          HD11      LEU  27   5.632  -3.370  -9.115
  208   HD12  LEU  27          HD12      LEU  27   7.150  -3.130  -8.248
  209   HD13  LEU  27          HD13      LEU  27   6.951  -2.479  -9.873
  210   HD21  LEU  27          HD21      LEU  27   4.364  -2.404  -7.268
  211   HD22  LEU  27          HD22      LEU  27   4.709  -0.779  -6.686
  212   HD23  LEU  27          HD23      LEU  27   5.827  -2.099  -6.332
  213    H    LYS  28           HN       LYS  28   8.161   2.364  -9.093
  214    HA   LYS  28           HA       LYS  28  10.483   2.625  -7.557
  215    HB2  LYS  28           HB2      LYS  28  10.237   2.964 -10.048
  216    HB3  LYS  28           HB1      LYS  28   9.399   4.452  -9.719
  217    HG2  LYS  28           HG2      LYS  28  12.251   3.990  -8.889
  218    HG3  LYS  28           HG1      LYS  28  11.811   4.589 -10.485
  219    HD2  LYS  28           HD2      LYS  28  10.611   6.466  -9.338
  220    HD3  LYS  28           HD1      LYS  28  11.301   5.895  -7.815
  221    HE2  LYS  28           HE2      LYS  28  12.807   6.839 -10.251
  222    HE3  LYS  28           HE1      LYS  28  12.648   7.694  -8.721
  223    HZ1  LYS  28           HZ1      LYS  28  14.025   5.072  -9.054
  224    HZ2  LYS  28           HZ2      LYS  28  13.930   6.003  -7.640
  225    HZ3  LYS  28           HZ3      LYS  28  14.771   6.575  -8.960
  226    H    LYS  29           HN       LYS  29   7.735   4.760  -8.005
  227    HA   LYS  29           HA       LYS  29   8.645   6.876  -6.332
  228    HB2  LYS  29           HB2      LYS  29   5.916   6.070  -7.237
  229    HB3  LYS  29           HB1      LYS  29   6.246   7.592  -6.420
  230    HG2  LYS  29           HG2      LYS  29   7.783   8.241  -8.281
  231    HG3  LYS  29           HG1      LYS  29   7.367   6.748  -9.096
  232    HD2  LYS  29           HD2      LYS  29   5.342   8.863  -8.359
  233    HD3  LYS  29           HD1      LYS  29   6.158   8.788  -9.922
  234    HE2  LYS  29           HE2      LYS  29   5.234   6.510 -10.235
  235    HE3  LYS  29           HE1      LYS  29   4.358   6.689  -8.720
  236    HZ1  LYS  29           HZ1      LYS  29   3.077   7.147 -10.762
  237    HZ2  LYS  29           HZ2      LYS  29   4.007   8.547 -11.008
  238    HZ3  LYS  29           HZ3      LYS  29   3.039   8.406  -9.634
  239    H    PHE  30           HN       PHE  30   6.444   4.204  -5.908
  240    HA   PHE  30           HA       PHE  30   5.585   4.769  -3.359
  241    HB2  PHE  30           HB2      PHE  30   4.165   3.238  -4.172
  242    HB3  PHE  30           HB1      PHE  30   5.361   2.606  -5.281
  243    HD1  PHE  30           HD2      PHE  30   3.920   2.276  -1.851
  244    HD2  PHE  30           HD1      PHE  30   6.483   0.664  -4.827
  245    HE1  PHE  30           HE2      PHE  30   3.985   0.207  -0.636
  246    HE2  PHE  30           HE1      PHE  30   6.567  -1.477  -3.579
  247    HZ   PHE  30           HZ       PHE  30   5.316  -1.702  -1.476
  248    H    LYS  31           HN       LYS  31   8.325   2.757  -4.353
  249    HA   LYS  31           HA       LYS  31   8.857   1.918  -1.675
  250    HB2  LYS  31           HB2      LYS  31  10.828   0.846  -2.539
  251    HB3  LYS  31           HB1      LYS  31   9.496   0.561  -3.642
  252    HG2  LYS  31           HG2      LYS  31  10.394   2.369  -5.099
  253    HG3  LYS  31           HG1      LYS  31  11.783   2.490  -4.019
  254    HD2  LYS  31           HD2      LYS  31  12.207   0.057  -4.422
  255    HD3  LYS  31           HD1      LYS  31  10.921   0.099  -5.628
  256    HE2  LYS  31           HE2      LYS  31  12.192   1.811  -6.873
  257    HE3  LYS  31           HE1      LYS  31  13.471   1.681  -5.665
  258    HZ1  LYS  31           HZ1      LYS  31  14.006   0.306  -7.578
  259    HZ2  LYS  31           HZ2      LYS  31  12.540  -0.460  -7.480
  260    HZ3  LYS  31           HZ3      LYS  31  13.663  -0.705  -6.263
  261    H    LEU  32           HN       LEU  32   9.912   4.674  -3.531
  262    HA   LEU  32           HA       LEU  32  11.964   5.181  -1.600
  263    HB2  LEU  32           HB2      LEU  32  12.463   7.211  -2.780
  264    HB3  LEU  32           HB1      LEU  32  12.249   5.920  -3.929
  265    HG   LEU  32           HG       LEU  32   9.839   6.961  -4.211
  266   HD11  LEU  32          HD11      LEU  32   9.973   8.548  -2.397
  267   HD12  LEU  32          HD12      LEU  32   9.796   9.373  -3.947
  268   HD13  LEU  32          HD13      LEU  32  11.371   9.318  -3.149
  269   HD21  LEU  32          HD21      LEU  32  12.341   8.236  -5.259
  270   HD22  LEU  32          HD22      LEU  32  10.735   8.366  -5.995
  271   HD23  LEU  32          HD23      LEU  32  11.562   6.805  -5.918
  272    H    TYR  33           HN       TYR  33   8.683   6.115  -2.143
  273    HA   TYR  33           HA       TYR  33   8.511   8.252  -0.371
  274    HB2  TYR  33           HB2      TYR  33   6.736   7.828  -1.967
  275    HB3  TYR  33           HB1      TYR  33   6.393   6.272  -1.221
  276    HD1  TYR  33           HD2      TYR  33   5.214   6.148   0.898
  277    HD2  TYR  33           HD1      TYR  33   5.988   9.883  -0.935
  278    HE1  TYR  33           HE2      TYR  33   3.609   7.185   2.425
  279    HE2  TYR  33           HE1      TYR  33   4.368  10.964   0.607
  280    HH   TYR  33           HH       TYR  33   3.169   9.325   3.363
  281    H    LEU  34           HN       LEU  34   7.836   4.805   0.206
  282    HA   LEU  34           HA       LEU  34   7.660   5.461   3.050
  283    HB2  LEU  34           HB2      LEU  34   6.791   3.159   3.328
  284    HB3  LEU  34           HB1      LEU  34   5.811   4.222   2.342
  285    HG   LEU  34           HG       LEU  34   6.665   3.029   0.317
  286   HD11  LEU  34          HD11      LEU  34   7.802   1.070   2.315
  287   HD12  LEU  34          HD12      LEU  34   8.736   2.080   1.213
  288   HD13  LEU  34          HD13      LEU  34   7.676   0.822   0.573
  289   HD21  LEU  34          HD21      LEU  34   4.535   2.564   1.284
  290   HD22  LEU  34          HD22      LEU  34   5.275   1.429   2.418
  291   HD23  LEU  34          HD23      LEU  34   5.275   1.074   0.682
  292    H    GLY  35           HN       GLY  35  10.002   4.504   0.993
  293    HA2  GLY  35           HA3      GLY  35  11.120   2.839   3.034
  294    HA3  GLY  35           HA2      GLY  35  11.722   2.887   1.365
  295    H    THR  36           HN       THR  36  12.234   5.459   0.912
  296    HA   THR  36           HA       THR  36  14.515   5.909   2.651
  297    HB   THR  36           HB       THR  36  15.237   7.580   0.985
  298    HG1  THR  36           HG1      THR  36  12.578   7.424   0.169
  299   HG21  THR  36          HG21      THR  36  14.238   5.033  -0.286
  300   HG22  THR  36          HG22      THR  36  15.805   5.248   0.505
  301   HG23  THR  36          HG23      THR  36  15.424   6.116  -0.991
  302    H    ALA  37           HN       ALA  37  11.539   6.572   3.102
  303    HA   ALA  37           HA       ALA  37  10.945   9.241   3.241
  304    HB1  ALA  37           HB1      ALA  37   9.300   7.509   3.541
  305    HB2  ALA  37           HB2      ALA  37   9.266   8.594   4.939
  306    HB3  ALA  37           HB3      ALA  37  10.061   7.019   5.040
  307    H    THR  38           HN       THR  38  11.775  10.869   4.303
  308    HA   THR  38           HA       THR  38  13.677  10.686   6.379
  309    HB   THR  38           HB       THR  38  11.990  13.074   5.629
  310    HG1  THR  38           HG1      THR  38  14.449  12.441   4.371
  311   HG21  THR  38          HG21      THR  38  13.483  13.396   7.557
  312   HG22  THR  38          HG22      THR  38  14.049  14.340   6.178
  313   HG23  THR  38          HG23      THR  38  14.852  12.831   6.602
  314    H    GLU  39           HN       GLU  39  10.303  10.973   6.181
  315    HA   GLU  39           HA       GLU  39   9.660  11.969   8.772
  316    HB2  GLU  39           HB3      GLU  39   8.004  10.427   6.802
  317    HB3  GLU  39           HB2      GLU  39   7.375  11.257   8.225
  318    HG2  GLU  39           HG3      GLU  39   8.095  13.354   7.414
  319    HG3  GLU  39           HG2      GLU  39   8.980  12.564   6.111
  320    H    LEU  40           HN       LEU  40  10.612   8.940   7.725
  321    HA   LEU  40           HA       LEU  40   9.402   7.518   9.981
  322    HB2  LEU  40           HB2      LEU  40  11.359   6.574   7.907
  323    HB3  LEU  40           HB1      LEU  40  10.596   5.572   9.115
  324    HG   LEU  40           HG       LEU  40   9.243   7.001   6.830
  325   HD11  LEU  40          HD11      LEU  40  10.529   5.070   6.112
  326   HD12  LEU  40          HD12      LEU  40   8.808   4.735   5.986
  327   HD13  LEU  40          HD13      LEU  40   9.740   4.070   7.327
  328   HD21  LEU  40          HD21      LEU  40   7.233   5.751   7.450
  329   HD22  LEU  40          HD22      LEU  40   7.716   6.902   8.692
  330   HD23  LEU  40          HD23      LEU  40   8.041   5.175   8.913
  331    H    GLY  41           HN       GLY  41  12.054   9.316   9.333
  332    HA2  GLY  41           HA3      GLY  41  13.498   9.963  11.203
  333    HA3  GLY  41           HA2      GLY  41  13.543   8.258  11.651
  334    H    GLU  42           HN       GLU  42  14.136   6.884   9.751
  335    HA   GLU  42           HA       GLU  42  16.382   7.981   8.192
  336    HB2  GLU  42           HB3      GLU  42  17.189   6.646  10.151
  337    HB3  GLU  42           HB2      GLU  42  16.244   5.281   9.574
  338    HG2  GLU  42           HG3      GLU  42  18.531   4.943   8.993
  339    HG3  GLU  42           HG2      GLU  42  17.617   5.264   7.520
  340    H    GLY  43           HN       GLY  43  14.119   5.322   8.749
  341    HA2  GLY  43           HA3      GLY  43  12.566   5.135   6.767
  342    HA3  GLY  43           HA2      GLY  43  14.070   4.719   5.935
  343    H    LYS  44           HN       LYS  44  11.517   3.371   7.249
  344    HA   LYS  44           HA       LYS  44  12.563   1.241   8.779
  345    HB2  LYS  44           HB2      LYS  44  10.012   1.721   7.361
  346    HB3  LYS  44           HB1      LYS  44  10.452   0.033   7.533
  347    HG2  LYS  44           HG2      LYS  44   9.029   0.648   9.355
  348    HG3  LYS  44           HG1      LYS  44  10.657   0.388   9.972
  349    HD2  LYS  44           HD2      LYS  44  10.995   2.856   9.908
  350    HD3  LYS  44           HD1      LYS  44   9.295   3.024   9.463
  351    HE2  LYS  44           HE2      LYS  44  10.374   1.794  12.014
  352    HE3  LYS  44           HE1      LYS  44   9.581   3.359  11.852
  353    HZ1  LYS  44           HZ1      LYS  44   8.087   1.738  12.718
  354    HZ2  LYS  44           HZ2      LYS  44   8.292   0.707  11.411
  355    HZ3  LYS  44           HZ3      LYS  44   7.547   2.210  11.204
  356    H    ILE  45           HN       ILE  45  12.372   1.833   5.403
  357    HA   ILE  45           HA       ILE  45  13.386  -0.813   4.741
  358    HB   ILE  45           HB       ILE  45  12.610   1.484   2.928
  359   HG12  ILE  45          HG12      ILE  45  10.648   0.677   4.197
  360   HG13  ILE  45          HG11      ILE  45  10.516   0.309   2.482
  361   HG21  ILE  45          HG21      ILE  45  14.157  -0.046   1.891
  362   HG22  ILE  45          HG22      ILE  45  12.552  -0.211   1.166
  363   HG23  ILE  45          HG23      ILE  45  13.132  -1.412   2.322
  364   HD11  ILE  45          HD11      ILE  45   9.740  -1.546   3.826
  365   HD12  ILE  45          HD12      ILE  45  11.290  -1.608   4.668
  366   HD13  ILE  45          HD13      ILE  45  11.206  -1.973   2.940
  367    HA   PRO  46           HA       PRO  46  17.423   1.165   4.660
  368    HB2  PRO  46           HB2      PRO  46  18.817  -0.927   3.645
  369    HB3  PRO  46           HB1      PRO  46  18.307  -0.853   5.335
  370    HG2  PRO  46           HG2      PRO  46  17.006  -2.246   3.033
  371    HG3  PRO  46           HG1      PRO  46  17.328  -2.866   4.674
  372    HD2  PRO  46           HD2      PRO  46  14.918  -1.971   3.902
  373    HD3  PRO  46           HD1      PRO  46  15.506  -1.723   5.558
  374    H    TRP  47           HN       TRP  47  19.068   1.550   3.065
  375    HA   TRP  47           HA       TRP  47  18.384   3.009   0.977
  376    HB2  TRP  47           HB2      TRP  47  20.679   2.798   0.139
  377    HB3  TRP  47           HB1      TRP  47  20.602   3.016   1.883
  378    HD1  TRP  47           HD1      TRP  47  21.788   0.626  -0.798
  379    HE1  TRP  47           HE1      TRP  47  23.090  -1.315   0.278
  380    HE3  TRP  47           HE3      TRP  47  20.728   1.531   4.126
  381    HZ2  TRP  47           HZ2      TRP  47  23.607  -2.326   2.846
  382    HZ3  TRP  47           HZ3      TRP  47  21.672   0.025   5.827
  383    HH2  TRP  47           HH2      TRP  47  23.080  -1.864   5.197
  384    H    GLY  48           HN       GLY  48  18.894  -0.514   0.582
  385    HA2  GLY  48           HA3      GLY  48  17.587  -0.249  -2.000
  386    HA3  GLY  48           HA2      GLY  48  19.257  -0.772  -2.056
  387    H    SER  49           HN       SER  49  16.682  -1.720   0.265
  388    HA   SER  49           HA       SER  49  17.318  -4.461  -0.339
  389    HB2  SER  49           HB2      SER  49  15.457  -4.916   1.309
  390    HB3  SER  49           HB1      SER  49  16.785  -3.947   1.948
  391    HG   SER  49           HG       SER  49  14.362  -3.321   2.115
  392    H    MET  50           HN       MET  50  15.159  -2.087  -1.351
  393    HA   MET  50           HA       MET  50  13.480  -4.011  -2.766
  394    HB2  MET  50           HB2      MET  50  11.972  -1.913  -3.022
  395    HB3  MET  50           HB1      MET  50  11.992  -2.791  -1.508
  396    HG2  MET  50           HG2      MET  50  11.970  -0.372  -1.174
  397    HG3  MET  50           HG1      MET  50  13.401  -1.123  -0.508
  398    HE1  MET  50           HE1      MET  50  14.491   1.326  -0.276
  399    HE2  MET  50           HE2      MET  50  13.028   2.019  -0.980
  400    HE3  MET  50           HE3      MET  50  14.609   2.460  -1.622
  401    H    GLU  51           HN       GLU  51  16.099  -3.112  -3.562
  402    HA   GLU  51           HA       GLU  51  16.149  -1.139  -5.524
  403    HB2  GLU  51           HB3      GLU  51  17.941  -2.966  -4.432
  404    HB3  GLU  51           HB2      GLU  51  17.855  -3.422  -6.123
  405    HG2  GLU  51           HG3      GLU  51  18.592  -0.720  -5.027
  406    HG3  GLU  51           HG2      GLU  51  19.674  -1.898  -5.766
  407    H    LYS  52           HN       LYS  52  15.746  -4.667  -5.928
  408    HA   LYS  52           HA       LYS  52  14.564  -4.182  -8.594
  409    HB2  LYS  52           HB2      LYS  52  16.001  -6.640  -7.585
  410    HB3  LYS  52           HB1      LYS  52  15.318  -6.431  -9.185
  411    HG2  LYS  52           HG2      LYS  52  17.643  -4.919  -8.012
  412    HG3  LYS  52           HG1      LYS  52  17.724  -6.190  -9.226
  413    HD2  LYS  52           HD2      LYS  52  16.309  -4.706 -10.696
  414    HD3  LYS  52           HD1      LYS  52  16.553  -3.428  -9.503
  415    HE2  LYS  52           HE2      LYS  52  18.673  -4.860 -11.088
  416    HE3  LYS  52           HE1      LYS  52  18.175  -3.183 -11.265
  417    HZ1  LYS  52           HZ1      LYS  52  19.488  -4.337  -8.859
  418    HZ2  LYS  52           HZ2      LYS  52  19.033  -2.727  -9.036
  419    HZ3  LYS  52           HZ3      LYS  52  20.232  -3.375 -10.017
  420    H    ALA  53           HN       ALA  53  13.345  -4.352  -5.844
  421    HA   ALA  53           HA       ALA  53  12.004  -6.890  -5.731
  422    HB1  ALA  53           HB1      ALA  53  11.498  -4.388  -4.129
  423    HB2  ALA  53           HB2      ALA  53  12.567  -5.714  -3.673
  424    HB3  ALA  53           HB3      ALA  53  10.829  -5.982  -3.795
  425    H    GLY  54           HN       GLY  54  10.001  -7.439  -6.373
  426    HA2  GLY  54           HA3      GLY  54   8.443  -5.406  -7.754
  427    HA3  GLY  54           HA2      GLY  54   8.380  -7.148  -8.042
  428    HA   PRO  55           HA       PRO  55   4.733  -5.591  -5.538
  429    HB2  PRO  55           HB2      PRO  55   3.592  -7.949  -6.939
  430    HB3  PRO  55           HB1      PRO  55   2.910  -6.334  -6.704
  431    HG2  PRO  55           HG2      PRO  55   3.898  -7.024  -9.062
  432    HG3  PRO  55           HG1      PRO  55   4.179  -5.401  -8.405
  433    HD2  PRO  55           HD2      PRO  55   6.096  -7.733  -8.512
  434    HD3  PRO  55           HD1      PRO  55   6.377  -6.004  -8.768
  435    H    LEU  56           HN       LEU  56   5.751  -8.965  -5.982
  436    HA   LEU  56           HA       LEU  56   4.385  -9.844  -3.584
  437    HB2  LEU  56           HB2      LEU  56   6.452 -11.266  -5.284
  438    HB3  LEU  56           HB1      LEU  56   5.656 -11.985  -3.910
  439    HG   LEU  56           HG       LEU  56   4.632 -12.871  -5.835
  440   HD11  LEU  56          HD11      LEU  56   3.077 -12.395  -4.089
  441   HD12  LEU  56          HD12      LEU  56   2.312 -12.193  -5.665
  442   HD13  LEU  56          HD13      LEU  56   2.799 -10.776  -4.734
  443   HD21  LEU  56          HD21      LEU  56   5.336 -11.246  -7.497
  444   HD22  LEU  56          HD22      LEU  56   4.214 -10.057  -6.841
  445   HD23  LEU  56          HD23      LEU  56   3.596 -11.520  -7.613
  446    H    GLU  57           HN       GLU  57   7.659  -9.108  -4.470
  447    HA   GLU  57           HA       GLU  57   8.828  -9.742  -1.972
  448    HB2  GLU  57           HB3      GLU  57   9.707  -7.857  -4.151
  449    HB3  GLU  57           HB2      GLU  57  10.715  -8.371  -2.800
  450    HG2  GLU  57           HG3      GLU  57  10.853 -10.546  -3.571
  451    HG3  GLU  57           HG2      GLU  57   9.453 -10.371  -4.628
  452    H    MET  58           HN       MET  58   7.588  -6.765  -3.373
  453    HA   MET  58           HA       MET  58   8.181  -4.992  -1.269
  454    HB2  MET  58           HB2      MET  58   5.966  -4.969  -3.300
  455    HB3  MET  58           HB1      MET  58   6.257  -3.633  -2.199
  456    HG2  MET  58           HG2      MET  58   8.352  -4.729  -3.996
  457    HG3  MET  58           HG1      MET  58   7.260  -3.475  -4.592
  458    HE1  MET  58           HE1      MET  58  10.153  -2.998  -4.982
  459    HE2  MET  58           HE2      MET  58  10.425  -1.414  -4.254
  460    HE3  MET  58           HE3      MET  58   8.949  -1.724  -5.165
  461    H    ALA  59           HN       ALA  59   5.331  -6.993  -1.876
  462    HA   ALA  59           HA       ALA  59   3.809  -6.054   0.263
  463    HB1  ALA  59           HB1      ALA  59   3.800  -8.823  -0.945
  464    HB2  ALA  59           HB2      ALA  59   2.888  -7.440  -1.547
  465    HB3  ALA  59           HB3      ALA  59   2.518  -8.122   0.038
  466    H    GLN  60           HN       GLN  60   6.176  -8.661   0.093
  467    HA   GLN  60           HA       GLN  60   5.807  -9.394   2.831
  468    HB2  GLN  60           HB2      GLN  60   8.082 -10.093   0.975
  469    HB3  GLN  60           HB1      GLN  60   7.707 -10.870   2.508
  470    HG2  GLN  60           HG2      GLN  60   5.516 -11.568   1.555
  471    HG3  GLN  60           HG1      GLN  60   6.025 -10.868   0.033
  472   HE21  GLN  60          HE21      GLN  60   5.396 -13.625   0.738
  473   HE22  GLN  60          HE22      GLN  60   6.763 -14.551   0.264
  474    H    LEU  61           HN       LEU  61   7.777  -7.184   1.110
  475    HA   LEU  61           HA       LEU  61   9.816  -6.632   2.978
  476    HB2  LEU  61           HB2      LEU  61   9.637  -5.931   0.549
  477    HB3  LEU  61           HB1      LEU  61   8.463  -4.747   1.064
  478    HG   LEU  61           HG       LEU  61  10.293  -3.808   2.550
  479   HD11  LEU  61          HD11      LEU  61  12.577  -4.241   1.795
  480   HD12  LEU  61          HD12      LEU  61  11.951  -5.446   0.667
  481   HD13  LEU  61          HD13      LEU  61  11.813  -5.717   2.407
  482   HD21  LEU  61          HD21      LEU  61  10.500  -3.686  -0.448
  483   HD22  LEU  61          HD22      LEU  61  11.228  -2.529   0.667
  484   HD23  LEU  61          HD23      LEU  61   9.472  -2.681   0.577
  485    H    LEU  62           HN       LEU  62   6.849  -4.856   2.169
  486    HA   LEU  62           HA       LEU  62   6.861  -3.024   4.209
  487    HB2  LEU  62           HB2      LEU  62   4.641  -4.199   2.565
  488    HB3  LEU  62           HB1      LEU  62   4.306  -3.056   3.826
  489    HG   LEU  62           HG       LEU  62   5.281  -1.224   2.565
  490   HD11  LEU  62          HD11      LEU  62   6.407  -3.242   0.697
  491   HD12  LEU  62          HD12      LEU  62   7.308  -2.340   1.918
  492   HD13  LEU  62          HD13      LEU  62   6.533  -1.478   0.579
  493   HD21  LEU  62          HD21      LEU  62   3.127  -1.981   1.800
  494   HD22  LEU  62          HD22      LEU  62   3.917  -3.108   0.696
  495   HD23  LEU  62          HD23      LEU  62   4.116  -1.372   0.468
  496    H    ILE  63           HN       ILE  63   5.355  -6.223   4.036
  497    HA   ILE  63           HA       ILE  63   3.973  -6.088   6.481
  498    HB   ILE  63           HB       ILE  63   3.853  -7.777   4.398
  499   HG12  ILE  63          HG12      ILE  63   2.212  -7.520   6.219
  500   HG13  ILE  63          HG11      ILE  63   2.307  -9.155   5.605
  501   HG21  ILE  63          HG21      ILE  63   5.374  -9.426   6.400
  502   HG22  ILE  63          HG22      ILE  63   5.975  -8.887   4.836
  503   HG23  ILE  63          HG23      ILE  63   4.631 -10.026   4.914
  504   HD11  ILE  63          HD11      ILE  63   3.460  -8.107   8.184
  505   HD12  ILE  63          HD12      ILE  63   3.706  -9.745   7.578
  506   HD13  ILE  63          HD13      ILE  63   2.085  -9.200   8.008
  507    H    THR  64           HN       THR  64   7.284  -6.941   5.782
  508    HA   THR  64           HA       THR  64   7.717  -8.117   8.364
  509    HB   THR  64           HB       THR  64   9.718  -7.349   6.217
  510    HG1  THR  64           HG1      THR  64   8.561  -8.945   5.359
  511   HG21  THR  64          HG21      THR  64  10.025  -9.190   8.611
  512   HG22  THR  64          HG22      THR  64  10.775  -7.601   8.442
  513   HG23  THR  64          HG23      THR  64  11.235  -8.916   7.357
  514    H    HIS  65           HN       HIS  65   8.173  -4.976   6.919
  515    HA   HIS  65           HA       HIS  65   9.667  -4.128   9.275
  516    HB2  HIS  65           HB2      HIS  65   9.132  -2.633   6.701
  517    HB3  HIS  65           HB1      HIS  65  10.039  -1.990   8.066
  518    HD1  HIS  65           HD1      HIS  65  12.438  -3.039   8.483
  519    HD2  HIS  65           HD2      HIS  65  10.479  -4.407   5.094
  520    HE1  HIS  65           HE1      HIS  65  14.173  -4.218   7.121
  521    H    PHE  66           HN       PHE  66   6.819  -3.006   7.473
  522    HA   PHE  66           HA       PHE  66   6.076  -1.230   9.554
  523    HB2  PHE  66           HB2      PHE  66   4.607  -2.147   7.089
  524    HB3  PHE  66           HB1      PHE  66   4.074  -0.834   8.151
  525    HD1  PHE  66           HD1      PHE  66   5.390   1.163   8.352
  526    HD2  PHE  66           HD2      PHE  66   6.360  -1.867   5.599
  527    HE1  PHE  66           HE1      PHE  66   6.945   2.726   7.190
  528    HE2  PHE  66           HE2      PHE  66   7.890  -0.358   4.402
  529    HZ   PHE  66           HZ       PHE  66   8.192   1.934   5.214
  530    H    GLY  67           HN       GLY  67   4.601  -4.204   8.305
  531    HA2  GLY  67           HA3      GLY  67   4.036  -5.748  10.261
  532    HA3  GLY  67           HA2      GLY  67   3.036  -4.404  10.799
  533    HA   PRO  68           HA       PRO  68   0.891  -7.370   7.743
  534    HB2  PRO  68           HB2      PRO  68  -1.253  -7.923   9.385
  535    HB3  PRO  68           HB1      PRO  68   0.190  -8.928   9.252
  536    HG2  PRO  68           HG2      PRO  68  -0.510  -6.877  11.309
  537    HG3  PRO  68           HG1      PRO  68   0.265  -8.451  11.527
  538    HD2  PRO  68           HD2      PRO  68   1.672  -6.160  11.560
  539    HD3  PRO  68           HD1      PRO  68   2.365  -7.631  10.875
  540    H    GLU  69           HN       GLU  69  -0.607  -5.018   9.910
  541    HA   GLU  69           HA       GLU  69  -2.567  -4.437   7.821
  542    HB2  GLU  69           HB3      GLU  69  -2.436  -3.434  10.667
  543    HB3  GLU  69           HB2      GLU  69  -3.774  -3.220   9.547
  544    HG2  GLU  69           HG3      GLU  69  -4.034  -5.688   9.474
  545    HG3  GLU  69           HG2      GLU  69  -2.796  -5.809  10.719
  546    H    GLU  70           HN       GLU  70   0.230  -3.220   9.356
  547    HA   GLU  70           HA       GLU  70  -0.166  -0.477   8.621
  548    HB2  GLU  70           HB3      GLU  70   1.246  -1.414  10.552
  549    HB3  GLU  70           HB2      GLU  70   2.475  -1.707   9.328
  550    HG2  GLU  70           HG3      GLU  70   2.839   0.421  10.441
  551    HG3  GLU  70           HG2      GLU  70   2.467   0.655   8.731
  552    H    ALA  71           HN       ALA  71   1.494  -3.226   7.237
  553    HA   ALA  71           HA       ALA  71   2.908  -2.048   5.128
  554    HB1  ALA  71           HB1      ALA  71   3.043  -4.415   5.689
  555    HB2  ALA  71           HB2      ALA  71   2.571  -4.229   3.996
  556    HB3  ALA  71           HB3      ALA  71   1.372  -4.650   5.214
  557    H    TRP  72           HN       TRP  72  -0.442  -3.075   5.321
  558    HA   TRP  72           HA       TRP  72  -1.037  -2.412   2.662
  559    HB2  TRP  72           HB2      TRP  72  -2.409  -4.073   3.685
  560    HB3  TRP  72           HB1      TRP  72  -2.811  -3.004   5.025
  561    HD1  TRP  72           HD1      TRP  72  -5.280  -2.456   4.829
  562    HE1  TRP  72           HE1      TRP  72  -6.855  -1.669   2.959
  563    HE3  TRP  72           HE3      TRP  72  -2.056  -2.686   0.875
  564    HZ2  TRP  72           HZ2      TRP  72  -6.744  -1.177   0.222
  565    HZ3  TRP  72           HZ3      TRP  72  -2.884  -2.033  -1.363
  566    HH2  TRP  72           HH2      TRP  72  -5.180  -1.298  -1.676
  567    H    ARG  73           HN       ARG  73  -1.571  -0.669   5.712
  568    HA   ARG  73           HA       ARG  73  -2.926   1.443   4.471
  569    HB2  ARG  73           HB2      ARG  73  -2.998   1.151   6.911
  570    HB3  ARG  73           HB1      ARG  73  -1.293   1.580   7.017
  571    HG2  ARG  73           HG2      ARG  73  -1.792   3.803   6.110
  572    HG3  ARG  73           HG1      ARG  73  -3.493   3.377   6.017
  573    HD2  ARG  73           HD2      ARG  73  -3.070   4.728   7.969
  574    HD3  ARG  73           HD1      ARG  73  -3.536   3.102   8.453
  575    HE   ARG  73           HE       ARG  73  -1.095   2.696   8.810
  576   HH11  ARG  73          HH11      ARG  73  -2.128   6.077   8.751
  577   HH12  ARG  73          HH12      ARG  73  -1.143   6.523  10.074
  578   HH21  ARG  73          HH21      ARG  73   0.258   3.313  10.565
  579   HH22  ARG  73          HH22      ARG  73   0.264   4.923  11.121
  580    H    LEU  74           HN       LEU  74   0.467   0.920   5.194
  581    HA   LEU  74           HA       LEU  74   1.514   3.315   4.291
  582    HB2  LEU  74           HB2      LEU  74   2.515   0.601   4.744
  583    HB3  LEU  74           HB1      LEU  74   3.408   1.493   3.538
  584    HG   LEU  74           HG       LEU  74   4.353   1.600   5.856
  585   HD11  LEU  74          HD11      LEU  74   3.558   4.218   4.589
  586   HD12  LEU  74          HD12      LEU  74   4.960   3.212   4.191
  587   HD13  LEU  74          HD13      LEU  74   4.860   3.978   5.762
  588   HD21  LEU  74          HD21      LEU  74   2.207   1.775   7.068
  589   HD22  LEU  74          HD22      LEU  74   1.982   3.393   6.401
  590   HD23  LEU  74          HD23      LEU  74   3.332   3.066   7.488
  591    H    ALA  75           HN       ALA  75   0.798   0.373   2.442
  592    HA   ALA  75           HA       ALA  75   1.787   1.322  -0.020
  593    HB1  ALA  75           HB1      ALA  75   0.421  -0.393  -1.045
  594    HB2  ALA  75           HB2      ALA  75  -0.409  -0.663   0.492
  595    HB3  ALA  75           HB3      ALA  75   1.318  -1.005   0.336
  596    H    LEU  76           HN       LEU  76  -1.559   1.303   1.251
  597    HA   LEU  76           HA       LEU  76  -2.560   2.579  -1.048
  598    HB2  LEU  76           HB2      LEU  76  -4.688   2.792   0.084
  599    HB3  LEU  76           HB1      LEU  76  -4.002   1.225   0.415
  600    HG   LEU  76           HG       LEU  76  -3.228   2.372   2.650
  601   HD11  LEU  76          HD11      LEU  76  -5.587   4.061   1.895
  602   HD12  LEU  76          HD12      LEU  76  -3.929   4.624   2.105
  603   HD13  LEU  76          HD13      LEU  76  -4.836   4.010   3.493
  604   HD21  LEU  76          HD21      LEU  76  -6.071   1.539   2.134
  605   HD22  LEU  76          HD22      LEU  76  -5.299   1.657   3.718
  606   HD23  LEU  76          HD23      LEU  76  -4.711   0.489   2.537
  607    H    SER  77           HN       SER  77  -1.374   3.898   1.979
  608    HA   SER  77           HA       SER  77  -2.241   6.530   1.347
  609    HB2  SER  77           HB2      SER  77  -1.880   5.585   3.666
  610    HB3  SER  77           HB1      SER  77  -0.150   5.729   3.379
  611    HG   SER  77           HG       SER  77  -1.820   7.914   2.920
  612    H    THR  78           HN       THR  78   0.416   4.594   0.416
  613    HA   THR  78           HA       THR  78   2.051   6.825  -0.317
  614    HB   THR  78           HB       THR  78   2.243   3.886  -1.064
  615    HG1  THR  78           HG1      THR  78   2.673   4.207   1.103
  616   HG21  THR  78          HG21      THR  78   4.537   4.438  -1.727
  617   HG22  THR  78          HG22      THR  78   4.169   6.155  -1.472
  618   HG23  THR  78          HG23      THR  78   3.335   5.249  -2.735
  619    H    PHE  79           HN       PHE  79  -0.239   4.597  -1.771
  620    HA   PHE  79           HA       PHE  79   0.023   5.093  -4.442
  621    HB2  PHE  79           HB2      PHE  79  -2.548   4.649  -2.911
  622    HB3  PHE  79           HB1      PHE  79  -2.449   4.616  -4.662
  623    HD1  PHE  79           HD2      PHE  79   0.464   3.118  -4.158
  624    HD2  PHE  79           HD1      PHE  79  -3.621   2.451  -3.147
  625    HE1  PHE  79           HE2      PHE  79   0.896   0.721  -3.972
  626    HE2  PHE  79           HE1      PHE  79  -3.188   0.045  -2.974
  627    HZ   PHE  79           HZ       PHE  79  -0.926  -0.827  -3.391
  628    H    GLU  80           HN       GLU  80  -2.108   6.777  -2.158
  629    HA   GLU  80           HA       GLU  80  -3.254   8.628  -3.891
  630    HB2  GLU  80           HB3      GLU  80  -3.804   9.939  -1.867
  631    HB3  GLU  80           HB2      GLU  80  -4.195   8.230  -1.713
  632    HG2  GLU  80           HG3      GLU  80  -2.233   7.842  -0.428
  633    HG3  GLU  80           HG2      GLU  80  -1.703   9.503  -0.667
  634    H    ARG  81           HN       ARG  81  -0.088   8.761  -2.375
  635    HA   ARG  81           HA       ARG  81   0.101  11.569  -3.124
  636    HB2  ARG  81           HB2      ARG  81   1.949   9.952  -1.386
  637    HB3  ARG  81           HB1      ARG  81   2.177  11.649  -1.790
  638    HG2  ARG  81           HG2      ARG  81  -0.031  12.135  -0.747
  639    HG3  ARG  81           HG1      ARG  81  -0.097  10.445  -0.251
  640    HD2  ARG  81           HD2      ARG  81   0.686  11.718   1.584
  641    HD3  ARG  81           HD1      ARG  81   2.016  10.752   0.936
  642    HE   ARG  81           HE       ARG  81   1.982  13.341  -0.188
  643   HH11  ARG  81          HH11      ARG  81   2.999  11.543   2.683
  644   HH12  ARG  81          HH12      ARG  81   4.019  12.783   3.276
  645   HH21  ARG  81          HH21      ARG  81   3.458  15.024   0.618
  646   HH22  ARG  81          HH22      ARG  81   4.307  14.756   2.066
  647    H    ILE  82           HN       ILE  82   1.067   8.539  -4.291
  648    HA   ILE  82           HA       ILE  82   3.226   9.761  -5.839
  649    HB   ILE  82           HB       ILE  82   3.745   7.511  -6.704
  650   HG12  ILE  82          HG12      ILE  82   1.583   6.481  -4.857
  651   HG13  ILE  82          HG11      ILE  82   1.400   6.616  -6.607
  652   HG21  ILE  82          HG21      ILE  82   4.836   8.242  -4.677
  653   HG22  ILE  82          HG22      ILE  82   4.541   6.502  -4.635
  654   HG23  ILE  82          HG23      ILE  82   3.511   7.592  -3.707
  655   HD11  ILE  82          HD11      ILE  82   3.373   4.891  -5.131
  656   HD12  ILE  82          HD12      ILE  82   3.223   5.006  -6.884
  657   HD13  ILE  82          HD13      ILE  82   1.900   4.337  -5.928
  658    H    ASN  83           HN       ASN  83   0.309  10.230  -6.117
  659    HA   ASN  83           HA       ASN  83  -1.101  10.900  -7.717
  660    HB2  ASN  83           HB3      ASN  83   0.938  11.618  -8.993
  661    HB3  ASN  83           HB2      ASN  83   0.991  10.032  -9.742
  662   HD21  ASN  83          HD21      ASN  83  -1.989  11.864  -9.184
  663   HD22  ASN  83          HD22      ASN  83  -2.308  12.142 -10.852
  664    H    ARG  84           HN       ARG  84  -0.853   8.168  -6.715
  665    HA   ARG  84           HA       ARG  84  -2.354   6.768  -8.791
  666    HB2  ARG  84           HB2      ARG  84  -0.199   5.764  -8.290
  667    HB3  ARG  84           HB1      ARG  84  -0.567   5.733  -6.584
  668    HG2  ARG  84           HG2      ARG  84  -0.718   3.533  -7.810
  669    HG3  ARG  84           HG1      ARG  84  -2.115   3.970  -6.825
  670    HD2  ARG  84           HD2      ARG  84  -2.763   3.041  -8.969
  671    HD3  ARG  84           HD1      ARG  84  -3.283   4.718  -8.758
  672    HE   ARG  84           HE       ARG  84  -0.807   4.695 -10.087
  673   HH11  ARG  84          HH11      ARG  84  -4.146   3.531 -10.894
  674   HH12  ARG  84          HH12      ARG  84  -3.972   3.955 -12.520
  675   HH21  ARG  84          HH21      ARG  84  -0.701   5.249 -12.279
  676   HH22  ARG  84          HH22      ARG  84  -2.017   4.945 -13.334
  677    H    LYS  85           HN       LYS  85  -3.798   8.488  -7.542
  678    HA   LYS  85           HA       LYS  85  -4.882   7.712  -5.019
  679    HB2  LYS  85           HB2      LYS  85  -4.809  10.045  -5.877
  680    HB3  LYS  85           HB1      LYS  85  -5.980   9.609  -7.118
  681    HG2  LYS  85           HG2      LYS  85  -7.595   9.077  -5.326
  682    HG3  LYS  85           HG1      LYS  85  -6.400   9.606  -4.142
  683    HD2  LYS  85           HD2      LYS  85  -7.627  11.307  -6.305
  684    HD3  LYS  85           HD1      LYS  85  -8.050  11.346  -4.595
  685    HE2  LYS  85           HE2      LYS  85  -5.733  12.047  -4.066
  686    HE3  LYS  85           HE1      LYS  85  -5.371  12.065  -5.790
  687    HZ1  LYS  85           HZ1      LYS  85  -5.898  14.285  -4.985
  688    HZ2  LYS  85           HZ2      LYS  85  -7.393  13.765  -4.437
  689    HZ3  LYS  85           HZ3      LYS  85  -7.067  13.770  -6.085
  690    H    ASP  86           HN       ASP  86  -5.299   7.013  -8.270
  691    HA   ASP  86           HA       ASP  86  -7.805   6.090  -8.617
  692    HB2  ASP  86           HB2      ASP  86  -6.335   6.254 -10.455
  693    HB3  ASP  86           HB1      ASP  86  -5.175   5.157  -9.728
  694    H    LEU  87           HN       LEU  87  -5.008   4.238  -7.410
  695    HA   LEU  87           HA       LEU  87  -6.687   1.928  -6.827
  696    HB2  LEU  87           HB2      LEU  87  -3.743   2.397  -6.339
  697    HB3  LEU  87           HB1      LEU  87  -4.580   0.941  -5.858
  698    HG   LEU  87           HG       LEU  87  -4.230   1.884  -8.703
  699   HD11  LEU  87          HD11      LEU  87  -2.681   0.006  -8.885
  700   HD12  LEU  87          HD12      LEU  87  -2.910  -0.352  -7.169
  701   HD13  LEU  87          HD13      LEU  87  -2.143   1.158  -7.664
  702   HD21  LEU  87          HD21      LEU  87  -5.423  -0.628  -7.555
  703   HD22  LEU  87          HD22      LEU  87  -4.972  -0.401  -9.237
  704   HD23  LEU  87          HD23      LEU  87  -6.219   0.616  -8.529
  705    H    TRP  88           HN       TRP  88  -5.549   4.695  -5.252
  706    HA   TRP  88           HA       TRP  88  -5.584   3.796  -2.585
  707    HB2  TRP  88           HB2      TRP  88  -4.503   5.845  -3.207
  708    HB3  TRP  88           HB1      TRP  88  -5.988   6.521  -3.800
  709    HD1  TRP  88           HD1      TRP  88  -4.643   5.261  -0.387
  710    HE1  TRP  88           HE1      TRP  88  -5.578   6.772   1.470
  711    HE3  TRP  88           HE3      TRP  88  -7.626   8.251  -3.220
  712    HZ2  TRP  88           HZ2      TRP  88  -7.361   8.947   1.700
  713    HZ3  TRP  88           HZ3      TRP  88  -8.915  10.023  -2.118
  714    HH2  TRP  88           HH2      TRP  88  -8.789  10.366   0.291
  715    H    GLU  89           HN       GLU  89  -8.051   5.400  -4.551
  716    HA   GLU  89           HA       GLU  89 -10.099   5.203  -2.622
  717    HB2  GLU  89           HB3      GLU  89 -10.147   5.615  -5.593
  718    HB3  GLU  89           HB2      GLU  89 -11.630   5.520  -4.647
  719    HG2  GLU  89           HG3      GLU  89  -9.409   7.445  -4.045
  720    HG3  GLU  89           HG2      GLU  89 -10.764   7.833  -5.099
  721    H    ARG  90           HN       ARG  90  -8.778   2.908  -4.714
  722    HA   ARG  90           HA       ARG  90 -11.015   1.106  -4.529
  723    HB2  ARG  90           HB2      ARG  90  -8.211   0.711  -5.599
  724    HB3  ARG  90           HB1      ARG  90  -9.457  -0.529  -5.612
  725    HG2  ARG  90           HG2      ARG  90 -10.844   0.850  -7.069
  726    HG3  ARG  90           HG1      ARG  90  -9.637   2.126  -7.026
  727    HD2  ARG  90           HD2      ARG  90  -9.535   0.765  -9.088
  728    HD3  ARG  90           HD1      ARG  90  -8.047   0.743  -8.146
  729    HE   ARG  90           HE       ARG  90  -9.707  -1.446  -7.451
  730   HH11  ARG  90          HH11      ARG  90  -7.568  -0.500 -10.180
  731   HH12  ARG  90          HH12      ARG  90  -7.085  -2.108 -10.465
  732   HH21  ARG  90          HH21      ARG  90  -9.032  -3.587  -7.945
  733   HH22  ARG  90          HH22      ARG  90  -7.913  -3.853  -9.225
  734    H    GLY  91           HN       GLY  91  -8.106   1.828  -2.803
  735    HA2  GLY  91           HA3      GLY  91  -8.094  -0.630  -1.270
  736    HA3  GLY  91           HA2      GLY  91  -6.987   0.730  -1.094
  737    H    GLN  92           HN       GLN  92  -9.189   2.638  -0.920
  738    HA   GLN  92           HA       GLN  92  -9.579   2.610   1.853
  739    HB2  GLN  92           HB2      GLN  92 -10.881   4.261  -0.302
  740    HB3  GLN  92           HB1      GLN  92 -11.271   4.454   1.398
  741    HG2  GLN  92           HG2      GLN  92  -8.520   4.762   0.216
  742    HG3  GLN  92           HG1      GLN  92  -9.611   6.095   0.578
  743   HE21  GLN  92          HE21      GLN  92  -8.262   7.024   2.053
  744   HE22  GLN  92          HE22      GLN  92  -7.911   6.349   3.604
  745    H    ARG  93           HN       ARG  93 -11.689   2.657   2.974
  746    HA   ARG  93           HA       ARG  93 -13.418   0.644   1.838
  747    HB2  ARG  93           HB2      ARG  93 -13.202  -0.857   3.713
  748    HB3  ARG  93           HB1      ARG  93 -11.643  -0.609   2.960
  749    HG2  ARG  93           HG2      ARG  93 -12.547   0.730   5.514
  750    HG3  ARG  93           HG1      ARG  93 -11.564  -0.727   5.453
  751    HD2  ARG  93           HD2      ARG  93  -9.786   0.574   4.312
  752    HD3  ARG  93           HD1      ARG  93 -10.805   2.009   4.402
  753    HE   ARG  93           HE       ARG  93 -10.346   0.737   6.915
  754   HH11  ARG  93          HH11      ARG  93  -9.030   3.179   4.657
  755   HH12  ARG  93          HH12      ARG  93  -8.214   4.030   5.851
  756   HH21  ARG  93          HH21      ARG  93  -9.149   1.886   8.528
  757   HH22  ARG  93          HH22      ARG  93  -8.255   3.273   8.137
  758    H    GLU  94           HN       GLU  94 -15.429   0.711   2.500
  759    HA   GLU  94           HA       GLU  94 -16.205   2.410   4.753
  760    HB2  GLU  94           HB3      GLU  94 -17.523   2.222   2.019
  761    HB3  GLU  94           HB2      GLU  94 -18.200   3.064   3.403
  762    HG2  GLU  94           HG3      GLU  94 -16.339   4.614   3.397
  763    HG3  GLU  94           HG2      GLU  94 -15.607   3.754   2.046
  764    H    ASP  95           HN       ASP  95 -18.611   1.739   5.273
  765    HA   ASP  95           HA       ASP  95 -18.734  -1.140   5.382
  766    HB2  ASP  95           HB2      ASP  95 -20.796   0.955   6.153
  767    HB3  ASP  95           HB1      ASP  95 -21.027  -0.772   6.370
  768    H    LEU  96           HN       LEU  96 -19.706  -2.428   3.964
  769    HA   LEU  96           HA       LEU  96 -20.648  -3.171   2.115
  770    HB2  LEU  96           HB2      LEU  96 -22.648  -1.966   2.871
  771    HB3  LEU  96           HB1      LEU  96 -22.106  -0.521   2.045
  772    HG   LEU  96           HG       LEU  96 -22.303  -1.760  -0.130
  773   HD11  LEU  96          HD11      LEU  96 -22.097  -4.028   0.728
  774   HD12  LEU  96          HD12      LEU  96 -23.580  -3.830  -0.193
  775   HD13  LEU  96          HD13      LEU  96 -23.638  -3.862   1.570
  776   HD21  LEU  96          HD21      LEU  96 -24.752  -1.656  -0.222
  777   HD22  LEU  96          HD22      LEU  96 -24.076  -0.262   0.618
  778   HD23  LEU  96          HD23      LEU  96 -24.814  -1.574   1.536
  779    H    VAL  97           HN       VAL  97 -20.583  -2.855  -0.290
  780    HA   VAL  97           HA       VAL  97 -18.094  -1.786  -0.946
  781    HB   VAL  97           HB       VAL  97 -18.778  -2.246  -3.332
  782   HG11  VAL  97          HG11      VAL  97 -18.569  -4.692  -3.014
  783   HG12  VAL  97          HG12      VAL  97 -18.909  -4.467  -1.288
  784   HG13  VAL  97          HG13      VAL  97 -17.457  -3.766  -2.002
  785   HG21  VAL  97          HG21      VAL  97 -21.195  -2.093  -3.060
  786   HG22  VAL  97          HG22      VAL  97 -21.179  -3.484  -1.971
  787   HG23  VAL  97          HG23      VAL  97 -20.745  -3.687  -3.672
  788    H    ARG  98           HN       ARG  98 -17.460  -0.025  -1.748
  789    HA   ARG  98           HA       ARG  98 -19.292   2.202  -1.650
  790    HB2  ARG  98           HB2      ARG  98 -17.328   3.584  -1.699
  791    HB3  ARG  98           HB1      ARG  98 -17.085   2.283  -0.552
  792    HG2  ARG  98           HG2      ARG  98 -15.821   1.100  -2.443
  793    HG3  ARG  98           HG1      ARG  98 -15.827   2.673  -3.244
  794    HD2  ARG  98           HD2      ARG  98 -14.620   1.886  -0.634
  795    HD3  ARG  98           HD1      ARG  98 -13.790   2.542  -2.048
  796    HE   ARG  98           HE       ARG  98 -15.726   4.115  -0.452
  797   HH11  ARG  98          HH11      ARG  98 -12.563   4.049  -2.100
  798   HH12  ARG  98          HH12      ARG  98 -12.211   5.665  -1.696
  799   HH21  ARG  98          HH21      ARG  98 -15.235   6.186   0.065
  800   HH22  ARG  98          HH22      ARG  98 -13.782   6.944  -0.449
  801    H    ASP  99           HN       ASP  99 -18.035   0.129  -3.920
  802    HA   ASP  99           HA       ASP  99 -18.673   1.946  -6.107
  803    HB2  ASP  99           HB2      ASP  99 -17.710   0.265  -7.604
  804    HB3  ASP  99           HB1      ASP  99 -16.562   0.595  -6.320
  805    H    THR 100           HN       THR 100 -20.555   1.671  -7.197
  806    HA   THR 100           HA       THR 100 -22.088  -0.732  -6.704
  807    HB   THR 100           HB       THR 100 -23.197   2.070  -6.262
  808    HG1  THR 100           HG1      THR 100 -21.873   0.308  -4.634
  809   HG21  THR 100          HG21      THR 100 -24.852   0.367  -7.003
  810   HG22  THR 100          HG22      THR 100 -25.146   0.902  -5.351
  811   HG23  THR 100          HG23      THR 100 -24.377  -0.656  -5.647
  812    H    VAL 101           HN       VAL 101 -23.646  -1.060  -8.318
  813    HA   VAL 101           HA       VAL 101 -24.547  -1.097 -10.337
  814    HB   VAL 101           HB       VAL 101 -23.456   1.715 -10.775
  815   HG11  VAL 101          HG11      VAL 101 -23.871   0.587 -12.890
  816   HG12  VAL 101          HG12      VAL 101 -25.053   1.869 -12.630
  817   HG13  VAL 101          HG13      VAL 101 -25.510   0.184 -12.374
  818   HG21  VAL 101          HG21      VAL 101 -25.762   2.464 -10.358
  819   HG22  VAL 101          HG22      VAL 101 -25.063   1.648  -8.960
  820   HG23  VAL 101          HG23      VAL 101 -26.223   0.800  -9.987
  821    H    GLU 102           HN       GLU 102 -23.617  -2.609 -11.376
  822    HA   GLU 102           HA       GLU 102 -21.062  -2.079 -12.693
  823    HB2  GLU 102           HB3      GLU 102 -20.835  -3.806 -10.931
  824    HB3  GLU 102           HB2      GLU 102 -22.137  -4.727 -11.674
  825    HG2  GLU 102           HG3      GLU 102 -20.772  -4.984 -13.704
  826    HG3  GLU 102           HG2      GLU 102 -19.457  -4.118 -12.913
  Start of MODEL   19
    1    H1   GLY   1           HT1      GLY   1 -20.411  -8.302  13.536
    2    H2   GLY   1           HT2      GLY   1 -20.132  -9.757  12.729
    3    H3   GLY   1           HT3      GLY   1 -18.872  -8.640  12.960
    4    HA2  GLY   1           HA2      GLY   1 -20.255 -10.098  15.097
    5    HA3  GLY   1           HA3      GLY   1 -18.636 -10.443  14.490
    6    H    HIS   2           HN       HIS   2 -19.506  -9.669  17.133
    7    HA   HIS   2           HA       HIS   2 -18.737  -6.905  17.485
    8    HB2  HIS   2           HB2      HIS   2 -19.612  -9.023  19.453
    9    HB3  HIS   2           HB1      HIS   2 -19.144  -7.398  19.930
   10    HD1  HIS   2           HD1      HIS   2 -20.986  -5.691  19.934
   11    HD2  HIS   2           HD2      HIS   2 -21.941  -9.039  17.667
   12    HE1  HIS   2           HE1      HIS   2 -23.362  -5.384  19.211
   13    H    MET   3           HN       MET   3 -17.280  -9.980  17.622
   14    HA   MET   3           HA       MET   3 -15.125  -9.298  19.360
   15    HB2  MET   3           HB2      MET   3 -15.396 -11.510  17.302
   16    HB3  MET   3           HB1      MET   3 -14.059 -11.367  18.432
   17    HG2  MET   3           HG2      MET   3 -15.509 -11.721  20.299
   18    HG3  MET   3           HG1      MET   3 -16.937 -11.646  19.275
   19    HE1  MET   3           HE1      MET   3 -16.361 -13.991  21.374
   20    HE2  MET   3           HE2      MET   3 -16.865 -15.390  20.425
   21    HE3  MET   3           HE3      MET   3 -17.802 -13.899  20.361
   22    H    LEU   4           HN       LEU   4 -15.094 -10.004  15.894
   23    HA   LEU   4           HA       LEU   4 -13.764  -9.407  14.216
   24    HB2  LEU   4           HB2      LEU   4 -15.293  -7.518  14.266
   25    HB3  LEU   4           HB1      LEU   4 -14.260  -6.676  15.399
   26    HG   LEU   4           HG       LEU   4 -12.495  -6.561  13.645
   27   HD11  LEU   4          HD11      LEU   4 -13.094  -7.012  11.319
   28   HD12  LEU   4          HD12      LEU   4 -14.633  -7.691  11.853
   29   HD13  LEU   4          HD13      LEU   4 -13.119  -8.472  12.305
   30   HD21  LEU   4          HD21      LEU   4 -15.163  -5.369  12.902
   31   HD22  LEU   4          HD22      LEU   4 -13.596  -4.829  12.300
   32   HD23  LEU   4          HD23      LEU   4 -13.982  -4.676  14.011
   33    H    ARG   5           HN       ARG   5 -11.953 -10.505  14.937
   34    HA   ARG   5           HA       ARG   5  -9.661  -8.749  15.081
   35    HB2  ARG   5           HB2      ARG   5 -10.271  -9.143  17.480
   36    HB3  ARG   5           HB1      ARG   5 -10.037 -10.861  17.216
   37    HG2  ARG   5           HG2      ARG   5  -8.074 -10.023  18.284
   38    HG3  ARG   5           HG1      ARG   5  -7.654 -10.365  16.609
   39    HD2  ARG   5           HD2      ARG   5  -8.376  -7.629  17.663
   40    HD3  ARG   5           HD1      ARG   5  -6.726  -8.211  17.493
   41    HE   ARG   5           HE       ARG   5  -7.342  -8.456  15.050
   42   HH11  ARG   5          HH11      ARG   5  -8.776  -5.940  17.116
   43   HH12  ARG   5          HH12      ARG   5  -8.946  -4.795  15.868
   44   HH21  ARG   5          HH21      ARG   5  -7.630  -6.848  13.301
   45   HH22  ARG   5          HH22      ARG   5  -8.281  -5.320  13.655
   46    H    THR   6           HN       THR   6 -10.652 -12.127  15.490
   47    HA   THR   6           HA       THR   6  -8.609 -12.855  13.562
   48    HB   THR   6           HB       THR   6 -10.160 -14.663  15.438
   49    HG1  THR   6           HG1      THR   6  -7.574 -14.343  16.129
   50   HG21  THR   6          HG21      THR   6  -9.119 -15.758  13.486
   51   HG22  THR   6          HG22      THR   6  -8.325 -16.228  14.989
   52   HG23  THR   6          HG23      THR   6  -7.564 -15.046  13.923
   53    H    ALA   7           HN       ALA   7  -9.924 -12.107  11.817
   54    HA   ALA   7           HA       ALA   7 -12.166 -13.896  11.169
   55    HB1  ALA   7           HB1      ALA   7 -13.092 -12.027   9.868
   56    HB2  ALA   7           HB2      ALA   7 -11.743 -11.008  10.370
   57    HB3  ALA   7           HB3      ALA   7 -12.902 -11.584  11.566
   58    H    GLY   8           HN       GLY   8  -9.103 -13.584  10.682
   59    HA2  GLY   8           HA3      GLY   8  -8.366 -14.973   8.720
   60    HA3  GLY   8           HA2      GLY   8  -9.141 -13.709   7.765
   61    H    ARG   9           HN       ARG   9  -6.907 -13.638   6.940
   62    HA   ARG   9           HA       ARG   9  -5.258 -11.826   8.584
   63    HB2  ARG   9           HB2      ARG   9  -3.275 -12.749   7.475
   64    HB3  ARG   9           HB1      ARG   9  -4.164 -14.046   8.266
   65    HG2  ARG   9           HG2      ARG   9  -5.035 -14.837   6.238
   66    HG3  ARG   9           HG1      ARG   9  -4.567 -13.374   5.380
   67    HD2  ARG   9           HD2      ARG   9  -2.198 -14.007   5.715
   68    HD3  ARG   9           HD1      ARG   9  -2.740 -15.527   6.440
   69    HE   ARG   9           HE       ARG   9  -4.071 -15.693   4.274
   70   HH11  ARG   9          HH11      ARG   9  -0.675 -14.610   4.488
   71   HH12  ARG   9          HH12      ARG   9  -0.376 -14.946   2.841
   72   HH21  ARG   9          HH21      ARG   9  -3.628 -16.047   2.083
   73   HH22  ARG   9          HH22      ARG   9  -2.070 -15.764   1.441
   74    H    ASP  10           HN       ASP  10  -3.995 -10.307   7.224
   75    HA   ASP  10           HA       ASP  10  -4.259 -10.262   4.441
   76    HB2  ASP  10           HB2      ASP  10  -6.534  -9.241   5.201
   77    HB3  ASP  10           HB1      ASP  10  -5.586  -7.860   5.748
   78    H    GLY  11           HN       GLY  11  -3.575  -7.654   3.976
   79    HA2  GLY  11           HA3      GLY  11  -1.943  -6.031   4.427
   80    HA3  GLY  11           HA2      GLY  11  -1.424  -6.978   5.818
   81    H    LEU  12           HN       LEU  12  -1.900  -8.916   3.308
   82    HA   LEU  12           HA       LEU  12   0.769  -8.657   2.169
   83    HB2  LEU  12           HB2      LEU  12   0.810 -10.266   4.170
   84    HB3  LEU  12           HB1      LEU  12  -0.268 -11.290   3.268
   85    HG   LEU  12           HG       LEU  12   2.105 -12.056   3.275
   86   HD11  LEU  12          HD11      LEU  12   0.646 -12.816   1.506
   87   HD12  LEU  12          HD12      LEU  12   2.290 -12.584   0.905
   88   HD13  LEU  12          HD13      LEU  12   1.040 -11.393   0.541
   89   HD21  LEU  12          HD21      LEU  12   2.597  -9.615   1.580
   90   HD22  LEU  12          HD22      LEU  12   3.751 -10.909   1.910
   91   HD23  LEU  12          HD23      LEU  12   3.179  -9.876   3.223
   92    H    CYS  13           HN       CYS  13  -2.131 -10.710   2.305
   93    HA   CYS  13           HA       CYS  13  -2.058 -11.473  -0.337
   94    HB2  CYS  13           HB2      CYS  13  -4.560 -11.983   0.135
   95    HB3  CYS  13           HB1      CYS  13  -3.298 -12.849   1.010
   96    HG   CYS  13           HG       CYS  13  -4.675 -10.058   2.448
   97    H    ARG  14           HN       ARG  14  -4.271  -8.918   1.063
   98    HA   ARG  14           HA       ARG  14  -5.082  -8.218  -1.579
   99    HB2  ARG  14           HB2      ARG  14  -6.548  -7.966   0.408
  100    HB3  ARG  14           HB1      ARG  14  -5.452  -6.756   1.039
  101    HG2  ARG  14           HG2      ARG  14  -5.965  -5.274  -0.783
  102    HG3  ARG  14           HG1      ARG  14  -6.981  -6.505  -1.532
  103    HD2  ARG  14           HD2      ARG  14  -7.449  -5.322   1.192
  104    HD3  ARG  14           HD1      ARG  14  -8.247  -4.781  -0.279
  105    HE   ARG  14           HE       ARG  14  -8.611  -7.556   0.031
  106   HH11  ARG  14          HH11      ARG  14  -9.634  -4.520   1.436
  107   HH12  ARG  14          HH12      ARG  14 -11.161  -5.052   1.948
  108   HH21  ARG  14          HH21      ARG  14 -10.733  -8.362   0.726
  109   HH22  ARG  14          HH22      ARG  14 -11.813  -7.321   1.536
  110    H    LEU  15           HN       LEU  15  -2.549  -7.318   0.512
  111    HA   LEU  15           HA       LEU  15  -1.797  -4.829  -0.530
  112    HB2  LEU  15           HB2      LEU  15  -0.901  -5.793   1.555
  113    HB3  LEU  15           HB1      LEU  15  -0.117  -7.056   0.630
  114    HG   LEU  15           HG       LEU  15   1.373  -5.409  -0.393
  115   HD11  LEU  15          HD11      LEU  15   1.408  -3.132   0.443
  116   HD12  LEU  15          HD12      LEU  15  -0.042  -3.460   1.389
  117   HD13  LEU  15          HD13      LEU  15  -0.111  -3.494  -0.375
  118   HD21  LEU  15          HD21      LEU  15   1.255  -5.224   2.604
  119   HD22  LEU  15          HD22      LEU  15   2.647  -4.825   1.598
  120   HD23  LEU  15          HD23      LEU  15   2.057  -6.486   1.670
  121    H    SER  16           HN       SER  16  -0.650  -8.127  -1.267
  122    HA   SER  16           HA       SER  16   0.545  -7.240  -3.723
  123    HB2  SER  16           HB2      SER  16   1.563  -9.000  -2.179
  124    HB3  SER  16           HB1      SER  16   0.252 -10.070  -2.652
  125    HG   SER  16           HG       SER  16   1.542  -8.960  -4.810
  126    H    THR  17           HN       THR  17  -1.874  -6.562  -3.827
  127    HA   THR  17           HA       THR  17  -2.974  -8.080  -6.042
  128    HB   THR  17           HB       THR  17  -4.692  -7.012  -3.753
  129    HG1  THR  17           HG1      THR  17  -3.454  -9.273  -3.949
  130   HG21  THR  17          HG21      THR  17  -6.590  -8.002  -4.971
  131   HG22  THR  17          HG22      THR  17  -5.508  -8.465  -6.282
  132   HG23  THR  17          HG23      THR  17  -5.797  -6.759  -5.941
  133    H    TYR  18           HN       TYR  18  -3.096  -5.158  -4.021
  134    HA   TYR  18           HA       TYR  18  -3.759  -3.555  -6.289
  135    HB2  TYR  18           HB2      TYR  18  -3.133  -2.861  -3.433
  136    HB3  TYR  18           HB1      TYR  18  -3.355  -1.621  -4.669
  137    HD1  TYR  18           HD1      TYR  18  -5.023  -4.223  -2.701
  138    HD2  TYR  18           HD2      TYR  18  -5.495  -1.232  -5.676
  139    HE1  TYR  18           HE1      TYR  18  -7.455  -4.396  -2.485
  140    HE2  TYR  18           HE2      TYR  18  -7.918  -1.409  -5.477
  141    HH   TYR  18           HH       TYR  18  -9.463  -2.922  -2.953
  142    H    LEU  19           HN       LEU  19  -0.821  -4.377  -4.569
  143    HA   LEU  19           HA       LEU  19   0.751  -2.495  -5.986
  144    HB2  LEU  19           HB2      LEU  19   1.511  -5.026  -4.529
  145    HB3  LEU  19           HB1      LEU  19   2.679  -3.918  -5.219
  146    HG   LEU  19           HG       LEU  19   0.742  -3.235  -2.979
  147   HD11  LEU  19          HD11      LEU  19   2.714  -3.195  -1.578
  148   HD12  LEU  19          HD12      LEU  19   3.701  -3.762  -2.930
  149   HD13  LEU  19          HD13      LEU  19   2.427  -4.790  -2.263
  150   HD21  LEU  19          HD21      LEU  19   1.277  -1.296  -4.381
  151   HD22  LEU  19          HD22      LEU  19   2.995  -1.625  -4.203
  152   HD23  LEU  19          HD23      LEU  19   2.035  -1.164  -2.801
  153    H    GLU  20           HN       GLU  20  -0.630  -5.489  -6.821
  154    HA   GLU  20           HA       GLU  20   1.162  -6.241  -8.912
  155    HB2  GLU  20           HB3      GLU  20  -1.786  -6.863  -8.859
  156    HB3  GLU  20           HB2      GLU  20  -0.510  -7.783  -9.624
  157    HG2  GLU  20           HG3      GLU  20  -1.059  -7.520  -6.688
  158    HG3  GLU  20           HG2      GLU  20  -1.328  -8.935  -7.695
  159    H    GLU  21           HN       GLU  21  -1.519  -4.063  -8.567
  160    HA   GLU  21           HA       GLU  21  -2.118  -3.678 -11.331
  161    HB2  GLU  21           HB3      GLU  21  -2.668  -1.933  -8.928
  162    HB3  GLU  21           HB2      GLU  21  -3.331  -1.667 -10.525
  163    HG2  GLU  21           HG3      GLU  21  -3.825  -4.150  -8.907
  164    HG3  GLU  21           HG2      GLU  21  -4.875  -2.738  -8.871
  165    H    LEU  22           HN       LEU  22   0.358  -2.566  -9.256
  166    HA   LEU  22           HA       LEU  22   0.798  -0.075 -10.665
  167    HB2  LEU  22           HB2      LEU  22   2.504  -1.322  -8.482
  168    HB3  LEU  22           HB1      LEU  22   2.744   0.204  -9.289
  169    HG   LEU  22           HG       LEU  22   0.417  -0.498  -7.514
  170   HD11  LEU  22          HD11      LEU  22   2.787   1.311  -7.112
  171   HD12  LEU  22          HD12      LEU  22   2.458  -0.207  -6.265
  172   HD13  LEU  22          HD13      LEU  22   1.404   1.188  -6.031
  173   HD21  LEU  22          HD21      LEU  22   1.097   2.086  -8.927
  174   HD22  LEU  22          HD22      LEU  22  -0.154   1.877  -7.703
  175   HD23  LEU  22          HD23      LEU  22  -0.294   1.044  -9.248
  176    H    GLU  23           HN       GLU  23   2.999   0.479 -11.121
  177    HA   GLU  23           HA       GLU  23   4.024  -1.364 -13.147
  178    HB2  GLU  23           HB3      GLU  23   2.894   1.109 -13.338
  179    HB3  GLU  23           HB2      GLU  23   4.589   1.509 -13.103
  180    HG2  GLU  23           HG3      GLU  23   3.484  -0.295 -15.104
  181    HG3  GLU  23           HG2      GLU  23   3.875   1.410 -15.425
  182    H    ALA  24           HN       ALA  24   6.418  -1.093 -13.382
  183    HA   ALA  24           HA       ALA  24   7.895  -1.186 -11.033
  184    HB1  ALA  24           HB1      ALA  24   8.664  -2.135 -13.149
  185    HB2  ALA  24           HB2      ALA  24   9.859  -1.007 -12.500
  186    HB3  ALA  24           HB3      ALA  24   8.803  -0.515 -13.826
  187    H    VAL  25           HN       VAL  25   7.239   1.507 -13.263
  188    HA   VAL  25           HA       VAL  25   8.877   3.377 -11.907
  189    HB   VAL  25           HB       VAL  25   8.114   3.846 -14.210
  190   HG11  VAL  25          HG11      VAL  25   5.834   4.569 -14.679
  191   HG12  VAL  25          HG12      VAL  25   5.377   4.195 -13.019
  192   HG13  VAL  25          HG13      VAL  25   5.885   2.898 -14.112
  193   HG21  VAL  25          HG21      VAL  25   7.108   5.883 -12.242
  194   HG22  VAL  25          HG22      VAL  25   7.459   6.196 -13.940
  195   HG23  VAL  25          HG23      VAL  25   8.764   5.753 -12.833
  196    H    GLU  26           HN       GLU  26   5.561   2.438 -11.463
  197    HA   GLU  26           HA       GLU  26   4.863   4.453  -9.577
  198    HB2  GLU  26           HB3      GLU  26   3.750   1.695  -9.990
  199    HB3  GLU  26           HB2      GLU  26   2.962   2.973  -9.071
  200    HG2  GLU  26           HG3      GLU  26   3.628   3.170 -11.992
  201    HG3  GLU  26           HG2      GLU  26   2.075   2.579 -11.395
  202    H    LEU  27           HN       LEU  27   6.063   1.143  -9.378
  203    HA   LEU  27           HA       LEU  27   6.145   0.942  -6.570
  204    HB2  LEU  27           HB2      LEU  27   7.771  -0.492  -8.675
  205    HB3  LEU  27           HB1      LEU  27   7.733  -0.937  -6.986
  206    HG   LEU  27           HG       LEU  27   5.345  -1.006  -8.830
  207   HD11  LEU  27          HD11      LEU  27   6.996  -2.656  -9.491
  208   HD12  LEU  27          HD12      LEU  27   5.602  -3.435  -8.752
  209   HD13  LEU  27          HD13      LEU  27   7.097  -3.249  -7.833
  210   HD21  LEU  27          HD21      LEU  27   5.731  -2.043  -6.018
  211   HD22  LEU  27          HD22      LEU  27   4.310  -2.313  -7.023
  212   HD23  LEU  27          HD23      LEU  27   4.720  -0.680  -6.498
  213    H    LYS  28           HN       LYS  28   8.364   2.176  -8.959
  214    HA   LYS  28           HA       LYS  28  10.616   2.561  -7.374
  215    HB2  LYS  28           HB2      LYS  28  10.626   2.868  -9.805
  216    HB3  LYS  28           HB1      LYS  28   9.579   4.271  -9.638
  217    HG2  LYS  28           HG2      LYS  28  11.357   5.404  -8.358
  218    HG3  LYS  28           HG1      LYS  28  12.405   4.012  -8.641
  219    HD2  LYS  28           HD2      LYS  28  12.207   4.378 -11.064
  220    HD3  LYS  28           HD1      LYS  28  11.184   5.781 -10.758
  221    HE2  LYS  28           HE2      LYS  28  13.471   6.460 -11.211
  222    HE3  LYS  28           HE1      LYS  28  13.018   6.855  -9.555
  223    HZ1  LYS  28           HZ1      LYS  28  14.232   4.897  -8.794
  224    HZ2  LYS  28           HZ2      LYS  28  15.247   5.892  -9.695
  225    HZ3  LYS  28           HZ3      LYS  28  14.631   4.489 -10.372
  226    H    LYS  29           HN       LYS  29   7.887   4.666  -8.054
  227    HA   LYS  29           HA       LYS  29   8.611   6.906  -6.484
  228    HB2  LYS  29           HB2      LYS  29   5.848   5.855  -7.043
  229    HB3  LYS  29           HB1      LYS  29   6.249   7.482  -6.545
  230    HG2  LYS  29           HG2      LYS  29   7.308   7.908  -8.693
  231    HG3  LYS  29           HG1      LYS  29   7.012   6.234  -9.174
  232    HD2  LYS  29           HD2      LYS  29   4.604   6.566  -8.916
  233    HD3  LYS  29           HD1      LYS  29   4.898   8.228  -8.421
  234    HE2  LYS  29           HE2      LYS  29   5.753   8.777 -10.581
  235    HE3  LYS  29           HE1      LYS  29   5.648   7.091 -11.092
  236    HZ1  LYS  29           HZ1      LYS  29   3.755   8.520 -11.829
  237    HZ2  LYS  29           HZ2      LYS  29   3.264   8.608 -10.193
  238    HZ3  LYS  29           HZ3      LYS  29   3.363   7.116 -10.993
  239    H    PHE  30           HN       PHE  30   6.380   4.274  -5.886
  240    HA   PHE  30           HA       PHE  30   5.565   4.686  -3.311
  241    HB2  PHE  30           HB2      PHE  30   4.458   3.102  -4.633
  242    HB3  PHE  30           HB1      PHE  30   5.944   2.302  -5.072
  243    HD1  PHE  30           HD2      PHE  30   4.049   2.987  -1.899
  244    HD2  PHE  30           HD1      PHE  30   6.107   0.204  -4.355
  245    HE1  PHE  30           HE2      PHE  30   3.583   1.209  -0.278
  246    HE2  PHE  30           HE1      PHE  30   5.636  -1.578  -2.738
  247    HZ   PHE  30           HZ       PHE  30   4.358  -1.070  -0.697
  248    H    LYS  31           HN       LYS  31   8.278   2.648  -4.331
  249    HA   LYS  31           HA       LYS  31   9.101   2.080  -1.716
  250    HB2  LYS  31           HB2      LYS  31   9.882   0.429  -3.031
  251    HB3  LYS  31           HB1      LYS  31  10.009   1.458  -4.432
  252    HG2  LYS  31           HG2      LYS  31  12.090   1.493  -2.232
  253    HG3  LYS  31           HG1      LYS  31  12.110   0.306  -3.537
  254    HD2  LYS  31           HD2      LYS  31  12.115   3.292  -4.002
  255    HD3  LYS  31           HD1      LYS  31  13.582   2.321  -3.922
  256    HE2  LYS  31           HE2      LYS  31  11.334   1.730  -5.829
  257    HE3  LYS  31           HE1      LYS  31  12.661   2.813  -6.258
  258    HZ1  LYS  31           HZ1      LYS  31  12.902   0.490  -7.044
  259    HZ2  LYS  31           HZ2      LYS  31  13.057  -0.053  -5.456
  260    HZ3  LYS  31           HZ3      LYS  31  14.171   1.014  -6.105
  261    H    LEU  32           HN       LEU  32  10.137   4.691  -3.861
  262    HA   LEU  32           HA       LEU  32  12.211   5.316  -2.024
  263    HB2  LEU  32           HB2      LEU  32  12.650   7.322  -3.338
  264    HB3  LEU  32           HB1      LEU  32  12.506   5.927  -4.366
  265    HG   LEU  32           HG       LEU  32  10.083   6.813  -4.811
  266   HD11  LEU  32          HD11      LEU  32   9.849   9.221  -4.707
  267   HD12  LEU  32          HD12      LEU  32  11.397   9.345  -3.872
  268   HD13  LEU  32          HD13      LEU  32  10.042   8.521  -3.096
  269   HD21  LEU  32          HD21      LEU  32  12.529   8.199  -5.866
  270   HD22  LEU  32          HD22      LEU  32  10.943   8.186  -6.645
  271   HD23  LEU  32          HD23      LEU  32  11.858   6.687  -6.462
  272    H    TYR  33           HN       TYR  33   8.936   6.348  -2.500
  273    HA   TYR  33           HA       TYR  33   8.954   8.608  -0.911
  274    HB2  TYR  33           HB2      TYR  33   7.080   8.015  -2.408
  275    HB3  TYR  33           HB1      TYR  33   6.646   6.694  -1.328
  276    HD1  TYR  33           HD1      TYR  33   5.597   7.139   0.832
  277    HD2  TYR  33           HD2      TYR  33   6.667  10.299  -1.788
  278    HE1  TYR  33           HE1      TYR  33   4.279   8.663   2.193
  279    HE2  TYR  33           HE2      TYR  33   5.341  11.870  -0.439
  280    HH   TYR  33           HH       TYR  33   4.388  11.190   2.636
  281    H    LEU  34           HN       LEU  34   8.525   5.240  -0.018
  282    HA   LEU  34           HA       LEU  34   8.276   6.170   2.725
  283    HB2  LEU  34           HB2      LEU  34   7.314   3.901   3.248
  284    HB3  LEU  34           HB1      LEU  34   6.391   4.962   2.211
  285    HG   LEU  34           HG       LEU  34   7.206   3.643   0.251
  286   HD11  LEU  34          HD11      LEU  34   9.121   2.538   1.211
  287   HD12  LEU  34          HD12      LEU  34   7.943   1.350   0.641
  288   HD13  LEU  34          HD13      LEU  34   8.086   1.696   2.364
  289   HD21  LEU  34          HD21      LEU  34   4.987   3.471   1.193
  290   HD22  LEU  34          HD22      LEU  34   5.543   2.214   2.306
  291   HD23  LEU  34          HD23      LEU  34   5.551   1.926   0.566
  292    H    GLY  35           HN       GLY  35  10.394   4.177   0.789
  293    HA2  GLY  35           HA3      GLY  35  11.597   3.181   3.217
  294    HA3  GLY  35           HA2      GLY  35  12.054   2.711   1.571
  295    H    THR  36           HN       THR  36  12.100   5.826   1.099
  296    HA   THR  36           HA       THR  36  14.702   6.179   2.436
  297    HB   THR  36           HB       THR  36  15.416   7.757   0.712
  298    HG1  THR  36           HG1      THR  36  12.733   7.582  -0.221
  299   HG21  THR  36          HG21      THR  36  15.781   5.416   0.131
  300   HG22  THR  36          HG22      THR  36  15.409   6.360  -1.320
  301   HG23  THR  36          HG23      THR  36  14.175   5.338  -0.598
  302    H    ALA  37           HN       ALA  37  11.886   6.657   3.217
  303    HA   ALA  37           HA       ALA  37  11.432   9.470   3.289
  304    HB1  ALA  37           HB1      ALA  37   9.489   8.931   4.588
  305    HB2  ALA  37           HB2      ALA  37  10.034   7.257   4.724
  306    HB3  ALA  37           HB3      ALA  37   9.603   7.922   3.146
  307    H    THR  38           HN       THR  38  12.154  10.843   4.709
  308    HA   THR  38           HA       THR  38  13.011   9.888   7.278
  309    HB   THR  38           HB       THR  38  13.576  12.376   7.540
  310    HG1  THR  38           HG1      THR  38  13.940  13.242   5.311
  311   HG21  THR  38          HG21      THR  38  15.281  10.661   7.111
  312   HG22  THR  38          HG22      THR  38  15.655  12.142   6.232
  313   HG23  THR  38          HG23      THR  38  14.955  10.766   5.382
  314    H    GLU  39           HN       GLU  39  10.344  11.241   5.704
  315    HA   GLU  39           HA       GLU  39   9.084  12.550   7.881
  316    HB2  GLU  39           HB3      GLU  39   7.007  12.485   6.553
  317    HB3  GLU  39           HB2      GLU  39   8.366  13.005   5.576
  318    HG2  GLU  39           HG3      GLU  39   8.507  10.728   4.629
  319    HG3  GLU  39           HG2      GLU  39   7.087  10.276   5.567
  320    H    LEU  40           HN       LEU  40   9.248   9.251   6.910
  321    HA   LEU  40           HA       LEU  40   7.204   8.287   8.670
  322    HB2  LEU  40           HB2      LEU  40   9.269   7.069   6.951
  323    HB3  LEU  40           HB1      LEU  40   8.786   6.125   8.332
  324    HG   LEU  40           HG       LEU  40   6.463   6.122   7.506
  325   HD11  LEU  40          HD11      LEU  40   6.457   8.208   6.248
  326   HD12  LEU  40          HD12      LEU  40   5.970   6.814   5.266
  327   HD13  LEU  40          HD13      LEU  40   7.589   7.491   5.085
  328   HD21  LEU  40          HD21      LEU  40   7.931   4.309   6.970
  329   HD22  LEU  40          HD22      LEU  40   8.545   5.179   5.568
  330   HD23  LEU  40          HD23      LEU  40   6.868   4.638   5.599
  331    H    GLY  41           HN       GLY  41  10.472   9.254   9.035
  332    HA2  GLY  41           HA3      GLY  41  11.810   9.338  10.898
  333    HA3  GLY  41           HA2      GLY  41  10.526   8.559  11.820
  334    H    GLU  42           HN       GLU  42  10.117   6.263  10.884
  335    HA   GLU  42           HA       GLU  42  12.635   4.811  11.103
  336    HB2  GLU  42           HB3      GLU  42  11.249   2.893  11.633
  337    HB3  GLU  42           HB2      GLU  42  10.895   4.265  12.675
  338    HG2  GLU  42           HG3      GLU  42   8.965   4.789  11.357
  339    HG3  GLU  42           HG2      GLU  42   9.331   3.432  10.282
  340    H    GLY  43           HN       GLY  43  11.457   6.098   8.620
  341    HA2  GLY  43           HA3      GLY  43  10.843   3.883   6.851
  342    HA3  GLY  43           HA2      GLY  43  11.007   5.575   6.384
  343    H    LYS  44           HN       LYS  44  12.902   2.997   7.697
  344    HA   LYS  44           HA       LYS  44  15.342   4.014   6.509
  345    HB2  LYS  44           HB2      LYS  44  14.756   1.705   8.250
  346    HB3  LYS  44           HB1      LYS  44  16.376   2.130   7.724
  347    HG2  LYS  44           HG2      LYS  44  14.572   3.888   9.421
  348    HG3  LYS  44           HG1      LYS  44  15.873   2.884  10.058
  349    HD2  LYS  44           HD2      LYS  44  16.223   5.154   8.087
  350    HD3  LYS  44           HD1      LYS  44  16.536   5.255   9.820
  351    HE2  LYS  44           HE2      LYS  44  18.251   3.489   9.587
  352    HE3  LYS  44           HE1      LYS  44  17.937   3.437   7.857
  353    HZ1  LYS  44           HZ1      LYS  44  18.709   5.731   7.680
  354    HZ2  LYS  44           HZ2      LYS  44  19.888   4.777   8.401
  355    HZ3  LYS  44           HZ3      LYS  44  18.948   5.791   9.342
  356    H    ILE  45           HN       ILE  45  13.897   0.773   6.705
  357    HA   ILE  45           HA       ILE  45  13.929  -1.004   5.376
  358    HB   ILE  45           HB       ILE  45  14.198   1.159   3.378
  359   HG12  ILE  45          HG12      ILE  45  12.170   1.269   4.683
  360   HG13  ILE  45          HG11      ILE  45  11.790   0.911   3.007
  361   HG21  ILE  45          HG21      ILE  45  14.946  -0.927   2.317
  362   HG22  ILE  45          HG22      ILE  45  13.367  -0.477   1.668
  363   HG23  ILE  45          HG23      ILE  45  13.492  -1.751   2.874
  364   HD11  ILE  45          HD11      ILE  45  11.529  -1.438   3.611
  365   HD12  ILE  45          HD12      ILE  45  10.413  -0.372   4.495
  366   HD13  ILE  45          HD13      ILE  45  11.856  -1.010   5.300
  367    HA   PRO  46           HA       PRO  46  18.294  -2.068   5.029
  368    HB2  PRO  46           HB2      PRO  46  17.903  -4.293   3.385
  369    HB3  PRO  46           HB1      PRO  46  17.910  -4.330   5.150
  370    HG2  PRO  46           HG2      PRO  46  15.643  -4.190   3.241
  371    HG3  PRO  46           HG1      PRO  46  15.750  -5.099   4.769
  372    HD2  PRO  46           HD2      PRO  46  14.345  -2.852   4.607
  373    HD3  PRO  46           HD1      PRO  46  15.330  -3.182   6.046
  374    H    TRP  47           HN       TRP  47  19.746  -1.397   3.717
  375    HA   TRP  47           HA       TRP  47  19.547   0.484   1.928
  376    HB2  TRP  47           HB2      TRP  47  21.857   0.113   1.277
  377    HB3  TRP  47           HB1      TRP  47  21.627  -0.178   2.995
  378    HD1  TRP  47           HD1      TRP  47  23.001  -1.744  -0.088
  379    HE1  TRP  47           HE1      TRP  47  23.739  -4.168   0.372
  380    HE3  TRP  47           HE3      TRP  47  20.874  -2.422   4.532
  381    HZ2  TRP  47           HZ2      TRP  47  23.440  -6.098   2.378
  382    HZ3  TRP  47           HZ3      TRP  47  21.149  -4.583   5.628
  383    HH2  TRP  47           HH2      TRP  47  22.405  -6.387   4.580
  384    H    GLY  48           HN       GLY  48  19.418  -2.903   0.819
  385    HA2  GLY  48           HA3      GLY  48  18.614  -1.858  -1.778
  386    HA3  GLY  48           HA2      GLY  48  20.040  -2.884  -1.738
  387    H    SER  49           HN       SER  49  17.013  -3.145   0.094
  388    HA   SER  49           HA       SER  49  16.765  -5.908  -0.762
  389    HB2  SER  49           HB2      SER  49  14.835  -5.767   0.871
  390    HB3  SER  49           HB1      SER  49  16.431  -5.417   1.550
  391    HG   SER  49           HG       SER  49  15.944  -3.278   1.643
  392    H    MET  50           HN       MET  50  15.670  -2.857  -1.588
  393    HA   MET  50           HA       MET  50  13.268  -3.792  -2.999
  394    HB2  MET  50           HB2      MET  50  12.765  -1.183  -2.560
  395    HB3  MET  50           HB1      MET  50  12.210  -2.491  -1.533
  396    HG2  MET  50           HG2      MET  50  13.187  -0.520  -0.358
  397    HG3  MET  50           HG1      MET  50  13.878  -2.060   0.088
  398    HE1  MET  50           HE1      MET  50  16.032   1.247  -2.337
  399    HE2  MET  50           HE2      MET  50  14.469   1.446  -1.542
  400    HE3  MET  50           HE3      MET  50  14.610   0.426  -2.975
  401    H    GLU  51           HN       GLU  51  15.935  -3.539  -4.069
  402    HA   GLU  51           HA       GLU  51  16.405  -1.139  -5.502
  403    HB2  GLU  51           HB3      GLU  51  17.166  -3.935  -6.311
  404    HB3  GLU  51           HB2      GLU  51  17.916  -2.453  -6.856
  405    HG2  GLU  51           HG3      GLU  51  18.851  -2.076  -4.684
  406    HG3  GLU  51           HG2      GLU  51  17.952  -3.442  -4.020
  407    H    LYS  52           HN       LYS  52  15.387  -4.295  -6.742
  408    HA   LYS  52           HA       LYS  52  13.813  -2.965  -8.846
  409    HB2  LYS  52           HB2      LYS  52  15.363  -5.550  -9.016
  410    HB3  LYS  52           HB1      LYS  52  14.386  -4.868 -10.302
  411    HG2  LYS  52           HG2      LYS  52  15.903  -2.921 -10.385
  412    HG3  LYS  52           HG1      LYS  52  16.904  -3.684  -9.149
  413    HD2  LYS  52           HD2      LYS  52  16.294  -4.858 -11.870
  414    HD3  LYS  52           HD1      LYS  52  17.790  -4.039 -11.428
  415    HE2  LYS  52           HE2      LYS  52  16.730  -6.577 -10.166
  416    HE3  LYS  52           HE1      LYS  52  18.005  -6.489 -11.372
  417    HZ1  LYS  52           HZ1      LYS  52  18.139  -5.303  -8.639
  418    HZ2  LYS  52           HZ2      LYS  52  19.351  -5.213  -9.794
  419    HZ3  LYS  52           HZ3      LYS  52  18.912  -6.694  -9.152
  420    H    ALA  53           HN       ALA  53  13.281  -4.078  -6.142
  421    HA   ALA  53           HA       ALA  53  11.991  -6.525  -6.150
  422    HB1  ALA  53           HB1      ALA  53  12.558  -5.393  -4.091
  423    HB2  ALA  53           HB2      ALA  53  10.821  -5.699  -4.108
  424    HB3  ALA  53           HB3      ALA  53  11.435  -4.090  -4.444
  425    H    GLY  54           HN       GLY  54  10.120  -7.224  -6.794
  426    HA2  GLY  54           HA3      GLY  54   8.383  -5.405  -8.258
  427    HA3  GLY  54           HA2      GLY  54   8.354  -7.167  -8.340
  428    HA   PRO  55           HA       PRO  55   4.912  -5.371  -5.724
  429    HB2  PRO  55           HB2      PRO  55   3.030  -7.199  -6.584
  430    HB3  PRO  55           HB1      PRO  55   3.297  -5.603  -7.291
  431    HG2  PRO  55           HG2      PRO  55   4.293  -8.268  -8.197
  432    HG3  PRO  55           HG1      PRO  55   3.691  -6.910  -9.164
  433    HD2  PRO  55           HD2      PRO  55   6.306  -7.444  -8.927
  434    HD3  PRO  55           HD1      PRO  55   5.714  -5.777  -9.027
  435    H    LEU  56           HN       LEU  56   5.804  -8.737  -6.197
  436    HA   LEU  56           HA       LEU  56   4.581  -9.588  -3.715
  437    HB2  LEU  56           HB2      LEU  56   6.523 -11.032  -5.527
  438    HB3  LEU  56           HB1      LEU  56   5.889 -11.735  -4.058
  439    HG   LEU  56           HG       LEU  56   3.578 -11.463  -5.076
  440   HD11  LEU  56          HD11      LEU  56   5.162 -10.993  -7.584
  441   HD12  LEU  56          HD12      LEU  56   4.065  -9.861  -6.793
  442   HD13  LEU  56          HD13      LEU  56   3.434 -11.342  -7.512
  443   HD21  LEU  56          HD21      LEU  56   5.525 -13.301  -6.450
  444   HD22  LEU  56          HD22      LEU  56   3.773 -13.487  -6.433
  445   HD23  LEU  56          HD23      LEU  56   4.688 -13.619  -4.931
  446    H    GLU  57           HN       GLU  57   7.843  -8.837  -4.717
  447    HA   GLU  57           HA       GLU  57   9.109  -9.412  -2.245
  448    HB2  GLU  57           HB3      GLU  57   9.863  -7.521  -4.469
  449    HB3  GLU  57           HB2      GLU  57  10.926  -7.934  -3.131
  450    HG2  GLU  57           HG3      GLU  57  11.043 -10.193  -3.841
  451    HG3  GLU  57           HG2      GLU  57   9.794  -9.939  -5.060
  452    H    MET  58           HN       MET  58   7.703  -6.539  -3.657
  453    HA   MET  58           HA       MET  58   8.289  -4.709  -1.607
  454    HB2  MET  58           HB2      MET  58   6.104  -4.781  -3.665
  455    HB3  MET  58           HB1      MET  58   6.316  -3.429  -2.563
  456    HG2  MET  58           HG2      MET  58   8.503  -4.447  -4.303
  457    HG3  MET  58           HG1      MET  58   7.394  -3.251  -4.949
  458    HE1  MET  58           HE1      MET  58  10.262  -2.655  -5.250
  459    HE2  MET  58           HE2      MET  58  10.537  -1.097  -4.473
  460    HE3  MET  58           HE3      MET  58   9.088  -1.356  -5.441
  461    H    ALA  59           HN       ALA  59   5.419  -6.751  -2.167
  462    HA   ALA  59           HA       ALA  59   3.896  -5.822  -0.051
  463    HB1  ALA  59           HB1      ALA  59   2.684  -7.937  -0.179
  464    HB2  ALA  59           HB2      ALA  59   4.000  -8.647  -1.109
  465    HB3  ALA  59           HB3      ALA  59   3.045  -7.332  -1.795
  466    H    GLN  60           HN       GLN  60   6.391  -8.299  -0.076
  467    HA   GLN  60           HA       GLN  60   5.942  -8.911   2.674
  468    HB2  GLN  60           HB2      GLN  60   8.308  -9.640   0.972
  469    HB3  GLN  60           HB1      GLN  60   7.922 -10.308   2.551
  470    HG2  GLN  60           HG2      GLN  60   5.725 -11.071   1.496
  471    HG3  GLN  60           HG1      GLN  60   6.484 -10.682  -0.038
  472   HE21  GLN  60          HE21      GLN  60   5.658 -13.268   1.078
  473   HE22  GLN  60          HE22      GLN  60   7.077 -14.247   1.036
  474    H    LEU  61           HN       LEU  61   7.762  -6.568   1.000
  475    HA   LEU  61           HA       LEU  61   9.868  -6.073   2.809
  476    HB2  LEU  61           HB2      LEU  61   9.437  -5.143   0.402
  477    HB3  LEU  61           HB1      LEU  61   8.428  -3.978   1.247
  478    HG   LEU  61           HG       LEU  61  10.408  -3.265   2.535
  479   HD11  LEU  61          HD11      LEU  61  12.619  -3.811   1.625
  480   HD12  LEU  61          HD12      LEU  61  11.863  -4.915   0.480
  481   HD13  LEU  61          HD13      LEU  61  11.797  -5.260   2.210
  482   HD21  LEU  61          HD21      LEU  61   9.553  -1.992   0.659
  483   HD22  LEU  61          HD22      LEU  61  10.464  -3.000  -0.462
  484   HD23  LEU  61          HD23      LEU  61  11.320  -1.942   0.662
  485    H    LEU  62           HN       LEU  62   6.751  -4.417   2.315
  486    HA   LEU  62           HA       LEU  62   7.006  -2.789   4.586
  487    HB2  LEU  62           HB2      LEU  62   4.523  -3.498   3.013
  488    HB3  LEU  62           HB1      LEU  62   4.569  -2.295   4.279
  489    HG   LEU  62           HG       LEU  62   4.587  -1.080   2.272
  490   HD11  LEU  62          HD11      LEU  62   6.165  -0.221   3.820
  491   HD12  LEU  62          HD12      LEU  62   6.704   0.025   2.158
  492   HD13  LEU  62          HD13      LEU  62   7.431  -1.248   3.142
  493   HD21  LEU  62          HD21      LEU  62   6.086  -1.484   0.412
  494   HD22  LEU  62          HD22      LEU  62   5.069  -2.897   0.751
  495   HD23  LEU  62          HD23      LEU  62   6.752  -2.877   1.264
  496    H    ILE  63           HN       ILE  63   5.470  -5.927   4.089
  497    HA   ILE  63           HA       ILE  63   4.079  -5.964   6.541
  498    HB   ILE  63           HB       ILE  63   3.975  -7.501   4.310
  499   HG12  ILE  63          HG12      ILE  63   2.255  -7.363   6.067
  500   HG13  ILE  63          HG11      ILE  63   2.412  -8.980   5.402
  501   HG21  ILE  63          HG21      ILE  63   4.715  -9.795   4.714
  502   HG22  ILE  63          HG22      ILE  63   5.431  -9.288   6.238
  503   HG23  ILE  63          HG23      ILE  63   6.076  -8.665   4.727
  504   HD11  ILE  63          HD11      ILE  63   2.064  -9.061   7.797
  505   HD12  ILE  63          HD12      ILE  63   3.466  -8.015   8.052
  506   HD13  ILE  63          HD13      ILE  63   3.684  -9.637   7.399
  507    H    THR  64           HN       THR  64   7.395  -6.724   5.731
  508    HA   THR  64           HA       THR  64   7.927  -8.184   8.124
  509    HB   THR  64           HB       THR  64   9.896  -6.893   6.203
  510    HG1  THR  64           HG1      THR  64   8.803  -8.376   5.051
  511   HG21  THR  64          HG21      THR  64  10.909  -7.511   8.374
  512   HG22  THR  64          HG22      THR  64  11.507  -8.529   7.062
  513   HG23  THR  64          HG23      THR  64  10.296  -9.153   8.178
  514    H    HIS  65           HN       HIS  65   7.915  -4.851   7.253
  515    HA   HIS  65           HA       HIS  65   9.399  -4.099   9.672
  516    HB2  HIS  65           HB2      HIS  65   8.534  -2.442   7.298
  517    HB3  HIS  65           HB1      HIS  65   9.241  -1.750   8.750
  518    HD1  HIS  65           HD1      HIS  65  11.728  -1.422   8.607
  519    HD2  HIS  65           HD2      HIS  65  10.345  -4.374   6.036
  520    HE1  HIS  65           HE1      HIS  65  13.724  -2.219   7.354
  521    H    PHE  66           HN       PHE  66   6.569  -2.888   8.004
  522    HA   PHE  66           HA       PHE  66   5.636  -1.445  10.246
  523    HB2  PHE  66           HB2      PHE  66   4.346  -2.092   7.614
  524    HB3  PHE  66           HB1      PHE  66   3.764  -0.882   8.745
  525    HD1  PHE  66           HD1      PHE  66   5.039   1.185   9.108
  526    HD2  PHE  66           HD2      PHE  66   6.289  -1.723   6.274
  527    HE1  PHE  66           HE1      PHE  66   6.596   2.831   8.092
  528    HE2  PHE  66           HE2      PHE  66   7.820  -0.125   5.263
  529    HZ   PHE  66           HZ       PHE  66   7.983   2.167   6.179
  530    H    GLY  67           HN       GLY  67   4.391  -4.318   8.632
  531    HA2  GLY  67           HA3      GLY  67   3.610  -6.010  10.378
  532    HA3  GLY  67           HA2      GLY  67   2.577  -4.668  10.898
  533    HA   PRO  68           HA       PRO  68   0.609  -7.119   7.399
  534    HB2  PRO  68           HB2      PRO  68  -1.724  -7.671   8.791
  535    HB3  PRO  68           HB1      PRO  68  -0.371  -8.790   8.600
  536    HG2  PRO  68           HG2      PRO  68  -1.079  -7.056  10.913
  537    HG3  PRO  68           HG1      PRO  68  -0.362  -8.675  10.902
  538    HD2  PRO  68           HD2      PRO  68   1.074  -6.421  11.376
  539    HD3  PRO  68           HD1      PRO  68   1.782  -7.844  10.609
  540    H    GLU  69           HN       GLU  69  -1.428  -5.337   9.729
  541    HA   GLU  69           HA       GLU  69  -3.058  -4.228   7.655
  542    HB2  GLU  69           HB3      GLU  69  -2.798  -3.425  10.556
  543    HB3  GLU  69           HB2      GLU  69  -4.070  -2.906   9.462
  544    HG2  GLU  69           HG3      GLU  69  -4.895  -5.164   9.279
  545    HG3  GLU  69           HG2      GLU  69  -3.556  -5.761  10.258
  546    H    GLU  70           HN       GLU  70  -0.272  -3.258   9.407
  547    HA   GLU  70           HA       GLU  70  -0.421  -0.502   8.810
  548    HB2  GLU  70           HB3      GLU  70   0.869  -1.868  10.649
  549    HB3  GLU  70           HB2      GLU  70   2.158  -1.826   9.461
  550    HG2  GLU  70           HG3      GLU  70   2.363  -0.005  11.055
  551    HG3  GLU  70           HG2      GLU  70   2.047   0.612   9.432
  552    H    ALA  71           HN       ALA  71   1.283  -3.260   7.318
  553    HA   ALA  71           HA       ALA  71   2.725  -1.911   5.333
  554    HB1  ALA  71           HB1      ALA  71   2.676  -4.021   4.108
  555    HB2  ALA  71           HB2      ALA  71   1.398  -4.613   5.172
  556    HB3  ALA  71           HB3      ALA  71   3.005  -4.282   5.821
  557    H    TRP  72           HN       TRP  72  -0.540  -3.226   5.285
  558    HA   TRP  72           HA       TRP  72  -1.177  -2.518   2.653
  559    HB2  TRP  72           HB2      TRP  72  -2.577  -4.116   3.760
  560    HB3  TRP  72           HB1      TRP  72  -2.917  -3.007   5.081
  561    HD1  TRP  72           HD1      TRP  72  -5.432  -2.547   4.936
  562    HE1  TRP  72           HE1      TRP  72  -7.064  -1.799   3.095
  563    HE3  TRP  72           HE3      TRP  72  -2.286  -2.688   0.928
  564    HZ2  TRP  72           HZ2      TRP  72  -7.019  -1.305   0.358
  565    HZ3  TRP  72           HZ3      TRP  72  -3.186  -2.070  -1.304
  566    HH2  TRP  72           HH2      TRP  72  -5.497  -1.397  -1.563
  567    H    ARG  73           HN       ARG  73  -1.561  -0.786   5.643
  568    HA   ARG  73           HA       ARG  73  -2.890   1.440   4.633
  569    HB2  ARG  73           HB2      ARG  73  -2.716   0.813   7.006
  570    HB3  ARG  73           HB1      ARG  73  -1.012   1.198   6.978
  571    HG2  ARG  73           HG2      ARG  73  -1.572   3.560   6.592
  572    HG3  ARG  73           HG1      ARG  73  -3.294   3.141   6.684
  573    HD2  ARG  73           HD2      ARG  73  -2.919   2.179   8.909
  574    HD3  ARG  73           HD1      ARG  73  -1.236   2.677   8.826
  575    HE   ARG  73           HE       ARG  73  -3.087   4.844   8.520
  576   HH11  ARG  73          HH11      ARG  73  -1.179   2.916  10.783
  577   HH12  ARG  73          HH12      ARG  73  -1.513   3.884  12.140
  578   HH21  ARG  73          HH21      ARG  73  -3.475   6.248  10.316
  579   HH22  ARG  73          HH22      ARG  73  -2.868   5.875  11.872
  580    H    LEU  74           HN       LEU  74   0.542   0.729   5.132
  581    HA   LEU  74           HA       LEU  74   1.646   3.145   4.257
  582    HB2  LEU  74           HB2      LEU  74   2.627   0.440   4.783
  583    HB3  LEU  74           HB1      LEU  74   3.510   1.251   3.512
  584    HG   LEU  74           HG       LEU  74   4.505   1.421   5.812
  585   HD11  LEU  74          HD11      LEU  74   4.985   3.859   5.666
  586   HD12  LEU  74          HD12      LEU  74   3.864   3.962   4.300
  587   HD13  LEU  74          HD13      LEU  74   5.310   2.954   4.212
  588   HD21  LEU  74          HD21      LEU  74   3.565   3.054   7.364
  589   HD22  LEU  74          HD22      LEU  74   2.453   1.710   7.098
  590   HD23  LEU  74          HD23      LEU  74   2.161   3.265   6.316
  591    H    ALA  75           HN       ALA  75   0.604   0.333   2.421
  592    HA   ALA  75           HA       ALA  75   1.707   1.358  -0.020
  593    HB1  ALA  75           HB1      ALA  75  -0.373  -0.773   0.366
  594    HB2  ALA  75           HB2      ALA  75   1.381  -1.018   0.178
  595    HB3  ALA  75           HB3      ALA  75   0.426  -0.352  -1.141
  596    H    LEU  76           HN       LEU  76  -1.641   1.129   1.197
  597    HA   LEU  76           HA       LEU  76  -2.666   2.392  -1.084
  598    HB2  LEU  76           HB2      LEU  76  -4.802   2.503  -0.006
  599    HB3  LEU  76           HB1      LEU  76  -4.054   0.999   0.445
  600    HG   LEU  76           HG       LEU  76  -3.420   2.302   2.640
  601   HD11  LEU  76          HD11      LEU  76  -4.113   4.486   2.026
  602   HD12  LEU  76          HD12      LEU  76  -5.243   3.905   3.265
  603   HD13  LEU  76          HD13      LEU  76  -5.693   3.894   1.552
  604   HD21  LEU  76          HD21      LEU  76  -5.535   1.595   3.655
  605   HD22  LEU  76          HD22      LEU  76  -4.860   0.371   2.582
  606   HD23  LEU  76          HD23      LEU  76  -6.215   1.364   2.042
  607    H    SER  77           HN       SER  77  -1.691   3.756   2.008
  608    HA   SER  77           HA       SER  77  -2.412   6.338   1.100
  609    HB2  SER  77           HB2      SER  77  -1.446   5.184   3.601
  610    HB3  SER  77           HB1      SER  77  -1.161   6.936   3.382
  611    HG   SER  77           HG       SER  77  -3.408   6.969   2.778
  612    H    THR  78           HN       THR  78   0.050   4.562   0.144
  613    HA   THR  78           HA       THR  78   1.608   6.980  -0.252
  614    HB   THR  78           HB       THR  78   2.452   4.079  -0.579
  615    HG1  THR  78           HG1      THR  78   2.802   4.377   1.417
  616   HG21  THR  78          HG21      THR  78   3.578   5.494  -2.270
  617   HG22  THR  78          HG22      THR  78   4.718   4.958  -1.033
  618   HG23  THR  78          HG23      THR  78   4.085   6.601  -0.994
  619    H    PHE  79           HN       PHE  79  -0.471   4.676  -1.743
  620    HA   PHE  79           HA       PHE  79   0.109   5.070  -4.423
  621    HB2  PHE  79           HB2      PHE  79  -2.568   4.655  -3.071
  622    HB3  PHE  79           HB1      PHE  79  -2.381   4.619  -4.826
  623    HD1  PHE  79           HD2      PHE  79   0.420   3.067  -4.386
  624    HD2  PHE  79           HD1      PHE  79  -3.600   2.520  -3.101
  625    HE1  PHE  79           HE2      PHE  79   0.823   0.668  -4.146
  626    HE2  PHE  79           HE1      PHE  79  -3.200   0.109  -2.862
  627    HZ   PHE  79           HZ       PHE  79  -0.984  -0.823  -3.387
  628    H    GLU  80           HN       GLU  80  -2.076   6.825  -2.272
  629    HA   GLU  80           HA       GLU  80  -2.947   8.892  -3.950
  630    HB2  GLU  80           HB3      GLU  80  -3.306  10.139  -1.763
  631    HB3  GLU  80           HB2      GLU  80  -4.066   8.551  -1.866
  632    HG2  GLU  80           HG3      GLU  80  -2.429   7.564  -0.581
  633    HG3  GLU  80           HG2      GLU  80  -1.367   8.966  -0.714
  634    H    ARG  81           HN       ARG  81   0.172   8.401  -2.599
  635    HA   ARG  81           HA       ARG  81   0.858  11.240  -2.553
  636    HB2  ARG  81           HB2      ARG  81   2.510   8.861  -1.753
  637    HB3  ARG  81           HB1      ARG  81   2.898  10.550  -1.462
  638    HG2  ARG  81           HG2      ARG  81   0.564   9.048  -0.291
  639    HG3  ARG  81           HG1      ARG  81   2.069   9.467   0.520
  640    HD2  ARG  81           HD2      ARG  81   1.596  11.791   0.370
  641    HD3  ARG  81           HD1      ARG  81   0.176  11.491  -0.635
  642    HE   ARG  81           HE       ARG  81  -0.919  10.543   1.268
  643   HH11  ARG  81          HH11      ARG  81   2.170  12.101   2.099
  644   HH12  ARG  81          HH12      ARG  81   1.633  12.616   3.630
  645   HH21  ARG  81          HH21      ARG  81  -1.583  11.160   3.433
  646   HH22  ARG  81          HH22      ARG  81  -0.503  12.065   4.395
  647    H    ILE  82           HN       ILE  82   1.179   8.463  -4.528
  648    HA   ILE  82           HA       ILE  82   3.474   9.626  -5.951
  649    HB   ILE  82           HB       ILE  82   3.875   7.400  -6.888
  650   HG12  ILE  82          HG12      ILE  82   1.529   6.491  -5.191
  651   HG13  ILE  82          HG11      ILE  82   1.512   6.623  -6.940
  652   HG21  ILE  82          HG21      ILE  82   3.539   7.368  -3.891
  653   HG22  ILE  82          HG22      ILE  82   4.929   7.987  -4.784
  654   HG23  ILE  82          HG23      ILE  82   4.555   6.266  -4.824
  655   HD11  ILE  82          HD11      ILE  82   3.231   4.758  -5.318
  656   HD12  ILE  82          HD12      ILE  82   3.235   4.882  -7.075
  657   HD13  ILE  82          HD13      ILE  82   1.791   4.314  -6.236
  658    H    ASN  83           HN       ASN  83   0.536  10.168  -6.116
  659    HA   ASN  83           HA       ASN  83  -1.046  10.770  -7.598
  660    HB2  ASN  83           HB3      ASN  83   0.947  11.785  -8.858
  661    HB3  ASN  83           HB2      ASN  83   1.002  10.321  -9.817
  662   HD21  ASN  83          HD21      ASN  83  -1.898  10.080 -10.208
  663   HD22  ASN  83          HD22      ASN  83  -2.370  11.387 -11.222
  664    H    ARG  84           HN       ARG  84  -1.412   8.487  -6.643
  665    HA   ARG  84           HA       ARG  84  -2.548   7.004  -8.842
  666    HB2  ARG  84           HB2      ARG  84  -0.419   5.876  -8.248
  667    HB3  ARG  84           HB1      ARG  84  -0.946   5.764  -6.580
  668    HG2  ARG  84           HG2      ARG  84  -1.144   3.654  -7.847
  669    HG3  ARG  84           HG1      ARG  84  -2.671   4.225  -7.170
  670    HD2  ARG  84           HD2      ARG  84  -2.939   3.413  -9.413
  671    HD3  ARG  84           HD1      ARG  84  -3.322   5.128  -9.268
  672    HE   ARG  84           HE       ARG  84  -0.576   4.647 -10.077
  673   HH11  ARG  84          HH11      ARG  84  -3.799   5.422 -11.329
  674   HH12  ARG  84          HH12      ARG  84  -3.290   5.581 -12.926
  675   HH21  ARG  84          HH21      ARG  84   0.133   4.992 -12.072
  676   HH22  ARG  84          HH22      ARG  84  -0.856   5.338 -13.433
  677    H    LYS  85           HN       LYS  85  -4.135   8.527  -7.849
  678    HA   LYS  85           HA       LYS  85  -5.203   7.914  -5.271
  679    HB2  LYS  85           HB2      LYS  85  -5.224  10.140  -5.676
  680    HB3  LYS  85           HB1      LYS  85  -5.627   9.996  -7.381
  681    HG2  LYS  85           HG2      LYS  85  -7.985   9.481  -6.686
  682    HG3  LYS  85           HG1      LYS  85  -7.500   9.744  -5.008
  683    HD2  LYS  85           HD2      LYS  85  -6.972  12.039  -5.433
  684    HD3  LYS  85           HD1      LYS  85  -7.141  11.815  -7.167
  685    HE2  LYS  85           HE2      LYS  85  -9.075  13.009  -6.185
  686    HE3  LYS  85           HE1      LYS  85  -9.543  11.486  -6.928
  687    HZ1  LYS  85           HZ1      LYS  85 -10.579  11.978  -4.723
  688    HZ2  LYS  85           HZ2      LYS  85  -9.070  11.750  -4.005
  689    HZ3  LYS  85           HZ3      LYS  85  -9.822  10.493  -4.887
  690    H    ASP  86           HN       ASP  86  -5.628   6.920  -8.489
  691    HA   ASP  86           HA       ASP  86  -8.295   6.235  -8.646
  692    HB2  ASP  86           HB2      ASP  86  -6.213   4.355  -9.753
  693    HB3  ASP  86           HB1      ASP  86  -7.753   4.805 -10.451
  694    H    LEU  87           HN       LEU  87  -5.478   4.331  -7.940
  695    HA   LEU  87           HA       LEU  87  -6.709   1.886  -7.216
  696    HB2  LEU  87           HB2      LEU  87  -4.349   2.382  -8.104
  697    HB3  LEU  87           HB1      LEU  87  -3.980   2.807  -6.438
  698    HG   LEU  87           HG       LEU  87  -4.526   0.550  -5.768
  699   HD11  LEU  87          HD11      LEU  87  -4.743   0.103  -8.749
  700   HD12  LEU  87          HD12      LEU  87  -6.048  -0.082  -7.573
  701   HD13  LEU  87          HD13      LEU  87  -4.664  -1.176  -7.546
  702   HD21  LEU  87          HD21      LEU  87  -2.507  -0.468  -6.709
  703   HD22  LEU  87          HD22      LEU  87  -2.247   1.201  -6.205
  704   HD23  LEU  87          HD23      LEU  87  -2.444   0.817  -7.916
  705    H    TRP  88           HN       TRP  88  -5.525   4.669  -5.518
  706    HA   TRP  88           HA       TRP  88  -5.467   3.789  -2.896
  707    HB2  TRP  88           HB2      TRP  88  -4.452   5.830  -3.598
  708    HB3  TRP  88           HB1      TRP  88  -5.978   6.459  -4.150
  709    HD1  TRP  88           HD1      TRP  88  -4.546   5.308  -0.721
  710    HE1  TRP  88           HE1      TRP  88  -5.371   6.958   1.060
  711    HE3  TRP  88           HE3      TRP  88  -7.427   8.274  -3.655
  712    HZ2  TRP  88           HZ2      TRP  88  -7.052   9.215   1.220
  713    HZ3  TRP  88           HZ3      TRP  88  -8.623  10.178  -2.623
  714    HH2  TRP  88           HH2      TRP  88  -8.433  10.632  -0.237
  715    H    GLU  89           HN       GLU  89  -8.145   5.362  -4.682
  716    HA   GLU  89           HA       GLU  89  -9.870   5.207  -2.454
  717    HB2  GLU  89           HB3      GLU  89 -10.341   5.852  -5.324
  718    HB3  GLU  89           HB2      GLU  89 -11.664   5.744  -4.167
  719    HG2  GLU  89           HG3      GLU  89 -10.624   7.463  -2.802
  720    HG3  GLU  89           HG2      GLU  89  -9.265   7.526  -3.923
  721    H    ARG  90           HN       ARG  90  -9.000   2.918  -4.722
  722    HA   ARG  90           HA       ARG  90 -11.353   1.240  -4.467
  723    HB2  ARG  90           HB2      ARG  90  -8.549   0.431  -5.212
  724    HB3  ARG  90           HB1      ARG  90  -9.991  -0.539  -5.452
  725    HG2  ARG  90           HG2      ARG  90 -10.735   1.115  -7.138
  726    HG3  ARG  90           HG1      ARG  90  -9.214   1.989  -6.898
  727    HD2  ARG  90           HD2      ARG  90  -8.026  -0.200  -7.399
  728    HD3  ARG  90           HD1      ARG  90  -9.581  -0.825  -7.914
  729    HE   ARG  90           HE       ARG  90  -9.191   1.521  -9.287
  730   HH11  ARG  90          HH11      ARG  90  -7.758  -1.735  -9.168
  731   HH12  ARG  90          HH12      ARG  90  -6.996  -1.663 -10.677
  732   HH21  ARG  90          HH21      ARG  90  -8.153   1.651 -11.428
  733   HH22  ARG  90          HH22      ARG  90  -7.259   0.335 -12.014
  734    H    GLY  91           HN       GLY  91  -8.367   1.806  -2.811
  735    HA2  GLY  91           HA3      GLY  91  -8.510  -0.661  -1.264
  736    HA3  GLY  91           HA2      GLY  91  -7.199   0.506  -1.284
  737    H    GLN  92           HN       GLN  92  -8.830   2.817  -0.707
  738    HA   GLN  92           HA       GLN  92  -8.876   2.222   2.082
  739    HB2  GLN  92           HB2      GLN  92  -9.030   4.676   2.497
  740    HB3  GLN  92           HB1      GLN  92  -7.581   4.115   1.708
  741    HG2  GLN  92           HG2      GLN  92  -8.145   6.165   0.703
  742    HG3  GLN  92           HG1      GLN  92  -8.598   4.923  -0.454
  743   HE21  GLN  92          HE21      GLN  92  -9.769   7.265   1.845
  744   HE22  GLN  92          HE22      GLN  92 -11.370   7.346   1.214
  745    H    ARG  93           HN       ARG  93 -10.285   2.550   3.547
  746    HA   ARG  93           HA       ARG  93 -13.017   3.309   2.858
  747    HB2  ARG  93           HB2      ARG  93 -13.877   1.526   4.378
  748    HB3  ARG  93           HB1      ARG  93 -13.007   0.816   3.033
  749    HG2  ARG  93           HG2      ARG  93 -11.724   1.246   5.731
  750    HG3  ARG  93           HG1      ARG  93 -12.656  -0.198   5.354
  751    HD2  ARG  93           HD2      ARG  93 -11.112  -0.797   3.601
  752    HD3  ARG  93           HD1      ARG  93 -10.256   0.734   3.763
  753    HE   ARG  93           HE       ARG  93  -9.852  -0.131   6.140
  754   HH11  ARG  93          HH11      ARG  93  -9.793  -2.160   3.189
  755   HH12  ARG  93          HH12      ARG  93  -8.757  -3.317   3.868
  756   HH21  ARG  93          HH21      ARG  93  -8.349  -1.762   6.983
  757   HH22  ARG  93          HH22      ARG  93  -7.922  -3.104   6.015
  758    H    GLU  94           HN       GLU  94 -10.575   4.430   3.918
  759    HA   GLU  94           HA       GLU  94 -10.930   4.709   6.798
  760    HB2  GLU  94           HB3      GLU  94  -8.654   5.557   5.012
  761    HB3  GLU  94           HB2      GLU  94  -8.667   5.552   6.763
  762    HG2  GLU  94           HG3      GLU  94  -8.805   3.120   4.989
  763    HG3  GLU  94           HG2      GLU  94  -7.377   3.695   5.841
  764    H    ASP  95           HN       ASP  95 -12.374   6.419   7.135
  765    HA   ASP  95           HA       ASP  95 -11.569   9.025   7.030
  766    HB2  ASP  95           HB2      ASP  95 -11.985   8.674   4.465
  767    HB3  ASP  95           HB1      ASP  95 -13.681   8.537   4.937
  768    H    LEU  96           HN       LEU  96 -13.900  10.413   7.141
  769    HA   LEU  96           HA       LEU  96 -16.067   8.997   8.250
  770    HB2  LEU  96           HB2      LEU  96 -14.554   8.757  10.117
  771    HB3  LEU  96           HB1      LEU  96 -14.224  10.478  10.111
  772    HG   LEU  96           HG       LEU  96 -16.632  10.882  10.626
  773   HD11  LEU  96          HD11      LEU  96 -17.957   9.039  11.553
  774   HD12  LEU  96          HD12      LEU  96 -16.692   7.903  11.083
  775   HD13  LEU  96          HD13      LEU  96 -17.576   8.801   9.850
  776   HD21  LEU  96          HD21      LEU  96 -16.463  10.277  13.015
  777   HD22  LEU  96          HD22      LEU  96 -14.985  11.001  12.387
  778   HD23  LEU  96          HD23      LEU  96 -15.078   9.256  12.628
  779    H    VAL  97           HN       VAL  97 -17.750  10.287   7.838
  780    HA   VAL  97           HA       VAL  97 -17.766  13.049   8.419
  781    HB   VAL  97           HB       VAL  97 -16.410  13.212   6.424
  782   HG11  VAL  97          HG11      VAL  97 -18.676  11.886   4.939
  783   HG12  VAL  97          HG12      VAL  97 -17.055  11.244   5.193
  784   HG13  VAL  97          HG13      VAL  97 -17.291  12.663   4.168
  785   HG21  VAL  97          HG21      VAL  97 -19.193  14.281   5.958
  786   HG22  VAL  97          HG22      VAL  97 -17.744  14.845   5.129
  787   HG23  VAL  97          HG23      VAL  97 -17.905  15.058   6.875
  788    H    ARG  98           HN       ARG  98 -19.248  10.437   6.613
  789    HA   ARG  98           HA       ARG  98 -21.884  11.658   7.076
  790    HB2  ARG  98           HB2      ARG  98 -21.319  11.175   4.736
  791    HB3  ARG  98           HB1      ARG  98 -21.048   9.489   5.144
  792    HG2  ARG  98           HG2      ARG  98 -23.463   9.401   5.879
  793    HG3  ARG  98           HG1      ARG  98 -23.650  10.993   5.138
  794    HD2  ARG  98           HD2      ARG  98 -22.851  10.071   3.005
  795    HD3  ARG  98           HD1      ARG  98 -22.724   8.481   3.755
  796    HE   ARG  98           HE       ARG  98 -25.201   9.968   3.266
  797   HH11  ARG  98          HH11      ARG  98 -23.660   6.876   4.142
  798   HH12  ARG  98          HH12      ARG  98 -24.936   5.909   3.614
  799   HH21  ARG  98          HH21      ARG  98 -26.990   8.640   2.535
  800   HH22  ARG  98          HH22      ARG  98 -26.928   6.950   2.643
  801    H    ASP  99           HN       ASP  99 -20.421   8.443   6.825
  802    HA   ASP  99           HA       ASP  99 -22.455   7.405   8.591
  803    HB2  ASP  99           HB2      ASP  99 -20.455   6.037   6.795
  804    HB3  ASP  99           HB1      ASP  99 -21.530   5.172   7.892
  805    H    THR 100           HN       THR 100 -22.068   7.513  10.579
  806    HA   THR 100           HA       THR 100 -19.340   7.268  11.630
  807    HB   THR 100           HB       THR 100 -21.867   7.962  12.982
  808    HG1  THR 100           HG1      THR 100 -20.900   9.275  11.043
  809   HG21  THR 100          HG21      THR 100 -18.995   8.666  13.647
  810   HG22  THR 100          HG22      THR 100 -19.987   7.460  14.468
  811   HG23  THR 100          HG23      THR 100 -20.397   9.170  14.590
  812    H    VAL 101           HN       VAL 101 -18.910   5.224  12.239
  813    HA   VAL 101           HA       VAL 101 -21.193   3.569  12.999
  814    HB   VAL 101           HB       VAL 101 -19.856   1.618  12.257
  815   HG11  VAL 101          HG11      VAL 101 -20.106   2.184   9.821
  816   HG12  VAL 101          HG12      VAL 101 -20.351   3.878  10.327
  817   HG13  VAL 101          HG13      VAL 101 -21.496   2.651  10.814
  818   HG21  VAL 101          HG21      VAL 101 -17.981   3.757  11.242
  819   HG22  VAL 101          HG22      VAL 101 -17.857   2.038  10.858
  820   HG23  VAL 101          HG23      VAL 101 -17.609   2.601  12.516
  821    H    GLU 102           HN       GLU 102 -18.497   5.028  14.309
  822    HA   GLU 102           HA       GLU 102 -18.802   3.336  16.636
  823    HB2  GLU 102           HB3      GLU 102 -16.183   4.378  15.514
  824    HB3  GLU 102           HB2      GLU 102 -16.352   3.743  17.142
  825    HG2  GLU 102           HG3      GLU 102 -17.095   1.597  16.196
  826    HG3  GLU 102           HG2      GLU 102 -16.824   2.235  14.579
  Start of MODEL   20
    1    H1   GLY   1           HT1      GLY   1   1.879 -14.152  29.997
    2    H2   GLY   1           HT2      GLY   1   0.414 -14.607  30.748
    3    H3   GLY   1           HT3      GLY   1   0.458 -13.352  29.617
    4    HA2  GLY   1           HA2      GLY   1   1.113 -16.118  28.911
    5    HA3  GLY   1           HA3      GLY   1  -0.466 -15.371  28.695
    6    H    HIS   2           HN       HIS   2   1.723 -16.329  26.794
    7    HA   HIS   2           HA       HIS   2   2.368 -13.831  25.484
    8    HB2  HIS   2           HB2      HIS   2   3.111 -16.685  24.798
    9    HB3  HIS   2           HB1      HIS   2   3.510 -15.319  23.772
   10    HD1  HIS   2           HD1      HIS   2   5.291 -17.418  25.835
   11    HD2  HIS   2           HD2      HIS   2   4.830 -13.282  25.830
   12    HE1  HIS   2           HE1      HIS   2   7.319 -16.494  26.981
   13    H    MET   3           HN       MET   3   0.784 -16.862  24.566
   14    HA   MET   3           HA       MET   3  -0.586 -17.456  22.928
   15    HB2  MET   3           HB2      MET   3  -2.240 -15.985  24.074
   16    HB3  MET   3           HB1      MET   3  -1.676 -14.622  23.117
   17    HG2  MET   3           HG2      MET   3  -2.468 -15.690  21.085
   18    HG3  MET   3           HG1      MET   3  -2.956 -17.113  22.000
   19    HE1  MET   3           HE1      MET   3  -3.645 -13.300  21.309
   20    HE2  MET   3           HE2      MET   3  -3.365 -13.323  23.051
   21    HE3  MET   3           HE3      MET   3  -4.972 -12.972  22.422
   22    H    LEU   4           HN       LEU   4   1.050 -17.804  21.615
   23    HA   LEU   4           HA       LEU   4   2.159 -15.740  19.969
   24    HB2  LEU   4           HB2      LEU   4   2.681 -18.716  20.012
   25    HB3  LEU   4           HB1      LEU   4   3.594 -17.541  19.091
   26    HG   LEU   4           HG       LEU   4   3.434 -17.628  22.105
   27   HD11  LEU   4          HD11      LEU   4   5.743 -18.392  21.996
   28   HD12  LEU   4          HD12      LEU   4   5.646 -18.434  20.236
   29   HD13  LEU   4          HD13      LEU   4   4.651 -19.525  21.201
   30   HD21  LEU   4          HD21      LEU   4   5.112 -15.941  20.248
   31   HD22  LEU   4          HD22      LEU   4   5.267 -16.002  22.004
   32   HD23  LEU   4          HD23      LEU   4   3.795 -15.365  21.272
   33    H    ARG   5           HN       ARG   5   2.659 -17.039  17.619
   34    HA   ARG   5           HA       ARG   5   1.916 -17.248  15.571
   35    HB2  ARG   5           HB2      ARG   5  -0.652 -18.194  16.850
   36    HB3  ARG   5           HB1      ARG   5  -0.460 -18.067  15.114
   37    HG2  ARG   5           HG2      ARG   5   1.084 -19.846  16.987
   38    HG3  ARG   5           HG1      ARG   5  -0.114 -20.337  15.788
   39    HD2  ARG   5           HD2      ARG   5   2.639 -19.193  15.293
   40    HD3  ARG   5           HD1      ARG   5   2.045 -20.789  14.864
   41    HE   ARG   5           HE       ARG   5   0.442 -18.873  13.589
   42   HH11  ARG   5          HH11      ARG   5   3.739 -20.193  13.353
   43   HH12  ARG   5          HH12      ARG   5   3.940 -19.754  11.742
   44   HH21  ARG   5          HH21      ARG   5   0.748 -18.228  11.416
   45   HH22  ARG   5          HH22      ARG   5   2.211 -18.547  10.591
   46    H    THR   6           HN       THR   6   2.220 -15.349  14.982
   47    HA   THR   6           HA       THR   6   0.764 -13.121  15.696
   48    HB   THR   6           HB       THR   6   3.040 -12.959  14.843
   49    HG1  THR   6           HG1      THR   6   1.931 -11.113  14.578
   50   HG21  THR   6          HG21      THR   6   1.917 -13.794  12.158
   51   HG22  THR   6          HG22      THR   6   3.007 -14.745  13.164
   52   HG23  THR   6          HG23      THR   6   3.566 -13.235  12.445
   53    H    ALA   7           HN       ALA   7  -1.074 -12.316  15.056
   54    HA   ALA   7           HA       ALA   7  -2.733 -13.710  13.215
   55    HB1  ALA   7           HB1      ALA   7  -3.135 -11.057  14.613
   56    HB2  ALA   7           HB2      ALA   7  -3.679 -12.629  15.198
   57    HB3  ALA   7           HB3      ALA   7  -4.375 -11.946  13.728
   58    H    GLY   8           HN       GLY   8  -2.325 -13.568  11.149
   59    HA2  GLY   8           HA3      GLY   8  -1.999 -10.914   9.983
   60    HA3  GLY   8           HA2      GLY   8  -0.862 -12.195   9.566
   61    H    ARG   9           HN       ARG   9  -3.645 -10.692   8.667
   62    HA   ARG   9           HA       ARG   9  -4.183 -12.700   6.695
   63    HB2  ARG   9           HB2      ARG   9  -5.683 -13.344   8.598
   64    HB3  ARG   9           HB1      ARG   9  -6.346 -11.719   8.590
   65    HG2  ARG   9           HG2      ARG   9  -7.151 -12.076   6.294
   66    HG3  ARG   9           HG1      ARG   9  -6.546 -13.728   6.357
   67    HD2  ARG   9           HD2      ARG   9  -8.067 -14.245   8.158
   68    HD3  ARG   9           HD1      ARG   9  -8.620 -12.567   8.208
   69    HE   ARG   9           HE       ARG   9  -8.914 -13.664   5.623
   70   HH11  ARG   9          HH11      ARG   9 -10.419 -13.719   8.811
   71   HH12  ARG   9          HH12      ARG   9 -11.978 -14.041   8.240
   72   HH21  ARG   9          HH21      ARG   9 -11.045 -14.121   4.816
   73   HH22  ARG   9          HH22      ARG   9 -12.354 -14.266   5.893
   74    H    ASP  10           HN       ASP  10  -5.195 -11.752   4.917
   75    HA   ASP  10           HA       ASP  10  -6.160 -10.283   3.551
   76    HB2  ASP  10           HB2      ASP  10  -7.601  -9.546   5.429
   77    HB3  ASP  10           HB1      ASP  10  -6.379  -8.364   5.870
   78    H    GLY  11           HN       GLY  11  -4.001  -8.587   5.736
   79    HA2  GLY  11           HA3      GLY  11  -3.015  -6.616   4.062
   80    HA3  GLY  11           HA2      GLY  11  -2.083  -7.352   5.358
   81    H    LEU  12           HN       LEU  12  -1.232  -9.667   4.692
   82    HA   LEU  12           HA       LEU  12   0.185  -9.180   2.230
   83    HB2  LEU  12           HB2      LEU  12   1.377  -9.997   4.189
   84    HB3  LEU  12           HB1      LEU  12   0.392 -11.466   4.106
   85    HG   LEU  12           HG       LEU  12   1.399 -12.017   1.932
   86   HD11  LEU  12          HD11      LEU  12   3.126  -9.599   2.409
   87   HD12  LEU  12          HD12      LEU  12   1.921  -9.798   1.130
   88   HD13  LEU  12          HD13      LEU  12   3.370 -10.800   1.141
   89   HD21  LEU  12          HD21      LEU  12   3.612 -12.608   2.739
   90   HD22  LEU  12          HD22      LEU  12   2.354 -12.910   3.950
   91   HD23  LEU  12          HD23      LEU  12   3.404 -11.495   4.098
   92    H    CYS  13           HN       CYS  13  -1.466  -9.270   1.154
   93    HA   CYS  13           HA       CYS  13  -1.929 -11.443  -0.559
   94    HB2  CYS  13           HB2      CYS  13  -3.288 -12.341   1.321
   95    HB3  CYS  13           HB1      CYS  13  -4.247 -10.870   1.334
   96    HG   CYS  13           HG       CYS  13  -5.342 -11.373  -1.244
   97    H    ARG  14           HN       ARG  14  -4.041  -8.924   0.856
   98    HA   ARG  14           HA       ARG  14  -5.099  -7.954  -1.554
   99    HB2  ARG  14           HB2      ARG  14  -6.058  -7.576   0.742
  100    HB3  ARG  14           HB1      ARG  14  -4.744  -6.450   1.055
  101    HG2  ARG  14           HG2      ARG  14  -5.536  -5.104  -0.887
  102    HG3  ARG  14           HG1      ARG  14  -6.925  -6.180  -0.994
  103    HD2  ARG  14           HD2      ARG  14  -6.192  -4.417   1.342
  104    HD3  ARG  14           HD1      ARG  14  -7.496  -4.139   0.197
  105    HE   ARG  14           HE       ARG  14  -7.451  -6.489   1.957
  106   HH11  ARG  14          HH11      ARG  14  -9.170  -3.571   0.817
  107   HH12  ARG  14          HH12      ARG  14 -10.580  -3.950   1.675
  108   HH21  ARG  14          HH21      ARG  14  -9.308  -6.953   3.033
  109   HH22  ARG  14          HH22      ARG  14 -10.683  -5.919   3.020
  110    H    LEU  15           HN       LEU  15  -2.438  -6.889   0.472
  111    HA   LEU  15           HA       LEU  15  -1.701  -4.551  -0.737
  112    HB2  LEU  15           HB2      LEU  15  -0.893  -5.336   1.395
  113    HB3  LEU  15           HB1      LEU  15  -0.072  -6.673   0.633
  114    HG   LEU  15           HG       LEU  15   1.518  -5.127  -0.388
  115   HD11  LEU  15          HD11      LEU  15   0.019  -3.209  -0.610
  116   HD12  LEU  15          HD12      LEU  15   1.507  -2.803   0.243
  117   HD13  LEU  15          HD13      LEU  15   0.013  -3.031   1.144
  118   HD21  LEU  15          HD21      LEU  15   1.114  -4.743   2.559
  119   HD22  LEU  15          HD22      LEU  15   2.603  -4.419   1.673
  120   HD23  LEU  15          HD23      LEU  15   1.989  -6.068   1.793
  121    H    SER  16           HN       SER  16  -0.648  -7.857  -1.486
  122    HA   SER  16           HA       SER  16   1.241  -7.116  -3.437
  123    HB2  SER  16           HB2      SER  16   1.223  -9.312  -2.239
  124    HB3  SER  16           HB1      SER  16  -0.233  -9.750  -3.120
  125    HG   SER  16           HG       SER  16   1.284 -10.611  -4.292
  126    H    THR  17           HN       THR  17  -2.172  -8.152  -3.626
  127    HA   THR  17           HA       THR  17  -2.455  -8.293  -6.389
  128    HB   THR  17           HB       THR  17  -4.541  -7.476  -4.352
  129    HG1  THR  17           HG1      THR  17  -3.149  -9.785  -4.831
  130   HG21  THR  17          HG21      THR  17  -4.787  -8.949  -6.990
  131   HG22  THR  17          HG22      THR  17  -5.260  -7.273  -6.717
  132   HG23  THR  17          HG23      THR  17  -6.116  -8.577  -5.890
  133    H    TYR  18           HN       TYR  18  -2.808  -5.527  -4.215
  134    HA   TYR  18           HA       TYR  18  -3.680  -3.775  -6.305
  135    HB2  TYR  18           HB2      TYR  18  -2.877  -3.293  -3.445
  136    HB3  TYR  18           HB1      TYR  18  -3.230  -1.959  -4.535
  137    HD1  TYR  18           HD1      TYR  18  -4.799  -5.222  -3.610
  138    HD2  TYR  18           HD2      TYR  18  -5.365  -1.083  -4.340
  139    HE1  TYR  18           HE1      TYR  18  -7.187  -5.463  -3.097
  140    HE2  TYR  18           HE2      TYR  18  -7.743  -1.312  -3.824
  141    HH   TYR  18           HH       TYR  18  -9.474  -3.070  -3.788
  142    H    LEU  19           HN       LEU  19  -0.602  -4.407  -4.717
  143    HA   LEU  19           HA       LEU  19   0.711  -2.245  -5.936
  144    HB2  LEU  19           HB2      LEU  19   1.762  -4.709  -4.597
  145    HB3  LEU  19           HB1      LEU  19   2.826  -3.511  -5.304
  146    HG   LEU  19           HG       LEU  19   0.860  -2.944  -3.059
  147   HD11  LEU  19          HD11      LEU  19   2.612  -4.442  -2.336
  148   HD12  LEU  19          HD12      LEU  19   2.836  -2.834  -1.647
  149   HD13  LEU  19          HD13      LEU  19   3.841  -3.362  -3.000
  150   HD21  LEU  19          HD21      LEU  19   1.361  -0.983  -4.465
  151   HD22  LEU  19          HD22      LEU  19   3.083  -1.260  -4.243
  152   HD23  LEU  19          HD23      LEU  19   2.071  -0.831  -2.866
  153    H    GLU  20           HN       GLU  20  -0.228  -5.236  -7.227
  154    HA   GLU  20           HA       GLU  20   1.830  -5.581  -9.133
  155    HB2  GLU  20           HB3      GLU  20  -1.018  -6.548  -9.193
  156    HB3  GLU  20           HB2      GLU  20   0.219  -7.034 -10.345
  157    HG2  GLU  20           HG3      GLU  20   1.553  -7.948  -8.528
  158    HG3  GLU  20           HG2      GLU  20   0.306  -7.474  -7.379
  159    H    GLU  21           HN       GLU  21  -0.722  -3.349  -9.019
  160    HA   GLU  21           HA       GLU  21  -0.790  -2.888 -11.855
  161    HB2  GLU  21           HB3      GLU  21  -1.988  -1.374  -9.540
  162    HB3  GLU  21           HB2      GLU  21  -2.227  -0.932 -11.222
  163    HG2  GLU  21           HG3      GLU  21  -3.258  -3.121 -11.641
  164    HG3  GLU  21           HG2      GLU  21  -3.036  -3.530  -9.942
  165    H    LEU  22           HN       LEU  22   1.335  -2.061  -9.411
  166    HA   LEU  22           HA       LEU  22   2.207   0.368 -10.712
  167    HB2  LEU  22           HB2      LEU  22   2.992  -0.945  -8.105
  168    HB3  LEU  22           HB1      LEU  22   3.818   0.435  -8.774
  169    HG   LEU  22           HG       LEU  22   1.654   1.680  -8.652
  170   HD11  LEU  22          HD11      LEU  22   0.098  -0.159  -8.520
  171   HD12  LEU  22          HD12      LEU  22  -0.075   0.924  -7.139
  172   HD13  LEU  22          HD13      LEU  22   0.764  -0.615  -6.950
  173   HD21  LEU  22          HD21      LEU  22   3.425   2.030  -7.046
  174   HD22  LEU  22          HD22      LEU  22   2.849   0.669  -6.084
  175   HD23  LEU  22          HD23      LEU  22   1.856   2.119  -6.245
  176    H    GLU  23           HN       GLU  23   3.965   0.414 -11.943
  177    HA   GLU  23           HA       GLU  23   5.446  -2.070 -12.324
  178    HB2  GLU  23           HB3      GLU  23   6.264  -1.090 -14.376
  179    HB3  GLU  23           HB2      GLU  23   4.523  -0.828 -14.256
  180    HG2  GLU  23           HG3      GLU  23   4.703   1.393 -14.070
  181    HG3  GLU  23           HG2      GLU  23   6.287   1.313 -13.286
  182    H    ALA  24           HN       ALA  24   7.895  -1.106 -13.198
  183    HA   ALA  24           HA       ALA  24   9.399  -0.827 -10.918
  184    HB1  ALA  24           HB1      ALA  24  10.316  -1.497 -13.078
  185    HB2  ALA  24           HB2      ALA  24  11.250  -0.183 -12.366
  186    HB3  ALA  24           HB3      ALA  24  10.117   0.148 -13.677
  187    H    VAL  25           HN       VAL  25   8.477   1.857 -13.138
  188    HA   VAL  25           HA       VAL  25   9.724   3.815 -11.507
  189    HB   VAL  25           HB       VAL  25   9.313   4.308 -13.887
  190   HG11  VAL  25          HG11      VAL  25   7.167   3.203 -14.190
  191   HG12  VAL  25          HG12      VAL  25   7.086   4.885 -14.717
  192   HG13  VAL  25          HG13      VAL  25   6.392   4.411 -13.165
  193   HG21  VAL  25          HG21      VAL  25   8.451   6.596 -13.675
  194   HG22  VAL  25          HG22      VAL  25   9.565   6.202 -12.355
  195   HG23  VAL  25          HG23      VAL  25   7.823   6.186 -12.080
  196    H    GLU  26           HN       GLU  26   6.570   2.450 -11.462
  197    HA   GLU  26           HA       GLU  26   5.380   4.495  -9.864
  198    HB2  GLU  26           HB3      GLU  26   4.520   1.658 -10.390
  199    HB3  GLU  26           HB2      GLU  26   3.516   2.906  -9.660
  200    HG2  GLU  26           HG3      GLU  26   4.707   3.014 -12.408
  201    HG3  GLU  26           HG2      GLU  26   3.041   2.560 -12.066
  202    H    LEU  27           HN       LEU  27   6.643   1.261  -9.258
  203    HA   LEU  27           HA       LEU  27   6.291   1.288  -6.458
  204    HB2  LEU  27           HB2      LEU  27   8.185  -0.260  -8.216
  205    HB3  LEU  27           HB1      LEU  27   8.022  -0.532  -6.499
  206    HG   LEU  27           HG       LEU  27   5.822  -0.930  -8.534
  207   HD11  LEU  27          HD11      LEU  27   7.525  -2.925  -7.051
  208   HD12  LEU  27          HD12      LEU  27   7.623  -2.551  -8.773
  209   HD13  LEU  27          HD13      LEU  27   6.172  -3.308  -8.116
  210   HD21  LEU  27          HD21      LEU  27   5.955  -1.570  -5.584
  211   HD22  LEU  27          HD22      LEU  27   4.661  -2.052  -6.675
  212   HD23  LEU  27          HD23      LEU  27   4.937  -0.344  -6.340
  213    H    LYS  28           HN       LYS  28   8.671   2.579  -8.583
  214    HA   LYS  28           HA       LYS  28  10.812   2.934  -6.819
  215    HB2  LYS  28           HB2      LYS  28  10.936   3.169  -9.290
  216    HB3  LYS  28           HB1      LYS  28  10.018   4.656  -9.164
  217    HG2  LYS  28           HG2      LYS  28  11.814   5.594  -7.776
  218    HG3  LYS  28           HG1      LYS  28  12.759   4.138  -8.075
  219    HD2  LYS  28           HD2      LYS  28  12.677   4.582 -10.476
  220    HD3  LYS  28           HD1      LYS  28  11.738   6.047 -10.171
  221    HE2  LYS  28           HE2      LYS  28  13.585   6.919  -8.806
  222    HE3  LYS  28           HE1      LYS  28  14.515   5.473  -9.188
  223    HZ1  LYS  28           HZ1      LYS  28  13.559   7.487 -11.140
  224    HZ2  LYS  28           HZ2      LYS  28  14.386   6.082 -11.525
  225    HZ3  LYS  28           HZ3      LYS  28  15.151   7.275 -10.617
  226    H    LYS  29           HN       LYS  29   8.088   4.985  -7.657
  227    HA   LYS  29           HA       LYS  29   8.768   7.259  -6.063
  228    HB2  LYS  29           HB2      LYS  29   6.015   6.279  -6.743
  229    HB3  LYS  29           HB1      LYS  29   6.500   7.941  -6.431
  230    HG2  LYS  29           HG2      LYS  29   7.708   8.017  -8.532
  231    HG3  LYS  29           HG1      LYS  29   7.296   6.326  -8.838
  232    HD2  LYS  29           HD2      LYS  29   4.888   6.968  -8.690
  233    HD3  LYS  29           HD1      LYS  29   5.399   8.654  -8.611
  234    HE2  LYS  29           HE2      LYS  29   5.970   6.733 -10.860
  235    HE3  LYS  29           HE1      LYS  29   4.730   7.978 -10.866
  236    HZ1  LYS  29           HZ1      LYS  29   6.664   8.684 -12.054
  237    HZ2  LYS  29           HZ2      LYS  29   7.657   8.449 -10.705
  238    HZ3  LYS  29           HZ3      LYS  29   6.477   9.649 -10.689
  239    H    PHE  30           HN       PHE  30   6.762   4.446  -5.664
  240    HA   PHE  30           HA       PHE  30   5.704   4.961  -3.167
  241    HB2  PHE  30           HB2      PHE  30   4.493   3.378  -4.241
  242    HB3  PHE  30           HB1      PHE  30   5.893   2.705  -5.035
  243    HD1  PHE  30           HD1      PHE  30   3.899   2.616  -1.846
  244    HD2  PHE  30           HD2      PHE  30   6.873   0.790  -4.284
  245    HE1  PHE  30           HE1      PHE  30   3.751   0.619  -0.515
  246    HE2  PHE  30           HE2      PHE  30   6.741  -1.239  -2.909
  247    HZ   PHE  30           HZ       PHE  30   5.182  -1.338  -1.032
  248    H    LYS  31           HN       LYS  31   8.588   3.046  -4.001
  249    HA   LYS  31           HA       LYS  31   9.166   2.360  -1.315
  250    HB2  LYS  31           HB2      LYS  31  11.268   1.532  -2.119
  251    HB3  LYS  31           HB1      LYS  31  10.030   1.151  -3.319
  252    HG2  LYS  31           HG2      LYS  31  10.841   3.071  -4.663
  253    HG3  LYS  31           HG1      LYS  31  12.130   3.311  -3.486
  254    HD2  LYS  31           HD2      LYS  31  12.924   1.012  -3.932
  255    HD3  LYS  31           HD1      LYS  31  11.667   0.837  -5.155
  256    HE2  LYS  31           HE2      LYS  31  13.684   1.368  -6.284
  257    HE3  LYS  31           HE1      LYS  31  12.694   2.820  -6.333
  258    HZ1  LYS  31           HZ1      LYS  31  15.034   2.285  -4.594
  259    HZ2  LYS  31           HZ2      LYS  31  14.054   3.653  -4.398
  260    HZ3  LYS  31           HZ3      LYS  31  14.912   3.433  -5.802
  261    H    LEU  32           HN       LEU  32   9.937   5.084  -3.292
  262    HA   LEU  32           HA       LEU  32  11.989   6.250  -1.823
  263    HB2  LEU  32           HB2      LEU  32  11.526   6.841  -4.023
  264    HB3  LEU  32           HB1      LEU  32   9.844   7.170  -3.652
  265    HG   LEU  32           HG       LEU  32  11.007   8.855  -2.026
  266   HD11  LEU  32          HD11      LEU  32  12.909   9.998  -3.116
  267   HD12  LEU  32          HD12      LEU  32  12.931   8.700  -4.309
  268   HD13  LEU  32          HD13      LEU  32  13.266   8.341  -2.610
  269   HD21  LEU  32          HD21      LEU  32  10.345   9.366  -4.912
  270   HD22  LEU  32          HD22      LEU  32  10.657  10.645  -3.730
  271   HD23  LEU  32          HD23      LEU  32   9.319   9.524  -3.476
  272    H    TYR  33           HN       TYR  33   8.477   6.539  -1.844
  273    HA   TYR  33           HA       TYR  33   8.335   8.675  -0.092
  274    HB2  TYR  33           HB2      TYR  33   6.561   8.303  -1.659
  275    HB3  TYR  33           HB1      TYR  33   6.217   6.719  -0.978
  276    HD1  TYR  33           HD1      TYR  33   6.155  10.347  -0.179
  277    HD2  TYR  33           HD2      TYR  33   4.635   6.486   0.749
  278    HE1  TYR  33           HE1      TYR  33   4.510  11.362   1.330
  279    HE2  TYR  33           HE2      TYR  33   2.979   7.489   2.263
  280    HH   TYR  33           HH       TYR  33   2.768   9.577   3.577
  281    H    LEU  34           HN       LEU  34   8.459   5.230   0.496
  282    HA   LEU  34           HA       LEU  34   7.938   5.849   3.312
  283    HB2  LEU  34           HB2      LEU  34   6.882   3.630   3.582
  284    HB3  LEU  34           HB1      LEU  34   6.030   4.772   2.569
  285    HG   LEU  34           HG       LEU  34   7.063   3.505   0.587
  286   HD11  LEU  34          HD11      LEU  34   8.678   2.160   1.795
  287   HD12  LEU  34          HD12      LEU  34   7.511   1.144   0.951
  288   HD13  LEU  34          HD13      LEU  34   7.378   1.378   2.695
  289   HD21  LEU  34          HD21      LEU  34   5.230   1.936   0.594
  290   HD22  LEU  34          HD22      LEU  34   4.736   3.538   1.157
  291   HD23  LEU  34          HD23      LEU  34   4.986   2.227   2.320
  292    H    GLY  35           HN       GLY  35   9.975   3.942   1.206
  293    HA2  GLY  35           HA3      GLY  35  10.938   2.525   3.489
  294    HA3  GLY  35           HA2      GLY  35  11.410   2.221   1.821
  295    H    THR  36           HN       THR  36  11.860   5.296   1.732
  296    HA   THR  36           HA       THR  36  14.348   5.340   3.263
  297    HB   THR  36           HB       THR  36  14.891   4.580   0.962
  298    HG1  THR  36           HG1      THR  36  16.023   6.541   2.258
  299   HG21  THR  36          HG21      THR  36  13.780   7.255   0.104
  300   HG22  THR  36          HG22      THR  36  13.097   5.669  -0.252
  301   HG23  THR  36          HG23      THR  36  14.654   6.132  -0.942
  302    H    ALA  37           HN       ALA  37  11.630   6.636   3.327
  303    HA   ALA  37           HA       ALA  37  12.207   9.409   2.760
  304    HB1  ALA  37           HB1      ALA  37  10.009   8.505   2.235
  305    HB2  ALA  37           HB2      ALA  37   9.894   9.793   3.431
  306    HB3  ALA  37           HB3      ALA  37   9.771   8.103   3.925
  307    H    THR  38           HN       THR  38  12.526  10.968   4.236
  308    HA   THR  38           HA       THR  38  13.513  10.215   6.777
  309    HB   THR  38           HB       THR  38  12.943  12.999   5.709
  310    HG1  THR  38           HG1      THR  38  15.048  11.159   5.277
  311   HG21  THR  38          HG21      THR  38  13.550  12.878   8.111
  312   HG22  THR  38          HG22      THR  38  14.824  13.650   7.164
  313   HG23  THR  38          HG23      THR  38  15.006  11.977   7.688
  314    H    GLU  39           HN       GLU  39  10.476  11.112   5.573
  315    HA   GLU  39           HA       GLU  39   9.419  12.001   8.085
  316    HB2  GLU  39           HB3      GLU  39   7.215  12.056   6.997
  317    HB3  GLU  39           HB2      GLU  39   8.433  12.897   6.059
  318    HG2  GLU  39           HG3      GLU  39   8.579  10.933   4.571
  319    HG3  GLU  39           HG2      GLU  39   7.282  10.176   5.497
  320    H    LEU  40           HN       LEU  40  10.229   9.051   6.954
  321    HA   LEU  40           HA       LEU  40   8.372   7.643   8.731
  322    HB2  LEU  40           HB2      LEU  40  10.058   6.833   6.426
  323    HB3  LEU  40           HB1      LEU  40   9.763   5.679   7.710
  324    HG   LEU  40           HG       LEU  40   8.211   5.324   5.859
  325   HD11  LEU  40          HD11      LEU  40   6.106   5.350   7.048
  326   HD12  LEU  40          HD12      LEU  40   6.760   6.484   8.216
  327   HD13  LEU  40          HD13      LEU  40   7.422   4.852   8.115
  328   HD21  LEU  40          HD21      LEU  40   6.498   6.983   5.272
  329   HD22  LEU  40          HD22      LEU  40   8.124   7.569   4.919
  330   HD23  LEU  40          HD23      LEU  40   7.269   8.144   6.352
  331    H    GLY  41           HN       GLY  41  10.858   9.300   9.077
  332    HA2  GLY  41           HA3      GLY  41  12.276   9.528  10.880
  333    HA3  GLY  41           HA2      GLY  41  11.824   7.909  11.402
  334    H    GLU  42           HN       GLU  42  12.736   6.168  10.275
  335    HA   GLU  42           HA       GLU  42  15.596   6.616   9.768
  336    HB2  GLU  42           HB3      GLU  42  14.007   4.085  10.057
  337    HB3  GLU  42           HB2      GLU  42  15.745   4.181   9.872
  338    HG2  GLU  42           HG3      GLU  42  15.987   5.166  12.009
  339    HG3  GLU  42           HG2      GLU  42  14.235   5.376  12.167
  340    H    GLY  43           HN       GLY  43  12.696   5.546   8.180
  341    HA2  GLY  43           HA3      GLY  43  12.390   4.869   5.952
  342    HA3  GLY  43           HA2      GLY  43  14.141   5.017   5.699
  343    H    LYS  44           HN       LYS  44  11.618   3.015   6.880
  344    HA   LYS  44           HA       LYS  44  13.036   1.287   8.487
  345    HB2  LYS  44           HB2      LYS  44  10.363   1.181   7.247
  346    HB3  LYS  44           HB1      LYS  44  11.010  -0.311   7.905
  347    HG2  LYS  44           HG2      LYS  44   9.587   0.948   9.500
  348    HG3  LYS  44           HG1      LYS  44  11.222   0.665  10.087
  349    HD2  LYS  44           HD2      LYS  44  11.823   2.965   9.423
  350    HD3  LYS  44           HD1      LYS  44  10.166   3.224   8.886
  351    HE2  LYS  44           HE2      LYS  44  10.562   4.159  11.080
  352    HE3  LYS  44           HE1      LYS  44   9.362   2.859  11.131
  353    HZ1  LYS  44           HZ1      LYS  44  11.119   1.384  11.961
  354    HZ2  LYS  44           HZ2      LYS  44  10.835   2.662  12.981
  355    HZ3  LYS  44           HZ3      LYS  44  12.224   2.659  12.041
  356    H    ILE  45           HN       ILE  45  12.763   1.138   5.035
  357    HA   ILE  45           HA       ILE  45  13.442  -1.685   5.005
  358    HB   ILE  45           HB       ILE  45  13.245   0.130   2.598
  359   HG12  ILE  45          HG12      ILE  45  11.113   0.306   3.877
  360   HG13  ILE  45          HG11      ILE  45  10.899  -0.486   2.324
  361   HG21  ILE  45          HG21      ILE  45  14.272  -1.986   2.142
  362   HG22  ILE  45          HG22      ILE  45  12.621  -2.021   1.488
  363   HG23  ILE  45          HG23      ILE  45  12.983  -2.842   2.991
  364   HD11  ILE  45          HD11      ILE  45  10.846  -2.647   3.461
  365   HD12  ILE  45          HD12      ILE  45   9.593  -1.558   4.057
  366   HD13  ILE  45          HD13      ILE  45  11.058  -1.832   5.007
  367    HA   PRO  46           HA       PRO  46  17.814  -0.772   4.651
  368    HB2  PRO  46           HB2      PRO  46  18.541  -3.089   3.309
  369    HB3  PRO  46           HB1      PRO  46  18.428  -2.928   5.063
  370    HG2  PRO  46           HG2      PRO  46  16.491  -4.078   3.129
  371    HG3  PRO  46           HG1      PRO  46  16.883  -4.600   4.782
  372    HD2  PRO  46           HD2      PRO  46  14.638  -3.249   4.175
  373    HD3  PRO  46           HD1      PRO  46  15.457  -3.048   5.733
  374    H    TRP  47           HN       TRP  47  19.272  -0.241   3.159
  375    HA   TRP  47           HA       TRP  47  18.685   1.494   1.267
  376    HB2  TRP  47           HB2      TRP  47  21.143  -0.227   1.359
  377    HB3  TRP  47           HB1      TRP  47  20.996   1.280   0.469
  378    HD1  TRP  47           HD1      TRP  47  21.427   3.486   1.785
  379    HE1  TRP  47           HE1      TRP  47  22.031   4.045   4.226
  380    HE3  TRP  47           HE3      TRP  47  20.690  -1.121   3.918
  381    HZ2  TRP  47           HZ2      TRP  47  22.168   2.732   6.706
  382    HZ3  TRP  47           HZ3      TRP  47  21.072  -1.372   6.323
  383    HH2  TRP  47           HH2      TRP  47  21.798   0.513   7.691
  384    H    GLY  48           HN       GLY  48  19.087  -1.981   0.447
  385    HA2  GLY  48           HA3      GLY  48  18.560  -1.144  -2.328
  386    HA3  GLY  48           HA2      GLY  48  19.817  -2.297  -1.952
  387    H    SER  49           HN       SER  49  16.952  -2.613  -0.072
  388    HA   SER  49           HA       SER  49  16.585  -5.175  -1.340
  389    HB2  SER  49           HB2      SER  49  15.128  -3.949   0.991
  390    HB3  SER  49           HB1      SER  49  15.036  -5.638   0.485
  391    HG   SER  49           HG       SER  49  17.571  -4.602   0.848
  392    H    MET  50           HN       MET  50  15.094  -2.074  -1.595
  393    HA   MET  50           HA       MET  50  12.573  -3.197  -2.563
  394    HB2  MET  50           HB2      MET  50  13.387  -0.279  -2.384
  395    HB3  MET  50           HB1      MET  50  11.778  -0.942  -2.675
  396    HG2  MET  50           HG2      MET  50  11.633  -1.786  -0.504
  397    HG3  MET  50           HG1      MET  50  13.332  -1.387  -0.205
  398    HE1  MET  50           HE1      MET  50  14.255   1.032   0.172
  399    HE2  MET  50           HE2      MET  50  13.289   2.501   0.024
  400    HE3  MET  50           HE3      MET  50  13.656   1.546  -1.410
  401    H    GLU  51           HN       GLU  51  15.550  -2.163  -3.745
  402    HA   GLU  51           HA       GLU  51  15.038  -0.875  -6.129
  403    HB2  GLU  51           HB3      GLU  51  17.232  -2.807  -5.555
  404    HB3  GLU  51           HB2      GLU  51  17.174  -1.697  -6.912
  405    HG2  GLU  51           HG3      GLU  51  17.390  -1.065  -3.977
  406    HG3  GLU  51           HG2      GLU  51  18.596  -0.740  -5.221
  407    H    LYS  52           HN       LYS  52  15.339  -4.342  -5.650
  408    HA   LYS  52           HA       LYS  52  14.384  -4.710  -8.416
  409    HB2  LYS  52           HB2      LYS  52  15.808  -6.658  -6.622
  410    HB3  LYS  52           HB1      LYS  52  15.254  -7.006  -8.255
  411    HG2  LYS  52           HG2      LYS  52  16.776  -5.236  -9.086
  412    HG3  LYS  52           HG1      LYS  52  17.378  -5.042  -7.439
  413    HD2  LYS  52           HD2      LYS  52  17.482  -7.566  -9.082
  414    HD3  LYS  52           HD1      LYS  52  18.845  -6.493  -8.782
  415    HE2  LYS  52           HE2      LYS  52  18.683  -6.973  -6.373
  416    HE3  LYS  52           HE1      LYS  52  17.317  -8.041  -6.678
  417    HZ1  LYS  52           HZ1      LYS  52  19.355  -9.288  -6.457
  418    HZ2  LYS  52           HZ2      LYS  52  20.069  -8.397  -7.694
  419    HZ3  LYS  52           HZ3      LYS  52  18.769  -9.416  -8.037
  420    H    ALA  53           HN       ALA  53  12.990  -4.310  -5.711
  421    HA   ALA  53           HA       ALA  53  11.624  -6.839  -5.404
  422    HB1  ALA  53           HB1      ALA  53  11.095  -4.229  -3.985
  423    HB2  ALA  53           HB2      ALA  53  12.175  -5.504  -3.419
  424    HB3  ALA  53           HB3      ALA  53  10.445  -5.811  -3.551
  425    H    GLY  54           HN       GLY  54   9.681  -7.371  -6.102
  426    HA2  GLY  54           HA3      GLY  54   8.247  -5.516  -7.816
  427    HA3  GLY  54           HA2      GLY  54   8.108  -7.286  -7.731
  428    HA   PRO  55           HA       PRO  55   4.504  -5.145  -5.528
  429    HB2  PRO  55           HB2      PRO  55   3.298  -7.567  -6.754
  430    HB3  PRO  55           HB1      PRO  55   2.656  -5.926  -6.639
  431    HG2  PRO  55           HG2      PRO  55   3.649  -6.860  -8.937
  432    HG3  PRO  55           HG1      PRO  55   3.885  -5.173  -8.442
  433    HD2  PRO  55           HD2      PRO  55   5.870  -7.425  -8.434
  434    HD3  PRO  55           HD1      PRO  55   6.099  -5.690  -8.675
  435    H    LEU  56           HN       LEU  56   5.237  -8.567  -5.865
  436    HA   LEU  56           HA       LEU  56   3.977  -9.408  -3.414
  437    HB2  LEU  56           HB2      LEU  56   4.315 -10.909  -5.322
  438    HB3  LEU  56           HB1      LEU  56   6.046 -10.742  -5.143
  439    HG   LEU  56           HG       LEU  56   5.891 -11.862  -2.942
  440   HD11  LEU  56          HD11      LEU  56   3.842 -13.073  -2.378
  441   HD12  LEU  56          HD12      LEU  56   3.025 -12.314  -3.745
  442   HD13  LEU  56          HD13      LEU  56   3.587 -11.326  -2.399
  443   HD21  LEU  56          HD21      LEU  56   6.484 -13.061  -4.952
  444   HD22  LEU  56          HD22      LEU  56   4.787 -13.357  -5.308
  445   HD23  LEU  56          HD23      LEU  56   5.537 -14.100  -3.886
  446    H    GLU  57           HN       GLU  57   7.259  -8.786  -4.393
  447    HA   GLU  57           HA       GLU  57   8.482  -9.531  -1.956
  448    HB2  GLU  57           HB3      GLU  57   9.490  -7.721  -4.148
  449    HB3  GLU  57           HB2      GLU  57  10.483  -8.532  -2.933
  450    HG2  GLU  57           HG3      GLU  57   9.880 -10.681  -3.799
  451    HG3  GLU  57           HG2      GLU  57   8.737  -9.949  -4.921
  452    H    MET  58           HN       MET  58   7.477  -6.458  -3.335
  453    HA   MET  58           HA       MET  58   8.282  -4.725  -1.285
  454    HB2  MET  58           HB2      MET  58   5.984  -4.610  -3.223
  455    HB3  MET  58           HB1      MET  58   6.343  -3.291  -2.120
  456    HG2  MET  58           HG2      MET  58   8.293  -4.410  -4.085
  457    HG3  MET  58           HG1      MET  58   7.263  -3.073  -4.514
  458    HE1  MET  58           HE1      MET  58  10.474  -1.068  -4.182
  459    HE2  MET  58           HE2      MET  58   8.901  -1.199  -4.945
  460    HE3  MET  58           HE3      MET  58  10.050  -2.530  -5.083
  461    H    ALA  59           HN       ALA  59   5.297  -6.533  -1.792
  462    HA   ALA  59           HA       ALA  59   3.875  -5.633   0.407
  463    HB1  ALA  59           HB1      ALA  59   2.891  -6.982  -1.397
  464    HB2  ALA  59           HB2      ALA  59   2.549  -7.681   0.185
  465    HB3  ALA  59           HB3      ALA  59   3.804  -8.384  -0.839
  466    H    GLN  60           HN       GLN  60   6.196  -8.256   0.123
  467    HA   GLN  60           HA       GLN  60   5.908  -9.099   2.818
  468    HB2  GLN  60           HB2      GLN  60   8.201  -9.625   0.918
  469    HB3  GLN  60           HB1      GLN  60   7.929 -10.461   2.441
  470    HG2  GLN  60           HG2      GLN  60   5.720 -11.219   1.517
  471    HG3  GLN  60           HG1      GLN  60   6.211 -10.529  -0.015
  472   HE21  GLN  60          HE21      GLN  60   6.821 -13.091   2.274
  473   HE22  GLN  60          HE22      GLN  60   7.748 -14.077   1.222
  474    H    LEU  61           HN       LEU  61   8.080  -6.894   1.186
  475    HA   LEU  61           HA       LEU  61   9.785  -6.362   3.350
  476    HB2  LEU  61           HB2      LEU  61   9.184  -5.106   0.764
  477    HB3  LEU  61           HB1      LEU  61   9.855  -3.969   1.886
  478    HG   LEU  61           HG       LEU  61  11.866  -5.354   2.111
  479   HD11  LEU  61          HD11      LEU  61  10.577  -7.172   0.084
  480   HD12  LEU  61          HD12      LEU  61  10.899  -7.564   1.774
  481   HD13  LEU  61          HD13      LEU  61  12.240  -7.279   0.665
  482   HD21  LEU  61          HD21      LEU  61  12.717  -5.031  -0.148
  483   HD22  LEU  61          HD22      LEU  61  11.768  -3.654   0.412
  484   HD23  LEU  61          HD23      LEU  61  11.068  -4.802  -0.732
  485    H    LEU  62           HN       LEU  62   6.895  -4.558   2.287
  486    HA   LEU  62           HA       LEU  62   6.881  -2.752   4.380
  487    HB2  LEU  62           HB2      LEU  62   4.671  -3.845   2.668
  488    HB3  LEU  62           HB1      LEU  62   4.339  -2.722   3.946
  489    HG   LEU  62           HG       LEU  62   5.406  -0.873   2.721
  490   HD11  LEU  62          HD11      LEU  62   6.446  -2.899   0.828
  491   HD12  LEU  62          HD12      LEU  62   7.372  -2.147   2.116
  492   HD13  LEU  62          HD13      LEU  62   6.707  -1.140   0.806
  493   HD21  LEU  62          HD21      LEU  62   4.190  -0.911   0.693
  494   HD22  LEU  62          HD22      LEU  62   3.204  -1.658   1.955
  495   HD23  LEU  62          HD23      LEU  62   4.026  -2.666   0.767
  496    H    ILE  63           HN       ILE  63   5.333  -5.954   4.108
  497    HA   ILE  63           HA       ILE  63   3.927  -5.825   6.534
  498    HB   ILE  63           HB       ILE  63   3.786  -7.507   4.459
  499   HG12  ILE  63          HG12      ILE  63   2.159  -7.284   6.260
  500   HG13  ILE  63          HG11      ILE  63   2.286  -8.935   5.678
  501   HG21  ILE  63          HG21      ILE  63   5.907  -8.630   4.838
  502   HG22  ILE  63          HG22      ILE  63   4.555  -9.758   4.944
  503   HG23  ILE  63          HG23      ILE  63   5.340  -9.180   6.417
  504   HD11  ILE  63          HD11      ILE  63   3.437  -7.834   8.237
  505   HD12  ILE  63          HD12      ILE  63   3.664  -9.485   7.660
  506   HD13  ILE  63          HD13      ILE  63   2.047  -8.914   8.093
  507    H    THR  64           HN       THR  64   7.225  -6.790   5.879
  508    HA   THR  64           HA       THR  64   7.656  -8.044   8.409
  509    HB   THR  64           HB       THR  64   9.698  -6.983   6.435
  510    HG1  THR  64           HG1      THR  64   8.409  -8.516   5.460
  511   HG21  THR  64          HG21      THR  64   9.972  -9.072   8.615
  512   HG22  THR  64          HG22      THR  64  10.636  -7.441   8.681
  513   HG23  THR  64          HG23      THR  64  11.236  -8.583   7.483
  514    H    HIS  65           HN       HIS  65   8.030  -4.790   7.212
  515    HA   HIS  65           HA       HIS  65   9.434  -4.074   9.667
  516    HB2  HIS  65           HB2      HIS  65   9.042  -2.452   7.146
  517    HB3  HIS  65           HB1      HIS  65   9.911  -1.907   8.581
  518    HD1  HIS  65           HD1      HIS  65  12.301  -2.928   8.976
  519    HD2  HIS  65           HD2      HIS  65  10.383  -4.271   5.544
  520    HE1  HIS  65           HE1      HIS  65  14.038  -4.184   7.644
  521    H    PHE  66           HN       PHE  66   6.728  -2.807   7.742
  522    HA   PHE  66           HA       PHE  66   5.856  -1.087   9.818
  523    HB2  PHE  66           HB2      PHE  66   4.511  -1.988   7.273
  524    HB3  PHE  66           HB1      PHE  66   3.927  -0.692   8.321
  525    HD1  PHE  66           HD1      PHE  66   5.237   1.335   8.584
  526    HD2  PHE  66           HD2      PHE  66   6.300  -1.685   5.839
  527    HE1  PHE  66           HE1      PHE  66   6.778   2.915   7.457
  528    HE2  PHE  66           HE2      PHE  66   7.829  -0.139   4.684
  529    HZ   PHE  66           HZ       PHE  66   8.077   2.144   5.497
  530    H    GLY  67           HN       GLY  67   4.423  -4.054   8.484
  531    HA2  GLY  67           HA3      GLY  67   3.682  -5.555  10.424
  532    HA3  GLY  67           HA2      GLY  67   2.661  -4.172  10.828
  533    HA   PRO  68           HA       PRO  68   0.715  -7.149   7.662
  534    HB2  PRO  68           HB2      PRO  68  -1.641  -7.511   9.075
  535    HB3  PRO  68           HB1      PRO  68  -0.263  -8.613   9.103
  536    HG2  PRO  68           HG2      PRO  68  -1.060  -6.521  11.072
  537    HG3  PRO  68           HG1      PRO  68  -0.331  -8.107  11.355
  538    HD2  PRO  68           HD2      PRO  68   1.088  -5.800  11.485
  539    HD3  PRO  68           HD1      PRO  68   1.811  -7.330  10.956
  540    H    GLU  69           HN       GLU  69  -1.352  -4.968   9.576
  541    HA   GLU  69           HA       GLU  69  -2.745  -4.243   7.134
  542    HB2  GLU  69           HB3      GLU  69  -3.211  -3.315   9.981
  543    HB3  GLU  69           HB2      GLU  69  -4.277  -3.045   8.614
  544    HG2  GLU  69           HG3      GLU  69  -4.789  -5.359   8.437
  545    HG3  GLU  69           HG2      GLU  69  -3.542  -5.784   9.608
  546    H    GLU  70           HN       GLU  70  -0.330  -3.081   9.226
  547    HA   GLU  70           HA       GLU  70  -0.297  -0.309   8.653
  548    HB2  GLU  70           HB3      GLU  70   1.001  -1.696  10.400
  549    HB3  GLU  70           HB2      GLU  70   2.142  -1.995   9.100
  550    HG2  GLU  70           HG3      GLU  70   2.981  -0.180  10.341
  551    HG3  GLU  70           HG2      GLU  70   2.327   0.496   8.845
  552    H    ALA  71           HN       ALA  71   1.410  -3.055   7.169
  553    HA   ALA  71           HA       ALA  71   2.748  -1.839   5.060
  554    HB1  ALA  71           HB1      ALA  71   2.952  -4.194   5.677
  555    HB2  ALA  71           HB2      ALA  71   2.568  -4.021   3.965
  556    HB3  ALA  71           HB3      ALA  71   1.314  -4.496   5.113
  557    H    TRP  72           HN       TRP  72  -0.552  -3.114   5.119
  558    HA   TRP  72           HA       TRP  72  -1.225  -2.399   2.502
  559    HB2  TRP  72           HB2      TRP  72  -2.585  -4.035   3.605
  560    HB3  TRP  72           HB1      TRP  72  -2.938  -2.939   4.933
  561    HD1  TRP  72           HD1      TRP  72  -5.472  -2.537   4.788
  562    HE1  TRP  72           HE1      TRP  72  -7.099  -1.740   2.945
  563    HE3  TRP  72           HE3      TRP  72  -2.283  -2.508   0.806
  564    HZ2  TRP  72           HZ2      TRP  72  -7.022  -1.172   0.252
  565    HZ3  TRP  72           HZ3      TRP  72  -3.162  -1.823  -1.407
  566    HH2  TRP  72           HH2      TRP  72  -5.479  -1.173  -1.666
  567    H    ARG  73           HN       ARG  73  -1.786  -0.746   5.529
  568    HA   ARG  73           HA       ARG  73  -3.141   1.476   4.632
  569    HB2  ARG  73           HB2      ARG  73  -2.951   0.940   6.947
  570    HB3  ARG  73           HB1      ARG  73  -1.205   1.083   6.896
  571    HG2  ARG  73           HG2      ARG  73  -1.486   3.518   6.518
  572    HG3  ARG  73           HG1      ARG  73  -3.230   3.299   6.738
  573    HD2  ARG  73           HD2      ARG  73  -2.858   2.354   8.935
  574    HD3  ARG  73           HD1      ARG  73  -1.118   2.507   8.724
  575    HE   ARG  73           HE       ARG  73  -2.550   4.966   8.468
  576   HH11  ARG  73          HH11      ARG  73  -0.710   2.834  10.624
  577   HH12  ARG  73          HH12      ARG  73  -0.673   3.936  11.917
  578   HH21  ARG  73          HH21      ARG  73  -2.435   6.480  10.188
  579   HH22  ARG  73          HH22      ARG  73  -1.673   6.064  11.672
  580    H    LEU  74           HN       LEU  74   0.326   0.964   5.050
  581    HA   LEU  74           HA       LEU  74   1.314   3.422   4.230
  582    HB2  LEU  74           HB2      LEU  74   2.356   0.697   4.499
  583    HB3  LEU  74           HB1      LEU  74   3.214   1.655   3.325
  584    HG   LEU  74           HG       LEU  74   4.257   1.643   5.579
  585   HD11  LEU  74          HD11      LEU  74   4.733   3.470   4.088
  586   HD12  LEU  74          HD12      LEU  74   4.656   4.043   5.742
  587   HD13  LEU  74          HD13      LEU  74   3.305   4.347   4.642
  588   HD21  LEU  74          HD21      LEU  74   1.814   3.206   6.417
  589   HD22  LEU  74          HD22      LEU  74   3.255   2.918   7.397
  590   HD23  LEU  74          HD23      LEU  74   2.222   1.567   6.930
  591    H    ALA  75           HN       ALA  75   0.576   0.557   2.271
  592    HA   ALA  75           HA       ALA  75   1.548   1.701  -0.133
  593    HB1  ALA  75           HB1      ALA  75   0.436  -0.085  -1.283
  594    HB2  ALA  75           HB2      ALA  75  -0.438  -0.516   0.190
  595    HB3  ALA  75           HB3      ALA  75   1.322  -0.686   0.114
  596    H    LEU  76           HN       LEU  76  -1.754   1.422   1.185
  597    HA   LEU  76           HA       LEU  76  -2.890   2.595  -1.104
  598    HB2  LEU  76           HB2      LEU  76  -4.987   2.783   0.110
  599    HB3  LEU  76           HB1      LEU  76  -4.253   1.231   0.407
  600    HG   LEU  76           HG       LEU  76  -3.430   2.346   2.625
  601   HD11  LEU  76          HD11      LEU  76  -4.984   3.987   3.539
  602   HD12  LEU  76          HD12      LEU  76  -5.779   4.096   1.966
  603   HD13  LEU  76          HD13      LEU  76  -4.101   4.613   2.145
  604   HD21  LEU  76          HD21      LEU  76  -5.511   1.655   3.735
  605   HD22  LEU  76          HD22      LEU  76  -4.921   0.489   2.555
  606   HD23  LEU  76          HD23      LEU  76  -6.286   1.531   2.151
  607    H    SER  77           HN       SER  77  -1.672   3.980   1.850
  608    HA   SER  77           HA       SER  77  -2.549   6.589   1.170
  609    HB2  SER  77           HB2      SER  77  -2.178   5.675   3.509
  610    HB3  SER  77           HB1      SER  77  -0.456   5.831   3.212
  611    HG   SER  77           HG       SER  77  -2.025   8.040   2.633
  612    H    THR  78           HN       THR  78  -0.048   4.653   0.037
  613    HA   THR  78           HA       THR  78   1.565   6.943  -0.685
  614    HB   THR  78           HB       THR  78   1.975   3.998  -1.325
  615    HG1  THR  78           HG1      THR  78   2.280   4.425   0.865
  616   HG21  THR  78          HG21      THR  78   3.812   6.371  -1.692
  617   HG22  THR  78          HG22      THR  78   3.066   5.432  -2.991
  618   HG23  THR  78          HG23      THR  78   4.251   4.680  -1.912
  619    H    PHE  79           HN       PHE  79  -0.742   4.682  -2.038
  620    HA   PHE  79           HA       PHE  79  -0.432   5.155  -4.746
  621    HB2  PHE  79           HB2      PHE  79  -2.994   4.619  -3.232
  622    HB3  PHE  79           HB1      PHE  79  -2.869   4.560  -4.990
  623    HD1  PHE  79           HD2      PHE  79  -0.069   3.164  -4.897
  624    HD2  PHE  79           HD1      PHE  79  -3.787   2.433  -2.969
  625    HE1  PHE  79           HE2      PHE  79   0.518   0.811  -4.680
  626    HE2  PHE  79           HE1      PHE  79  -3.202   0.055  -2.736
  627    HZ   PHE  79           HZ       PHE  79  -1.048  -0.765  -3.593
  628    H    GLU  80           HN       GLU  80  -2.217   6.959  -2.327
  629    HA   GLU  80           HA       GLU  80  -3.385   8.812  -4.113
  630    HB2  GLU  80           HB3      GLU  80  -3.876  10.138  -2.063
  631    HB3  GLU  80           HB2      GLU  80  -4.395   8.464  -1.959
  632    HG2  GLU  80           HG3      GLU  80  -2.486   7.909  -0.617
  633    HG3  GLU  80           HG2      GLU  80  -1.848   9.539  -0.795
  634    H    ARG  81           HN       ARG  81  -0.300   8.796  -2.378
  635    HA   ARG  81           HA       ARG  81   0.364  11.518  -2.970
  636    HB2  ARG  81           HB2      ARG  81   1.902   9.193  -1.895
  637    HB3  ARG  81           HB1      ARG  81   2.768  10.596  -2.474
  638    HG2  ARG  81           HG2      ARG  81   2.465  10.605  -0.054
  639    HG3  ARG  81           HG1      ARG  81   1.693  11.989  -0.824
  640    HD2  ARG  81           HD2      ARG  81  -0.453  11.071  -0.491
  641    HD3  ARG  81           HD1      ARG  81   0.216   9.488  -0.116
  642    HE   ARG  81           HE       ARG  81   1.137  10.522   1.919
  643   HH11  ARG  81          HH11      ARG  81  -1.551  12.244   0.395
  644   HH12  ARG  81          HH12      ARG  81  -2.382  12.547   1.850
  645   HH21  ARG  81          HH21      ARG  81   0.004  10.990   3.963
  646   HH22  ARG  81          HH22      ARG  81  -1.462  11.848   3.914
  647    H    ILE  82           HN       ILE  82   0.979   8.432  -4.518
  648    HA   ILE  82           HA       ILE  82   2.747   9.686  -6.462
  649    HB   ILE  82           HB       ILE  82   3.122   7.435  -7.371
  650   HG12  ILE  82          HG12      ILE  82   1.308   6.401  -5.184
  651   HG13  ILE  82          HG11      ILE  82   0.780   6.557  -6.868
  652   HG21  ILE  82          HG21      ILE  82   4.205   6.457  -5.380
  653   HG22  ILE  82          HG22      ILE  82   3.291   7.567  -4.360
  654   HG23  ILE  82          HG23      ILE  82   4.481   8.195  -5.497
  655   HD11  ILE  82          HD11      ILE  82   2.555   4.963  -7.483
  656   HD12  ILE  82          HD12      ILE  82   1.398   4.291  -6.339
  657   HD13  ILE  82          HD13      ILE  82   2.986   4.820  -5.781
  658    H    ASN  83           HN       ASN  83  -0.187  10.049  -6.193
  659    HA   ASN  83           HA       ASN  83  -2.040  10.424  -7.364
  660    HB2  ASN  83           HB3      ASN  83  -0.423  11.987  -8.521
  661    HB3  ASN  83           HB2      ASN  83  -0.269  10.782  -9.790
  662   HD21  ASN  83          HD21      ASN  83  -2.032  10.427 -11.152
  663   HD22  ASN  83          HD22      ASN  83  -3.378  11.509 -11.271
  664    H    ARG  84           HN       ARG  84  -2.201   8.082  -6.947
  665    HA   ARG  84           HA       ARG  84  -3.406   6.931  -9.345
  666    HB2  ARG  84           HB2      ARG  84  -1.017   5.939  -8.527
  667    HB3  ARG  84           HB1      ARG  84  -2.029   5.150  -7.338
  668    HG2  ARG  84           HG2      ARG  84  -2.110   4.797 -10.341
  669    HG3  ARG  84           HG1      ARG  84  -1.622   3.611  -9.138
  670    HD2  ARG  84           HD2      ARG  84  -3.980   3.700  -8.280
  671    HD3  ARG  84           HD1      ARG  84  -4.378   4.695  -9.672
  672    HE   ARG  84           HE       ARG  84  -3.507   1.884  -9.767
  673   HH11  ARG  84          HH11      ARG  84  -5.147   4.619 -11.368
  674   HH12  ARG  84          HH12      ARG  84  -5.757   3.644 -12.629
  675   HH21  ARG  84          HH21      ARG  84  -4.492   0.569 -11.476
  676   HH22  ARG  84          HH22      ARG  84  -5.383   1.346 -12.684
  677    H    LYS  85           HN       LYS  85  -4.926   8.402  -7.788
  678    HA   LYS  85           HA       LYS  85  -5.417   7.513  -5.198
  679    HB2  LYS  85           HB2      LYS  85  -6.805   9.314  -5.048
  680    HB3  LYS  85           HB1      LYS  85  -5.801   9.823  -6.362
  681    HG2  LYS  85           HG2      LYS  85  -8.526   8.564  -6.780
  682    HG3  LYS  85           HG1      LYS  85  -8.257  10.298  -6.683
  683    HD2  LYS  85           HD2      LYS  85  -6.838  10.189  -8.672
  684    HD3  LYS  85           HD1      LYS  85  -7.030   8.435  -8.707
  685    HE2  LYS  85           HE2      LYS  85  -9.373  10.323  -8.879
  686    HE3  LYS  85           HE1      LYS  85  -8.498   9.793 -10.308
  687    HZ1  LYS  85           HZ1      LYS  85  -9.085   7.522  -9.800
  688    HZ2  LYS  85           HZ2      LYS  85 -10.463   8.470  -9.895
  689    HZ3  LYS  85           HZ3      LYS  85  -9.922   7.970  -8.389
  690    H    ASP  86           HN       ASP  86  -6.301   6.530  -8.225
  691    HA   ASP  86           HA       ASP  86  -8.894   5.708  -8.093
  692    HB2  ASP  86           HB2      ASP  86  -6.803   4.055  -9.481
  693    HB3  ASP  86           HB1      ASP  86  -8.439   4.426 -10.008
  694    H    LEU  87           HN       LEU  87  -5.885   4.062  -7.431
  695    HA   LEU  87           HA       LEU  87  -7.092   1.588  -6.650
  696    HB2  LEU  87           HB2      LEU  87  -4.893   1.907  -7.850
  697    HB3  LEU  87           HB1      LEU  87  -4.244   2.503  -6.333
  698    HG   LEU  87           HG       LEU  87  -4.567   0.333  -5.336
  699   HD11  LEU  87          HD11      LEU  87  -6.513  -0.404  -6.699
  700   HD12  LEU  87          HD12      LEU  87  -5.200  -1.576  -6.764
  701   HD13  LEU  87          HD13      LEU  87  -5.464  -0.475  -8.116
  702   HD21  LEU  87          HD21      LEU  87  -2.845  -0.820  -6.633
  703   HD22  LEU  87          HD22      LEU  87  -2.480   0.895  -6.424
  704   HD23  LEU  87          HD23      LEU  87  -3.104   0.308  -7.964
  705    H    TRP  88           HN       TRP  88  -6.093   4.506  -5.168
  706    HA   TRP  88           HA       TRP  88  -5.851   3.614  -2.471
  707    HB2  TRP  88           HB2      TRP  88  -4.774   5.672  -2.993
  708    HB3  TRP  88           HB1      TRP  88  -6.200   6.294  -3.801
  709    HD1  TRP  88           HD1      TRP  88  -5.090   5.413  -0.195
  710    HE1  TRP  88           HE1      TRP  88  -6.221   7.084   1.387
  711    HE3  TRP  88           HE3      TRP  88  -7.876   7.979  -3.613
  712    HZ2  TRP  88           HZ2      TRP  88  -8.062   9.224   1.211
  713    HZ3  TRP  88           HZ3      TRP  88  -9.295   9.824  -2.830
  714    HH2  TRP  88           HH2      TRP  88  -9.384  10.434  -0.471
  715    H    GLU  89           HN       GLU  89  -8.423   5.110  -4.391
  716    HA   GLU  89           HA       GLU  89 -10.500   5.074  -2.482
  717    HB2  GLU  89           HB3      GLU  89 -10.642   4.740  -5.477
  718    HB3  GLU  89           HB2      GLU  89 -11.996   5.134  -4.437
  719    HG2  GLU  89           HG3      GLU  89 -11.051   7.288  -3.949
  720    HG3  GLU  89           HG2      GLU  89  -9.571   6.873  -4.819
  721    H    ARG  90           HN       ARG  90  -9.380   2.816  -4.900
  722    HA   ARG  90           HA       ARG  90 -11.247   0.721  -4.548
  723    HB2  ARG  90           HB2      ARG  90  -8.398   0.665  -5.515
  724    HB3  ARG  90           HB1      ARG  90  -9.481  -0.705  -5.583
  725    HG2  ARG  90           HG2      ARG  90 -10.214   1.877  -6.905
  726    HG3  ARG  90           HG1      ARG  90  -9.144   0.721  -7.697
  727    HD2  ARG  90           HD2      ARG  90 -11.420   0.407  -8.415
  728    HD3  ARG  90           HD1      ARG  90 -10.807  -0.971  -7.492
  729    HE   ARG  90           HE       ARG  90 -12.356   0.974  -5.998
  730   HH11  ARG  90          HH11      ARG  90 -12.471  -2.053  -7.822
  731   HH12  ARG  90          HH12      ARG  90 -13.842  -2.665  -7.027
  732   HH21  ARG  90          HH21      ARG  90 -14.222   0.130  -4.853
  733   HH22  ARG  90          HH22      ARG  90 -14.890  -1.367  -5.310
  734    H    GLY  91           HN       GLY  91  -8.601   1.771  -2.693
  735    HA2  GLY  91           HA3      GLY  91  -7.858  -0.707  -1.535
  736    HA3  GLY  91           HA2      GLY  91  -7.375   0.894  -1.006
  737    H    GLN  92           HN       GLN  92  -8.264   1.740   0.737
  738    HA   GLN  92           HA       GLN  92  -9.353   1.914   2.692
  739    HB2  GLN  92           HB2      GLN  92 -11.607   0.598   1.160
  740    HB3  GLN  92           HB1      GLN  92 -11.780   1.356   2.734
  741    HG2  GLN  92           HG2      GLN  92 -11.194   3.507   1.803
  742    HG3  GLN  92           HG1      GLN  92 -10.890   2.771   0.230
  743   HE21  GLN  92          HE21      GLN  92 -12.759   4.863   1.008
  744   HE22  GLN  92          HE22      GLN  92 -14.323   4.297   0.546
  745    H    ARG  93           HN       ARG  93 -10.732   0.563   4.332
  746    HA   ARG  93           HA       ARG  93 -10.257  -2.276   4.223
  747    HB2  ARG  93           HB2      ARG  93  -9.260  -2.224   6.586
  748    HB3  ARG  93           HB1      ARG  93  -8.212  -1.758   5.257
  749    HG2  ARG  93           HG2      ARG  93  -8.593   0.598   5.786
  750    HG3  ARG  93           HG1      ARG  93  -9.648   0.110   7.114
  751    HD2  ARG  93           HD2      ARG  93  -7.877  -0.892   8.274
  752    HD3  ARG  93           HD1      ARG  93  -6.800  -0.753   6.873
  753    HE   ARG  93           HE       ARG  93  -7.406   1.780   7.321
  754   HH11  ARG  93          HH11      ARG  93  -6.424  -0.674   9.706
  755   HH12  ARG  93          HH12      ARG  93  -5.553   0.399  10.677
  756   HH21  ARG  93          HH21      ARG  93  -6.171   3.259   8.681
  757   HH22  ARG  93          HH22      ARG  93  -5.392   2.683  10.080
  758    H    GLU  94           HN       GLU  94 -11.545   0.508   5.974
  759    HA   GLU  94           HA       GLU  94 -13.356   0.868   7.213
  760    HB2  GLU  94           HB3      GLU  94 -14.506  -1.366   5.538
  761    HB3  GLU  94           HB2      GLU  94 -15.442  -0.181   6.441
  762    HG2  GLU  94           HG3      GLU  94 -14.516   1.613   5.060
  763    HG3  GLU  94           HG2      GLU  94 -13.587   0.425   4.151
  764    H    ASP  95           HN       ASP  95 -11.580  -0.494   8.517
  765    HA   ASP  95           HA       ASP  95 -12.515  -2.983   9.566
  766    HB2  ASP  95           HB2      ASP  95 -10.463  -2.929  10.881
  767    HB3  ASP  95           HB1      ASP  95 -10.124  -2.562   9.196
  768    H    LEU  96           HN       LEU  96 -12.556  -3.262  11.933
  769    HA   LEU  96           HA       LEU  96 -14.437  -1.351  13.045
  770    HB2  LEU  96           HB2      LEU  96 -14.907  -3.762  13.080
  771    HB3  LEU  96           HB1      LEU  96 -13.447  -4.037  13.999
  772    HG   LEU  96           HG       LEU  96 -14.442  -2.692  15.858
  773   HD11  LEU  96          HD11      LEU  96 -16.843  -2.298  15.849
  774   HD12  LEU  96          HD12      LEU  96 -16.929  -2.871  14.183
  775   HD13  LEU  96          HD13      LEU  96 -16.033  -1.403  14.562
  776   HD21  LEU  96          HD21      LEU  96 -14.485  -5.129  15.893
  777   HD22  LEU  96          HD22      LEU  96 -15.987  -5.126  14.968
  778   HD23  LEU  96          HD23      LEU  96 -15.956  -4.467  16.605
  779    H    VAL  97           HN       VAL  97 -14.023  -0.166  14.963
  780    HA   VAL  97           HA       VAL  97 -11.292   0.115  15.705
  781    HB   VAL  97           HB       VAL  97 -13.772   1.154  17.154
  782   HG11  VAL  97          HG11      VAL  97 -12.205   2.666  18.309
  783   HG12  VAL  97          HG12      VAL  97 -10.859   1.861  17.492
  784   HG13  VAL  97          HG13      VAL  97 -11.840   0.968  18.640
  785   HG21  VAL  97          HG21      VAL  97 -11.860   2.546  15.276
  786   HG22  VAL  97          HG22      VAL  97 -13.201   3.314  16.131
  787   HG23  VAL  97          HG23      VAL  97 -13.521   2.092  14.899
  788    H    ARG  98           HN       ARG  98 -10.294  -1.235  16.821
  789    HA   ARG  98           HA       ARG  98 -11.636  -3.489  17.856
  790    HB2  ARG  98           HB2      ARG  98  -8.745  -2.776  17.629
  791    HB3  ARG  98           HB1      ARG  98  -9.354  -4.327  18.223
  792    HG2  ARG  98           HG2      ARG  98 -10.471  -4.747  16.160
  793    HG3  ARG  98           HG1      ARG  98 -10.039  -3.155  15.560
  794    HD2  ARG  98           HD2      ARG  98  -7.747  -3.711  15.574
  795    HD3  ARG  98           HD1      ARG  98  -8.080  -5.289  16.311
  796    HE   ARG  98           HE       ARG  98  -9.531  -5.583  14.216
  797   HH11  ARG  98          HH11      ARG  98  -6.434  -3.887  14.276
  798   HH12  ARG  98          HH12      ARG  98  -6.026  -4.368  12.677
  799   HH21  ARG  98          HH21      ARG  98  -8.970  -6.150  12.047
  800   HH22  ARG  98          HH22      ARG  98  -7.496  -5.563  11.381
  801    H    ASP  99           HN       ASP  99 -11.582  -4.369  19.750
  802    HA   ASP  99           HA       ASP  99 -10.660  -3.732  22.196
  803    HB2  ASP  99           HB2      ASP  99 -11.587  -1.440  22.018
  804    HB3  ASP  99           HB1      ASP  99 -13.181  -2.109  21.685
  805    H    THR 100           HN       THR 100 -13.683  -4.162  20.476
  806    HA   THR 100           HA       THR 100 -14.922  -5.685  22.523
  807    HB   THR 100           HB       THR 100 -15.870  -5.402  19.678
  808    HG1  THR 100           HG1      THR 100 -16.043  -3.617  21.902
  809   HG21  THR 100          HG21      THR 100 -18.088  -5.533  20.742
  810   HG22  THR 100          HG22      THR 100 -17.326  -5.670  22.324
  811   HG23  THR 100          HG23      THR 100 -17.130  -6.960  21.138
  812    H    VAL 101           HN       VAL 101 -14.700  -6.851  19.123
  813    HA   VAL 101           HA       VAL 101 -14.441  -9.502  20.294
  814    HB   VAL 101           HB       VAL 101 -15.073 -10.404  18.068
  815   HG11  VAL 101          HG11      VAL 101 -16.817  -9.972  19.700
  816   HG12  VAL 101          HG12      VAL 101 -17.404  -9.648  18.071
  817   HG13  VAL 101          HG13      VAL 101 -16.962  -8.308  19.129
  818   HG21  VAL 101          HG21      VAL 101 -15.934  -8.841  16.345
  819   HG22  VAL 101          HG22      VAL 101 -14.202  -8.710  16.609
  820   HG23  VAL 101          HG23      VAL 101 -15.288  -7.490  17.286
  821    H    GLU 102           HN       GLU 102 -12.514  -7.176  19.008
  822    HA   GLU 102           HA       GLU 102 -10.237  -8.735  18.985
  823    HB2  GLU 102           HB3      GLU 102  -9.589  -7.944  16.634
  824    HB3  GLU 102           HB2      GLU 102 -10.765  -9.244  16.663
  825    HG2  GLU 102           HG3      GLU 102 -12.549  -7.717  16.160
  826    HG3  GLU 102           HG2      GLU 102 -11.486  -6.334  16.307